#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bk5 h PRO 90 N 0.00 1.06 -0.19 3.23 0.11 -2.00 -0.72 132.00 133.48 1bk5 h PRO 90 Ca 0.00 -0.20 -0.01 0.00 0.11 0.00 0.00 66.00 65.89 1bk5 h PRO 90 Cb 0.00 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 1bk5 h PRO 90 CO 0.00 0.89 0.07 1.96 -0.21 0.00 0.00 178.00 180.71 1bk5 h GLN 91 N 1.03 0.30 -0.26 1.05 4.20 -2.05 -2.52 115.11 116.85 1bk5 h GLN 91 Ca 0.23 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.87 1bk5 h GLN 91 Cb 0.25 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 1bk5 h GLN 91 CO -0.01 0.39 0.11 0.52 -0.67 0.00 0.00 178.83 179.16 1bk5 h MET 92 N 0.14 0.39 -0.68 1.46 2.86 -1.95 -2.28 114.93 114.88 1bk5 h MET 92 Ca 0.06 -0.07 0.18 0.00 -2.06 0.00 0.00 59.70 57.82 1bk5 h MET 92 Cb 0.21 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 1bk5 h MET 92 CO -0.00 0.42 0.48 1.15 1.06 0.00 0.00 176.91 180.02 1bk5 h THR 93 N 0.27 0.69 0.27 2.22 2.02 -1.06 -0.58 112.91 116.76 1bk5 h THR 93 Ca 0.09 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.23 1bk5 h THR 93 Cb 0.18 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1bk5 h THR 93 CO -0.01 0.01 -0.13 1.56 0.37 0.00 0.00 175.52 177.33 1bk5 h GLN 94 N 0.08 -0.35 -0.54 6.66 4.20 -0.97 -2.86 115.11 121.32 1bk5 h GLN 94 Ca 0.33 0.02 0.11 0.00 0.06 0.00 0.00 58.65 59.17 1bk5 h GLN 94 Cb 1.19 0.08 -0.10 0.00 0.30 0.00 0.00 27.48 28.95 1bk5 h GLN 94 CO -0.03 -0.01 -0.10 1.96 -0.67 0.00 0.00 178.83 179.98 1bk5 h GLN 95 N -0.92 0.02 -0.86 1.46 4.20 -0.93 -0.72 115.11 117.36 1bk5 h GLN 95 Ca -0.04 -0.00 0.16 0.00 0.06 0.00 0.00 58.65 58.83 1bk5 h GLN 95 Cb 0.50 -0.01 -0.10 0.00 0.30 0.00 0.00 27.48 28.18 1bk5 h GLN 95 CO 0.06 0.02 0.44 1.25 -0.67 0.00 0.00 178.83 179.92 1bk5 h LEU 96 N 0.02 0.50 -0.13 1.46 5.85 -1.19 0.30 115.31 122.14 1bk5 h LEU 96 Ca 0.26 0.10 0.00 0.00 0.84 0.00 0.00 57.88 59.09 1bk5 h LEU 96 Cb 0.41 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.47 1bk5 h LEU 96 CO -0.53 0.18 0.00 0.59 -0.34 0.00 0.00 178.44 178.34 1bk5 n ASN 97 N -4.90 0.20 -4.75 1.25 3.02 -0.34 -4.78 115.26 104.97 1bk5 n ASN 97 Ca 0.18 -1.13 -0.31 0.00 -0.03 0.00 0.00 54.58 53.29 1bk5 n ASN 97 Cb 0.48 -0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.75 1bk5 n ASN 97 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1bk5 s SER 98 N -1.93 4.15 0.00 6.41 0.15 0.11 -4.93 113.70 117.65 1bk5 s SER 98 Ca 0.44 1.92 0.24 0.00 0.70 0.00 0.00 55.95 59.25 1bk5 s SER 98 Cb 0.20 -2.53 0.26 0.00 -1.71 0.00 0.00 66.02 62.24 1bk5 s SER 98 CO 0.34 -2.28 1.26 0.47 1.20 0.00 0.00 173.24 174.23 1bk5 n ASP 99 N -3.64 1.70 -4.58 5.45 8.00 -1.26 -4.75 116.55 117.46 1bk5 n ASP 99 Ca 0.10 -1.31 -0.42 0.00 0.71 0.00 0.00 54.79 53.86 1bk5 n ASP 99 Cb 0.53 0.35 -0.02 0.00 -0.02 0.00 0.00 41.12 41.96 1bk5 n ASP 99 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1bk5 s ASP 100 N -2.47 6.49 0.19 -2.24 -1.08 -1.26 -4.91 116.67 111.39 1bk5 s ASP 100 Ca 0.21 0.17 -0.22 0.00 -0.52 0.00 0.00 52.55 52.19 1bk5 s ASP 100 Cb 0.19 -2.54 0.11 0.00 -1.46 0.00 0.00 42.92 39.21 1bk5 s ASP 100 CO 0.55 -1.40 1.57 -0.03 0.52 0.00 0.00 175.17 176.37 1bk5 h MET 101 N 9.45 -0.12 -0.81 4.34 1.85 -1.98 0.43 114.93 128.08 1bk5 h MET 101 Ca -0.24 0.01 0.14 0.00 -0.61 0.00 0.00 59.70 58.99 1bk5 h MET 101 Cb 1.06 0.03 -0.06 0.00 0.43 0.00 0.00 31.60 33.06 1bk5 h MET 101 CO 1.16 -0.08 0.53 0.37 -0.40 0.00 0.00 176.91 178.50 1bk5 h GLN 102 N -0.12 0.54 0.07 0.39 4.15 -1.99 -0.54 115.11 117.60 1bk5 h GLN 102 Ca 0.24 -0.03 -0.25 0.00 0.77 0.00 0.00 58.65 59.37 1bk5 h GLN 102 Cb 0.56 -0.12 0.01 0.00 0.21 0.00 0.00 27.48 28.13 1bk5 h GLN 102 CO -0.80 0.36 -1.10 1.49 -1.93 0.00 0.00 178.83 176.85 1bk5 h GLU 103 N 0.56 0.37 -0.31 1.69 4.81 -0.65 -2.50 114.58 118.55 1bk5 h GLU 103 Ca 0.40 -0.49 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 1bk5 h GLU 103 Cb 0.75 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 1bk5 h GLU 103 CO -0.16 1.18 0.15 1.96 -0.73 0.00 0.00 179.01 181.42 1bk5 h GLN 104 N 0.16 0.44 -0.68 1.92 4.20 0.45 -1.50 115.11 120.11 1bk5 h GLN 104 Ca -0.12 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.54 1bk5 h GLN 104 Cb 1.78 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 29.44 1bk5 h GLN 104 CO 0.19 0.41 0.44 1.25 -0.67 0.00 0.00 178.83 180.45 1bk5 h LEU 105 N 0.36 0.75 -0.94 1.46 5.85 -1.18 0.32 115.31 121.93 1bk5 h LEU 105 Ca 0.11 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.85 1bk5 h LEU 105 Cb 0.11 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 1bk5 h LEU 105 CO -0.01 0.54 0.61 -1.28 -0.34 0.00 0.00 178.44 177.95 1bk5 h SER 106 N 0.89 1.01 -0.08 1.25 0.87 -1.07 -1.59 113.55 114.82 1bk5 h SER 106 Ca 0.26 -0.01 -0.09 0.00 -1.23 0.00 0.00 61.79 60.72 1bk5 h SER 106 Cb -0.07 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 61.67 1bk5 h SER 106 CO -0.07 0.68 -0.29 0.00 -0.53 0.00 0.00 176.83 176.62 1bk5 h ALA 107 N 1.39 0.15 -0.98 6.23 0.00 -0.59 -3.08 119.26 122.38 1bk5 h ALA 107 Ca 0.38 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1bk5 h ALA 107 Cb 0.03 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1bk5 h ALA 107 CO -0.13 0.17 0.63 1.15 0.00 0.00 0.00 179.25 181.07 1bk5 h THR 108 N -0.13 1.26 -0.70 0.00 2.02 -0.80 -0.67 112.91 113.89 1bk5 h THR 108 Ca -0.01 -0.51 0.05 0.00 0.77 0.00 0.00 66.41 66.71 1bk5 h THR 108 Cb 0.92 -0.17 -0.05 0.00 -1.74 0.00 0.00 68.15 67.11 1bk5 h THR 108 CO 0.06 0.26 0.41 0.58 0.37 0.00 0.00 175.52 177.20 1bk5 h VAL 109 N 1.34 1.00 0.06 3.16 2.07 -1.34 0.65 116.25 123.19 1bk5 h VAL 109 Ca 0.36 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.62 1bk5 h VAL 109 Cb -0.12 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 29.83 1bk5 h VAL 109 CO -0.07 0.14 -0.03 0.11 0.02 0.00 0.00 177.57 177.74 1bk5 h LYS 110 N 0.76 -0.08 -0.23 1.57 1.57 -1.20 -0.71 116.57 118.25 1bk5 h LYS 110 Ca 0.30 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1bk5 h LYS 110 Cb 0.15 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1bk5 h LYS 110 CO -0.16 0.07 0.13 0.74 -0.57 0.00 0.00 179.45 179.66 1bk5 h PHE 111 N -0.21 0.29 -0.40 -1.35 -1.00 -0.78 -2.00 116.94 111.48 1bk5 h PHE 111 Ca -0.01 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.68 1bk5 h PHE 111 Cb 0.18 -0.10 -0.01 0.00 3.61 0.00 0.00 35.95 39.64 1bk5 h PHE 111 CO -0.03 0.20 -0.12 -0.09 -1.61 0.00 0.00 178.31 176.67 1bk5 h ARG 112 N 0.31 0.79 -0.59 1.51 2.43 -0.45 -2.42 114.38 115.97 1bk5 h ARG 112 Ca 0.08 -0.31 -0.09 0.00 -0.81 0.00 0.00 59.98 58.85 1bk5 h ARG 112 Cb 0.00 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1bk5 h ARG 112 CO -0.01 0.93 0.01 1.96 -1.51 0.00 0.00 179.97 181.35 1bk5 h GLN 113 N 0.60 1.03 -0.10 0.20 4.20 -0.44 -2.02 115.11 118.58 1bk5 h GLN 113 Ca 0.10 -0.32 -0.17 0.00 0.06 0.00 0.00 58.65 58.32 1bk5 h GLN 113 Cb 0.65 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1bk5 h GLN 113 CO 0.04 1.01 -0.66 -0.84 -0.67 0.00 0.00 178.83 177.72 1bk5 h ILE 114 N 0.93 1.37 0.00 2.54 3.07 -1.44 -2.50 117.51 121.48 1bk5 h ILE 114 Ca 0.17 -2.02 0.00 0.00 1.55 0.00 0.00 64.86 64.56 1bk5 h ILE 114 Cb 0.54 2.01 0.00 0.00 -0.27 0.00 0.00 36.82 39.10 1bk5 h ILE 114 CO 0.03 0.61 0.00 0.18 -1.05 0.00 0.00 178.15 177.92 1bk5 n LEU 115 N -3.87 0.00 -0.77 0.16 4.77 -0.91 -2.52 117.00 113.85 1bk5 n LEU 115 Ca -0.04 0.36 0.13 0.00 -0.03 0.00 0.00 56.01 56.44 1bk5 n LEU 115 Cb 0.66 -0.36 0.27 0.00 -2.33 0.00 0.00 43.42 41.66 1bk5 n LEU 115 CO 0.47 -0.11 0.73 -1.20 -1.33 0.00 0.00 177.39 175.94 1bk5 n SER 116 N -1.36 2.41 -4.70 -1.43 7.64 -0.77 -4.86 113.62 110.55 1bk5 n SER 116 Ca 0.08 -1.80 -0.43 0.00 1.01 0.00 0.00 58.87 57.72 1bk5 n SER 116 Cb 0.19 -0.01 -0.02 0.00 -1.01 0.00 0.00 64.21 63.36 1bk5 n SER 116 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1bk5 n ARG 117 N 0.88 2.25 0.06 1.43 1.74 -1.05 -4.89 116.66 117.09 1bk5 n ARG 117 Ca 0.16 0.80 -0.06 0.00 -0.77 0.00 0.00 57.85 57.98 1bk5 n ARG 117 Cb 0.50 -2.48 -0.10 0.00 -1.02 0.00 0.00 32.46 29.36 1bk5 n ARG 117 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1bk5 h GLU 118 N 4.06 0.00 0.00 5.56 5.08 -1.92 -3.36 114.58 124.00 1bk5 h GLU 118 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1bk5 h GLU 118 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1bk5 h GLU 118 CO 0.74 0.90 0.00 0.72 -1.00 0.00 0.00 179.01 180.37 1bk5 n HIS 119 N -3.31 0.00 -3.37 4.33 8.25 -1.26 -4.84 115.22 115.02 1bk5 n HIS 119 Ca -0.01 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.23 1bk5 n HIS 119 Cb 0.92 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.94 1bk5 n HIS 119 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1bk5 s ARG 120 N 0.00 0.66 0.14 -0.41 3.52 -1.26 -5.12 118.95 116.48 1bk5 s ARG 120 Ca 0.00 -1.19 -0.32 0.00 -0.13 0.00 0.00 55.73 54.08 1bk5 s ARG 120 Cb 0.00 -0.97 -0.12 0.00 -1.56 0.00 0.00 34.95 32.30 1bk5 s ARG 120 CO 0.00 -1.23 1.76 -0.35 -0.81 0.00 0.00 175.30 174.67 1bk5 n PRO 121 N 3.93 2.64 -0.17 5.12 -0.04 -1.26 -4.81 135.00 140.41 1bk5 n PRO 121 Ca 0.14 0.96 -0.03 0.00 -0.04 0.00 0.00 63.50 64.53 1bk5 n PRO 121 Cb 0.43 -2.81 -0.02 0.00 -0.04 0.00 0.00 33.50 31.06 1bk5 n PRO 121 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1bk5 n PRO 122 N 4.84 0.39 -0.03 0.54 -0.04 -1.26 -4.57 135.00 134.87 1bk5 n PRO 122 Ca 0.18 -0.33 -0.09 0.00 -0.04 0.00 0.00 63.50 63.22 1bk5 n PRO 122 Cb 0.35 -1.74 -0.03 0.00 -0.04 0.00 0.00 33.50 32.04 1bk5 n PRO 122 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1bk5 h ILE 123 N 3.14 0.77 -0.84 0.52 2.04 -1.92 -2.09 117.51 119.13 1bk5 h ILE 123 Ca 0.06 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.93 1bk5 h ILE 123 Cb 0.18 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 1bk5 h ILE 123 CO 0.65 0.00 0.56 0.44 0.00 0.00 0.00 178.15 179.80 1bk5 h ASP 124 N -0.04 0.95 0.15 1.72 3.32 -1.99 -0.60 116.42 119.93 1bk5 h ASP 124 Ca 0.09 -0.02 -0.14 0.00 0.02 0.00 0.00 57.03 56.98 1bk5 h ASP 124 Cb 0.17 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1bk5 h ASP 124 CO -0.20 0.68 -0.52 1.62 -1.72 0.00 0.00 179.24 179.11 1bk5 h VAL 125 N 1.12 1.34 -0.63 -1.35 3.04 -1.88 0.24 116.25 118.13 1bk5 h VAL 125 Ca 0.31 -1.77 -0.06 0.00 -1.01 0.00 0.00 66.70 64.17 1bk5 h VAL 125 Cb -0.10 1.79 -0.03 0.00 -2.01 0.00 0.00 31.29 30.94 1bk5 h VAL 125 CO -0.07 0.54 0.15 0.58 -1.01 0.00 0.00 177.57 177.76 1bk5 h VAL 126 N 0.32 1.25 -0.18 1.51 2.07 -0.69 0.22 116.25 120.75 1bk5 h VAL 126 Ca 0.01 -0.93 -0.13 0.00 0.82 0.00 0.00 66.70 66.48 1bk5 h VAL 126 Cb 1.02 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1bk5 h VAL 126 CO 0.09 0.35 -0.43 0.40 0.02 0.00 0.00 177.57 178.00 1bk5 h ILE 127 N 0.92 1.31 0.00 4.57 2.04 -0.82 -2.28 117.51 123.25 1bk5 h ILE 127 Ca 0.20 -1.60 -0.00 0.00 1.00 0.00 0.00 64.86 64.45 1bk5 h ILE 127 Cb 0.36 1.65 -0.00 0.00 -0.74 0.00 0.00 36.82 38.09 1bk5 h ILE 127 CO 0.00 0.49 -0.01 1.56 0.00 0.00 0.00 178.15 180.19 1bk5 h GLN 128 N 0.35 0.00 -0.00 2.37 4.20 0.38 -1.83 115.11 120.58 1bk5 h GLN 128 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1bk5 h GLN 128 Cb 0.90 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.68 1bk5 h GLN 128 CO 0.08 0.01 -0.08 0.00 -0.67 0.00 0.00 178.83 178.17 1bk5 n ALA 129 N -2.10 2.59 -1.29 3.87 0.00 0.69 -4.93 120.51 119.34 1bk5 n ALA 129 Ca 0.00 -0.17 -0.10 0.00 0.00 0.00 0.00 53.44 53.18 1bk5 n ALA 129 Cb 0.29 -1.41 -0.04 0.00 0.00 0.00 0.00 19.45 18.29 1bk5 n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bk5 n GLY 130 N 1.41 1.10 0.43 0.00 0.00 -0.69 -4.91 105.19 102.53 1bk5 n GLY 130 Ca 0.10 -0.33 0.09 0.00 0.00 0.00 0.00 46.02 45.88 1bk5 n GLY 130 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1bk5 n VAL 131 N -2.57 0.20 0.40 1.61 0.24 -1.25 -4.41 118.33 112.55 1bk5 n VAL 131 Ca -0.10 -0.28 -0.16 0.00 -2.04 0.00 0.00 64.34 61.76 1bk5 n VAL 131 Cb 0.40 0.20 -0.08 0.00 -1.47 0.00 0.00 33.84 32.89 1bk5 n VAL 131 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 1bk5 h VAL 132 N 1.62 0.00 -0.84 3.34 2.07 -1.89 -2.36 116.25 118.19 1bk5 h VAL 132 Ca 0.00 -0.17 0.24 0.00 0.82 0.00 0.00 66.70 67.59 1bk5 h VAL 132 Cb 0.36 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 1bk5 h VAL 132 CO 0.00 0.00 0.61 1.55 0.02 0.00 0.00 177.57 179.75 1bk5 h PRO 133 N -1.20 0.02 -0.14 1.57 0.13 -1.92 0.06 132.00 130.52 1bk5 h PRO 133 Ca -0.11 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.97 1bk5 h PRO 133 Cb 0.79 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.92 1bk5 h PRO 133 CO 0.17 0.01 -0.10 -0.09 -0.23 0.00 0.00 178.00 177.76 1bk5 h ARG 134 N 0.02 0.31 -0.41 0.86 9.65 -1.81 -2.03 114.38 120.98 1bk5 h ARG 134 Ca 0.40 -0.15 -0.00 0.00 -1.10 0.00 0.00 59.98 59.13 1bk5 h ARG 134 Cb 1.59 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 30.14 1bk5 h ARG 134 CO -0.01 0.68 0.23 -0.07 2.80 0.00 0.00 179.97 183.60 1bk5 h LEU 135 N -0.05 0.48 -0.87 3.80 3.38 -0.49 -0.50 115.31 121.07 1bk5 h LEU 135 Ca 0.03 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1bk5 h LEU 135 Cb 0.61 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1bk5 h LEU 135 CO 0.03 0.38 0.09 0.58 0.09 0.00 0.00 178.44 179.61 1bk5 h VAL 136 N 0.56 1.25 -0.77 1.22 2.07 -0.97 -2.40 116.25 117.21 1bk5 h VAL 136 Ca 0.15 -0.95 0.08 0.00 0.82 0.00 0.00 66.70 66.80 1bk5 h VAL 136 Cb -0.00 0.70 -0.07 0.00 -1.52 0.00 0.00 31.29 30.40 1bk5 h VAL 136 CO -0.03 0.35 0.43 -0.33 0.02 0.00 0.00 177.57 178.02 1bk5 h GLU 137 N 0.88 0.73 0.00 1.57 5.08 -0.35 -1.85 114.58 120.64 1bk5 h GLU 137 Ca 0.18 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1bk5 h GLU 137 Cb 0.39 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1bk5 h GLU 137 CO 0.01 0.48 0.00 1.19 -1.00 0.00 0.00 179.01 179.69 1bk5 n PHE 138 N -4.76 0.00 0.70 4.33 3.72 -0.90 -1.72 117.46 118.82 1bk5 n PHE 138 Ca 0.12 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.64 1bk5 n PHE 138 Cb 0.25 -0.20 0.15 0.00 -0.94 0.00 0.00 39.48 38.74 1bk5 n PHE 138 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1bk5 n MET 139 N -1.20 2.41 -1.73 -1.08 2.81 -0.69 -3.65 117.12 113.99 1bk5 n MET 139 Ca 0.05 -2.09 -0.36 0.00 -1.81 0.00 0.00 57.70 53.49 1bk5 n MET 139 Cb 0.06 -1.49 0.06 0.00 -0.71 0.00 0.00 33.22 31.14 1bk5 n MET 139 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1bk5 s ARG 140 N -1.78 2.56 0.20 0.03 0.52 -0.70 -4.91 118.95 114.88 1bk5 s ARG 140 Ca 0.33 1.87 -0.04 0.00 -0.52 0.00 0.00 55.73 57.37 1bk5 s ARG 140 Cb 0.21 -1.87 0.38 0.00 0.52 0.00 0.00 34.95 34.19 1bk5 s ARG 140 CO 0.31 -1.54 1.08 -1.91 0.02 0.00 0.00 175.30 173.26 1bk5 n GLU 141 N -2.08 -0.06 -0.94 3.54 2.13 -1.26 -1.71 120.64 120.26 1bk5 n GLU 141 Ca 0.14 1.07 -0.02 0.00 0.66 0.00 0.00 57.16 59.01 1bk5 n GLU 141 Cb 0.49 -1.63 0.32 0.00 0.27 0.00 0.00 31.44 30.89 1bk5 n GLU 141 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1bk5 n ASN 142 N -5.07 4.82 -4.88 4.31 5.03 -1.26 -4.97 115.26 113.24 1bk5 n ASN 142 Ca 0.13 -3.18 -0.30 0.00 0.87 0.00 0.00 54.58 52.09 1bk5 n ASN 142 Cb 0.40 -0.71 -0.03 0.00 -1.02 0.00 0.00 39.78 38.42 1bk5 n ASN 142 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1bk5 s GLN 143 N -2.96 3.78 0.47 3.52 -1.52 -0.69 -5.02 119.66 117.23 1bk5 s GLN 143 Ca 0.53 0.42 -0.25 0.00 -1.95 0.00 0.00 55.36 54.12 1bk5 s GLN 143 Cb 0.43 -2.43 -0.08 0.00 -0.22 0.00 0.00 33.01 30.71 1bk5 s GLN 143 CO 0.13 0.02 1.41 -2.14 -0.25 0.00 0.00 175.29 174.46 1bk5 s PRO 144 N -3.71 3.60 0.34 2.91 0.02 -1.26 -4.81 135.00 132.09 1bk5 s PRO 144 Ca 0.50 2.37 0.03 0.00 0.02 0.00 0.00 61.00 63.92 1bk5 s PRO 144 Cb -0.10 -2.59 0.63 0.00 0.02 0.00 0.00 34.50 32.46 1bk5 s PRO 144 CO 0.30 -0.87 1.97 1.49 -0.33 0.00 0.00 177.00 179.56 1bk5 h GLU 145 N 2.19 0.86 -0.73 5.54 4.81 -1.96 -0.77 114.58 124.52 1bk5 h GLU 145 Ca -0.51 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.65 1bk5 h GLU 145 Cb 1.27 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 30.42 1bk5 h GLU 145 CO 0.60 0.57 0.36 1.98 -0.73 0.00 0.00 179.01 181.80 1bk5 h MET 146 N 0.89 1.04 -0.48 1.92 4.05 -1.99 0.14 114.93 120.49 1bk5 h MET 146 Ca 0.30 -0.14 -0.08 0.00 -0.28 0.00 0.00 59.70 59.50 1bk5 h MET 146 Cb 0.09 -0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 30.68 1bk5 h MET 146 CO -0.09 0.80 -0.02 1.25 0.23 0.00 0.00 176.91 179.08 1bk5 h LEU 147 N 1.01 0.78 -0.34 3.39 5.85 -1.64 -1.58 115.31 122.77 1bk5 h LEU 147 Ca 0.25 -0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 1bk5 h LEU 147 Cb 0.09 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1bk5 h LEU 147 CO -0.03 0.86 0.03 1.56 -0.34 0.00 0.00 178.44 180.52 1bk5 h GLN 148 N 0.75 0.59 -0.21 1.25 4.20 -0.39 -0.90 115.11 120.40 1bk5 h GLN 148 Ca 0.14 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 1bk5 h GLN 148 Cb 0.49 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 1bk5 h GLN 148 CO 0.02 0.68 0.03 1.25 -0.67 0.00 0.00 178.83 180.15 1bk5 h LEU 149 N 0.41 0.33 -0.69 1.46 5.85 -0.58 -0.37 115.31 121.71 1bk5 h LEU 149 Ca 0.10 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 1bk5 h LEU 149 Cb 0.39 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 1bk5 h LEU 149 CO 0.01 0.51 0.34 -0.33 -0.34 0.00 0.00 178.44 178.63 1bk5 h GLU 150 N 0.14 0.99 -0.25 1.25 4.39 -1.24 0.94 114.58 120.80 1bk5 h GLU 150 Ca 0.06 -0.14 -0.10 0.00 0.34 0.00 0.00 59.36 59.52 1bk5 h GLU 150 Cb 0.32 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1bk5 h GLU 150 CO 0.00 0.78 -0.24 0.00 -1.16 0.00 0.00 179.01 178.40 1bk5 h ALA 151 N 1.16 0.36 -0.62 3.43 0.00 -1.09 -1.79 119.26 120.71 1bk5 h ALA 151 Ca 0.24 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1bk5 h ALA 151 Cb 0.10 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1bk5 h ALA 151 CO -0.03 0.33 0.05 0.00 0.00 0.00 0.00 179.25 179.60 1bk5 h ALA 152 N 0.68 0.83 0.21 0.00 0.00 -0.97 -0.39 119.26 119.62 1bk5 h ALA 152 Ca 0.04 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1bk5 h ALA 152 Cb 0.79 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1bk5 h ALA 152 CO 0.06 0.63 -0.15 2.35 0.00 0.00 0.00 179.25 182.14 1bk5 h TRP 153 N 0.96 -0.39 -0.45 0.00 2.91 -0.77 0.17 115.95 118.38 1bk5 h TRP 153 Ca 0.18 -0.00 0.04 0.00 1.13 0.00 0.00 58.89 60.24 1bk5 h TRP 153 Cb 0.50 0.15 -0.04 0.00 -0.51 0.00 0.00 29.16 29.25 1bk5 h TRP 153 CO 0.04 -0.24 0.21 0.00 -1.03 0.00 0.00 178.44 177.42 1bk5 h ALA 154 N 0.41 0.56 0.00 2.65 0.00 -1.15 -1.48 119.26 120.26 1bk5 h ALA 154 Ca -0.01 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1bk5 h ALA 154 Cb 0.32 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1bk5 h ALA 154 CO -0.00 -0.15 -0.35 -0.07 0.00 0.00 0.00 179.25 178.67 1bk5 h LEU 155 N 0.42 0.00 -0.32 0.00 3.38 -0.83 -2.86 115.31 115.10 1bk5 h LEU 155 Ca 0.20 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.98 1bk5 h LEU 155 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1bk5 h LEU 155 CO -0.16 0.35 -0.65 0.74 0.09 0.00 0.00 178.44 178.82 1bk5 h THR 156 N 0.00 1.30 0.00 0.22 2.02 0.03 0.18 112.91 116.65 1bk5 h THR 156 Ca -0.00 -1.88 -0.02 0.00 0.77 0.00 0.00 66.41 65.28 1bk5 h THR 156 Cb 0.69 1.84 -0.00 0.00 -1.74 0.00 0.00 68.15 68.93 1bk5 h THR 156 CO 0.05 0.59 -0.08 0.78 0.37 0.00 0.00 175.52 177.23 1bk5 h ASN 157 N 0.52 0.00 0.01 4.18 2.35 -1.07 -0.61 115.58 120.96 1bk5 h ASN 157 Ca -0.01 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 1bk5 h ASN 157 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 1bk5 h ASN 157 CO 0.13 0.08 -0.06 0.40 -1.65 0.00 0.00 177.43 176.32 1bk5 h ILE 158 N 0.00 1.76 0.00 2.81 2.04 -1.32 -3.31 117.51 119.49 1bk5 h ILE 158 Ca -0.00 -2.32 0.00 0.00 1.00 0.00 0.00 64.86 63.54 1bk5 h ILE 158 Cb 0.14 3.33 0.00 0.00 -0.74 0.00 0.00 36.82 39.55 1bk5 h ILE 158 CO 0.01 0.61 0.00 0.00 0.00 0.00 0.00 178.15 178.77 1bk5 h ALA 159 N 0.03 1.00 -0.63 1.87 0.00 -0.29 -1.18 119.26 120.06 1bk5 h ALA 159 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bk5 h ALA 159 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1bk5 h ALA 159 CO 0.01 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.13 1bk5 n SER 160 N -2.69 4.20 -0.45 0.00 3.41 -0.27 -4.50 113.62 113.32 1bk5 n SER 160 Ca -0.01 -2.28 0.00 0.00 -0.26 0.00 0.00 58.87 56.31 1bk5 n SER 160 Cb 0.12 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.55 1bk5 n SER 160 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bk5 n GLY 161 N 1.24 1.35 3.67 5.00 0.00 -0.45 -5.06 105.19 110.95 1bk5 n GLY 161 Ca 0.24 -1.57 -0.29 0.00 0.00 0.00 0.00 46.02 44.40 1bk5 n GLY 161 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bk5 s THR 162 N 2.02 2.06 0.27 2.61 -4.23 -1.26 -4.76 115.64 112.36 1bk5 s THR 162 Ca 0.00 0.02 -0.04 0.00 -1.18 0.00 0.00 61.69 60.49 1bk5 s THR 162 Cb 0.00 -2.50 0.26 0.00 1.34 0.00 0.00 72.50 71.60 1bk5 s THR 162 CO 0.00 -0.03 1.94 -1.28 -0.54 0.00 0.00 174.62 174.72 1bk5 h SER 163 N -1.92 1.07 -0.03 3.99 0.87 -1.96 -0.44 113.55 115.13 1bk5 h SER 163 Ca -0.55 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 59.99 1bk5 h SER 163 Cb 1.33 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 63.02 1bk5 h SER 163 CO 0.57 0.77 0.02 0.00 -0.53 0.00 0.00 176.83 177.66 1bk5 h ALA 164 N 1.42 0.03 -0.66 6.23 0.00 -1.99 -0.69 119.26 123.60 1bk5 h ALA 164 Ca 0.35 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.26 1bk5 h ALA 164 Cb -0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1bk5 h ALA 164 CO -0.08 -0.46 0.44 1.96 0.00 0.00 0.00 179.25 181.11 1bk5 h GLN 165 N 0.01 0.84 -0.64 0.00 4.20 -1.74 -1.58 115.11 116.21 1bk5 h GLN 165 Ca 0.01 -0.05 -0.09 0.00 0.06 0.00 0.00 58.65 58.58 1bk5 h GLN 165 Cb 0.02 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.58 1bk5 h GLN 165 CO -0.00 0.56 0.04 1.15 -0.67 0.00 0.00 178.83 179.91 1bk5 h THR 166 N 0.87 1.27 -0.84 -0.54 2.02 -0.49 -2.98 112.91 112.21 1bk5 h THR 166 Ca 0.25 -1.12 0.04 0.00 0.77 0.00 0.00 66.41 66.34 1bk5 h THR 166 Cb -0.06 0.73 -0.05 0.00 -1.74 0.00 0.00 68.15 67.03 1bk5 h THR 166 CO -0.06 0.41 0.54 0.50 0.37 0.00 0.00 175.52 177.28 1bk5 h LYS 167 N 1.01 1.00 0.20 6.66 3.64 -0.14 -1.14 116.57 127.81 1bk5 h LYS 167 Ca 0.19 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1bk5 h LYS 167 Cb 0.52 -0.23 -0.04 0.00 -0.41 0.00 0.00 32.23 32.08 1bk5 h LYS 167 CO 0.02 0.66 -0.37 0.28 -2.27 0.00 0.00 179.45 177.78 1bk5 h VAL 168 N 1.04 0.24 -0.50 2.00 2.07 -1.33 0.38 116.25 120.15 1bk5 h VAL 168 Ca 0.34 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.90 1bk5 h VAL 168 Cb 0.03 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 29.99 1bk5 h VAL 168 CO -0.12 0.00 0.25 0.58 0.02 0.00 0.00 177.57 178.30 1bk5 h VAL 169 N -0.65 0.97 -0.14 2.57 2.07 -1.46 -1.39 116.25 118.21 1bk5 h VAL 169 Ca 0.01 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.38 1bk5 h VAL 169 Cb 0.65 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1bk5 h VAL 169 CO -0.17 0.09 0.03 0.58 0.02 0.00 0.00 177.57 178.12 1bk5 h VAL 170 N 0.50 0.94 0.00 2.57 2.07 -0.78 -2.13 116.25 119.42 1bk5 h VAL 170 Ca 0.22 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.71 1bk5 h VAL 170 Cb 0.12 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1bk5 h VAL 170 CO -0.15 0.02 -0.01 0.44 0.02 0.00 0.00 177.57 177.89 1bk5 h ASP 171 N 0.08 0.00 0.00 0.57 3.32 0.26 0.15 116.42 120.81 1bk5 h ASP 171 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1bk5 h ASP 171 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 1bk5 h ASP 171 CO -0.08 0.01 0.00 0.00 -1.72 0.00 0.00 179.24 177.44 1bk5 n ALA 172 N -2.40 2.39 -3.61 3.45 0.00 -0.57 -4.86 120.51 114.91 1bk5 n ALA 172 Ca -0.03 -0.06 -0.22 0.00 0.00 0.00 0.00 53.44 53.13 1bk5 n ALA 172 Cb 0.09 -1.15 0.07 0.00 0.00 0.00 0.00 19.45 18.46 1bk5 n ALA 172 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1bk5 n ASP 173 N -0.67 -3.68 0.08 0.00 2.03 0.54 -4.92 116.55 109.93 1bk5 n ASP 173 Ca 0.07 -0.66 -0.04 0.00 0.52 0.00 0.00 54.79 54.68 1bk5 n ASP 173 Cb 0.03 -4.70 -0.08 0.00 -0.72 0.00 0.00 41.12 35.66 1bk5 n ASP 173 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bk5 h ALA 174 N 0.94 0.50 -0.28 -1.67 0.00 -1.66 -3.38 119.26 113.72 1bk5 h ALA 174 Ca -0.59 -0.82 0.07 0.00 0.00 0.00 0.00 54.91 53.57 1bk5 h ALA 174 Cb 1.36 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 19.02 1bk5 h ALA 174 CO 0.56 1.07 -0.24 0.28 0.00 0.00 0.00 179.25 180.92 1bk5 h VAL 175 N 0.00 0.38 -0.68 0.00 2.07 -1.83 0.12 116.25 116.31 1bk5 h VAL 175 Ca -0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.56 1bk5 h VAL 175 Cb 1.66 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.77 1bk5 h VAL 175 CO 0.10 0.00 0.45 1.55 0.02 0.00 0.00 177.57 179.69 1bk5 h PRO 176 N -0.23 0.60 -0.11 1.57 0.13 -1.95 -1.46 132.00 130.55 1bk5 h PRO 176 Ca 0.15 -0.04 -0.24 0.00 -0.87 0.00 0.00 66.00 65.01 1bk5 h PRO 176 Cb 0.46 -0.13 0.01 0.00 0.13 0.00 0.00 31.00 31.47 1bk5 h PRO 176 CO -0.41 0.40 -0.86 -0.07 -0.23 0.00 0.00 178.00 176.83 1bk5 h LEU 177 N 0.62 0.94 -1.01 1.56 3.38 -1.53 -2.66 115.31 116.60 1bk5 h LEU 177 Ca 0.30 -0.66 0.04 0.00 0.09 0.00 0.00 57.88 57.66 1bk5 h LEU 177 Cb 0.39 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.80 1bk5 h LEU 177 CO -0.10 1.46 0.66 -0.26 0.09 0.00 0.00 178.44 180.29 1bk5 h PHE 178 N 0.50 1.23 -0.58 1.13 0.04 -0.52 -1.61 116.94 117.13 1bk5 h PHE 178 Ca -0.08 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.63 1bk5 h PHE 178 Cb 1.49 -0.41 -0.02 0.00 2.20 0.00 0.00 35.95 39.21 1bk5 h PHE 178 CO 0.09 0.70 -0.01 0.82 -0.60 0.00 0.00 178.31 179.31 1bk5 h ILE 179 N 1.26 1.26 0.00 -0.55 2.04 -1.21 -2.22 117.51 118.10 1bk5 h ILE 179 Ca 0.41 -1.14 -0.11 0.00 1.00 0.00 0.00 64.86 65.02 1bk5 h ILE 179 Cb 0.03 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1bk5 h ILE 179 CO -0.13 0.41 -0.53 0.06 0.00 0.00 0.00 178.15 177.96 1bk5 h GLN 180 N 0.93 0.00 0.00 2.37 3.07 -1.12 -2.26 115.11 118.10 1bk5 h GLN 180 Ca 0.17 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.87 1bk5 h GLN 180 Cb 0.55 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.10 1bk5 h GLN 180 CO 0.03 0.53 -0.15 -0.07 0.09 0.00 0.00 178.83 179.26 1bk5 h LEU 181 N 0.00 0.00 -1.41 0.06 3.38 -0.91 -1.23 115.31 115.20 1bk5 h LEU 181 Ca -0.01 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1bk5 h LEU 181 Cb 1.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1bk5 h LEU 181 CO 0.07 0.15 -0.24 -0.07 0.09 0.00 0.00 178.44 178.44 1bk5 h LEU 182 N 0.00 0.08 0.02 1.67 3.38 -0.80 0.31 115.31 119.97 1bk5 h LEU 182 Ca -0.00 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1bk5 h LEU 182 Cb 0.47 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1bk5 h LEU 182 CO 0.02 0.33 -0.01 1.88 0.09 0.00 0.00 178.44 180.75 1bk5 h TYR 183 N 0.08 -0.02 0.04 1.13 0.05 -1.29 -3.42 116.97 113.53 1bk5 h TYR 183 Ca 0.01 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.79 1bk5 h TYR 183 Cb 0.47 0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.22 1bk5 h TYR 183 CO 0.00 0.67 -0.02 1.15 -1.05 0.00 0.00 178.16 178.92 1bk5 h THR 184 N -0.96 1.18 -1.96 -2.88 2.02 -1.30 -3.49 112.91 105.52 1bk5 h THR 184 Ca -0.00 -1.72 -0.54 0.00 0.77 0.00 0.00 66.41 64.92 1bk5 h THR 184 Cb 0.70 2.17 0.23 0.00 -1.74 0.00 0.00 68.15 69.51 1bk5 h THR 184 CO 0.00 0.38 -1.75 0.61 0.37 0.00 0.00 175.52 175.13 1bk5 n GLY 185 N 1.33 -4.41 3.92 2.16 0.00 0.11 -5.00 105.19 103.29 1bk5 n GLY 185 Ca -0.07 -0.71 -0.28 0.00 0.00 0.00 0.00 46.02 44.95 1bk5 n GLY 185 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bk5 s SER 186 N -0.98 4.20 0.21 1.61 1.04 -1.26 -4.72 113.70 113.79 1bk5 s SER 186 Ca 0.41 0.54 -0.10 0.00 0.48 0.00 0.00 55.95 57.28 1bk5 s SER 186 Cb -0.21 -0.94 0.30 0.00 0.10 0.00 0.00 66.02 65.27 1bk5 s SER 186 CO 0.79 -2.06 1.69 0.58 0.98 0.00 0.00 173.24 175.22 1bk5 h VAL 187 N -1.10 0.58 -0.39 5.02 2.07 -1.99 0.72 116.25 121.17 1bk5 h VAL 187 Ca -0.45 -0.07 0.04 0.00 0.82 0.00 0.00 66.70 67.04 1bk5 h VAL 187 Cb 1.30 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 1bk5 h VAL 187 CO 0.57 0.04 0.16 -0.33 0.02 0.00 0.00 177.57 178.03 1bk5 h GLU 188 N 0.20 0.33 -0.70 1.57 5.08 -2.00 0.09 114.58 119.16 1bk5 h GLU 188 Ca 0.32 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.59 1bk5 h GLU 188 Cb 0.50 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 1bk5 h GLU 188 CO -0.45 0.22 0.16 0.28 -1.00 0.00 0.00 179.01 178.22 1bk5 h VAL 189 N 0.34 1.26 -0.45 3.13 2.07 -1.63 -2.77 116.25 118.21 1bk5 h VAL 189 Ca 0.17 -0.98 -0.06 0.00 0.82 0.00 0.00 66.70 66.66 1bk5 h VAL 189 Cb 0.12 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1bk5 h VAL 189 CO -0.15 0.37 0.05 0.11 0.02 0.00 0.00 177.57 177.97 1bk5 h LYS 190 N 1.06 0.70 0.00 1.57 1.57 -0.25 -2.25 116.57 118.97 1bk5 h LYS 190 Ca 0.22 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1bk5 h LYS 190 Cb 0.38 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1bk5 h LYS 190 CO 0.00 0.69 -0.22 0.93 -0.57 0.00 0.00 179.45 180.28 1bk5 h GLU 191 N 0.67 0.00 0.05 3.15 5.08 -0.71 -1.18 114.58 121.64 1bk5 h GLU 191 Ca 0.14 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.43 1bk5 h GLU 191 Cb 0.35 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.60 1bk5 h GLU 191 CO 0.01 0.22 -0.32 1.96 -1.00 0.00 0.00 179.01 179.88 1bk5 h GLN 192 N 0.00 0.11 -0.37 2.33 1.08 -1.39 -3.13 115.11 113.73 1bk5 h GLN 192 Ca -0.00 -0.18 0.04 0.00 -1.45 0.00 0.00 58.65 57.05 1bk5 h GLN 192 Cb 0.39 0.07 -0.04 0.00 -0.05 0.00 0.00 27.48 27.85 1bk5 h GLN 192 CO 0.03 1.09 0.15 0.00 -0.95 0.00 0.00 178.83 179.15 1bk5 h ALA 193 N 0.02 0.45 -0.46 3.87 0.00 -1.29 -0.22 119.26 121.63 1bk5 h ALA 193 Ca -0.06 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1bk5 h ALA 193 Cb 1.24 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1bk5 h ALA 193 CO 0.05 -0.23 -0.03 0.97 0.00 0.00 0.00 179.25 180.00 1bk5 h ILE 194 N 0.32 1.25 0.07 0.00 6.09 -1.36 0.76 117.51 124.63 1bk5 h ILE 194 Ca 0.17 -1.05 -0.00 0.00 -1.37 0.00 0.00 64.86 62.60 1bk5 h ILE 194 Cb 0.12 0.93 0.00 0.00 0.47 0.00 0.00 36.82 38.34 1bk5 h ILE 194 CO -0.15 0.37 -0.03 -0.25 -3.07 0.00 0.00 178.15 175.01 1bk5 h TRP 195 N 0.72 -0.08 -0.79 2.19 -0.00 -1.38 -0.12 115.95 116.48 1bk5 h TRP 195 Ca 0.14 -0.00 0.01 0.00 -0.00 0.00 0.00 58.89 59.03 1bk5 h TRP 195 Cb 0.49 0.03 -0.04 0.00 -0.00 0.00 0.00 29.16 29.64 1bk5 h TRP 195 CO 0.03 0.12 0.52 0.00 -0.00 0.00 0.00 178.44 179.11 1bk5 h ALA 196 N 0.64 1.01 -0.10 2.65 0.00 -0.83 -1.30 119.26 121.32 1bk5 h ALA 196 Ca -0.01 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1bk5 h ALA 196 Cb 0.24 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1bk5 h ALA 196 CO 0.02 0.42 -0.33 -0.07 0.00 0.00 0.00 179.25 179.29 1bk5 h LEU 197 N 1.08 0.19 -0.48 0.00 3.38 -0.73 -1.65 115.31 117.10 1bk5 h LEU 197 Ca 0.29 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 58.10 1bk5 h LEU 197 Cb -0.12 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1bk5 h LEU 197 CO -0.06 0.52 -0.08 1.23 0.09 0.00 0.00 178.44 180.14 1bk5 h GLY 198 N 1.08 0.97 1.58 0.83 0.00 -0.12 -0.15 103.07 107.26 1bk5 h GLY 198 Ca 0.02 -0.77 -0.11 0.00 0.00 0.00 0.00 47.33 46.47 1bk5 h GLY 198 CO 0.05 0.71 -0.33 3.43 0.00 0.00 0.00 176.54 180.40 1bk5 h ASN 199 N 0.74 0.49 -0.22 0.19 2.35 -0.96 -0.29 115.58 117.89 1bk5 h ASN 199 Ca 0.13 -0.19 -0.11 0.00 -0.55 0.00 0.00 56.30 55.57 1bk5 h ASN 199 Cb 0.62 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 1bk5 h ASN 199 CO 0.04 0.79 -0.31 0.58 -1.65 0.00 0.00 177.43 176.88 1bk5 h VAL 200 N 0.41 1.33 -0.20 2.81 2.07 -1.12 -2.49 116.25 119.04 1bk5 h VAL 200 Ca 0.05 -1.51 -0.05 0.00 0.82 0.00 0.00 66.70 66.01 1bk5 h VAL 200 Cb 0.78 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.32 1bk5 h VAL 200 CO 0.06 0.47 -0.10 0.00 0.02 0.00 0.00 177.57 178.01 1bk5 h ALA 201 N 0.63 1.45 -0.21 1.67 0.00 -0.85 -2.61 119.26 119.34 1bk5 h ALA 201 Ca 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1bk5 h ALA 201 Cb 0.88 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1bk5 h ALA 201 CO 0.07 0.38 0.00 0.41 0.00 0.00 0.00 179.25 180.12 1bk5 n GLY 202 N -0.85 0.52 0.10 0.00 0.00 -0.13 -3.90 105.19 100.92 1bk5 n GLY 202 Ca -0.00 -0.47 -0.15 0.00 0.00 0.00 0.00 46.02 45.41 1bk5 n GLY 202 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1bk5 h ASP 203 N 2.55 0.24 -5.12 1.61 3.58 -1.04 -3.49 116.42 114.75 1bk5 h ASP 203 Ca 0.00 -0.68 0.10 0.00 0.42 0.00 0.00 57.03 56.87 1bk5 h ASP 203 Cb 0.56 -0.07 -0.05 0.00 1.72 0.00 0.00 39.33 41.49 1bk5 h ASP 203 CO 0.00 0.88 0.33 -0.94 -2.88 0.00 0.00 179.24 176.63 1bk5 s SER 204 N -6.21 -0.19 0.27 2.28 1.04 -1.26 -5.03 113.70 104.60 1bk5 s SER 204 Ca -0.15 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 55.71 1bk5 s SER 204 Cb 0.02 0.66 0.39 0.00 0.10 0.00 0.00 66.02 67.18 1bk5 s SER 204 CO 0.74 -1.23 1.67 0.00 0.98 0.00 0.00 173.24 175.40 1bk5 h THR 205 N 2.00 1.30 -0.14 2.02 1.03 -1.94 -0.77 112.91 116.42 1bk5 h THR 205 Ca -0.22 -1.52 -0.17 0.00 -0.01 0.00 0.00 66.41 64.49 1bk5 h THR 205 Cb 1.24 1.63 -0.01 0.00 -1.07 0.00 0.00 68.15 69.94 1bk5 h THR 205 CO 0.26 0.46 -0.62 -2.24 -0.01 0.00 0.00 175.52 173.38 1bk5 h ASP 206 N 0.29 0.54 0.10 0.00 2.03 -1.96 -1.34 116.42 116.09 1bk5 h ASP 206 Ca 0.03 -0.31 -0.18 0.00 -0.73 0.00 0.00 57.03 55.83 1bk5 h ASP 206 Cb 0.83 -0.16 -0.00 0.00 -0.83 0.00 0.00 39.33 39.17 1bk5 h ASP 206 CO 0.07 1.03 -0.65 1.88 -1.03 0.00 0.00 179.24 180.53 1bk5 h TYR 207 N 0.35 0.68 -0.27 4.15 -1.99 -1.81 0.34 116.97 118.42 1bk5 h TYR 207 Ca -0.01 -0.27 0.05 0.00 2.00 0.00 0.00 58.73 60.50 1bk5 h TYR 207 Cb 1.17 -0.12 -0.05 0.00 2.00 0.00 0.00 36.73 39.73 1bk5 h TYR 207 CO 0.04 1.03 -0.07 -0.09 -0.00 0.00 0.00 178.16 179.07 1bk5 h ARG 208 N 0.38 -0.01 -0.40 4.88 2.43 -0.89 0.61 114.38 121.38 1bk5 h ARG 208 Ca -0.02 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.03 1bk5 h ARG 208 Cb 1.22 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.76 1bk5 h ARG 208 CO 0.12 -0.00 -0.24 -0.44 -1.51 0.00 0.00 179.97 177.90 1bk5 h ASP 209 N -0.01 0.82 0.14 -3.80 3.32 -1.09 -2.22 116.42 113.59 1bk5 h ASP 209 Ca 0.13 -0.30 0.02 0.00 0.02 0.00 0.00 57.03 56.89 1bk5 h ASP 209 Cb 0.20 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 1bk5 h ASP 209 CO -0.28 1.02 -0.27 0.22 -1.72 0.00 0.00 179.24 178.21 1bk5 h TYR 210 N 0.69 -0.72 -0.70 4.55 3.20 -0.01 0.18 116.97 124.16 1bk5 h TYR 210 Ca 0.09 0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.06 1bk5 h TYR 210 Cb 0.76 0.30 -0.07 0.00 1.54 0.00 0.00 36.73 39.26 1bk5 h TYR 210 CO 0.04 -0.38 0.35 0.28 -1.64 0.00 0.00 178.16 176.82 1bk5 h VAL 211 N -0.50 0.87 -0.77 1.81 2.07 -0.82 -0.35 116.25 118.57 1bk5 h VAL 211 Ca 0.02 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.30 1bk5 h VAL 211 Cb 0.51 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 1bk5 h VAL 211 CO -0.14 0.11 0.34 -0.07 0.02 0.00 0.00 177.57 177.83 1bk5 h LEU 212 N 0.61 1.02 -0.50 2.57 3.38 -0.90 -2.48 115.31 119.01 1bk5 h LEU 212 Ca 0.34 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1bk5 h LEU 212 Cb 0.33 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1bk5 h LEU 212 CO -0.25 0.88 0.00 1.56 0.09 0.00 0.00 178.44 180.72 1bk5 h GLN 213 N 1.10 0.00 0.00 1.13 7.50 -0.12 -2.09 115.11 122.63 1bk5 h GLN 213 Ca 0.26 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.41 1bk5 h GLN 213 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.69 1bk5 h GLN 213 CO -0.03 0.00 0.00 0.00 -1.50 0.00 0.00 178.83 177.30 1bk5 n ASN 215 N -0.86 -3.11 0.22 0.00 3.02 -0.79 -4.94 115.26 108.80 1bk5 n ASN 215 Ca 0.16 -0.50 0.13 0.00 -0.03 0.00 0.00 54.58 54.34 1bk5 n ASN 215 Cb 0.07 -4.34 0.25 0.00 -0.61 0.00 0.00 39.78 35.15 1bk5 n ASN 215 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bk5 h ALA 216 N 0.78 1.00 -0.79 5.41 0.00 -1.69 -3.35 119.26 120.63 1bk5 h ALA 216 Ca -0.49 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.50 1bk5 h ALA 216 Cb 1.29 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.02 1bk5 h ALA 216 CO 0.43 0.00 0.46 1.98 0.00 0.00 0.00 179.25 182.12 1bk5 h MET 217 N 0.00 0.78 0.79 0.00 -1.53 -1.84 -0.48 114.93 112.64 1bk5 h MET 217 Ca 0.00 -0.05 -0.04 0.00 -3.44 0.00 0.00 59.70 56.17 1bk5 h MET 217 Cb 0.92 -0.18 0.01 0.00 -0.55 0.00 0.00 31.60 31.80 1bk5 h MET 217 CO 0.00 0.52 -0.38 1.49 0.14 0.00 0.00 176.91 178.68 1bk5 h GLU 218 N 0.80 -1.02 -0.59 0.39 4.81 -1.99 0.08 114.58 117.06 1bk5 h GLU 218 Ca 0.36 0.07 0.07 0.00 -0.13 0.00 0.00 59.36 59.73 1bk5 h GLU 218 Cb 0.26 0.23 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 1bk5 h GLU 218 CO -0.21 -0.68 0.39 -1.00 -0.73 0.00 0.00 179.01 176.78 1bk5 h PRO 219 N -1.13 0.52 -0.42 0.92 0.13 -1.77 -2.02 132.00 128.24 1bk5 h PRO 219 Ca -0.11 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.96 1bk5 h PRO 219 Cb 0.81 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.81 1bk5 h PRO 219 CO 0.18 0.34 0.13 0.82 -0.23 0.00 0.00 178.00 179.25 1bk5 h ILE 220 N 0.54 1.22 0.00 -3.56 2.04 -0.94 -2.55 117.51 114.26 1bk5 h ILE 220 Ca 0.26 -0.72 -0.02 0.00 1.00 0.00 0.00 64.86 65.39 1bk5 h ILE 220 Cb 0.33 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1bk5 h ILE 220 CO -0.08 0.25 -0.08 -0.07 0.00 0.00 0.00 178.15 178.18 1bk5 h LEU 221 N 0.54 0.00 -0.41 1.44 3.38 -0.27 -2.42 115.31 117.57 1bk5 h LEU 221 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1bk5 h LEU 221 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1bk5 h LEU 221 CO -0.00 0.08 0.00 1.23 0.09 0.00 0.00 178.44 179.84 1bk5 h GLY 222 N 0.99 0.00 2.00 0.83 0.00 -1.01 -3.16 103.07 102.72 1bk5 h GLY 222 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1bk5 h GLY 222 CO 0.01 0.00 -0.13 1.41 0.00 0.00 0.00 176.54 177.83 1bk5 h LEU 223 N 0.00 0.00 0.00 3.11 3.38 -1.36 -2.67 115.31 117.77 1bk5 h LEU 223 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1bk5 h LEU 223 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1bk5 h LEU 223 CO 0.00 0.13 0.00 0.49 0.09 0.00 0.00 178.44 179.15 1bk5 n PHE 224 N -3.49 0.00 0.27 1.13 3.01 -1.20 -2.39 117.46 114.79 1bk5 n PHE 224 Ca -0.01 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.52 1bk5 n PHE 224 Cb 0.28 -0.09 0.23 0.00 -0.01 0.00 0.00 39.48 39.88 1bk5 n PHE 224 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1bk5 n ASN 225 N -1.09 3.00 -4.96 4.37 3.02 -1.00 -4.88 115.26 113.71 1bk5 n ASN 225 Ca 0.19 -2.16 -0.19 0.00 -0.03 0.00 0.00 54.58 52.38 1bk5 n ASN 225 Cb 0.14 -0.40 0.00 0.00 -0.61 0.00 0.00 39.78 38.91 1bk5 n ASN 225 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1bk5 s SER 226 N -0.87 5.32 -0.15 6.41 1.04 -1.01 -5.06 113.70 119.38 1bk5 s SER 226 Ca 0.33 -0.64 0.18 0.00 0.48 0.00 0.00 55.95 56.31 1bk5 s SER 226 Cb 0.20 -0.44 0.39 0.00 0.10 0.00 0.00 66.02 66.27 1bk5 s SER 226 CO 0.19 -0.82 1.26 -0.46 0.98 0.00 0.00 173.24 174.39 1bk5 n ASN 227 N -1.80 2.97 -4.49 7.02 0.23 -1.26 -4.97 115.26 112.97 1bk5 n ASN 227 Ca 0.07 -3.07 -0.41 0.00 -0.53 0.00 0.00 54.58 50.64 1bk5 n ASN 227 Cb 0.61 -0.48 -0.11 0.00 -2.08 0.00 0.00 39.78 37.72 1bk5 n ASN 227 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 1bk5 s LYS 228 N -2.87 3.25 0.16 -3.83 2.20 -1.26 -4.99 119.74 112.40 1bk5 s LYS 228 Ca 0.36 -0.81 -0.25 0.00 -0.36 0.00 0.00 55.97 54.91 1bk5 s LYS 228 Cb 0.31 -3.84 0.03 0.00 -1.51 0.00 0.00 37.83 32.81 1bk5 s LYS 228 CO 0.05 -0.56 1.59 -1.00 -0.36 0.00 0.00 175.35 175.06 1bk5 h PRO 229 N 8.52 -0.29 -0.91 4.03 0.13 -1.99 -1.49 132.00 140.00 1bk5 h PRO 229 Ca -0.29 0.02 0.11 0.00 -0.87 0.00 0.00 66.00 64.96 1bk5 h PRO 229 Cb 1.14 0.07 -0.08 0.00 0.13 0.00 0.00 31.00 32.26 1bk5 h PRO 229 CO 0.67 -0.20 0.54 0.66 -0.23 0.00 0.00 178.00 179.45 1bk5 h SER 230 N -0.30 0.79 -0.50 1.44 4.64 -1.99 1.00 113.55 118.62 1bk5 h SER 230 Ca 0.15 0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.41 1bk5 h SER 230 Cb 0.57 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.53 1bk5 h SER 230 CO -0.54 0.43 -0.12 0.25 -0.87 0.00 0.00 176.83 175.98 1bk5 h LEU 231 N 0.88 0.99 -0.96 5.97 5.85 -1.85 -2.45 115.31 123.74 1bk5 h LEU 231 Ca 0.45 -0.33 -0.10 0.00 0.84 0.00 0.00 57.88 58.74 1bk5 h LEU 231 Cb 0.43 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1bk5 h LEU 231 CO -0.26 1.11 -0.28 0.40 -0.34 0.00 0.00 178.44 179.07 1bk5 h ILE 232 N 0.88 1.27 0.89 4.05 1.08 -0.19 -1.80 117.51 123.69 1bk5 h ILE 232 Ca 0.14 -1.29 -0.04 0.00 -0.39 0.00 0.00 64.86 63.27 1bk5 h ILE 232 Cb 0.67 1.41 0.01 0.00 -3.07 0.00 0.00 36.82 35.85 1bk5 h ILE 232 CO 0.05 0.40 -0.43 0.03 -0.69 0.00 0.00 178.15 177.52 1bk5 h ARG 233 N 0.37 -1.15 -0.43 2.37 3.08 -0.55 0.94 114.38 119.00 1bk5 h ARG 233 Ca 0.05 0.08 0.09 0.00 0.07 0.00 0.00 59.98 60.27 1bk5 h ARG 233 Cb 0.69 0.26 -0.09 0.00 0.08 0.00 0.00 29.97 30.90 1bk5 h ARG 233 CO 0.05 -0.77 -0.25 1.15 -1.07 0.00 0.00 179.97 179.09 1bk5 h THR 234 N -1.20 0.33 -0.57 2.04 2.02 -1.43 0.30 112.91 114.40 1bk5 h THR 234 Ca -0.12 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.16 1bk5 h THR 234 Cb 0.92 0.33 -0.08 0.00 -1.74 0.00 0.00 68.15 67.57 1bk5 h THR 234 CO 0.20 0.00 0.13 0.00 0.37 0.00 0.00 175.52 176.22 1bk5 h ALA 235 N 1.05 0.67 -0.77 6.16 0.00 -1.22 0.30 119.26 125.46 1bk5 h ALA 235 Ca 0.20 0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 1bk5 h ALA 235 Cb 0.48 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1bk5 h ALA 235 CO -0.53 -0.30 0.29 1.15 0.00 0.00 0.00 179.25 179.87 1bk5 h THR 236 N 0.26 1.26 -0.20 0.00 2.02 0.12 0.13 112.91 116.50 1bk5 h THR 236 Ca 0.30 -0.84 -0.00 0.00 0.77 0.00 0.00 66.41 66.64 1bk5 h THR 236 Cb 0.42 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 1bk5 h THR 236 CO -0.37 0.34 0.12 -0.25 0.37 0.00 0.00 175.52 175.73 1bk5 h TRP 237 N 1.12 0.26 -0.56 3.16 7.01 0.12 -1.16 115.95 125.90 1bk5 h TRP 237 Ca 0.25 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 61.22 1bk5 h TRP 237 Cb 0.24 -0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 27.18 1bk5 h TRP 237 CO 0.02 0.20 0.20 1.15 -2.79 0.00 0.00 178.44 177.22 1bk5 h THR 238 N 0.25 1.21 -0.72 2.65 2.02 -0.17 -2.08 112.91 116.07 1bk5 h THR 238 Ca 0.07 -0.68 -0.03 0.00 0.77 0.00 0.00 66.41 66.54 1bk5 h THR 238 Cb 0.01 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 1bk5 h THR 238 CO -0.01 0.26 0.32 0.25 0.37 0.00 0.00 175.52 176.71 1bk5 h LEU 239 N 0.81 0.96 -0.96 2.58 5.85 -0.46 -2.25 115.31 121.84 1bk5 h LEU 239 Ca 0.19 -0.15 -0.09 0.00 0.84 0.00 0.00 57.88 58.67 1bk5 h LEU 239 Cb 0.19 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1bk5 h LEU 239 CO -0.01 0.85 -0.16 0.77 -0.34 0.00 0.00 178.44 179.54 1bk5 h SER 240 N 1.01 0.56 0.44 1.25 4.64 -0.62 -2.03 113.55 118.81 1bk5 h SER 240 Ca 0.24 -0.17 -0.03 0.00 -0.47 0.00 0.00 61.79 61.37 1bk5 h SER 240 Cb 0.16 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1bk5 h SER 240 CO -0.03 0.74 -0.15 0.78 -0.87 0.00 0.00 176.83 177.30 1bk5 h ASN 241 N 0.51 0.00 1.15 4.97 2.35 -0.84 -1.75 115.58 121.98 1bk5 h ASN 241 Ca 0.09 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.67 1bk5 h ASN 241 Cb 0.58 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.93 1bk5 h ASN 241 CO 0.04 0.15 -0.87 -0.07 -1.65 0.00 0.00 177.43 175.03 1bk5 h LEU 242 N 0.00 0.00 0.00 1.61 3.38 -0.87 -3.31 115.31 116.12 1bk5 h LEU 242 Ca -0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1bk5 h LEU 242 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1bk5 h LEU 242 CO 0.02 0.72 -0.84 0.00 0.09 0.00 0.00 178.44 178.43 1bk5 s ARG 244 N -3.11 4.08 0.00 0.00 3.52 -0.71 -4.54 118.95 118.19 1bk5 s ARG 244 Ca 0.01 1.61 0.00 0.00 -0.13 0.00 0.00 55.73 57.22 1bk5 s ARG 244 Cb 0.08 -2.54 0.00 0.00 -1.56 0.00 0.00 34.95 30.93 1bk5 s ARG 244 CO 0.77 -0.24 0.00 0.41 -0.81 0.00 0.00 175.30 175.43 1bk5 n GLY 245 N 0.41 3.61 0.01 8.12 0.00 -1.26 -4.72 105.19 111.37 1bk5 n GLY 245 Ca 0.05 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1bk5 n GLY 245 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bk5 n LYS 246 N 0.31 1.64 -0.11 1.61 5.02 -1.26 -4.09 118.16 121.29 1bk5 n LYS 246 Ca 0.00 -0.01 -0.03 0.00 -2.02 0.00 0.00 58.31 56.25 1bk5 n LYS 246 Cb 0.00 -1.07 0.02 0.00 -0.02 0.00 0.00 35.03 33.96 1bk5 n LYS 246 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1bk5 n LYS 247 N -1.82 -0.97 0.00 1.97 4.76 -1.26 -3.47 118.16 117.36 1bk5 n LYS 247 Ca -0.02 -0.16 0.00 0.00 -2.87 0.00 0.00 58.31 55.25 1bk5 n LYS 247 Cb 0.30 -0.14 0.00 0.00 -1.84 0.00 0.00 35.03 33.35 1bk5 n LYS 247 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1bk5 n PRO 248 N -1.69 0.00 -2.06 1.97 -0.02 -1.26 -4.72 135.00 127.22 1bk5 n PRO 248 Ca 0.01 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.09 1bk5 n PRO 248 Cb 0.05 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.52 1bk5 n PRO 248 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1bk5 s GLN 249 N 0.00 4.22 0.81 -0.52 2.00 -1.23 -4.85 119.66 120.09 1bk5 s GLN 249 Ca 0.00 2.24 -0.13 0.00 -2.00 0.00 0.00 55.36 55.47 1bk5 s GLN 249 Cb 0.00 -2.97 0.08 0.00 0.80 0.00 0.00 33.01 30.92 1bk5 s GLN 249 CO 0.00 -0.31 1.21 -1.25 -0.50 0.00 0.00 175.29 174.44 1bk5 s PRO 250 N -1.95 1.62 -0.70 1.67 0.04 -1.26 -4.76 135.00 129.66 1bk5 s PRO 250 Ca 0.51 1.78 -0.25 0.00 0.04 0.00 0.00 61.00 63.08 1bk5 s PRO 250 Cb -0.40 -1.77 -0.14 0.00 0.04 0.00 0.00 34.50 32.23 1bk5 s PRO 250 CO 0.53 -2.23 2.45 -3.47 0.04 0.00 0.00 177.00 174.31 1bk5 n ASP 251 N -3.28 1.50 -0.08 6.66 -0.08 -1.26 -4.80 116.55 115.20 1bk5 n ASP 251 Ca 0.14 -0.63 0.21 0.00 -1.51 0.00 0.00 54.79 53.00 1bk5 n ASP 251 Cb 0.50 -1.39 0.65 0.00 2.34 0.00 0.00 41.12 43.22 1bk5 n ASP 251 CO 0.00 0.00 0.00 -0.25 0.12 0.00 0.00 177.20 177.07 1bk5 h TRP 252 N 15.87 0.12 0.00 -0.67 2.91 -1.99 -0.22 115.95 131.98 1bk5 h TRP 252 Ca -0.12 0.00 -0.05 0.00 1.13 0.00 0.00 58.89 59.85 1bk5 h TRP 252 Cb 1.20 -0.04 -0.01 0.00 -0.51 0.00 0.00 29.16 29.81 1bk5 h TRP 252 CO 1.07 0.04 -0.23 0.66 -1.03 0.00 0.00 178.44 178.96 1bk5 h SER 253 N 0.10 0.00 0.00 2.65 4.64 -2.00 -2.15 113.55 116.79 1bk5 h SER 253 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1bk5 h SER 253 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1bk5 h SER 253 CO -0.03 0.23 -0.17 0.58 -0.87 0.00 0.00 176.83 176.56 1bk5 h VAL 254 N 0.00 0.00 -0.53 0.95 2.07 -1.44 -3.40 116.25 113.90 1bk5 h VAL 254 Ca -0.00 -0.76 0.13 0.00 0.82 0.00 0.00 66.70 66.89 1bk5 h VAL 254 Cb 0.40 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.15 1bk5 h VAL 254 CO 0.03 0.00 0.37 -0.37 0.02 0.00 0.00 177.57 177.62 1bk5 h VAL 255 N -0.76 0.80 0.00 2.57 -1.51 -1.49 -1.34 116.25 114.52 1bk5 h VAL 255 Ca 0.00 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 65.42 1bk5 h VAL 255 Cb 0.17 0.64 0.00 0.00 -2.13 0.00 0.00 31.29 29.97 1bk5 h VAL 255 CO 0.00 0.03 0.00 -1.54 -1.23 0.00 0.00 177.57 174.83 1bk5 n SER 256 N -4.43 0.63 0.14 4.19 3.41 -0.81 -1.68 113.62 115.07 1bk5 n SER 256 Ca 0.09 0.72 0.12 0.00 -0.26 0.00 0.00 58.87 59.54 1bk5 n SER 256 Cb 0.50 -0.83 0.50 0.00 -0.26 0.00 0.00 64.21 64.13 1bk5 n SER 256 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bk5 n GLN 257 N -2.26 0.19 0.13 4.33 6.02 -0.51 -2.53 117.38 122.75 1bk5 n GLN 257 Ca 0.00 0.44 0.05 0.00 -0.01 0.00 0.00 57.00 57.49 1bk5 n GLN 257 Cb 0.13 -1.89 0.03 0.00 1.02 0.00 0.00 30.24 29.54 1bk5 n GLN 257 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1bk5 h ALA 258 N 2.24 0.72 -0.92 -1.58 0.00 -1.52 -3.39 119.26 114.82 1bk5 h ALA 258 Ca 0.00 -0.37 0.21 0.00 0.00 0.00 0.00 54.91 54.75 1bk5 h ALA 258 Cb 0.34 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 17.97 1bk5 h ALA 258 CO 0.00 0.47 -0.09 -0.07 0.00 0.00 0.00 179.25 179.56 1bk5 h LEU 259 N 0.00 -0.62 -0.59 0.00 3.38 -1.67 -0.29 115.31 115.52 1bk5 h LEU 259 Ca -0.03 0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1bk5 h LEU 259 Cb 1.29 0.50 -0.03 0.00 0.09 0.00 0.00 40.66 42.51 1bk5 h LEU 259 CO 0.04 -0.30 0.37 -0.65 0.09 0.00 0.00 178.44 177.99 1bk5 h PRO 260 N 0.02 0.78 -0.33 1.13 0.11 -1.83 0.36 132.00 132.24 1bk5 h PRO 260 Ca 0.50 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.50 1bk5 h PRO 260 Cb 0.89 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.82 1bk5 h PRO 260 CO -0.88 0.54 0.03 1.15 -0.21 0.00 0.00 178.00 178.63 1bk5 h THR 261 N 0.79 1.25 -0.88 -1.15 2.02 -1.47 -2.82 112.91 110.64 1bk5 h THR 261 Ca 0.21 -0.89 0.06 0.00 0.77 0.00 0.00 66.41 66.56 1bk5 h THR 261 Cb -0.05 1.18 -0.06 0.00 -1.74 0.00 0.00 68.15 67.48 1bk5 h THR 261 CO -0.04 0.30 0.57 -0.07 0.37 0.00 0.00 175.52 176.65 1bk5 h LEU 262 N 0.39 0.89 -1.81 2.58 4.07 -0.84 0.28 115.31 120.86 1bk5 h LEU 262 Ca 0.10 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.03 1bk5 h LEU 262 Cb 0.40 -0.19 -0.00 0.00 1.08 0.00 0.00 40.66 41.95 1bk5 h LEU 262 CO 0.01 0.57 -0.13 0.00 -1.08 0.00 0.00 178.44 177.82 1bk5 h ALA 263 N 1.52 1.65 0.13 1.53 0.00 -0.68 -2.59 119.26 120.82 1bk5 h ALA 263 Ca 0.38 -0.12 -0.33 0.00 0.00 0.00 0.00 54.91 54.83 1bk5 h ALA 263 Cb 0.18 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1bk5 h ALA 263 CO -0.14 0.16 -1.73 0.87 0.00 0.00 0.00 179.25 178.41 1bk5 h LYS 264 N 0.00 0.28 -0.02 0.00 1.57 -1.04 -3.36 116.57 114.01 1bk5 h LYS 264 Ca -0.00 -0.48 0.01 0.00 -1.87 0.00 0.00 60.65 58.30 1bk5 h LYS 264 Cb 0.25 0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 1bk5 h LYS 264 CO 0.02 1.16 0.01 -0.07 -0.57 0.00 0.00 179.45 180.00 1bk5 h LEU 265 N 0.08 0.00 -0.46 2.94 3.38 -0.63 -1.80 115.31 118.82 1bk5 h LEU 265 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1bk5 h LEU 265 Cb 2.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.80 1bk5 h LEU 265 CO 0.14 0.00 0.00 2.30 0.09 0.00 0.00 178.44 180.97 1bk5 n ILE 266 N -4.29 0.00 -0.21 1.22 -5.35 -1.03 -1.05 119.36 108.65 1bk5 n ILE 266 Ca -0.03 0.00 0.01 0.00 -0.27 0.00 0.00 62.75 62.47 1bk5 n ILE 266 Cb 0.11 -0.24 0.02 0.00 -1.74 0.00 0.00 39.64 37.78 1bk5 n ILE 266 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1bk5 n TYR 267 N -0.22 0.00 -1.77 4.28 4.01 -0.68 -5.02 117.16 117.77 1bk5 n TYR 267 Ca 0.00 -0.52 -0.35 0.00 -0.16 0.00 0.00 57.90 56.88 1bk5 n TYR 267 Cb 0.09 -0.06 0.06 0.00 -0.31 0.00 0.00 39.34 39.12 1bk5 n TYR 267 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1bk5 s SER 268 N -1.14 4.83 0.17 7.72 0.15 -0.22 -4.95 113.70 120.27 1bk5 s SER 268 Ca 0.04 2.31 0.17 0.00 0.70 0.00 0.00 55.95 59.16 1bk5 s SER 268 Cb 0.03 -2.59 -0.03 0.00 -1.71 0.00 0.00 66.02 61.72 1bk5 s SER 268 CO 0.00 -1.83 1.12 0.24 1.20 0.00 0.00 173.24 173.97 1bk5 h MET 269 N 0.33 0.00 -6.11 5.44 2.86 -1.98 -3.45 114.93 112.02 1bk5 h MET 269 Ca -0.49 0.00 -0.58 0.00 -2.06 0.00 0.00 59.70 56.58 1bk5 h MET 269 Cb 1.29 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.89 1bk5 h MET 269 CO 0.53 0.35 0.80 0.34 1.06 0.00 0.00 176.91 179.99 1bk5 s ASP 270 N -6.05 7.08 0.14 1.22 2.15 -1.26 -4.96 116.67 115.00 1bk5 s ASP 270 Ca 0.00 1.46 -0.15 0.00 0.43 0.00 0.00 52.55 54.29 1bk5 s ASP 270 Cb 0.08 -2.54 0.02 0.00 -0.30 0.00 0.00 42.92 40.18 1bk5 s ASP 270 CO 0.78 -0.67 1.71 0.74 -0.17 0.00 0.00 175.17 177.56 1bk5 h THR 271 N 5.42 1.19 -0.94 1.71 2.02 -2.00 -1.52 112.91 118.80 1bk5 h THR 271 Ca -0.22 -0.58 0.01 0.00 0.77 0.00 0.00 66.41 66.40 1bk5 h THR 271 Cb 1.08 0.75 -0.05 0.00 -1.74 0.00 0.00 68.15 68.19 1bk5 h THR 271 CO 0.97 0.22 0.62 -0.33 0.37 0.00 0.00 175.52 177.36 1bk5 h GLU 272 N 0.58 1.23 -0.38 6.66 5.08 -1.99 -0.78 114.58 124.98 1bk5 h GLU 272 Ca 0.15 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1bk5 h GLU 272 Cb 0.16 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1bk5 h GLU 272 CO -0.02 0.81 0.21 1.15 -1.00 0.00 0.00 179.01 180.16 1bk5 h THR 273 N 1.27 1.15 -0.06 1.13 2.02 -1.86 -1.84 112.91 114.71 1bk5 h THR 273 Ca 0.34 -0.38 0.03 0.00 0.77 0.00 0.00 66.41 67.17 1bk5 h THR 273 Cb -0.14 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 66.94 1bk5 h THR 273 CO -0.08 0.15 -0.14 -0.07 0.37 0.00 0.00 175.52 175.76 1bk5 h LEU 274 N 0.48 -0.41 0.04 2.58 3.38 -0.62 -1.47 115.31 119.31 1bk5 h LEU 274 Ca 0.13 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.20 1bk5 h LEU 274 Cb 0.06 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 1bk5 h LEU 274 CO -0.02 -0.18 -0.40 0.58 0.09 0.00 0.00 178.44 178.50 1bk5 h VAL 275 N -0.20 0.18 -0.12 1.22 2.07 -0.95 -0.67 116.25 117.78 1bk5 h VAL 275 Ca 0.07 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.54 1bk5 h VAL 275 Cb 0.29 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 1bk5 h VAL 275 CO -0.18 0.00 -0.13 0.44 0.02 0.00 0.00 177.57 177.72 1bk5 h ASP 276 N -0.59 0.18 -0.50 0.57 3.32 -1.24 -0.54 116.42 117.62 1bk5 h ASP 276 Ca 0.04 -0.03 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 1bk5 h ASP 276 Cb 0.65 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 1bk5 h ASP 276 CO -0.28 0.33 -0.08 0.00 -1.72 0.00 0.00 179.24 177.49 1bk5 h ALA 277 N 1.69 0.69 -0.30 3.45 0.00 -0.84 0.54 119.26 124.48 1bk5 h ALA 277 Ca 0.04 -0.33 -0.12 0.00 0.00 0.00 0.00 54.91 54.50 1bk5 h ALA 277 Cb 0.35 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1bk5 h ALA 277 CO 0.02 0.57 -0.31 0.00 0.00 0.00 0.00 179.25 179.53 1bk5 h TRP 279 N 0.55 0.86 -0.38 0.00 4.06 -0.82 -0.90 115.95 119.33 1bk5 h TRP 279 Ca 0.06 -0.14 0.01 0.00 2.06 0.00 0.00 58.89 60.88 1bk5 h TRP 279 Cb 0.81 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 28.72 1bk5 h TRP 279 CO 0.04 0.83 0.24 0.00 -3.56 0.00 0.00 178.44 175.98 1bk5 h ALA 280 N 0.92 0.48 -0.72 1.49 0.00 -0.69 -1.57 119.26 119.17 1bk5 h ALA 280 Ca 0.13 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1bk5 h ALA 280 Cb 0.48 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1bk5 h ALA 280 CO 0.02 -0.09 0.43 0.82 0.00 0.00 0.00 179.25 180.44 1bk5 h ILE 281 N 0.48 1.20 -0.14 0.00 2.04 -1.01 -1.36 117.51 118.72 1bk5 h ILE 281 Ca 0.14 -0.44 -0.10 0.00 1.00 0.00 0.00 64.86 65.47 1bk5 h ILE 281 Cb -0.03 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.22 1bk5 h ILE 281 CO -0.05 0.21 -0.34 0.77 0.00 0.00 0.00 178.15 178.74 1bk5 h SER 282 N 0.99 0.28 -0.25 1.72 4.64 -0.54 -1.03 113.55 119.36 1bk5 h SER 282 Ca 0.26 -0.10 -0.17 0.00 -0.47 0.00 0.00 61.79 61.31 1bk5 h SER 282 Cb -0.04 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1bk5 h SER 282 CO -0.05 0.61 -0.47 1.88 -0.87 0.00 0.00 176.83 177.93 1bk5 h TYR 283 N 0.24 1.01 0.00 4.77 0.05 -0.52 -2.30 116.97 120.23 1bk5 h TYR 283 Ca 0.03 -0.33 -0.10 0.00 0.05 0.00 0.00 58.73 58.38 1bk5 h TYR 283 Cb 0.72 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 38.25 1bk5 h TYR 283 CO 0.01 1.13 -0.47 -0.07 -1.05 0.00 0.00 178.16 177.72 1bk5 h LEU 284 N 0.65 0.00 -0.42 3.88 3.38 -1.00 -2.72 115.31 119.08 1bk5 h LEU 284 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1bk5 h LEU 284 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1bk5 h LEU 284 CO 0.11 0.47 -0.04 -1.20 0.09 0.00 0.00 178.44 177.86 1bk5 n SER 285 N -3.69 0.69 -3.64 -0.43 7.64 -0.41 -4.18 113.62 109.59 1bk5 n SER 285 Ca -0.01 -1.04 -0.41 0.00 1.01 0.00 0.00 58.87 58.42 1bk5 n SER 285 Cb 0.54 -0.02 0.01 0.00 -1.01 0.00 0.00 64.21 63.73 1bk5 n SER 285 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1bk5 n ASP 286 N -0.57 7.30 -0.54 6.43 -0.08 -0.88 -4.47 116.55 123.74 1bk5 n ASP 286 Ca 0.19 -3.40 0.00 0.00 -1.51 0.00 0.00 54.79 50.06 1bk5 n ASP 286 Cb 0.25 -1.28 0.00 0.00 2.34 0.00 0.00 41.12 42.43 1bk5 n ASP 286 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1bk5 n GLY 287 N 1.01 2.87 3.46 0.27 0.00 -1.26 -5.00 105.19 106.54 1bk5 n GLY 287 Ca 0.50 -1.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.18 1bk5 n GLY 287 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1bk5 s PRO 288 N -0.63 -2.24 0.36 1.61 0.04 -1.26 -4.68 135.00 128.19 1bk5 s PRO 288 Ca 0.00 -0.10 0.08 0.00 0.04 0.00 0.00 61.00 61.01 1bk5 s PRO 288 Cb 0.00 -1.48 0.79 0.00 0.04 0.00 0.00 34.50 33.85 1bk5 s PRO 288 CO 0.00 -4.37 1.90 1.96 0.04 0.00 0.00 177.00 176.53 1bk5 h GLN 289 N -3.05 0.70 -0.47 4.56 4.20 -1.99 -1.50 115.11 117.56 1bk5 h GLN 289 Ca -0.42 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.30 1bk5 h GLN 289 Cb 1.31 -0.16 -0.05 0.00 0.30 0.00 0.00 27.48 28.88 1bk5 h GLN 289 CO 0.27 0.46 0.21 1.49 -0.67 0.00 0.00 178.83 180.59 1bk5 h GLU 290 N 0.72 0.40 0.78 1.46 4.81 -1.99 0.27 114.58 121.02 1bk5 h GLU 290 Ca 0.40 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.57 1bk5 h GLU 290 Cb 0.56 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.85 1bk5 h GLU 290 CO -0.16 0.26 -0.37 0.00 -0.73 0.00 0.00 179.01 178.00 1bk5 h ALA 291 N 1.28 -1.05 -0.51 2.92 0.00 -1.60 -2.00 119.26 118.30 1bk5 h ALA 291 Ca 0.21 -0.23 0.10 0.00 0.00 0.00 0.00 54.91 54.99 1bk5 h ALA 291 Cb 0.16 0.41 -0.08 0.00 0.00 0.00 0.00 17.79 18.28 1bk5 h ALA 291 CO -0.18 -1.06 0.01 0.82 0.00 0.00 0.00 179.25 178.84 1bk5 h ILE 292 N -1.10 0.61 -0.39 0.00 2.04 -1.17 0.64 117.51 118.14 1bk5 h ILE 292 Ca -0.11 -0.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1bk5 h ILE 292 Cb 0.81 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1bk5 h ILE 292 CO 0.18 0.02 0.23 -0.61 0.00 0.00 0.00 178.15 177.97 1bk5 h GLN 293 N 0.13 0.52 -0.65 2.37 5.75 -0.44 -0.92 115.11 121.87 1bk5 h GLN 293 Ca 0.26 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.69 1bk5 h GLN 293 Cb 0.39 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.79 1bk5 h GLN 293 CO -0.41 0.37 0.31 0.00 -2.65 0.00 0.00 178.83 176.44 1bk5 h ALA 294 N 1.72 0.83 -0.17 3.38 0.00 -0.12 0.24 119.26 125.15 1bk5 h ALA 294 Ca 0.14 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1bk5 h ALA 294 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1bk5 h ALA 294 CO -0.03 0.40 -0.30 0.28 0.00 0.00 0.00 179.25 179.61 1bk5 h VAL 295 N 0.89 1.27 -0.25 0.00 2.07 -0.45 -2.99 116.25 116.79 1bk5 h VAL 295 Ca 0.22 -1.28 -0.08 0.00 0.82 0.00 0.00 66.70 66.38 1bk5 h VAL 295 Cb 0.12 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 1bk5 h VAL 295 CO -0.03 0.39 -0.17 0.40 0.02 0.00 0.00 177.57 178.18 1bk5 h ILE 296 N 0.29 1.31 -0.02 4.57 2.04 -0.48 -3.08 117.51 122.14 1bk5 h ILE 296 Ca 0.04 -1.30 -0.05 0.00 1.00 0.00 0.00 64.86 64.56 1bk5 h ILE 296 Cb 0.67 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.34 1bk5 h ILE 296 CO 0.05 0.40 -0.21 0.44 0.00 0.00 0.00 178.15 178.83 1bk5 h ASP 297 N 0.28 0.03 -0.17 1.72 3.32 -0.85 -1.77 116.42 118.98 1bk5 h ASP 297 Ca 0.05 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1bk5 h ASP 297 Cb 0.70 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1bk5 h ASP 297 CO 0.05 0.25 0.00 0.55 -1.72 0.00 0.00 179.24 178.37 1bk5 n VAL 298 N -4.27 0.63 -4.06 -1.35 3.14 -1.14 -4.89 118.33 106.39 1bk5 n VAL 298 Ca -0.02 -0.36 -0.32 0.00 -2.96 0.00 0.00 64.34 60.68 1bk5 n VAL 298 Cb 0.28 -0.27 -0.01 0.00 -1.06 0.00 0.00 33.84 32.78 1bk5 n VAL 298 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1bk5 n ARG 299 N 0.16 -4.02 0.14 1.45 1.74 -0.67 -4.90 116.66 110.55 1bk5 n ARG 299 Ca 0.08 0.46 -0.23 0.00 -0.77 0.00 0.00 57.85 57.39 1bk5 n ARG 299 Cb 0.42 -5.14 -0.15 0.00 -1.02 0.00 0.00 32.46 26.57 1bk5 n ARG 299 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1bk5 h ILE 300 N -1.76 1.31 -0.95 0.55 2.04 -1.73 -3.40 117.51 113.57 1bk5 h ILE 300 Ca -0.59 -2.77 0.15 0.00 1.00 0.00 0.00 64.86 62.65 1bk5 h ILE 300 Cb 1.38 3.01 -0.15 0.00 -0.74 0.00 0.00 36.82 40.31 1bk5 h ILE 300 CO 0.71 0.83 -0.36 -2.65 0.00 0.00 0.00 178.15 176.68 1bk5 n PRO 301 N -3.67 -0.21 -0.24 2.37 -0.02 -1.26 -1.45 135.00 130.52 1bk5 n PRO 301 Ca -0.16 1.46 -0.02 0.00 -2.02 0.00 0.00 63.50 62.76 1bk5 n PRO 301 Cb 1.09 -2.17 0.17 0.00 -0.02 0.00 0.00 33.50 32.57 1bk5 n PRO 301 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1bk5 h LYS 302 N 0.00 1.05 -0.45 -0.52 1.63 -1.91 -1.17 116.57 115.21 1bk5 h LYS 302 Ca 0.34 -0.13 -0.11 0.00 -0.85 0.00 0.00 60.65 59.90 1bk5 h LYS 302 Cb 0.57 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 31.98 1bk5 h LYS 302 CO -0.94 0.79 -0.15 -0.09 -3.45 0.00 0.00 179.45 175.61 1bk5 h ARG 303 N 1.05 0.85 -0.79 1.90 9.65 -1.48 -1.89 114.38 123.67 1bk5 h ARG 303 Ca 0.26 -0.32 0.02 0.00 -1.10 0.00 0.00 59.98 58.85 1bk5 h ARG 303 Cb 0.07 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.55 1bk5 h ARG 303 CO -0.04 0.95 0.51 -0.07 2.80 0.00 0.00 179.97 184.12 1bk5 h LEU 304 N 0.75 0.87 -1.00 3.80 4.07 -0.66 -1.33 115.31 121.82 1bk5 h LEU 304 Ca 0.12 -0.02 -0.07 0.00 0.08 0.00 0.00 57.88 57.99 1bk5 h LEU 304 Cb 0.67 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 42.19 1bk5 h LEU 304 CO 0.05 0.62 -0.08 0.58 -1.08 0.00 0.00 178.44 178.53 1bk5 h VAL 305 N 1.03 1.24 -0.31 1.22 2.07 -0.85 -2.62 116.25 118.03 1bk5 h VAL 305 Ca 0.30 -1.03 -0.12 0.00 0.82 0.00 0.00 66.70 66.67 1bk5 h VAL 305 Cb -0.07 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1bk5 h VAL 305 CO -0.08 0.35 -0.31 -0.33 0.02 0.00 0.00 177.57 177.21 1bk5 h GLU 306 N 0.59 0.66 0.00 1.57 5.08 -0.56 -2.83 114.58 119.09 1bk5 h GLU 306 Ca 0.11 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1bk5 h GLU 306 Cb 0.49 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1bk5 h GLU 306 CO 0.03 0.89 0.00 1.28 -1.00 0.00 0.00 179.01 180.21 1bk5 n LEU 307 N -4.08 0.47 0.28 1.33 4.77 -0.58 -2.51 117.00 116.68 1bk5 n LEU 307 Ca -0.01 0.64 0.16 0.00 -0.03 0.00 0.00 56.01 56.78 1bk5 n LEU 307 Cb 0.47 -0.61 0.74 0.00 -2.33 0.00 0.00 43.42 41.69 1bk5 n LEU 307 CO 0.45 -0.58 0.99 -0.07 -1.33 0.00 0.00 177.39 176.84 1bk5 h LEU 308 N 0.00 0.00 -3.45 2.23 3.38 -1.34 -2.25 115.31 113.88 1bk5 h LEU 308 Ca 0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 1bk5 h LEU 308 Cb 0.23 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.91 1bk5 h LEU 308 CO 0.00 0.06 0.08 -1.54 0.09 0.00 0.00 178.44 177.12 1bk5 n SER 309 N -3.22 3.77 -4.77 -0.43 3.41 -1.04 -4.87 113.62 106.47 1bk5 n SER 309 Ca -0.00 -3.31 -0.38 0.00 -0.26 0.00 0.00 58.87 54.92 1bk5 n SER 309 Cb 0.28 -0.64 -0.01 0.00 -0.26 0.00 0.00 64.21 63.58 1bk5 n SER 309 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1bk5 s HIS 310 N -3.01 2.92 0.57 7.33 5.04 -0.85 -4.88 115.29 122.41 1bk5 s HIS 310 Ca 0.47 1.51 0.29 0.00 -1.54 0.00 0.00 55.06 55.79 1bk5 s HIS 310 Cb 0.39 -3.46 1.48 0.00 0.04 0.00 0.00 32.58 31.03 1bk5 s HIS 310 CO 0.08 -1.60 1.92 1.05 -2.34 0.00 0.00 174.74 173.85 1bk5 h GLU 311 N 2.38 0.00 -5.73 2.88 4.11 -1.94 -3.43 114.58 112.86 1bk5 h GLU 311 Ca -0.49 0.00 -0.66 0.00 0.07 0.00 0.00 59.36 58.28 1bk5 h GLU 311 Cb 1.24 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.34 1bk5 h GLU 311 CO 0.61 0.00 -0.60 0.45 0.07 0.00 0.00 179.01 179.54 1bk5 s SER 312 N -5.48 5.39 0.54 3.06 0.15 -1.26 -4.98 113.70 111.12 1bk5 s SER 312 Ca -0.04 0.14 0.32 0.00 0.70 0.00 0.00 55.95 57.07 1bk5 s SER 312 Cb 0.17 -1.67 1.36 0.00 -1.71 0.00 0.00 66.02 64.17 1bk5 s SER 312 CO 0.62 0.32 1.99 0.71 1.20 0.00 0.00 173.24 178.07 1bk5 h THR 313 N 4.38 0.13 0.00 6.45 1.35 -1.98 -0.87 112.91 122.37 1bk5 h THR 313 Ca -0.46 -0.59 -0.05 0.00 -0.55 0.00 0.00 66.41 64.76 1bk5 h THR 313 Cb 1.19 1.51 -0.01 0.00 -1.73 0.00 0.00 68.15 69.12 1bk5 h THR 313 CO 0.59 0.04 -0.25 -0.07 -0.25 0.00 0.00 175.52 175.59 1bk5 h LEU 314 N 0.00 0.00 0.07 3.87 3.38 -1.96 0.61 115.31 121.28 1bk5 h LEU 314 Ca -0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 1bk5 h LEU 314 Cb 0.51 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1bk5 h LEU 314 CO 0.01 0.25 -1.95 0.52 0.09 0.00 0.00 178.44 177.35 1bk5 n VAL 315 N -3.78 1.66 -0.18 1.22 0.31 -0.86 -4.30 118.33 112.40 1bk5 n VAL 315 Ca -0.01 -0.47 -0.03 0.00 -0.01 0.00 0.00 64.34 63.81 1bk5 n VAL 315 Cb 0.35 -1.77 0.07 0.00 -0.91 0.00 0.00 33.84 31.57 1bk5 n VAL 315 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1bk5 h GLN 316 N -0.28 0.46 0.31 5.55 4.20 -1.03 -1.94 115.11 122.37 1bk5 h GLN 316 Ca -0.46 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.22 1bk5 h GLN 316 Cb 1.81 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 29.46 1bk5 h GLN 316 CO -0.06 0.30 -0.43 1.15 -0.67 0.00 0.00 178.83 179.13 1bk5 h THR 317 N 0.47 0.00 -0.19 -0.54 2.02 -1.08 0.69 112.91 114.28 1bk5 h THR 317 Ca 0.25 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.37 1bk5 h THR 317 Cb 0.20 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.60 1bk5 h THR 317 CO -0.20 0.00 -0.12 1.55 0.37 0.00 0.00 175.52 177.12 1bk5 h PRO 318 N -0.77 0.31 -0.48 6.66 0.13 -1.74 -0.84 132.00 135.27 1bk5 h PRO 318 Ca -0.04 -0.08 -0.04 0.00 -0.87 0.00 0.00 66.00 64.98 1bk5 h PRO 318 Cb 0.70 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.77 1bk5 h PRO 318 CO -0.12 0.44 0.16 0.00 -0.23 0.00 0.00 178.00 178.26 1bk5 h ALA 319 N 1.58 0.63 -0.46 -0.56 0.00 -1.12 -0.80 119.26 118.53 1bk5 h ALA 319 Ca 0.06 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1bk5 h ALA 319 Cb 0.40 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1bk5 h ALA 319 CO 0.02 0.27 -0.19 1.25 0.00 0.00 0.00 179.25 180.60 1bk5 h LEU 320 N 0.64 0.92 -0.56 0.00 5.85 -0.60 -0.97 115.31 120.58 1bk5 h LEU 320 Ca 0.16 -0.33 0.01 0.00 0.84 0.00 0.00 57.88 58.56 1bk5 h LEU 320 Cb 0.25 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 1bk5 h LEU 320 CO -0.01 1.09 0.36 -0.09 -0.34 0.00 0.00 178.44 179.45 1bk5 h ARG 321 N 0.79 0.72 -0.30 1.25 9.65 -0.85 0.32 114.38 125.95 1bk5 h ARG 321 Ca 0.11 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.93 1bk5 h ARG 321 Cb 0.74 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 29.14 1bk5 h ARG 321 CO 0.06 0.47 0.11 0.00 2.80 0.00 0.00 179.97 183.42 1bk5 h ALA 322 N 1.22 0.40 -0.65 2.80 0.00 -0.88 0.56 119.26 122.71 1bk5 h ALA 322 Ca 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1bk5 h ALA 322 Cb -0.06 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1bk5 h ALA 322 CO -0.06 0.01 0.42 0.28 0.00 0.00 0.00 179.25 179.90 1bk5 h VAL 323 N 0.34 1.17 -0.78 0.00 2.07 -0.83 -1.28 116.25 116.95 1bk5 h VAL 323 Ca 0.10 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 1bk5 h VAL 323 Cb 0.20 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 1bk5 h VAL 323 CO -0.01 0.17 0.36 1.23 0.02 0.00 0.00 177.57 179.35 1bk5 h GLY 324 N 0.88 1.20 1.56 2.17 0.00 0.04 -1.83 103.07 107.09 1bk5 h GLY 324 Ca 0.24 -0.60 -0.11 0.00 0.00 0.00 0.00 47.33 46.86 1bk5 h GLY 324 CO -0.05 0.57 -0.31 3.43 0.00 0.00 0.00 176.54 180.18 1bk5 h ASN 325 N 1.11 0.51 -0.34 0.19 2.35 -0.41 -3.20 115.58 115.78 1bk5 h ASN 325 Ca 0.27 -0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.75 1bk5 h ASN 325 Cb 0.13 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1bk5 h ASN 325 CO -0.03 0.80 -0.08 0.40 -1.65 0.00 0.00 177.43 176.87 1bk5 h ILE 326 N 0.43 1.28 0.00 2.81 2.04 -0.63 -2.72 117.51 120.72 1bk5 h ILE 326 Ca 0.05 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.78 1bk5 h ILE 326 Cb 0.75 1.31 0.00 0.00 -0.74 0.00 0.00 36.82 38.15 1bk5 h ILE 326 CO 0.06 0.37 0.00 1.33 0.00 0.00 0.00 178.15 179.91 1bk5 n VAL 327 N -4.43 0.00 0.90 1.67 0.24 -0.75 -1.51 118.33 114.46 1bk5 n VAL 327 Ca -0.02 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 62.41 1bk5 n VAL 327 Cb 0.33 -0.54 0.41 0.00 -1.47 0.00 0.00 33.84 32.57 1bk5 n VAL 327 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1bk5 n THR 328 N -0.85 0.11 0.00 3.34 -2.24 -1.03 -4.66 114.28 108.96 1bk5 n THR 328 Ca 0.10 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1bk5 n THR 328 Cb 0.05 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 1bk5 n THR 328 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bk5 n GLY 329 N 1.46 -1.81 3.92 3.38 0.00 -0.57 -5.04 105.19 106.53 1bk5 n GLY 329 Ca 0.06 -1.37 -0.27 0.00 0.00 0.00 0.00 46.02 44.43 1bk5 n GLY 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bk5 s ASN 330 N -1.49 4.53 0.34 1.61 2.20 -1.26 -4.82 114.94 116.06 1bk5 s ASN 330 Ca 0.00 0.56 0.07 0.00 -0.94 0.00 0.00 52.86 52.55 1bk5 s ASN 330 Cb 0.00 -1.09 0.75 0.00 -2.00 0.00 0.00 41.25 38.92 1bk5 s ASN 330 CO 0.00 -1.83 1.88 0.44 -2.94 0.00 0.00 177.10 174.65 1bk5 h ASP 331 N -0.88 0.71 -0.49 3.54 5.19 -1.96 -0.41 116.42 122.13 1bk5 h ASP 331 Ca -0.45 0.04 -0.10 0.00 -0.62 0.00 0.00 57.03 55.89 1bk5 h ASP 331 Cb 1.31 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 40.70 1bk5 h ASP 331 CO 0.60 0.38 -0.10 -0.07 -3.12 0.00 0.00 179.24 176.94 1bk5 h LEU 332 N 0.77 0.94 -0.74 1.55 4.07 -2.00 -1.51 115.31 118.39 1bk5 h LEU 332 Ca 0.44 -0.35 -0.10 0.00 0.08 0.00 0.00 57.88 57.94 1bk5 h LEU 332 Cb 0.60 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 42.07 1bk5 h LEU 332 CO -0.20 1.07 -0.13 1.56 -1.08 0.00 0.00 178.44 179.66 1bk5 h GLN 333 N 0.79 0.83 -0.25 1.13 4.20 -1.65 -2.95 115.11 117.21 1bk5 h GLN 333 Ca 0.13 -0.29 -0.12 0.00 0.06 0.00 0.00 58.65 58.43 1bk5 h GLN 333 Cb 0.65 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 1bk5 h GLN 333 CO 0.04 0.91 -0.34 1.15 -0.67 0.00 0.00 178.83 179.93 1bk5 h THR 334 N 0.74 1.29 -0.08 -0.54 2.02 -0.97 -2.76 112.91 112.61 1bk5 h THR 334 Ca 0.12 -1.45 -0.06 0.00 0.77 0.00 0.00 66.41 65.79 1bk5 h THR 334 Cb 0.63 1.46 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 1bk5 h THR 334 CO 0.04 0.46 -0.23 -0.61 0.37 0.00 0.00 175.52 175.55 1bk5 h GLN 335 N 0.46 0.14 -0.55 6.66 5.75 -1.11 -0.84 115.11 125.61 1bk5 h GLN 335 Ca 0.05 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 1bk5 h GLN 335 Cb 0.81 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.32 1bk5 h GLN 335 CO 0.07 0.37 0.35 0.28 -2.65 0.00 0.00 178.83 177.25 1bk5 h VAL 336 N 0.13 1.15 -0.31 2.39 2.07 -1.33 0.28 116.25 120.63 1bk5 h VAL 336 Ca 0.02 -0.31 -0.10 0.00 0.82 0.00 0.00 66.70 67.13 1bk5 h VAL 336 Cb 0.49 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1bk5 h VAL 336 CO 0.03 0.15 -0.23 0.58 0.02 0.00 0.00 177.57 178.13 1bk5 h VAL 337 N 0.75 1.27 -0.48 2.57 2.07 -1.30 -2.49 116.25 118.64 1bk5 h VAL 337 Ca 0.20 -1.28 -0.13 0.00 0.82 0.00 0.00 66.70 66.31 1bk5 h VAL 337 Cb -0.06 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1bk5 h VAL 337 CO -0.04 0.42 -0.21 0.40 0.02 0.00 0.00 177.57 178.16 1bk5 h ILE 338 N 0.53 1.27 0.00 4.57 2.04 -0.46 -2.63 117.51 122.83 1bk5 h ILE 338 Ca 0.08 -1.37 0.00 0.00 1.00 0.00 0.00 64.86 64.57 1bk5 h ILE 338 Cb 0.68 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 1bk5 h ILE 338 CO 0.05 0.47 0.00 0.78 0.00 0.00 0.00 178.15 179.45 1bk5 h ASN 339 N 0.84 0.00 0.84 1.72 2.35 -0.28 -0.66 115.58 120.38 1bk5 h ASN 339 Ca 0.11 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1bk5 h ASN 339 Cb 0.78 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.15 1bk5 h ASN 339 CO 0.06 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.84 1bk5 n ALA 340 N -1.85 2.33 -1.55 -0.83 0.00 -0.96 -4.91 120.51 112.73 1bk5 n ALA 340 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1bk5 n ALA 340 Cb 0.29 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.28 1bk5 n ALA 340 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bk5 n GLY 341 N 1.32 0.95 0.18 0.00 0.00 -0.25 -4.90 105.19 102.49 1bk5 n GLY 341 Ca 0.09 -0.51 0.03 0.00 0.00 0.00 0.00 46.02 45.63 1bk5 n GLY 341 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1bk5 h VAL 342 N 0.00 1.16 0.13 1.61 3.04 -1.64 -3.26 116.25 117.29 1bk5 h VAL 342 Ca 0.00 -1.52 -0.01 0.00 -1.01 0.00 0.00 66.70 64.17 1bk5 h VAL 342 Cb 0.67 1.85 0.00 0.00 -2.01 0.00 0.00 31.29 31.81 1bk5 h VAL 342 CO 0.00 0.41 -0.06 -0.07 -1.01 0.00 0.00 177.57 176.84 1bk5 h LEU 343 N 0.00 -0.15 -1.61 3.16 3.38 -1.86 0.15 115.31 118.37 1bk5 h LEU 343 Ca -0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1bk5 h LEU 343 Cb 0.82 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1bk5 h LEU 343 CO 0.05 0.03 0.11 -0.65 0.09 0.00 0.00 178.44 178.07 1bk5 h PRO 344 N -0.33 0.36 -0.47 1.13 0.11 -1.90 -1.90 132.00 129.00 1bk5 h PRO 344 Ca -0.02 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.94 1bk5 h PRO 344 Cb 0.26 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.28 1bk5 h PRO 344 CO 0.03 0.30 -0.17 0.00 -0.21 0.00 0.00 178.00 177.96 1bk5 h ALA 345 N 1.76 0.81 -0.13 -0.75 0.00 -1.51 -2.85 119.26 116.58 1bk5 h ALA 345 Ca 0.09 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1bk5 h ALA 345 Cb 0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1bk5 h ALA 345 CO -0.01 0.65 -0.17 -0.07 0.00 0.00 0.00 179.25 179.66 1bk5 h LEU 346 N 0.81 0.19 -1.52 0.00 3.38 0.04 -2.45 115.31 115.76 1bk5 h LEU 346 Ca 0.12 -0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.13 1bk5 h LEU 346 Cb 0.71 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 1bk5 h LEU 346 CO 0.05 0.38 0.44 -0.09 0.09 0.00 0.00 178.44 179.31 1bk5 h ARG 347 N 0.19 0.54 0.09 1.13 2.43 -1.16 -1.21 114.38 116.38 1bk5 h ARG 347 Ca 0.04 -0.03 -0.25 0.00 -0.81 0.00 0.00 59.98 58.92 1bk5 h ARG 347 Cb 0.41 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1bk5 h ARG 347 CO 0.03 0.35 -1.16 -0.07 -1.51 0.00 0.00 179.97 177.61 1bk5 h LEU 348 N 0.55 0.34 -1.12 3.80 3.38 -1.50 -3.29 115.31 117.47 1bk5 h LEU 348 Ca 0.30 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1bk5 h LEU 348 Cb 0.45 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1bk5 h LEU 348 CO -0.10 1.26 -0.29 -0.07 0.09 0.00 0.00 178.44 179.33 1bk5 h LEU 349 N 0.07 0.00 -0.98 1.67 3.38 -1.16 -2.55 115.31 115.74 1bk5 h LEU 349 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1bk5 h LEU 349 Cb 1.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.63 1bk5 h LEU 349 CO 0.18 0.29 0.00 -0.07 0.09 0.00 0.00 178.44 178.94 1bk5 h LEU 350 N 0.00 0.00 -1.91 1.67 3.38 -1.38 -1.93 115.31 115.15 1bk5 h LEU 350 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1bk5 h LEU 350 Cb 0.77 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1bk5 h LEU 350 CO 0.04 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 177.37 1bk5 n SER 351 N -2.42 2.95 -4.69 -0.43 7.64 -0.96 -4.86 113.62 110.84 1bk5 n SER 351 Ca 0.01 -1.98 -0.44 0.00 1.01 0.00 0.00 58.87 57.47 1bk5 n SER 351 Cb 0.22 -0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.39 1bk5 n SER 351 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1bk5 n SER 352 N 1.32 3.32 0.04 6.43 2.88 -0.72 -4.85 113.62 122.04 1bk5 n SER 352 Ca 0.14 1.09 0.05 0.00 -1.33 0.00 0.00 58.87 58.82 1bk5 n SER 352 Cb 0.59 -1.48 0.25 0.00 -0.75 0.00 0.00 64.21 62.82 1bk5 n SER 352 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1bk5 n PRO 353 N 3.22 0.05 -2.93 -1.46 -0.04 -1.26 -4.49 135.00 128.08 1bk5 n PRO 353 Ca 0.15 0.44 -0.42 0.00 -0.04 0.00 0.00 63.50 63.63 1bk5 n PRO 353 Cb 0.31 -1.62 -0.05 0.00 -0.04 0.00 0.00 33.50 32.10 1bk5 n PRO 353 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1bk5 s LYS 354 N -3.13 3.71 0.15 0.54 2.47 -1.26 -4.97 119.74 117.25 1bk5 s LYS 354 Ca 0.02 0.28 -0.18 0.00 -1.56 0.00 0.00 55.97 54.53 1bk5 s LYS 354 Cb 0.05 -3.83 0.04 0.00 -1.46 0.00 0.00 37.83 32.63 1bk5 s LYS 354 CO 0.16 -0.92 1.68 1.49 0.16 0.00 0.00 175.35 177.92 1bk5 h GLU 355 N 8.58 0.00 0.00 4.03 4.57 -2.00 -1.18 114.58 128.58 1bk5 h GLU 355 Ca -0.24 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.93 1bk5 h GLU 355 Cb 1.09 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.68 1bk5 h GLU 355 CO 0.93 0.00 -0.01 -0.91 -1.18 0.00 0.00 179.01 177.85 1bk5 h ASN 356 N 0.00 0.00 0.16 1.04 2.35 -1.95 0.48 115.58 117.65 1bk5 h ASN 356 Ca 0.15 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.59 1bk5 h ASN 356 Cb 0.23 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.64 1bk5 h ASN 356 CO -0.33 0.01 -1.31 0.40 -1.65 0.00 0.00 177.43 174.55 1bk5 h ILE 357 N 0.00 1.28 -0.70 2.81 2.04 -1.59 -0.72 117.51 120.64 1bk5 h ILE 357 Ca -0.00 -2.52 -0.06 0.00 1.00 0.00 0.00 64.86 63.28 1bk5 h ILE 357 Cb 0.14 2.79 -0.03 0.00 -0.74 0.00 0.00 36.82 38.98 1bk5 h ILE 357 CO 0.00 0.76 0.20 0.11 0.00 0.00 0.00 178.15 179.22 1bk5 h LYS 358 N 0.24 1.09 0.30 2.37 1.57 -0.84 0.72 116.57 122.03 1bk5 h LYS 358 Ca -0.21 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.31 1bk5 h LYS 358 Cb 1.98 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 34.14 1bk5 h LYS 358 CO 0.25 0.95 -0.15 -0.22 -0.57 0.00 0.00 179.45 179.72 1bk5 h LYS 359 N 1.03 -0.39 0.00 3.15 3.64 -0.91 -0.92 116.57 122.17 1bk5 h LYS 359 Ca 0.22 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1bk5 h LYS 359 Cb 0.33 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1bk5 h LYS 359 CO -0.00 -0.26 0.00 0.93 -2.27 0.00 0.00 179.45 177.84 1bk5 h GLU 360 N -0.41 0.00 -0.15 1.90 5.08 -0.99 -1.04 114.58 118.96 1bk5 h GLU 360 Ca -0.04 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.16 1bk5 h GLU 360 Cb 0.32 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.57 1bk5 h GLU 360 CO 0.06 0.00 -0.54 0.00 -1.00 0.00 0.00 179.01 177.53 1bk5 h ALA 361 N 2.06 0.27 -0.39 3.43 0.00 -0.47 -0.75 119.26 123.41 1bk5 h ALA 361 Ca 0.00 -0.52 -0.10 0.00 0.00 0.00 0.00 54.91 54.29 1bk5 h ALA 361 Cb 0.61 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1bk5 h ALA 361 CO 0.00 0.48 -0.17 0.00 0.00 0.00 0.00 179.25 179.56 1bk5 h TRP 363 N 0.65 -0.03 -0.14 0.00 7.01 -1.14 0.41 115.95 122.70 1bk5 h TRP 363 Ca 0.10 -0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.13 1bk5 h TRP 363 Cb 0.65 0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 27.69 1bk5 h TRP 363 CO 0.03 0.05 -0.04 1.15 -2.79 0.00 0.00 178.44 176.85 1bk5 h THR 364 N -0.11 0.84 -1.00 2.65 2.02 -0.96 -2.23 112.91 114.12 1bk5 h THR 364 Ca -0.00 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.21 1bk5 h THR 364 Cb 0.10 0.84 -0.06 0.00 -1.74 0.00 0.00 68.15 67.30 1bk5 h THR 364 CO 0.01 0.00 0.66 0.40 0.37 0.00 0.00 175.52 176.95 1bk5 h ILE 365 N -0.01 1.19 0.00 3.11 2.04 -1.05 -1.78 117.51 121.01 1bk5 h ILE 365 Ca 0.07 -0.44 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 1bk5 h ILE 365 Cb 0.12 -0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 35.99 1bk5 h ILE 365 CO -0.15 0.23 -0.16 0.77 0.00 0.00 0.00 178.15 178.84 1bk5 h SER 366 N 1.29 0.00 -0.03 1.72 4.64 -0.34 0.18 113.55 121.01 1bk5 h SER 366 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1bk5 h SER 366 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1bk5 h SER 366 CO -0.11 0.16 0.00 0.59 -0.87 0.00 0.00 176.83 176.59 1bk5 n ASN 367 N -3.95 0.65 -0.09 4.97 3.02 -0.69 -1.81 115.26 117.37 1bk5 n ASN 367 Ca -0.02 -1.31 -0.11 0.00 -0.03 0.00 0.00 54.58 53.11 1bk5 n ASN 367 Cb 0.25 -0.01 -0.10 0.00 -0.61 0.00 0.00 39.78 39.30 1bk5 n ASN 367 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1bk5 n ILE 368 N -0.45 1.07 0.92 2.41 5.41 -0.12 -4.25 119.36 124.36 1bk5 n ILE 368 Ca 0.20 -0.51 0.13 0.00 1.00 0.00 0.00 62.75 63.56 1bk5 n ILE 368 Cb 0.20 -0.94 0.57 0.00 -0.71 0.00 0.00 39.64 38.76 1bk5 n ILE 368 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1bk5 n THR 369 N -2.85 0.18 1.49 1.39 -2.24 -0.22 -1.68 114.28 110.35 1bk5 n THR 369 Ca -0.30 0.04 0.15 0.00 -2.27 0.00 0.00 64.05 61.67 1bk5 n THR 369 Cb 0.92 -0.59 0.68 0.00 -2.10 0.00 0.00 70.33 69.24 1bk5 n THR 369 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bk5 n ALA 370 N -1.49 2.68 -1.35 6.98 0.00 -0.75 -4.01 120.51 122.56 1bk5 n ALA 370 Ca 0.07 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1bk5 n ALA 370 Cb 0.31 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1bk5 n ALA 370 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bk5 n GLY 371 N 1.24 0.87 3.86 0.00 0.00 -0.68 -5.07 105.19 105.42 1bk5 n GLY 371 Ca 0.16 -1.68 -0.30 0.00 0.00 0.00 0.00 46.02 44.20 1bk5 n GLY 371 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bk5 s ASN 372 N -1.00 5.01 0.32 1.61 2.20 -1.26 -4.82 114.94 116.99 1bk5 s ASN 372 Ca 0.00 1.11 0.09 0.00 -0.94 0.00 0.00 52.86 53.13 1bk5 s ASN 372 Cb 0.00 -1.84 0.89 0.00 -2.00 0.00 0.00 41.25 38.30 1bk5 s ASN 372 CO 0.00 -1.62 1.72 0.74 -2.94 0.00 0.00 177.10 175.00 1bk5 h THR 373 N -0.85 0.50 -0.03 0.54 2.02 -1.95 -0.08 112.91 113.06 1bk5 h THR 373 Ca -0.46 -0.18 -0.11 0.00 0.77 0.00 0.00 66.41 66.43 1bk5 h THR 373 Cb 1.27 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 1bk5 h THR 373 CO 0.63 0.10 -0.49 -0.33 0.37 0.00 0.00 175.52 175.79 1bk5 h GLU 374 N 0.52 0.07 -0.01 6.66 5.08 -1.99 -1.01 114.58 123.91 1bk5 h GLU 374 Ca 0.65 -0.04 -0.21 0.00 -1.00 0.00 0.00 59.36 58.76 1bk5 h GLU 374 Cb 1.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.52 1bk5 h GLU 374 CO -0.50 0.55 -0.88 1.96 -1.00 0.00 0.00 179.01 179.14 1bk5 h GLN 375 N 0.06 0.33 -0.48 2.33 4.20 -1.37 -1.73 115.11 118.45 1bk5 h GLN 375 Ca -0.00 -0.34 -0.09 0.00 0.06 0.00 0.00 58.65 58.27 1bk5 h GLN 375 Cb 0.90 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.75 1bk5 h GLN 375 CO 0.07 1.03 -0.06 0.82 -0.67 0.00 0.00 178.83 180.01 1bk5 h ILE 376 N 0.19 1.27 -0.46 2.54 2.04 -1.11 -2.39 117.51 119.59 1bk5 h ILE 376 Ca -0.06 -1.17 -0.05 0.00 1.00 0.00 0.00 64.86 64.57 1bk5 h ILE 376 Cb 1.51 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 38.61 1bk5 h ILE 376 CO 0.15 0.41 0.07 -0.61 0.00 0.00 0.00 178.15 178.16 1bk5 h GLN 377 N 0.75 0.72 -0.56 2.37 5.75 -1.13 -2.10 115.11 120.92 1bk5 h GLN 377 Ca 0.13 -0.16 -0.03 0.00 -0.15 0.00 0.00 58.65 58.44 1bk5 h GLN 377 Cb 0.60 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 29.02 1bk5 h GLN 377 CO 0.04 0.69 0.23 0.00 -2.65 0.00 0.00 178.83 177.14 1bk5 h ALA 378 N 1.38 0.72 -0.78 3.38 0.00 -1.02 0.18 119.26 123.13 1bk5 h ALA 378 Ca 0.15 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bk5 h ALA 378 Cb 0.33 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1bk5 h ALA 378 CO 0.01 0.33 0.47 0.28 0.00 0.00 0.00 179.25 180.33 1bk5 h VAL 379 N 0.76 1.22 -0.02 0.00 2.07 -1.00 -0.63 116.25 118.65 1bk5 h VAL 379 Ca 0.19 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 1bk5 h VAL 379 Cb 0.19 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.07 1bk5 h VAL 379 CO -0.02 0.23 0.00 0.40 0.02 0.00 0.00 177.57 178.20 1bk5 h ILE 380 N 1.08 1.24 0.00 4.57 2.04 -0.77 -2.73 117.51 122.95 1bk5 h ILE 380 Ca 0.28 -0.73 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 1bk5 h ILE 380 Cb -0.04 1.70 -0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1bk5 h ILE 380 CO -0.05 0.19 -0.00 0.44 0.00 0.00 0.00 178.15 178.73 1bk5 h ASP 381 N -0.26 0.00 -0.02 1.72 3.32 -0.22 -1.47 116.42 119.48 1bk5 h ASP 381 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1bk5 h ASP 381 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1bk5 h ASP 381 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 1bk5 n ALA 382 N -2.09 2.60 -3.26 3.45 0.00 -0.28 -4.92 120.51 116.01 1bk5 n ALA 382 Ca -0.01 -0.37 -0.17 0.00 0.00 0.00 0.00 53.44 52.89 1bk5 n ALA 382 Cb 0.18 -1.26 0.06 0.00 0.00 0.00 0.00 19.45 18.43 1bk5 n ALA 382 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1bk5 n ASN 383 N -0.16 -5.06 0.07 0.00 2.85 -0.55 -4.87 115.26 107.53 1bk5 n ASN 383 Ca 0.20 -0.38 0.12 0.00 -0.11 0.00 0.00 54.58 54.41 1bk5 n ASN 383 Cb 0.28 -3.65 0.06 0.00 1.24 0.00 0.00 39.78 37.70 1bk5 n ASN 383 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1bk5 n LEU 384 N -3.64 0.71 -0.05 1.20 4.32 -1.04 -4.37 117.00 114.13 1bk5 n LEU 384 Ca 0.01 0.20 -0.12 0.00 -0.02 0.00 0.00 56.01 56.08 1bk5 n LEU 384 Cb 0.54 -0.11 -0.06 0.00 -1.62 0.00 0.00 43.42 42.17 1bk5 n LEU 384 CO 0.45 -0.08 0.74 0.40 -1.22 0.00 0.00 177.39 177.68 1bk5 h ILE 385 N 0.00 1.26 -0.06 -0.08 1.08 -1.86 -2.80 117.51 115.04 1bk5 h ILE 385 Ca 0.00 -0.86 0.04 0.00 -0.39 0.00 0.00 64.86 63.65 1bk5 h ILE 385 Cb 0.85 1.54 -0.05 0.00 -3.07 0.00 0.00 36.82 36.09 1bk5 h ILE 385 CO 0.00 0.25 -0.24 -0.65 -0.69 0.00 0.00 178.15 176.82 1bk5 h PRO 386 N -0.00 -0.33 0.00 2.37 0.11 -1.92 0.22 132.00 132.45 1bk5 h PRO 386 Ca 0.04 0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.14 1bk5 h PRO 386 Cb 0.39 0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.57 1bk5 h PRO 386 CO 0.01 -0.22 -0.16 -1.00 -0.21 0.00 0.00 178.00 176.42 1bk5 h PRO 387 N -0.34 0.00 -0.06 1.05 0.13 -1.81 -1.85 132.00 129.12 1bk5 h PRO 387 Ca 0.08 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.20 1bk5 h PRO 387 Cb 0.46 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.59 1bk5 h PRO 387 CO -0.26 0.16 -0.02 1.25 -0.23 0.00 0.00 178.00 178.91 1bk5 h LEU 388 N 0.00 0.12 -1.25 1.56 5.85 -1.06 -1.59 115.31 118.93 1bk5 h LEU 388 Ca -0.00 -0.38 0.04 0.00 0.84 0.00 0.00 57.88 58.38 1bk5 h LEU 388 Cb 0.30 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 1bk5 h LEU 388 CO 0.02 0.47 0.52 0.58 -0.34 0.00 0.00 178.44 179.70 1bk5 h VAL 389 N -0.23 1.12 -0.27 1.05 2.07 -0.16 -0.35 116.25 119.47 1bk5 h VAL 389 Ca 0.01 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 1bk5 h VAL 389 Cb 0.42 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1bk5 h VAL 389 CO 0.01 0.18 0.09 0.50 0.02 0.00 0.00 177.57 178.36 1bk5 h LYS 390 N 0.97 0.42 -0.74 1.57 1.63 -1.16 -2.67 116.57 116.58 1bk5 h LYS 390 Ca 0.32 -0.09 -0.06 0.00 -0.85 0.00 0.00 60.65 59.97 1bk5 h LYS 390 Cb 0.06 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 31.60 1bk5 h LYS 390 CO -0.10 0.48 0.23 -0.07 -3.45 0.00 0.00 179.45 176.55 1bk5 h LEU 391 N 0.28 1.08 -2.10 5.20 3.38 -0.69 0.48 115.31 122.93 1bk5 h LEU 391 Ca 0.09 -0.20 0.09 0.00 0.09 0.00 0.00 57.88 57.94 1bk5 h LEU 391 Cb 0.24 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1bk5 h LEU 391 CO -0.00 1.00 0.32 0.25 0.09 0.00 0.00 178.44 180.09 1bk5 h LEU 392 N 1.10 0.00 0.04 1.67 6.46 -0.88 -1.61 115.31 122.10 1bk5 h LEU 392 Ca 0.24 0.00 -0.36 0.00 -0.12 0.00 0.00 57.88 57.64 1bk5 h LEU 392 Cb 0.30 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.19 1bk5 h LEU 392 CO -0.01 0.00 -2.07 1.21 -0.62 0.00 0.00 178.44 176.95 1bk5 n GLU 393 N -3.78 0.66 -0.00 1.25 2.13 -0.27 -4.80 120.64 115.83 1bk5 n GLU 393 Ca 0.04 0.30 0.04 0.00 0.66 0.00 0.00 57.16 58.20 1bk5 n GLU 393 Cb 0.47 -1.63 -0.06 0.00 0.27 0.00 0.00 31.44 30.49 1bk5 n GLU 393 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 1bk5 n VAL 394 N -3.76 0.00 -0.89 6.31 0.24 -0.00 -5.06 118.33 115.18 1bk5 n VAL 394 Ca -0.40 -0.22 -0.28 0.00 -2.04 0.00 0.00 64.34 61.40 1bk5 n VAL 394 Cb 0.93 0.43 0.22 0.00 -1.47 0.00 0.00 33.84 33.95 1bk5 n VAL 394 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1bk5 s ALA 395 N -2.44 0.21 1.00 2.33 0.00 -0.63 -5.00 121.76 117.24 1bk5 s ALA 395 Ca -0.02 -0.33 -0.12 0.00 0.00 0.00 0.00 51.96 51.50 1bk5 s ALA 395 Cb 0.06 -3.15 0.19 0.00 0.00 0.00 0.00 23.12 20.22 1bk5 s ALA 395 CO 0.35 -3.39 1.08 -1.21 0.00 0.00 0.00 175.76 172.60 1bk5 s GLU 396 N -4.77 0.37 0.15 0.00 0.41 -1.26 -4.66 118.70 108.94 1bk5 s GLU 396 Ca 0.67 1.04 -0.17 0.00 -0.41 0.00 0.00 54.97 56.10 1bk5 s GLU 396 Cb -0.21 -1.69 0.02 0.00 -1.78 0.00 0.00 34.13 30.47 1bk5 s GLU 396 CO 0.61 -2.91 1.77 -0.92 -0.49 0.00 0.00 175.26 173.32 1bk5 h TYR 397 N -2.04 0.28 -0.24 1.61 3.20 -1.97 -1.15 116.97 116.66 1bk5 h TYR 397 Ca -0.52 0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.43 1bk5 h TYR 397 Cb 1.30 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.48 1bk5 h TYR 397 CO 0.39 0.15 0.28 1.57 -1.64 0.00 0.00 178.16 178.91 1bk5 h LYS 398 N 0.32 0.00 0.09 1.82 2.10 -2.00 0.19 116.57 119.09 1bk5 h LYS 398 Ca 0.14 0.00 -0.29 0.00 -2.00 0.00 0.00 60.65 58.49 1bk5 h LYS 398 Cb 0.06 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.37 1bk5 h LYS 398 CO -0.10 0.00 -1.56 1.15 -2.00 0.00 0.00 179.45 176.94 1bk5 h THR 399 N 0.00 0.86 -0.77 0.07 2.02 -1.75 -3.31 112.91 110.03 1bk5 h THR 399 Ca 0.11 -2.32 0.11 0.00 0.77 0.00 0.00 66.41 65.08 1bk5 h THR 399 Cb 0.67 2.51 -0.08 0.00 -1.74 0.00 0.00 68.15 69.51 1bk5 h THR 399 CO -0.00 0.66 0.40 0.11 0.37 0.00 0.00 175.52 177.05 1bk5 h LYS 400 N -0.38 0.62 -0.64 6.66 1.57 -0.11 0.41 116.57 124.71 1bk5 h LYS 400 Ca -0.36 -0.04 0.13 0.00 -1.87 0.00 0.00 60.65 58.52 1bk5 h LYS 400 Cb 1.72 -0.14 -0.10 0.00 0.08 0.00 0.00 32.23 33.79 1bk5 h LYS 400 CO -0.01 0.41 0.11 -0.22 -0.57 0.00 0.00 179.45 179.17 1bk5 h LYS 401 N 0.64 0.22 -0.34 3.15 3.64 -0.82 0.23 116.57 123.29 1bk5 h LYS 401 Ca 0.39 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.62 1bk5 h LYS 401 Cb 0.44 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1bk5 h LYS 401 CO -0.29 0.14 -0.31 1.49 -2.27 0.00 0.00 179.45 178.21 1bk5 h GLU 402 N 0.22 0.80 -0.58 1.90 4.57 -1.09 -2.67 114.58 117.73 1bk5 h GLU 402 Ca 0.34 -0.41 -0.03 0.00 -1.18 0.00 0.00 59.36 58.08 1bk5 h GLU 402 Cb 0.55 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.12 1bk5 h GLU 402 CO -0.47 1.04 0.25 0.00 -1.18 0.00 0.00 179.01 178.66 1bk5 h ALA 403 N 0.74 1.35 0.17 2.92 0.00 0.10 -2.09 119.26 122.45 1bk5 h ALA 403 Ca 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1bk5 h ALA 403 Cb 0.88 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1bk5 h ALA 403 CO 0.08 0.49 -0.08 0.00 0.00 0.00 0.00 179.25 179.74 1bk5 h TRP 405 N -0.32 0.54 -0.34 0.00 4.06 -1.18 0.80 115.95 119.51 1bk5 h TRP 405 Ca -0.02 0.03 0.01 0.00 2.06 0.00 0.00 58.89 60.97 1bk5 h TRP 405 Cb 0.25 -0.14 -0.02 0.00 -1.00 0.00 0.00 29.16 28.25 1bk5 h TRP 405 CO -0.04 0.17 0.21 0.00 -3.56 0.00 0.00 178.44 175.22 1bk5 h ALA 406 N 1.44 0.42 -0.22 1.49 0.00 -1.11 0.22 119.26 121.50 1bk5 h ALA 406 Ca 0.34 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 55.05 1bk5 h ALA 406 Cb 0.40 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1bk5 h ALA 406 CO -0.29 -0.13 -0.61 0.82 0.00 0.00 0.00 179.25 179.03 1bk5 h ILE 407 N 0.43 1.30 -0.35 0.00 2.04 -0.15 -2.14 117.51 118.63 1bk5 h ILE 407 Ca 0.13 -1.83 -0.08 0.00 1.00 0.00 0.00 64.86 64.07 1bk5 h ILE 407 Cb -0.03 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 1bk5 h ILE 407 CO -0.04 0.58 -0.10 -1.28 0.00 0.00 0.00 178.15 177.30 1bk5 h SER 408 N 0.55 0.71 -0.61 1.72 0.87 0.81 -1.11 113.55 116.49 1bk5 h SER 408 Ca -0.00 -0.37 -0.03 0.00 -1.23 0.00 0.00 61.79 60.15 1bk5 h SER 408 Cb 1.20 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.94 1bk5 h SER 408 CO 0.13 0.92 0.28 0.78 -0.53 0.00 0.00 176.83 178.41 1bk5 h ASN 409 N 0.49 0.83 -0.69 6.23 2.35 -0.59 -2.25 115.58 121.95 1bk5 h ASN 409 Ca 0.09 -0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1bk5 h ASN 409 Cb 0.62 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.75 1bk5 h ASN 409 CO 0.04 0.72 0.37 0.00 -1.65 0.00 0.00 177.43 176.91 1bk5 h ALA 410 N 1.41 0.88 0.00 -0.83 0.00 -0.99 -2.01 119.26 117.72 1bk5 h ALA 410 Ca 0.22 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1bk5 h ALA 410 Cb 0.13 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1bk5 h ALA 410 CO -0.02 0.41 -0.02 0.66 0.00 0.00 0.00 179.25 180.27 1bk5 h SER 411 N 0.94 0.00 0.15 0.00 4.64 -0.64 -2.44 113.55 116.21 1bk5 h SER 411 Ca 0.24 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.50 1bk5 h SER 411 Cb 0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 1bk5 h SER 411 CO -0.04 0.02 -0.22 0.28 -0.87 0.00 0.00 176.83 176.00 1bk5 h SER 412 N 0.00 0.13 0.21 4.97 0.02 -0.91 -0.78 113.55 117.19 1bk5 h SER 412 Ca -0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1bk5 h SER 412 Cb 0.39 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1bk5 h SER 412 CO 0.00 0.37 0.00 0.61 -1.14 0.00 0.00 176.83 176.67 1bk5 n GLY 413 N -0.74 -1.08 0.17 -3.77 0.00 -0.92 -3.30 105.19 95.54 1bk5 n GLY 413 Ca -0.01 -0.17 0.03 0.00 0.00 0.00 0.00 46.02 45.86 1bk5 n GLY 413 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1bk5 h GLY 414 N 4.89 0.00 0.56 -0.02 0.00 -1.22 -2.10 103.07 105.17 1bk5 h GLY 414 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.42 1bk5 h GLY 414 CO 0.00 0.00 0.51 1.41 0.00 0.00 0.00 176.54 178.46 1bk5 h LEU 415 N 0.00 0.75 0.00 3.11 3.38 -1.70 -2.79 115.31 118.06 1bk5 h LEU 415 Ca -0.00 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1bk5 h LEU 415 Cb 0.97 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1bk5 h LEU 415 CO 0.06 0.44 0.00 0.00 0.09 0.00 0.00 178.44 179.03 1bk5 n GLN 416 N -4.69 0.00 -2.63 1.13 6.02 -1.09 -4.63 117.38 111.49 1bk5 n GLN 416 Ca 0.14 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.72 1bk5 n GLN 416 Cb 0.27 -0.41 -0.03 0.00 1.02 0.00 0.00 30.24 31.08 1bk5 n GLN 416 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1bk5 s ARG 417 N -0.13 3.23 0.49 -1.09 0.52 -0.81 -4.88 118.95 116.28 1bk5 s ARG 417 Ca 0.00 -0.27 0.17 0.00 -0.52 0.00 0.00 55.73 55.11 1bk5 s ARG 417 Cb 0.00 -4.16 1.19 0.00 0.52 0.00 0.00 34.95 32.51 1bk5 s ARG 417 CO 0.00 -1.98 2.08 -1.00 0.02 0.00 0.00 175.30 174.42 1bk5 h PRO 418 N 9.83 0.00 0.00 3.54 0.13 -1.75 -2.37 132.00 141.38 1bk5 h PRO 418 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1bk5 h PRO 418 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1bk5 h PRO 418 CO 1.24 0.09 0.00 -0.44 -0.23 0.00 0.00 178.00 178.66 1bk5 h ASP 419 N 0.00 0.00 -0.29 1.44 5.19 -1.90 -1.63 116.42 119.23 1bk5 h ASP 419 Ca -0.00 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.36 1bk5 h ASP 419 Cb 0.16 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.66 1bk5 h ASP 419 CO 0.01 0.00 -0.02 0.40 -3.12 0.00 0.00 179.24 176.51 1bk5 h ILE 420 N 0.00 1.27 -0.44 0.35 2.04 -1.77 0.80 117.51 119.76 1bk5 h ILE 420 Ca 0.00 -0.99 -0.05 0.00 1.00 0.00 0.00 64.86 64.82 1bk5 h ILE 420 Cb 0.24 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 1bk5 h ILE 420 CO 0.00 0.32 0.07 0.40 0.00 0.00 0.00 178.15 178.94 1bk5 h ILE 421 N 0.32 1.25 -0.96 -0.67 1.08 -1.47 -0.47 117.51 116.58 1bk5 h ILE 421 Ca 0.08 -0.90 0.05 0.00 -0.39 0.00 0.00 64.86 63.70 1bk5 h ILE 421 Cb 0.47 0.97 -0.06 0.00 -3.07 0.00 0.00 36.82 35.13 1bk5 h ILE 421 CO 0.02 0.31 0.62 0.03 -0.69 0.00 0.00 178.15 178.44 1bk5 h ARG 422 N 0.60 1.13 -0.34 2.37 3.08 -1.17 -0.99 114.38 119.06 1bk5 h ARG 422 Ca 0.13 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 60.02 1bk5 h ARG 422 Cb 0.38 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1bk5 h ARG 422 CO 0.01 0.75 -0.15 -0.92 -1.07 0.00 0.00 179.97 178.59 1bk5 h TYR 423 N 1.17 0.80 -0.48 3.04 3.20 -0.42 -1.92 116.97 122.35 1bk5 h TYR 423 Ca 0.40 -0.20 0.06 0.00 3.14 0.00 0.00 58.73 62.13 1bk5 h TYR 423 Cb 0.08 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 38.11 1bk5 h TYR 423 CO -0.01 0.90 0.19 -0.07 -1.64 0.00 0.00 178.16 177.53 1bk5 h LEU 424 N 0.47 0.21 -1.15 2.82 4.07 -0.53 -1.66 115.31 119.53 1bk5 h LEU 424 Ca 0.08 0.05 -0.06 0.00 0.08 0.00 0.00 57.88 58.03 1bk5 h LEU 424 Cb 0.68 0.03 -0.02 0.00 1.08 0.00 0.00 40.66 42.43 1bk5 h LEU 424 CO 0.05 0.15 -0.05 0.58 -1.08 0.00 0.00 178.44 178.09 1bk5 h VAL 425 N 0.37 1.21 -0.50 1.22 2.07 -1.13 -2.57 116.25 116.92 1bk5 h VAL 425 Ca 0.23 -0.89 -0.06 0.00 0.82 0.00 0.00 66.70 66.79 1bk5 h VAL 425 Cb 0.22 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1bk5 h VAL 425 CO -0.22 0.30 0.06 0.77 0.02 0.00 0.00 177.57 178.50 1bk5 h SER 426 N 0.50 0.76 0.00 0.57 4.64 -0.50 -2.16 113.55 117.37 1bk5 h SER 426 Ca 0.10 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1bk5 h SER 426 Cb 0.40 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1bk5 h SER 426 CO 0.02 0.79 0.00 0.00 -0.87 0.00 0.00 176.83 176.77 1bk5 n GLN 427 N -4.24 0.84 -3.02 4.77 1.13 -0.76 -4.88 117.38 111.23 1bk5 n GLN 427 Ca 0.03 0.00 -0.12 0.00 -1.94 0.00 0.00 57.00 54.97 1bk5 n GLN 427 Cb 0.27 -1.00 0.06 0.00 0.11 0.00 0.00 30.24 29.67 1bk5 n GLN 427 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1bk5 n GLY 428 N 0.35 -0.06 0.06 1.08 0.00 -0.81 -4.93 105.19 100.89 1bk5 n GLY 428 Ca 0.00 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.05 1bk5 n GLY 428 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bk5 h ILE 430 N 0.00 0.80 -0.11 0.00 2.04 -1.86 -2.44 117.51 115.95 1bk5 h ILE 430 Ca 0.00 -0.36 0.04 0.00 1.00 0.00 0.00 64.86 65.55 1bk5 h ILE 430 Cb 0.76 1.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 1bk5 h ILE 430 CO 0.00 0.08 -0.21 0.50 0.00 0.00 0.00 178.15 178.52 1bk5 h LYS 431 N -0.52 -0.27 -0.96 2.37 1.63 -1.92 -0.65 116.57 116.25 1bk5 h LYS 431 Ca -0.03 0.02 0.08 0.00 -0.85 0.00 0.00 60.65 59.86 1bk5 h LYS 431 Cb 0.39 0.06 -0.07 0.00 -0.60 0.00 0.00 32.23 32.01 1bk5 h LYS 431 CO 0.06 -0.18 0.62 -1.35 -3.45 0.00 0.00 179.45 175.15 1bk5 h PRO 432 N -0.28 1.03 -0.27 1.90 0.11 -1.78 -1.38 132.00 131.34 1bk5 h PRO 432 Ca 0.09 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.11 1bk5 h PRO 432 Cb 0.42 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 1bk5 h PRO 432 CO -0.27 0.68 0.04 -0.07 -0.21 0.00 0.00 178.00 178.18 1bk5 h LEU 433 N 1.06 0.42 -0.11 2.35 4.07 -0.90 -2.16 115.31 120.04 1bk5 h LEU 433 Ca 0.43 -0.26 -0.00 0.00 0.08 0.00 0.00 57.88 58.13 1bk5 h LEU 433 Cb 0.27 -0.11 -0.00 0.00 1.08 0.00 0.00 40.66 41.90 1bk5 h LEU 433 CO -0.18 0.57 0.05 0.00 -1.08 0.00 0.00 178.44 177.80 1bk5 h ASP 435 N 0.04 1.07 -0.90 0.00 3.32 -1.28 -2.02 116.42 116.64 1bk5 h ASP 435 Ca 0.04 -0.00 0.17 0.00 0.02 0.00 0.00 57.03 57.25 1bk5 h ASP 435 Cb 0.14 -0.23 -0.07 0.00 0.22 0.00 0.00 39.33 39.38 1bk5 h ASP 435 CO -0.00 0.71 0.58 0.25 -1.72 0.00 0.00 179.24 179.06 1bk5 h LEU 436 N 1.23 0.57 -1.48 1.55 5.85 -1.18 0.03 115.31 121.87 1bk5 h LEU 436 Ca 0.41 0.05 0.22 0.00 0.84 0.00 0.00 57.88 59.40 1bk5 h LEU 436 Cb 0.07 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 40.96 1bk5 h LEU 436 CO -0.14 0.26 0.62 -0.07 -0.34 0.00 0.00 178.44 178.77 1bk5 h LEU 437 N 0.59 0.41 -1.34 2.25 3.38 -1.35 -0.71 115.31 118.54 1bk5 h LEU 437 Ca 0.47 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.45 1bk5 h LEU 437 Cb 0.90 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 1bk5 h LEU 437 CO -0.21 0.14 -0.20 -0.08 0.09 0.00 0.00 178.44 178.18 1bk5 h GLU 438 N 0.40 0.00 0.00 1.13 4.81 -1.12 -3.33 114.58 116.46 1bk5 h GLU 438 Ca 0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.73 1bk5 h GLU 438 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 1bk5 h GLU 438 CO -0.20 0.20 -0.42 0.44 -0.73 0.00 0.00 179.01 178.29 1bk5 n ILE 439 N -3.45 0.00 -1.42 2.32 -5.35 -0.47 -5.08 119.36 105.92 1bk5 n ILE 439 Ca -0.00 -0.30 -0.31 0.00 -0.27 0.00 0.00 62.75 61.86 1bk5 n ILE 439 Cb 0.38 0.80 0.07 0.00 -1.74 0.00 0.00 39.64 39.15 1bk5 n ILE 439 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1bk5 s ALA 440 N -1.45 2.43 0.80 -1.28 0.00 -0.40 -5.06 121.76 116.79 1bk5 s ALA 440 Ca 0.00 0.22 -0.12 0.00 0.00 0.00 0.00 51.96 52.06 1bk5 s ALA 440 Cb 0.01 -3.24 0.08 0.00 0.00 0.00 0.00 23.12 19.96 1bk5 s ALA 440 CO 0.03 -1.52 1.16 0.16 0.00 0.00 0.00 175.76 175.60 1bk5 s ASP 441 N -3.48 4.56 0.25 0.00 1.47 -1.26 -4.80 116.67 113.41 1bk5 s ASP 441 Ca 0.60 0.77 -0.04 0.00 1.18 0.00 0.00 52.55 55.06 1bk5 s ASP 441 Cb -0.16 -1.28 0.36 0.00 -0.34 0.00 0.00 42.92 41.50 1bk5 s ASP 441 CO 0.54 -1.86 1.87 0.78 0.68 0.00 0.00 175.17 177.18 1bk5 h ASN 442 N -1.01 0.97 -0.55 2.11 2.35 -1.99 -1.24 115.58 116.23 1bk5 h ASN 442 Ca -0.46 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.26 1bk5 h ASN 442 Cb 1.33 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 39.47 1bk5 h ASN 442 CO 0.65 0.63 0.21 -0.09 -1.65 0.00 0.00 177.43 177.19 1bk5 h ARG 443 N 1.11 0.87 0.00 0.81 9.65 -2.00 -1.58 114.38 123.24 1bk5 h ARG 443 Ca 0.40 -0.14 -0.15 0.00 -1.10 0.00 0.00 59.98 58.99 1bk5 h ARG 443 Cb 0.14 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 28.55 1bk5 h ARG 443 CO -0.16 0.73 -0.70 0.82 2.80 0.00 0.00 179.97 183.46 1bk5 h ILE 444 N 0.85 1.35 -0.39 1.20 1.08 -1.82 -2.38 117.51 117.41 1bk5 h ILE 444 Ca 0.20 -2.51 -0.06 0.00 -0.39 0.00 0.00 64.86 62.10 1bk5 h ILE 444 Cb 0.20 2.41 -0.01 0.00 -3.07 0.00 0.00 36.82 36.35 1bk5 h ILE 444 CO -0.01 0.68 0.01 0.40 -0.69 0.00 0.00 178.15 178.54 1bk5 h ILE 445 N 0.00 1.26 -0.18 -0.67 2.04 -0.65 0.12 117.51 119.42 1bk5 h ILE 445 Ca -0.01 -0.98 0.03 0.00 1.00 0.00 0.00 64.86 64.90 1bk5 h ILE 445 Cb 1.36 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 38.54 1bk5 h ILE 445 CO 0.09 0.33 0.01 -0.33 0.00 0.00 0.00 178.15 178.25 1bk5 h GLU 446 N 0.50 0.07 -0.53 2.37 5.08 -1.21 0.34 114.58 121.20 1bk5 h GLU 446 Ca 0.11 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1bk5 h GLU 446 Cb 0.46 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 1bk5 h GLU 446 CO 0.02 0.05 0.35 0.28 -1.00 0.00 0.00 179.01 178.71 1bk5 h VAL 447 N 0.08 1.13 -0.58 3.13 2.07 -1.23 -1.04 116.25 119.79 1bk5 h VAL 447 Ca 0.08 -0.24 -0.08 0.00 0.82 0.00 0.00 66.70 67.28 1bk5 h VAL 447 Cb 0.10 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1bk5 h VAL 447 CO -0.13 0.13 0.03 0.74 0.02 0.00 0.00 177.57 178.35 1bk5 h THR 448 N 0.71 1.26 0.00 2.57 2.02 -0.32 -2.30 112.91 116.85 1bk5 h THR 448 Ca 0.20 -1.08 -0.07 0.00 0.77 0.00 0.00 66.41 66.22 1bk5 h THR 448 Cb -0.07 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 1bk5 h THR 448 CO -0.05 0.39 -0.35 -0.07 0.37 0.00 0.00 175.52 175.81 1bk5 h LEU 449 N 0.92 0.00 -0.31 2.58 3.38 0.06 -1.50 115.31 120.44 1bk5 h LEU 449 Ca 0.17 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.05 1bk5 h LEU 449 Cb 0.50 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1bk5 h LEU 449 CO 0.02 0.35 -0.16 0.44 0.09 0.00 0.00 178.44 179.18 1bk5 h ASP 450 N 0.00 0.68 -0.41 -0.43 3.32 -0.75 -0.88 116.42 117.95 1bk5 h ASP 450 Ca -0.00 -0.41 -0.04 0.00 0.02 0.00 0.00 57.03 56.60 1bk5 h ASP 450 Cb 0.71 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 1bk5 h ASP 450 CO 0.05 0.95 0.12 0.00 -1.72 0.00 0.00 179.24 178.63 1bk5 h ALA 451 N 0.76 0.54 -0.64 3.45 0.00 -1.15 -0.59 119.26 121.62 1bk5 h ALA 451 Ca 0.07 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1bk5 h ALA 451 Cb 0.70 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1bk5 h ALA 451 CO 0.05 0.20 0.17 -0.07 0.00 0.00 0.00 179.25 179.60 1bk5 h LEU 452 N 0.53 0.94 -0.38 0.00 3.38 -1.23 -0.76 115.31 117.78 1bk5 h LEU 452 Ca 0.13 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.80 1bk5 h LEU 452 Cb 0.28 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1bk5 h LEU 452 CO -0.00 0.90 -0.26 -0.08 0.09 0.00 0.00 178.44 179.09 1bk5 h GLU 453 N 0.96 0.85 -0.63 1.13 4.81 -0.95 0.18 114.58 120.93 1bk5 h GLU 453 Ca 0.21 -0.40 -0.04 0.00 -0.13 0.00 0.00 59.36 58.99 1bk5 h GLU 453 Cb 0.32 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 1bk5 h GLU 453 CO -0.00 1.04 0.23 -0.91 -0.73 0.00 0.00 179.01 178.64 1bk5 h ASN 454 N 0.65 0.86 -0.54 1.04 2.35 -0.87 0.26 115.58 119.35 1bk5 h ASN 454 Ca 0.08 -0.13 -0.07 0.00 -0.55 0.00 0.00 56.30 55.63 1bk5 h ASN 454 Cb 0.83 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.95 1bk5 h ASN 454 CO 0.07 0.79 0.08 0.40 -1.65 0.00 0.00 177.43 177.12 1bk5 h ILE 455 N 0.92 1.25 -0.16 2.81 2.04 -0.89 -2.15 117.51 121.33 1bk5 h ILE 455 Ca 0.21 -0.98 -0.19 0.00 1.00 0.00 0.00 64.86 64.91 1bk5 h ILE 455 Cb 0.22 0.72 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1bk5 h ILE 455 CO -0.01 0.36 -0.66 -0.07 0.00 0.00 0.00 178.15 177.77 1bk5 h LEU 456 N 0.88 0.69 -0.84 1.44 3.38 0.15 -2.12 115.31 118.91 1bk5 h LEU 456 Ca 0.18 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 1bk5 h LEU 456 Cb 0.41 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 1bk5 h LEU 456 CO 0.01 1.17 0.44 0.11 0.09 0.00 0.00 178.44 180.26 1bk5 h LYS 457 N 0.44 1.18 0.21 1.13 1.57 -0.32 -0.75 116.57 120.03 1bk5 h LYS 457 Ca -0.02 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1bk5 h LYS 457 Cb 1.24 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.33 1bk5 h LYS 457 CO 0.13 0.88 -0.10 1.98 -0.57 0.00 0.00 179.45 181.77 1bk5 h MET 458 N 1.17 -0.27 0.00 3.15 4.05 -1.31 0.30 114.93 122.02 1bk5 h MET 458 Ca 0.29 0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.73 1bk5 h MET 458 Cb 0.06 0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 30.92 1bk5 h MET 458 CO -0.04 -0.00 -0.02 0.78 0.23 0.00 0.00 176.91 177.86 1bk5 h GLY 459 N -0.52 0.00 0.69 1.39 0.00 -1.27 -1.63 103.07 101.74 1bk5 h GLY 459 Ca -0.03 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.12 1bk5 h GLY 459 CO 0.05 0.00 -0.78 -2.09 0.00 0.00 0.00 176.54 173.72 1bk5 h GLU 460 N 0.00 0.31 -0.33 4.80 4.57 -0.83 -3.13 114.58 119.97 1bk5 h GLU 460 Ca -0.00 -0.50 0.04 0.00 -1.18 0.00 0.00 59.36 57.73 1bk5 h GLU 460 Cb 0.05 0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 28.78 1bk5 h GLU 460 CO 0.00 1.22 0.08 0.00 -1.18 0.00 0.00 179.01 179.14 1bk5 h ALA 461 N 0.11 0.35 -0.31 2.92 0.00 0.53 -2.05 119.26 120.82 1bk5 h ALA 461 Ca -0.13 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1bk5 h ALA 461 Cb 1.60 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1bk5 h ALA 461 CO 0.15 -0.32 0.00 -0.40 0.00 0.00 0.00 179.25 178.67 1bk5 n ASP 462 N -5.07 2.05 0.13 0.00 5.75 -0.89 -1.83 116.55 116.69 1bk5 n ASP 462 Ca 0.01 -1.88 -0.23 0.00 -0.01 0.00 0.00 54.79 52.67 1bk5 n ASP 462 Cb 0.13 -0.20 -0.15 0.00 -1.03 0.00 0.00 41.12 39.87 1bk5 n ASP 462 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 1bk5 h LYS 463 N 2.44 0.47 0.06 0.11 3.64 -1.32 -2.92 116.57 119.05 1bk5 h LYS 463 Ca 0.00 -0.81 -0.25 0.00 -1.27 0.00 0.00 60.65 58.32 1bk5 h LYS 463 Cb 0.55 0.30 0.01 0.00 -0.41 0.00 0.00 32.23 32.68 1bk5 h LYS 463 CO 0.00 1.38 -1.07 0.93 -2.27 0.00 0.00 179.45 178.42 1bk5 h GLU 464 N 0.13 0.38 -0.01 1.90 5.08 -1.38 -3.02 114.58 117.66 1bk5 h GLU 464 Ca -0.25 -0.49 0.00 0.00 -1.00 0.00 0.00 59.36 57.63 1bk5 h GLU 464 Cb 2.13 0.16 -0.00 0.00 0.50 0.00 0.00 28.75 31.54 1bk5 h GLU 464 CO 0.25 1.17 0.04 0.00 -1.00 0.00 0.00 179.01 179.47 1bk5 h ALA 465 N 0.65 1.16 -0.54 3.43 0.00 -1.38 -3.41 119.26 119.16 1bk5 h ALA 465 Ca -0.11 -0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.13 1bk5 h ALA 465 Cb 1.74 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 19.40 1bk5 h ALA 465 CO 0.18 -0.05 -0.52 1.03 0.00 0.00 0.00 179.25 179.90 1bk5 s ARG 466 N -4.25 2.16 -0.06 0.00 0.52 -1.11 -5.03 118.95 111.19 1bk5 s ARG 466 Ca -0.05 -2.37 0.13 0.00 -0.52 0.00 0.00 55.73 52.92 1bk5 s ARG 466 Cb 0.13 -1.47 0.48 0.00 0.52 0.00 0.00 34.95 34.61 1bk5 s ARG 466 CO 0.43 -0.35 1.35 0.41 0.02 0.00 0.00 175.30 177.16 1bk5 n GLY 467 N -1.22 1.74 3.73 -3.53 0.00 -1.26 -4.79 105.19 99.87 1bk5 n GLY 467 Ca -0.17 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 44.91 1bk5 n GLY 467 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bk5 s LEU 468 N -1.31 3.61 -0.27 0.99 1.43 -1.23 -4.95 118.68 116.95 1bk5 s LEU 468 Ca 0.34 2.66 0.11 0.00 -1.03 0.00 0.00 54.13 56.21 1bk5 s LEU 468 Cb 0.21 -4.57 0.53 0.00 0.03 0.00 0.00 46.19 42.38 1bk5 s LEU 468 CO 0.18 -1.97 1.49 0.59 0.23 0.00 0.00 176.35 176.87 1bk5 n ASN 469 N -1.80 2.97 -3.74 2.29 3.02 -1.26 -4.77 115.26 111.97 1bk5 n ASN 469 Ca 0.15 -3.55 -0.14 0.00 -0.03 0.00 0.00 54.58 51.02 1bk5 n ASN 469 Cb 0.48 -0.63 -0.09 0.00 -0.61 0.00 0.00 39.78 38.93 1bk5 n ASN 469 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1bk5 s ILE 470 N -3.13 0.05 -0.54 2.41 2.07 -1.26 -5.09 121.20 115.70 1bk5 s ILE 470 Ca 0.45 -0.38 -0.16 0.00 -1.41 0.00 0.00 60.65 59.15 1bk5 s ILE 470 Cb 0.39 -0.63 0.12 0.00 0.13 0.00 0.00 42.46 42.48 1bk5 s ILE 470 CO 0.03 -0.21 0.53 0.21 -1.91 0.00 0.00 174.94 173.59 1bk5 s ASN 471 N -1.11 6.19 0.24 4.50 3.84 -1.26 -4.81 114.94 122.53 1bk5 s ASN 471 Ca -0.12 -1.70 -0.06 0.00 0.21 0.00 0.00 52.86 51.19 1bk5 s ASN 471 Cb -0.04 -2.22 0.43 0.00 -0.55 0.00 0.00 41.25 38.86 1bk5 s ASN 471 CO 0.04 -0.89 1.67 -0.33 -2.79 0.00 0.00 177.10 174.81 1bk5 h GLU 472 N 8.93 0.20 -0.63 0.43 5.08 -1.99 -0.73 114.58 125.86 1bk5 h GLU 472 Ca -0.30 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.01 1bk5 h GLU 472 Cb 1.10 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.28 1bk5 h GLU 472 CO 1.04 0.13 0.24 -0.91 -1.00 0.00 0.00 179.01 178.51 1bk5 h ASN 473 N 0.20 0.85 -0.65 1.42 2.35 -1.89 0.35 115.58 118.21 1bk5 h ASN 473 Ca 0.40 -0.12 -0.07 0.00 -0.55 0.00 0.00 56.30 55.95 1bk5 h ASN 473 Cb 0.68 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.81 1bk5 h ASN 473 CO -0.55 0.77 0.12 0.00 -1.65 0.00 0.00 177.43 176.13 1bk5 h ALA 474 N 1.35 0.86 -0.57 -0.83 0.00 -1.54 0.21 119.26 118.74 1bk5 h ALA 474 Ca 0.21 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1bk5 h ALA 474 Cb 0.20 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1bk5 h ALA 474 CO -0.02 0.62 0.07 0.22 0.00 0.00 0.00 179.25 180.14 1bk5 h ASP 475 N 0.99 0.93 -0.41 0.00 1.82 -0.44 -1.05 116.42 118.26 1bk5 h ASP 475 Ca 0.20 -0.27 0.06 0.00 -0.39 0.00 0.00 57.03 56.63 1bk5 h ASP 475 Cb 0.42 -0.25 -0.05 0.00 0.68 0.00 0.00 39.33 40.13 1bk5 h ASP 475 CO 0.01 0.97 0.10 -0.26 -1.61 0.00 0.00 179.24 178.45 1bk5 h PHE 476 N 0.86 0.16 -0.62 0.28 0.04 0.35 -1.26 116.94 116.76 1bk5 h PHE 476 Ca 0.17 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.94 1bk5 h PHE 476 Cb 0.45 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.56 1bk5 h PHE 476 CO 0.03 0.03 0.29 0.82 -0.60 0.00 0.00 178.31 178.88 1bk5 h ILE 477 N 0.23 1.22 -0.46 -0.55 2.04 -0.60 -1.92 117.51 117.47 1bk5 h ILE 477 Ca 0.20 -0.64 0.01 0.00 1.00 0.00 0.00 64.86 65.43 1bk5 h ILE 477 Cb 0.23 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 1bk5 h ILE 477 CO -0.25 0.26 0.29 -0.08 0.00 0.00 0.00 178.15 178.37 1bk5 h GLU 478 N 0.86 0.58 -0.52 2.37 4.81 -0.55 0.33 114.58 122.45 1bk5 h GLU 478 Ca 0.21 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.39 1bk5 h GLU 478 Cb 0.14 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1bk5 h GLU 478 CO -0.02 0.38 0.26 0.87 -0.73 0.00 0.00 179.01 179.77 1bk5 h LYS 479 N 0.59 0.73 0.00 1.92 1.79 -1.09 -1.61 116.57 118.91 1bk5 h LYS 479 Ca 0.17 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1bk5 h LYS 479 Cb -0.04 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 30.47 1bk5 h LYS 479 CO -0.05 0.60 0.00 0.00 -1.08 0.00 0.00 179.45 178.91 1bk5 n ALA 480 N -2.30 2.08 -1.04 3.86 0.00 -0.74 -4.81 120.51 117.57 1bk5 n ALA 480 Ca 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 53.44 53.36 1bk5 n ALA 480 Cb 0.11 -1.23 -0.01 0.00 0.00 0.00 0.00 19.45 18.32 1bk5 n ALA 480 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bk5 n GLY 481 N 0.00 0.50 0.20 0.00 0.00 -0.60 -4.85 105.19 100.44 1bk5 n GLY 481 Ca 0.11 -0.31 -0.03 0.00 0.00 0.00 0.00 46.02 45.79 1bk5 n GLY 481 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1bk5 h GLY 482 N 0.00 0.30 0.55 -0.02 0.00 -0.54 -3.21 103.07 100.15 1bk5 h GLY 482 Ca -0.03 -0.28 0.05 0.00 0.00 0.00 0.00 47.33 47.07 1bk5 h GLY 482 CO 0.04 0.26 -0.05 1.98 0.00 0.00 0.00 176.54 178.77 1bk5 h MET 483 N 0.23 0.02 -0.84 4.80 -1.53 -1.82 0.12 114.93 115.91 1bk5 h MET 483 Ca 0.02 -0.00 -0.01 0.00 -3.44 0.00 0.00 59.70 56.27 1bk5 h MET 483 Cb 0.83 -0.00 -0.04 0.00 -0.55 0.00 0.00 31.60 31.84 1bk5 h MET 483 CO 0.07 0.01 0.50 1.49 0.14 0.00 0.00 176.91 179.12 1bk5 h GLU 484 N 0.02 1.14 -0.09 0.39 4.81 -1.92 0.11 114.58 119.03 1bk5 h GLU 484 Ca 0.11 -0.10 -0.14 0.00 -0.13 0.00 0.00 59.36 59.10 1bk5 h GLU 484 Cb 0.17 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1bk5 h GLU 484 CO -0.23 0.80 -0.55 0.87 -0.73 0.00 0.00 179.01 179.17 1bk5 h LYS 485 N 1.16 0.27 -0.13 1.92 1.57 -1.38 -1.11 116.57 118.87 1bk5 h LYS 485 Ca 0.30 -0.17 -0.17 0.00 -1.87 0.00 0.00 60.65 58.74 1bk5 h LYS 485 Cb -0.04 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1bk5 h LYS 485 CO -0.06 0.75 -0.65 0.82 -0.57 0.00 0.00 179.45 179.74 1bk5 h ILE 486 N 0.21 1.35 -0.51 1.86 2.04 -0.12 -2.83 117.51 119.51 1bk5 h ILE 486 Ca 0.00 -1.97 -0.03 0.00 1.00 0.00 0.00 64.86 63.86 1bk5 h ILE 486 Cb 1.03 1.95 -0.02 0.00 -0.74 0.00 0.00 36.82 39.04 1bk5 h ILE 486 CO 0.09 0.60 0.21 0.15 0.00 0.00 0.00 178.15 179.20 1bk5 h PHE 487 N 0.35 0.76 -0.37 1.37 3.57 -0.54 -2.38 116.94 119.71 1bk5 h PHE 487 Ca -0.01 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.49 1bk5 h PHE 487 Cb 1.21 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.70 1bk5 h PHE 487 CO 0.05 0.63 0.25 -0.91 -2.23 0.00 0.00 178.31 176.09 1bk5 h ASN 488 N 0.68 0.23 0.37 0.41 2.35 -1.07 -0.41 115.58 118.14 1bk5 h ASN 488 Ca 0.17 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1bk5 h ASN 488 Cb 0.18 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1bk5 h ASN 488 CO -0.02 0.15 0.00 0.00 -1.65 0.00 0.00 177.43 175.92 1bk5 h GLN 490 N 0.00 0.00 -0.67 0.00 4.20 -1.13 -1.63 115.11 115.89 1bk5 h GLN 490 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1bk5 h GLN 490 Cb 0.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.97 1bk5 h GLN 490 CO 0.00 0.01 0.00 1.04 -0.67 0.00 0.00 178.83 179.21 1bk5 n GLN 491 N -3.14 3.66 -2.52 1.46 6.02 -0.78 -4.77 117.38 117.31 1bk5 n GLN 491 Ca -0.02 -2.83 -0.37 0.00 -0.01 0.00 0.00 57.00 53.77 1bk5 n GLN 491 Cb 0.17 -1.88 -0.04 0.00 1.02 0.00 0.00 30.24 29.51 1bk5 n GLN 491 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1bk5 s ASN 492 N -0.89 6.82 0.46 1.08 3.84 -0.61 -4.94 114.94 120.70 1bk5 s ASN 492 Ca 0.51 2.09 0.24 0.00 0.21 0.00 0.00 52.86 55.90 1bk5 s ASN 492 Cb 0.32 -2.59 1.09 0.00 -0.55 0.00 0.00 41.25 39.52 1bk5 s ASN 492 CO 0.25 -0.45 1.91 1.05 -2.79 0.00 0.00 177.10 177.07 1bk5 h GLU 493 N 2.70 0.00 -6.22 0.43 9.09 -1.92 -3.41 114.58 115.25 1bk5 h GLU 493 Ca -0.48 0.00 -0.56 0.00 0.05 0.00 0.00 59.36 58.37 1bk5 h GLU 493 Cb 1.22 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.28 1bk5 h GLU 493 CO 0.63 0.21 0.78 1.21 0.05 0.00 0.00 179.01 181.90 1bk5 s ASN 494 N -6.26 7.03 0.13 3.06 3.84 -1.26 -4.96 114.94 116.51 1bk5 s ASN 494 Ca -0.01 1.69 -0.26 0.00 0.21 0.00 0.00 52.86 54.50 1bk5 s ASN 494 Cb 0.12 -2.55 -0.04 0.00 -0.55 0.00 0.00 41.25 38.23 1bk5 s ASN 494 CO 0.63 -0.65 1.63 0.44 -2.79 0.00 0.00 177.10 176.35 1bk5 h ASP 495 N 7.73 -0.81 -0.78 -4.21 3.32 -2.00 -1.13 116.42 118.54 1bk5 h ASP 495 Ca -0.29 0.12 0.14 0.00 0.02 0.00 0.00 57.03 57.02 1bk5 h ASP 495 Cb 1.13 0.34 -0.09 0.00 0.22 0.00 0.00 39.33 40.92 1bk5 h ASP 495 CO 0.93 -0.33 0.34 0.11 -1.72 0.00 0.00 179.24 178.56 1bk5 h LYS 496 N -0.39 0.48 0.61 3.56 1.57 -1.97 -0.99 116.57 119.43 1bk5 h LYS 496 Ca 0.07 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1bk5 h LYS 496 Cb 0.50 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.70 1bk5 h LYS 496 CO -0.26 0.32 -0.29 0.82 -0.57 0.00 0.00 179.45 179.46 1bk5 h ILE 497 N 0.49 0.03 -0.79 1.86 2.04 -1.81 -1.74 117.51 117.59 1bk5 h ILE 497 Ca 0.43 -0.40 0.01 0.00 1.00 0.00 0.00 64.86 65.90 1bk5 h ILE 497 Cb 0.63 0.05 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 1bk5 h ILE 497 CO -0.39 0.01 0.53 0.10 0.00 0.00 0.00 178.15 178.39 1bk5 h TYR 498 N -1.21 0.99 -0.37 1.37 -0.00 -1.13 0.19 116.97 116.81 1bk5 h TYR 498 Ca -0.08 0.02 -0.09 0.00 0.00 0.00 0.00 58.73 58.58 1bk5 h TYR 498 Cb 0.64 -0.33 -0.02 0.00 0.00 0.00 0.00 36.73 37.02 1bk5 h TYR 498 CO 0.00 0.61 -0.15 0.93 -0.00 0.00 0.00 178.16 179.55 1bk5 h GLU 499 N 1.05 0.68 -0.47 0.10 5.08 -1.26 -0.19 114.58 119.57 1bk5 h GLU 499 Ca 0.30 -0.23 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 1bk5 h GLU 499 Cb -0.09 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 1bk5 h GLU 499 CO -0.07 0.80 -0.05 -0.22 -1.00 0.00 0.00 179.01 178.47 1bk5 h LYS 500 N 0.61 0.81 -0.03 2.33 1.63 -0.31 -2.42 116.57 119.18 1bk5 h LYS 500 Ca 0.10 -0.24 -0.01 0.00 -0.85 0.00 0.00 60.65 59.65 1bk5 h LYS 500 Cb 0.61 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 32.15 1bk5 h LYS 500 CO 0.04 0.85 -0.01 0.00 -3.45 0.00 0.00 179.45 176.88 1bk5 h ALA 501 N 1.20 0.04 -0.50 5.00 0.00 -0.41 -1.93 119.26 122.66 1bk5 h ALA 501 Ca 0.14 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1bk5 h ALA 501 Cb 0.52 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1bk5 h ALA 501 CO 0.03 -0.25 0.29 1.88 0.00 0.00 0.00 179.25 181.20 1bk5 h TYR 502 N -0.31 0.53 -0.70 0.00 0.05 -1.00 -1.91 116.97 113.64 1bk5 h TYR 502 Ca 0.01 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.81 1bk5 h TYR 502 Cb 0.41 -0.17 -0.03 0.00 1.01 0.00 0.00 36.73 37.94 1bk5 h TYR 502 CO 0.06 0.29 0.46 -0.22 -1.05 0.00 0.00 178.16 177.70 1bk5 h LYS 503 N 0.57 0.93 0.17 4.88 3.64 -1.43 -0.19 116.57 125.13 1bk5 h LYS 503 Ca 0.21 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1bk5 h LYS 503 Cb 0.05 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1bk5 h LYS 503 CO -0.11 0.62 -0.08 0.82 -2.27 0.00 0.00 179.45 178.43 1bk5 h ILE 504 N 0.95 0.92 -0.03 2.00 2.04 -0.98 0.25 117.51 122.66 1bk5 h ILE 504 Ca 0.26 -0.45 0.01 0.00 1.00 0.00 0.00 64.86 65.67 1bk5 h ILE 504 Cb -0.10 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1bk5 h ILE 504 CO -0.05 0.11 -0.03 0.40 0.00 0.00 0.00 178.15 178.57 1bk5 h ILE 505 N -0.45 0.91 -0.49 -0.67 1.08 -1.26 -0.19 117.51 116.43 1bk5 h ILE 505 Ca -0.02 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.45 1bk5 h ILE 505 Cb 0.35 0.91 -0.02 0.00 -3.07 0.00 0.00 36.82 34.98 1bk5 h ILE 505 CO 0.04 0.00 0.31 -0.08 -0.69 0.00 0.00 178.15 177.73 1bk5 h GLU 506 N -0.04 0.65 -0.25 2.37 4.81 -0.99 0.41 114.58 121.54 1bk5 h GLU 506 Ca 0.02 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 59.05 1bk5 h GLU 506 Cb 0.08 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.32 1bk5 h GLU 506 CO -0.05 0.46 -0.45 1.15 -0.73 0.00 0.00 179.01 179.38 1bk5 h THR 507 N 0.65 1.30 0.00 0.32 2.02 -0.31 -3.32 112.91 113.58 1bk5 h THR 507 Ca 0.18 -1.65 0.00 0.00 0.77 0.00 0.00 66.41 65.70 1bk5 h THR 507 Cb -0.04 1.74 0.00 0.00 -1.74 0.00 0.00 68.15 68.11 1bk5 h THR 507 CO -0.04 0.53 -0.43 -1.22 0.37 0.00 0.00 175.52 174.73 1bk5 n TYR 508 N -4.15 0.00 -2.13 3.16 4.02 -0.10 -4.71 117.16 113.26 1bk5 n TYR 508 Ca -0.05 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.78 1bk5 n TYR 508 Cb 0.57 -0.02 0.08 0.00 -0.02 0.00 0.00 39.34 39.95 1bk5 n TYR 508 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1bk5 n PHE 509 N -1.23 1.24 1.57 -0.72 3.01 0.14 -5.01 117.46 116.47 1bk5 n PHE 509 Ca 0.01 -1.73 0.14 0.00 1.01 0.00 0.00 57.45 56.88 1bk5 n PHE 509 Cb 0.09 -0.26 0.58 0.00 -0.01 0.00 0.00 39.48 39.88 1bk5 n PHE 509 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18