#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hi1 s GLU 91 N 0.00 4.23 -0.08 -0.78 0.41 -1.26 -4.96 118.70 116.26 3hi1 s GLU 91 Ca 0.00 0.20 -0.11 0.00 -0.41 0.00 0.00 54.97 54.65 3hi1 s GLU 91 Cb 0.00 -3.41 -0.05 0.00 -1.78 0.00 0.00 34.13 28.90 3hi1 s GLU 91 CO 0.00 0.27 0.26 -0.80 -0.49 0.00 0.00 175.26 174.50 3hi1 s ASN 92 N 0.34 6.55 -0.03 -0.19 0.01 -1.26 -0.96 114.94 119.40 3hi1 s ASN 92 Ca 0.19 0.65 0.02 0.00 -0.71 0.00 0.00 52.86 53.02 3hi1 s ASN 92 Cb -0.14 -2.15 0.00 0.00 0.41 0.00 0.00 41.25 39.38 3hi1 s ASN 92 CO 0.06 0.34 -0.09 -0.36 -1.51 0.00 0.00 177.10 175.54 3hi1 s PHE 93 N -0.83 0.92 -0.37 2.20 0.40 -0.47 -4.99 117.98 114.84 3hi1 s PHE 93 Ca 0.18 -0.23 0.01 0.00 -0.60 0.00 0.00 56.93 56.29 3hi1 s PHE 93 Cb -0.14 -0.67 0.14 0.00 0.51 0.00 0.00 43.02 42.86 3hi1 s PHE 93 CO 0.07 -0.10 0.22 1.21 0.70 0.00 0.00 175.22 177.32 3hi1 s ASN 94 N 0.23 3.16 0.48 1.36 3.04 -1.26 -1.25 114.94 120.71 3hi1 s ASN 94 Ca -0.04 -2.29 0.30 0.00 0.04 0.00 0.00 52.86 50.87 3hi1 s ASN 94 Cb -0.09 -0.57 1.64 0.00 -1.54 0.00 0.00 41.25 40.69 3hi1 s ASN 94 CO 0.00 -0.30 1.91 0.00 -3.04 0.00 0.00 177.10 175.68 3hi1 h MET 95 N 6.96 0.00 0.00 0.43 -0.00 -1.62 -1.58 114.93 119.11 3hi1 h MET 95 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.74 3hi1 h MET 95 Cb 0.96 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.56 3hi1 h MET 95 CO 0.32 0.00 -0.69 0.91 -0.00 0.00 0.00 176.91 177.46 3hi1 n TRP 96 N -2.59 0.18 -3.67 -0.10 8.01 -1.26 -4.25 117.44 113.76 3hi1 n TRP 96 Ca -0.02 0.05 -0.28 0.00 -1.31 0.00 0.00 57.50 55.94 3hi1 n TRP 96 Cb 0.10 -0.36 -0.12 0.00 -2.01 0.00 0.00 31.31 28.92 3hi1 n TRP 96 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.69 176.83 3hi1 s LYS 97 N -3.08 1.54 -0.34 -0.99 1.02 -0.59 -5.05 119.74 112.25 3hi1 s LYS 97 Ca 0.08 -2.48 -0.01 0.00 0.02 0.00 0.00 55.97 53.59 3hi1 s LYS 97 Cb 0.16 -2.38 0.13 0.00 -0.52 0.00 0.00 37.83 35.22 3hi1 s LYS 97 CO 0.74 -1.28 0.19 1.21 -0.92 0.00 0.00 175.35 175.30 3hi1 s ASN 98 N -0.33 3.10 0.55 2.83 2.47 -1.25 -4.80 114.94 117.50 3hi1 s ASN 98 Ca 0.25 -2.00 0.10 0.00 0.42 0.00 0.00 52.86 51.63 3hi1 s ASN 98 Cb -0.08 -0.39 0.57 0.00 -1.45 0.00 0.00 41.25 39.89 3hi1 s ASN 98 CO -0.12 -0.34 1.26 0.78 -3.72 0.00 0.00 177.10 174.97 3hi1 h ASN 99 N 7.31 0.00 -0.83 -4.21 2.35 -1.96 0.75 115.58 119.00 3hi1 h ASN 99 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 3hi1 h ASN 99 Cb 0.98 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.31 3hi1 h ASN 99 CO 0.30 0.00 0.52 0.24 -1.65 0.00 0.00 177.43 176.84 3hi1 h MET 100 N 0.00 1.11 0.77 0.81 2.86 -1.98 0.40 114.93 118.90 3hi1 h MET 100 Ca 0.00 -0.08 -0.04 0.00 -2.06 0.00 0.00 59.70 57.52 3hi1 h MET 100 Cb 1.32 -0.24 0.01 0.00 0.06 0.00 0.00 31.60 32.75 3hi1 h MET 100 CO 0.00 0.76 -0.37 0.28 1.06 0.00 0.00 176.91 178.64 3hi1 h VAL 101 N 1.13 0.18 -0.61 -2.22 2.07 0.15 0.66 116.25 117.61 3hi1 h VAL 101 Ca 0.30 -0.12 0.13 0.00 0.82 0.00 0.00 66.70 67.83 3hi1 h VAL 101 Cb -0.09 0.20 -0.11 0.00 -1.52 0.00 0.00 31.29 29.78 3hi1 h VAL 101 CO -0.06 0.01 -0.03 -0.33 0.02 0.00 0.00 177.57 177.18 3hi1 h GLU 102 N -1.13 0.09 -0.17 1.57 3.07 -1.59 -1.03 114.58 115.38 3hi1 h GLU 102 Ca -0.11 -0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.77 3hi1 h GLU 102 Cb 0.81 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.67 3hi1 h GLU 102 CO 0.17 0.06 0.02 0.37 -1.40 0.00 0.00 179.01 178.23 3hi1 h GLN 103 N 0.09 0.08 -0.40 2.33 5.75 -0.07 -1.80 115.11 121.10 3hi1 h GLN 103 Ca 0.32 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.82 3hi1 h GLN 103 Cb 0.51 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.02 3hi1 h GLN 103 CO -0.55 0.05 0.27 1.98 -2.65 0.00 0.00 178.83 177.93 3hi1 h MET 104 N 0.08 0.53 -0.39 1.69 4.05 0.01 -2.38 114.93 118.52 3hi1 h MET 104 Ca 0.08 -0.03 0.08 0.00 -0.28 0.00 0.00 59.70 59.54 3hi1 h MET 104 Cb 0.08 -0.12 -0.07 0.00 -0.80 0.00 0.00 31.60 30.69 3hi1 h MET 104 CO -0.12 0.35 -0.10 1.25 0.23 0.00 0.00 176.91 178.53 3hi1 h HIS 105 N 0.54 -0.21 -0.63 1.39 -0.00 -0.94 -0.61 115.15 114.70 3hi1 h HIS 105 Ca 0.15 0.03 0.11 0.00 -0.00 0.00 0.00 60.37 60.66 3hi1 h HIS 105 Cb -0.06 0.15 -0.12 0.00 -0.00 0.00 0.00 27.41 27.38 3hi1 h HIS 105 CO -0.05 -0.17 -0.34 0.93 -0.00 0.00 0.00 177.93 178.31 3hi1 h GLU 106 N 0.00 -0.14 -0.19 5.26 4.39 -0.85 -0.21 114.58 122.85 3hi1 h GLU 106 Ca 0.19 0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.90 3hi1 h GLU 106 Cb 0.28 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 3hi1 h GLU 106 CO -0.40 -0.09 0.11 -0.44 -1.16 0.00 0.00 179.01 177.03 3hi1 h ASP 107 N -0.14 0.18 -0.60 1.42 3.45 -0.75 -0.02 116.42 119.95 3hi1 h ASP 107 Ca 0.25 0.00 0.07 0.00 0.43 0.00 0.00 57.03 57.78 3hi1 h ASP 107 Cb 0.55 -0.04 -0.06 0.00 -0.56 0.00 0.00 39.33 39.23 3hi1 h ASP 107 CO -0.71 0.13 0.28 0.40 -1.57 0.00 0.00 179.24 177.77 3hi1 h ILE 108 N 0.23 0.88 -0.06 0.35 2.04 -0.58 0.25 117.51 120.62 3hi1 h ILE 108 Ca 0.07 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.78 3hi1 h ILE 108 Cb -0.01 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 36.36 3hi1 h ILE 108 CO -0.03 0.09 -0.12 0.40 0.00 0.00 0.00 178.15 178.49 3hi1 h ILE 109 N 0.52 0.67 -0.28 -0.67 1.08 -0.41 -1.77 117.51 116.64 3hi1 h ILE 109 Ca 0.28 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.82 3hi1 h ILE 109 Cb 0.26 0.67 -0.06 0.00 -3.07 0.00 0.00 36.82 34.61 3hi1 h ILE 109 CO -0.23 0.00 -0.14 0.28 -0.69 0.00 0.00 178.15 177.38 3hi1 h SER 110 N -0.18 -0.46 -0.75 1.72 0.02 -0.23 0.77 113.55 114.44 3hi1 h SER 110 Ca 0.07 0.11 0.22 0.00 -0.84 0.00 0.00 61.79 61.34 3hi1 h SER 110 Cb 0.27 0.25 -0.03 0.00 0.14 0.00 0.00 62.40 63.03 3hi1 h SER 110 CO -0.17 -0.17 0.59 0.25 -1.14 0.00 0.00 176.83 176.19 3hi1 h LEU 111 N -0.10 0.00 0.03 5.07 5.85 -0.12 0.41 115.31 126.46 3hi1 h LEU 111 Ca 0.15 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 3hi1 h LEU 111 Cb 0.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.35 3hi1 h LEU 111 CO -0.35 0.00 -0.23 -0.25 -0.34 0.00 0.00 178.44 177.27 3hi1 h TRP 112 N 0.00 0.12 0.11 1.25 7.01 -0.03 -2.76 115.95 121.65 3hi1 h TRP 112 Ca 0.36 -0.09 -0.00 0.00 2.11 0.00 0.00 58.89 61.27 3hi1 h TRP 112 Cb 1.52 -0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 28.58 3hi1 h TRP 112 CO 0.00 1.09 -0.07 -0.44 -2.79 0.00 0.00 178.44 176.23 3hi1 h ASP 113 N -0.86 -0.16 -0.97 2.65 3.45 -0.21 -1.28 116.42 119.05 3hi1 h ASP 113 Ca -0.05 0.01 0.31 0.00 0.43 0.00 0.00 57.03 57.74 3hi1 h ASP 113 Cb 1.15 0.05 -0.17 0.00 -0.56 0.00 0.00 39.33 39.80 3hi1 h ASP 113 CO 0.02 -0.11 0.26 -0.61 -1.57 0.00 0.00 179.24 177.23 3hi1 h GLN 114 N -0.17 0.06 0.00 3.56 -0.00 -0.34 0.58 115.11 118.80 3hi1 h GLN 114 Ca -0.01 -0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 3hi1 h GLN 114 Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 27.48 27.61 3hi1 h GLN 114 CO 0.01 0.04 0.00 -1.13 0.00 0.00 0.00 178.83 177.75 3hi1 n SER 115 N -5.34 0.00 -0.08 -0.69 3.41 -0.50 -3.52 113.62 106.90 3hi1 n SER 115 Ca 0.28 -0.31 -0.10 0.00 -0.26 0.00 0.00 58.87 58.48 3hi1 n SER 115 Cb 0.92 -0.18 -0.07 0.00 -0.26 0.00 0.00 64.21 64.61 3hi1 n SER 115 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hi1 n LEU 116 N -1.18 2.90 -4.70 1.04 4.77 0.20 -4.97 117.00 115.05 3hi1 n LEU 116 Ca 0.14 -0.08 -0.40 0.00 -0.03 0.00 0.00 56.01 55.64 3hi1 n LEU 116 Cb 0.15 -0.51 0.03 0.00 -2.33 0.00 0.00 43.42 40.76 3hi1 n LEU 116 CO 0.17 0.75 0.87 0.29 -1.33 0.00 0.00 177.39 178.13 3hi1 n LYS 117 N -2.93 1.68 -2.42 3.23 5.02 -0.79 -4.74 118.16 117.21 3hi1 n LYS 117 Ca -0.27 0.61 -0.24 0.00 -2.02 0.00 0.00 58.31 56.39 3hi1 n LYS 117 Cb 0.79 -2.42 0.09 0.00 -0.02 0.00 0.00 35.03 33.47 3hi1 n LYS 117 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3hi1 s PRO 118 N -2.54 1.92 0.16 1.97 0.05 -1.26 -5.00 135.00 130.31 3hi1 s PRO 118 Ca 0.67 -0.72 -0.30 0.00 0.05 0.00 0.00 61.00 60.70 3hi1 s PRO 118 Cb -0.46 -2.27 -0.08 0.00 0.05 0.00 0.00 34.50 31.74 3hi1 s PRO 118 CO 0.53 -1.31 1.24 0.00 0.05 0.00 0.00 177.00 177.51 3hi1 s VAL 120 N 0.26 4.91 0.42 0.00 -7.23 -1.26 -5.02 120.40 112.48 3hi1 s VAL 120 Ca 0.56 1.69 -0.26 0.00 -1.81 0.00 0.00 61.98 62.15 3hi1 s VAL 120 Cb -0.34 -4.16 -0.09 0.00 0.56 0.00 0.00 36.38 32.36 3hi1 s VAL 120 CO 0.35 0.10 1.45 -1.59 -0.31 0.00 0.00 175.10 175.10 3hi1 s LYS 121 N 1.61 3.83 0.47 4.82 -2.85 -1.26 -4.99 119.74 121.38 3hi1 s LYS 121 Ca 0.41 2.47 0.02 0.00 -1.00 0.00 0.00 55.97 57.87 3hi1 s LYS 121 Cb -0.18 -2.76 0.01 0.00 -2.06 0.00 0.00 37.83 32.84 3hi1 s LYS 121 CO 0.17 -0.72 0.68 -0.51 0.10 0.00 0.00 175.35 175.07 3hi1 s LEU 122 N -2.50 3.54 0.20 2.77 1.43 -1.26 -5.12 118.68 117.73 3hi1 s LEU 122 Ca 0.58 0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.77 3hi1 s LEU 122 Cb -0.45 -2.96 -0.05 0.00 0.03 0.00 0.00 46.19 42.76 3hi1 s LEU 122 CO 0.59 -0.85 -0.00 0.42 0.23 0.00 0.00 176.35 176.74 3hi1 s THR 123 N -2.58 0.85 0.00 5.49 -4.23 -1.26 -5.11 115.64 108.80 3hi1 s THR 123 Ca 0.52 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 3hi1 s THR 123 Cb -0.10 -2.23 0.00 0.00 1.34 0.00 0.00 72.50 71.51 3hi1 s THR 123 CO 0.37 -0.40 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 3hi1 n GLY 124 N -0.33 2.25 0.17 3.99 0.00 -1.26 -4.78 105.19 105.23 3hi1 n GLY 124 Ca -0.06 -1.72 0.13 0.00 0.00 0.00 0.00 46.02 44.38 3hi1 n GLY 124 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3hi1 h GLY 198 N 0.00 0.00 -6.78 -0.02 0.00 -2.07 -3.34 103.07 90.86 3hi1 h GLY 198 Ca 0.00 0.00 -0.71 0.00 0.00 0.00 0.00 47.33 46.62 3hi1 h GLY 198 CO 0.00 0.00 0.04 -1.14 0.00 0.00 0.00 176.54 175.44 3hi1 n SER 199 N -2.39 4.84 -3.96 0.19 3.41 -1.26 -4.98 113.62 109.46 3hi1 n SER 199 Ca 0.01 -3.34 -0.25 0.00 -0.26 0.00 0.00 58.87 55.03 3hi1 n SER 199 Cb 0.19 -1.00 -0.17 0.00 -0.26 0.00 0.00 64.21 62.98 3hi1 n SER 199 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3hi1 s VAL 200 N -2.26 1.02 0.00 -3.33 -7.23 -1.26 -5.08 120.40 102.26 3hi1 s VAL 200 Ca 0.33 -0.36 0.00 0.00 -1.81 0.00 0.00 61.98 60.14 3hi1 s VAL 200 Cb 0.05 -0.98 0.00 0.00 0.56 0.00 0.00 36.38 36.01 3hi1 s VAL 200 CO -0.00 0.34 0.89 -0.38 -0.31 0.00 0.00 175.10 175.64 3hi1 n ILE 201 N 4.26 0.00 -4.42 -0.62 5.41 -1.26 -4.88 119.36 117.85 3hi1 n ILE 201 Ca -0.19 1.39 -0.20 0.00 1.00 0.00 0.00 62.75 64.74 3hi1 n ILE 201 Cb 0.51 -2.38 -0.10 0.00 -0.71 0.00 0.00 39.64 36.95 3hi1 n ILE 201 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 3hi1 s THR 202 N -2.61 0.96 -0.82 1.39 -4.23 -1.26 -5.03 115.64 104.04 3hi1 s THR 202 Ca 0.00 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.76 3hi1 s THR 202 Cb 0.00 -2.71 0.02 0.00 1.34 0.00 0.00 72.50 71.15 3hi1 s THR 202 CO 0.00 0.00 1.37 0.00 -0.54 0.00 0.00 174.62 175.45 3hi1 n GLN 203 N -0.64 0.14 -1.98 3.99 1.13 -1.26 -4.85 117.38 113.91 3hi1 n GLN 203 Ca -0.02 0.03 -0.43 0.00 -1.94 0.00 0.00 57.00 54.65 3hi1 n GLN 203 Cb 0.66 -1.58 -0.03 0.00 0.11 0.00 0.00 30.24 29.40 3hi1 n GLN 203 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3hi1 s ALA 204 N -3.08 3.22 0.01 -1.58 0.00 -1.26 -4.90 121.76 114.17 3hi1 s ALA 204 Ca 0.09 0.62 -0.00 0.00 0.00 0.00 0.00 51.96 52.66 3hi1 s ALA 204 Cb 0.16 -3.89 -0.04 0.00 0.00 0.00 0.00 23.12 19.35 3hi1 s ALA 204 CO 0.71 -2.05 0.10 0.00 0.00 0.00 0.00 175.76 174.52 3hi1 s PRO 206 N -1.89 4.55 -0.17 0.00 0.04 -1.26 -5.00 135.00 131.27 3hi1 s PRO 206 Ca 0.25 1.26 0.00 0.00 0.04 0.00 0.00 61.00 62.55 3hi1 s PRO 206 Cb -0.12 -3.42 0.01 0.00 0.04 0.00 0.00 34.50 31.00 3hi1 s PRO 206 CO 0.16 0.08 -0.17 0.15 0.04 0.00 0.00 177.00 177.26 3hi1 s LYS 207 N 0.59 3.11 -0.21 4.56 -0.14 -1.26 -5.10 119.74 121.29 3hi1 s LYS 207 Ca 0.46 -0.79 -0.23 0.00 -1.36 0.00 0.00 55.97 54.05 3hi1 s LYS 207 Cb -0.21 -2.62 -0.02 0.00 -1.68 0.00 0.00 37.83 33.31 3hi1 s LYS 207 CO 0.26 -0.11 0.74 0.08 -0.76 0.00 0.00 175.35 175.56 3hi1 s VAL 208 N 1.10 4.92 0.76 3.17 1.01 -1.26 -5.03 120.40 125.07 3hi1 s VAL 208 Ca 0.00 1.42 -0.14 0.00 0.00 0.00 0.00 61.98 63.26 3hi1 s VAL 208 Cb -0.14 -4.05 0.05 0.00 0.00 0.00 0.00 36.38 32.24 3hi1 s VAL 208 CO -0.06 0.03 1.19 -0.94 0.00 0.00 0.00 175.10 175.32 3hi1 s SER 209 N 1.25 4.05 -1.12 3.32 1.04 -1.26 -4.70 113.70 116.28 3hi1 s SER 209 Ca 0.33 2.30 -0.21 0.00 0.48 0.00 0.00 55.95 58.85 3hi1 s SER 209 Cb -0.16 -2.58 0.06 0.00 0.10 0.00 0.00 66.02 63.44 3hi1 s SER 209 CO 0.10 -2.36 1.55 0.12 0.98 0.00 0.00 173.24 173.63 3hi1 s PHE 210 N -2.12 2.65 0.05 5.02 5.36 -1.26 -4.91 117.98 122.76 3hi1 s PHE 210 Ca 0.73 -1.17 -0.01 0.00 -0.96 0.00 0.00 56.93 55.52 3hi1 s PHE 210 Cb -0.28 -4.71 -0.04 0.00 -0.34 0.00 0.00 43.02 37.66 3hi1 s PHE 210 CO 0.47 -1.87 -0.02 -1.21 -1.46 0.00 0.00 175.22 171.13 3hi1 s GLU 211 N 4.59 0.60 -0.21 10.12 2.02 -1.26 -3.40 118.70 131.17 3hi1 s GLU 211 Ca 0.49 -1.18 -0.32 0.00 0.02 0.00 0.00 54.97 53.98 3hi1 s GLU 211 Cb 0.01 0.21 -0.09 0.00 0.10 0.00 0.00 34.13 34.37 3hi1 s GLU 211 CO -0.03 -0.11 2.12 -2.30 0.02 0.00 0.00 175.26 174.95 3hi1 n PRO 212 N 0.18 1.80 -4.11 0.39 -0.02 -1.26 -4.95 135.00 127.03 3hi1 n PRO 212 Ca -0.15 0.56 -0.35 0.00 -2.02 0.00 0.00 63.50 61.54 3hi1 n PRO 212 Cb 0.61 -2.84 -0.09 0.00 -0.02 0.00 0.00 33.50 31.15 3hi1 n PRO 212 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3hi1 s ILE 213 N 6.76 4.70 -0.06 4.25 -1.09 -1.26 -4.87 121.20 129.63 3hi1 s ILE 213 Ca 1.01 -0.08 -0.30 0.00 -2.23 0.00 0.00 60.65 59.05 3hi1 s ILE 213 Cb -0.59 -3.07 -0.06 0.00 -1.58 0.00 0.00 42.46 37.16 3hi1 s ILE 213 CO 0.44 0.52 1.76 -2.16 -1.23 0.00 0.00 174.94 174.27 3hi1 s PRO 214 N -0.12 4.08 -0.03 2.79 0.04 -1.26 -4.24 135.00 136.26 3hi1 s PRO 214 Ca 0.06 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.34 3hi1 s PRO 214 Cb -0.12 -4.05 0.03 0.00 0.04 0.00 0.00 34.50 30.39 3hi1 s PRO 214 CO 0.01 -0.98 -0.00 0.42 0.04 0.00 0.00 177.00 176.49 3hi1 s ILE 215 N 4.46 0.23 0.09 0.56 1.01 -0.58 -4.87 121.20 122.10 3hi1 s ILE 215 Ca 0.78 0.06 0.01 0.00 0.00 0.00 0.00 60.65 61.51 3hi1 s ILE 215 Cb -0.35 -0.32 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 3hi1 s ILE 215 CO 0.33 0.16 0.22 -1.00 0.00 0.00 0.00 174.94 174.65 3hi1 s HIS 216 N 1.05 3.47 -0.06 3.97 3.76 -1.26 -1.07 115.29 125.15 3hi1 s HIS 216 Ca -0.09 0.19 0.00 0.00 -0.15 0.00 0.00 55.06 55.01 3hi1 s HIS 216 Cb -0.14 -1.71 -0.03 0.00 1.11 0.00 0.00 32.58 31.81 3hi1 s HIS 216 CO -0.02 0.56 -0.05 0.71 -0.85 0.00 0.00 174.74 175.09 3hi1 s TYR 217 N -1.58 2.99 0.01 1.40 1.51 -1.26 -4.93 117.35 115.48 3hi1 s TYR 217 Ca 0.34 0.06 -0.02 0.00 -1.01 0.00 0.00 57.07 56.45 3hi1 s TYR 217 Cb -0.12 -1.72 -0.01 0.00 -0.11 0.00 0.00 41.96 40.00 3hi1 s TYR 217 CO 0.28 0.37 0.02 0.00 -1.11 0.00 0.00 175.55 175.10 3hi1 s ALA 219 N -0.92 3.66 0.90 0.00 0.00 -1.00 -5.04 121.76 119.36 3hi1 s ALA 219 Ca -0.10 -0.27 -0.12 0.00 0.00 0.00 0.00 51.96 51.47 3hi1 s ALA 219 Cb -0.06 -2.38 0.13 0.00 0.00 0.00 0.00 23.12 20.81 3hi1 s ALA 219 CO -0.00 0.52 1.12 -2.14 0.00 0.00 0.00 175.76 175.26 3hi1 s PRO 220 N -1.98 1.25 0.45 0.00 0.02 -1.26 -4.92 135.00 128.56 3hi1 s PRO 220 Ca 0.36 0.39 -0.25 0.00 0.02 0.00 0.00 61.00 61.52 3hi1 s PRO 220 Cb -0.14 -1.84 -0.08 0.00 0.02 0.00 0.00 34.50 32.45 3hi1 s PRO 220 CO 0.19 -2.14 1.38 0.00 -0.33 0.00 0.00 177.00 176.09 3hi1 n ALA 221 N -3.75 1.79 -0.73 -1.55 0.00 -1.26 -1.74 120.51 113.27 3hi1 n ALA 221 Ca 0.06 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.75 3hi1 n ALA 221 Cb 0.58 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.68 3hi1 n ALA 221 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hi1 n GLY 222 N 0.66 0.84 3.36 0.00 0.00 -1.26 -5.01 105.19 103.78 3hi1 n GLY 222 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 3hi1 n GLY 222 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hi1 s PHE 223 N -3.31 1.64 0.13 1.61 0.40 -0.71 -0.13 117.98 117.61 3hi1 s PHE 223 Ca 0.00 -1.18 -0.24 0.00 -0.60 0.00 0.00 56.93 54.91 3hi1 s PHE 223 Cb 0.00 -0.98 0.07 0.00 0.51 0.00 0.00 43.02 42.63 3hi1 s PHE 223 CO 0.00 -0.30 0.69 0.00 0.70 0.00 0.00 175.22 176.31 3hi1 s ALA 224 N -3.62 -1.63 -0.17 5.36 0.00 0.24 -4.70 121.76 117.25 3hi1 s ALA 224 Ca 0.36 0.56 -0.03 0.00 0.00 0.00 0.00 51.96 52.85 3hi1 s ALA 224 Cb 0.07 0.76 -0.02 0.00 0.00 0.00 0.00 23.12 23.93 3hi1 s ALA 224 CO 0.15 -0.78 -0.05 0.42 0.00 0.00 0.00 175.76 175.50 3hi1 s ILE 225 N -3.58 3.70 -0.13 0.00 1.01 -0.61 -0.69 121.20 120.90 3hi1 s ILE 225 Ca 0.03 -0.42 -0.17 0.00 0.00 0.00 0.00 60.65 60.09 3hi1 s ILE 225 Cb -0.01 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 3hi1 s ILE 225 CO -0.10 0.48 0.43 -0.76 0.00 0.00 0.00 174.94 174.99 3hi1 s LEU 226 N 0.62 4.26 -0.28 2.97 1.02 0.66 -0.02 118.68 127.92 3hi1 s LEU 226 Ca -0.03 0.73 -0.04 0.00 0.02 0.00 0.00 54.13 54.82 3hi1 s LEU 226 Cb -0.15 -2.61 0.03 0.00 0.02 0.00 0.00 46.19 43.48 3hi1 s LEU 226 CO 0.02 0.02 0.00 -0.75 0.02 0.00 0.00 176.35 175.67 3hi1 s LYS 227 N 0.61 2.83 0.16 1.70 2.20 0.13 -1.70 119.74 125.67 3hi1 s LYS 227 Ca 0.23 -1.00 -0.30 0.00 -0.36 0.00 0.00 55.97 54.54 3hi1 s LYS 227 Cb -0.15 -3.17 -0.08 0.00 -1.51 0.00 0.00 37.83 32.93 3hi1 s LYS 227 CO 0.09 -0.47 1.22 0.00 -0.36 0.00 0.00 175.35 175.83 3hi1 n ASN 229 N 2.87 1.79 -4.69 0.00 3.02 0.72 -4.90 115.26 114.07 3hi1 n ASN 229 Ca 0.06 -1.84 -0.44 0.00 -0.03 0.00 0.00 54.58 52.33 3hi1 n ASN 229 Cb 0.45 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.58 3hi1 n ASN 229 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3hi1 n ASP 230 N -0.42 3.36 -4.68 6.41 10.43 -1.25 -4.88 116.55 125.51 3hi1 n ASP 230 Ca 0.00 1.09 -0.44 0.00 2.57 0.00 0.00 54.79 58.02 3hi1 n ASP 230 Cb 0.23 -1.48 -0.02 0.00 1.84 0.00 0.00 41.12 41.69 3hi1 n ASP 230 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3hi1 n LYS 231 N 3.20 2.10 -3.99 -1.24 4.01 -1.26 -2.68 118.16 118.31 3hi1 n LYS 231 Ca 0.15 0.74 -0.41 0.00 -0.51 0.00 0.00 58.31 58.28 3hi1 n LYS 231 Cb 0.32 -2.38 0.02 0.00 -0.51 0.00 0.00 35.03 32.47 3hi1 n LYS 231 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 3hi1 n LYS 232 N 1.54 -0.58 -2.28 1.97 5.02 -1.26 -4.85 118.16 117.72 3hi1 n LYS 232 Ca 0.09 0.25 -0.41 0.00 -2.02 0.00 0.00 58.31 56.22 3hi1 n LYS 232 Cb 0.33 -2.60 -0.03 0.00 -0.02 0.00 0.00 35.03 32.72 3hi1 n LYS 232 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 3hi1 s PHE 233 N -3.41 3.31 0.47 2.13 5.36 -1.09 -4.93 117.98 119.83 3hi1 s PHE 233 Ca 0.39 1.40 0.13 0.00 -0.96 0.00 0.00 56.93 57.90 3hi1 s PHE 233 Cb -0.21 -3.52 1.10 0.00 -0.34 0.00 0.00 43.02 40.06 3hi1 s PHE 233 CO 0.95 -1.46 2.08 -0.97 -1.46 0.00 0.00 175.22 174.36 3hi1 h ASN 234 N 4.59 0.22 0.00 6.13 -0.73 -1.91 -3.46 115.58 120.42 3hi1 h ASN 234 Ca -0.46 -0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.71 3hi1 h ASN 234 Cb 1.22 -0.05 0.00 0.00 0.27 0.00 0.00 38.32 39.76 3hi1 h ASN 234 CO 0.72 0.15 0.00 0.61 -0.37 0.00 0.00 177.43 178.54 3hi1 n GLY 235 N -1.52 3.24 2.85 1.57 0.00 -1.26 -4.86 105.19 105.20 3hi1 n GLY 235 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 3hi1 n GLY 235 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hi1 s THR 236 N -2.38 -0.03 0.00 2.61 -4.23 -1.26 -1.89 115.64 108.47 3hi1 s THR 236 Ca 0.00 0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.61 3hi1 s THR 236 Cb 0.00 -0.07 0.00 0.00 1.34 0.00 0.00 72.50 73.77 3hi1 s THR 236 CO 0.00 0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 3hi1 n GLY 237 N 3.58 -0.30 3.81 3.99 0.00 -0.38 -4.97 105.19 110.92 3hi1 n GLY 237 Ca -0.19 -2.21 -0.31 0.00 0.00 0.00 0.00 46.02 43.31 3hi1 n GLY 237 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hi1 s PRO 238 N 0.00 3.01 -0.00 1.61 0.02 -1.25 -1.36 135.00 137.01 3hi1 s PRO 238 Ca 0.00 1.03 0.01 0.00 0.02 0.00 0.00 61.00 62.06 3hi1 s PRO 238 Cb 0.00 -2.00 0.00 0.00 0.02 0.00 0.00 34.50 32.52 3hi1 s PRO 238 CO 0.00 -1.05 -0.02 0.00 -0.33 0.00 0.00 177.00 175.60 3hi1 n THR 240 N 3.14 1.51 -3.08 0.00 -2.24 -1.26 -4.04 114.28 108.30 3hi1 n THR 240 Ca -0.14 -0.09 -0.44 0.00 -2.27 0.00 0.00 64.05 61.11 3hi1 n THR 240 Cb 0.58 -2.09 -0.00 0.00 -2.10 0.00 0.00 70.33 66.72 3hi1 n THR 240 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3hi1 s ASN 241 N -6.76 7.11 -0.48 3.42 0.01 -1.26 -4.97 114.94 112.01 3hi1 s ASN 241 Ca -0.30 -3.11 -0.07 0.00 -0.71 0.00 0.00 52.86 48.67 3hi1 s ASN 241 Cb 0.08 -2.33 0.12 0.00 0.41 0.00 0.00 41.25 39.53 3hi1 s ASN 241 CO 0.47 -0.62 0.32 -0.69 -1.51 0.00 0.00 177.10 175.08 3hi1 s VAL 242 N 0.70 3.91 0.40 1.60 1.01 -1.26 -0.20 120.40 126.55 3hi1 s VAL 242 Ca 0.37 -2.00 -0.23 0.00 0.00 0.00 0.00 61.98 60.12 3hi1 s VAL 242 Cb -0.05 -3.60 -0.10 0.00 0.00 0.00 0.00 36.38 32.63 3hi1 s VAL 242 CO -0.03 -0.77 1.00 -0.94 0.00 0.00 0.00 175.10 174.36 3hi1 s SER 243 N 2.21 6.90 -0.18 3.32 1.04 -0.36 -4.82 113.70 121.81 3hi1 s SER 243 Ca 0.08 1.89 -0.05 0.00 0.48 0.00 0.00 55.95 58.35 3hi1 s SER 243 Cb -0.24 -2.57 -0.03 0.00 0.10 0.00 0.00 66.02 63.28 3hi1 s SER 243 CO -0.02 -0.39 -0.01 0.42 0.98 0.00 0.00 173.24 174.21 3hi1 s THR 244 N -1.82 4.00 0.28 2.02 -4.23 -1.26 0.23 115.64 114.86 3hi1 s THR 244 Ca 0.58 -0.31 0.02 0.00 -1.18 0.00 0.00 61.69 60.80 3hi1 s THR 244 Cb -0.17 -2.78 -0.06 0.00 1.34 0.00 0.00 72.50 70.83 3hi1 s THR 244 CO 0.22 0.46 0.08 0.68 -0.54 0.00 0.00 174.62 175.52 3hi1 s VAL 245 N 0.62 0.79 -0.07 2.29 -7.23 0.97 -4.97 120.40 112.80 3hi1 s VAL 245 Ca -0.01 -2.00 0.11 0.00 -1.81 0.00 0.00 61.98 58.26 3hi1 s VAL 245 Cb -0.14 -2.68 -0.24 0.00 0.56 0.00 0.00 36.38 33.89 3hi1 s VAL 245 CO 0.02 -0.02 0.54 1.67 -0.31 0.00 0.00 175.10 177.01 3hi1 n GLN 246 N -0.54 0.65 -4.15 4.82 7.27 -1.26 -1.58 117.38 122.60 3hi1 n GLN 246 Ca -0.01 0.26 -0.10 0.00 0.07 0.00 0.00 57.00 57.22 3hi1 n GLN 246 Cb 0.66 -1.75 -0.10 0.00 2.41 0.00 0.00 30.24 31.47 3hi1 n GLN 246 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3hi1 s THR 248 N -3.91 2.47 0.87 0.00 -4.23 -0.23 -4.96 115.64 105.64 3hi1 s THR 248 Ca 0.18 0.12 -0.10 0.00 -1.18 0.00 0.00 61.69 60.70 3hi1 s THR 248 Cb 0.07 -3.14 0.11 0.00 1.34 0.00 0.00 72.50 70.88 3hi1 s THR 248 CO -0.02 -0.19 1.12 -1.38 -0.54 0.00 0.00 174.62 173.61 3hi1 s HIS 249 N -3.48 2.03 0.08 3.99 -3.43 -1.26 -4.50 115.29 108.71 3hi1 s HIS 249 Ca 0.61 1.65 -0.31 0.00 -0.80 0.00 0.00 55.06 56.21 3hi1 s HIS 249 Cb -0.11 -3.21 -0.07 0.00 -1.43 0.00 0.00 32.58 27.76 3hi1 s HIS 249 CO 0.49 -2.42 1.33 0.20 -2.00 0.00 0.00 174.74 172.34 3hi1 s GLY 250 N -2.99 2.09 -0.12 -1.38 0.00 -1.26 -4.55 107.32 99.10 3hi1 s GLY 250 Ca 0.64 0.99 0.03 0.00 0.00 0.00 0.00 44.72 46.38 3hi1 s GLY 250 CO 0.57 2.28 -0.22 -0.42 0.00 0.00 0.00 173.10 175.31 3hi1 s ILE 251 N 1.33 2.02 -0.95 0.90 1.01 -0.23 -4.82 121.20 120.44 3hi1 s ILE 251 Ca 0.63 -0.97 -0.08 0.00 0.00 0.00 0.00 60.65 60.22 3hi1 s ILE 251 Cb -0.34 -1.77 0.24 0.00 0.01 0.00 0.00 42.46 40.61 3hi1 s ILE 251 CO 0.29 0.55 0.90 -0.13 0.00 0.00 0.00 174.94 176.54 3hi1 s ARG 252 N 0.63 3.73 0.32 2.79 0.52 -1.26 -1.53 118.95 124.14 3hi1 s ARG 252 Ca -0.12 -2.97 -0.29 0.00 -0.52 0.00 0.00 55.73 51.83 3hi1 s ARG 252 Cb -0.16 -4.34 -0.10 0.00 0.52 0.00 0.00 34.95 30.87 3hi1 s ARG 252 CO 0.02 -1.25 1.24 -2.14 0.02 0.00 0.00 175.30 173.19 3hi1 s PRO 253 N -0.80 4.45 -0.13 3.54 0.02 -1.26 -4.81 135.00 136.01 3hi1 s PRO 253 Ca 0.25 2.08 0.01 0.00 0.02 0.00 0.00 61.00 63.37 3hi1 s PRO 253 Cb -0.10 -3.11 -0.01 0.00 0.02 0.00 0.00 34.50 31.30 3hi1 s PRO 253 CO -0.09 -0.06 -0.18 0.08 -0.33 0.00 0.00 177.00 176.43 3hi1 s VAL 254 N -1.15 2.58 -0.23 3.83 1.01 -1.26 -4.36 120.40 120.81 3hi1 s VAL 254 Ca 0.47 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 3hi1 s VAL 254 Cb -0.37 -2.05 -0.00 0.00 0.00 0.00 0.00 36.38 33.95 3hi1 s VAL 254 CO 0.49 0.53 1.22 -0.69 0.00 0.00 0.00 175.10 176.65 3hi1 s VAL 255 N 0.49 4.33 0.22 2.92 1.01 -1.26 -4.84 120.40 123.27 3hi1 s VAL 255 Ca -0.12 1.57 -0.23 0.00 0.00 0.00 0.00 61.98 63.21 3hi1 s VAL 255 Cb -0.16 -4.14 0.04 0.00 0.00 0.00 0.00 36.38 32.11 3hi1 s VAL 255 CO 0.05 -0.28 0.77 -0.94 0.00 0.00 0.00 175.10 174.70 3hi1 s SER 256 N 2.05 -0.29 0.26 3.32 1.04 -1.26 -1.69 113.70 117.13 3hi1 s SER 256 Ca 0.52 -0.45 0.11 0.00 0.48 0.00 0.00 55.95 56.62 3hi1 s SER 256 Cb -0.18 0.64 -0.05 0.00 0.10 0.00 0.00 66.02 66.53 3hi1 s SER 256 CO 0.16 -1.16 -0.20 0.42 0.98 0.00 0.00 173.24 173.45 3hi1 s THR 257 N -3.70 2.37 0.00 2.02 -4.23 -0.62 -4.88 115.64 106.60 3hi1 s THR 257 Ca 0.10 -2.35 0.00 0.00 -1.18 0.00 0.00 61.69 58.25 3hi1 s THR 257 Cb -0.04 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 71.55 3hi1 s THR 257 CO 0.02 -0.40 0.00 0.00 -0.54 0.00 0.00 174.62 173.70 3hi1 n GLN 258 N -0.52 0.00 -4.03 3.99 6.02 -1.25 -4.28 117.38 117.31 3hi1 n GLN 258 Ca -0.06 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.58 3hi1 n GLN 258 Cb 0.60 0.00 -0.12 0.00 1.02 0.00 0.00 30.24 31.74 3hi1 n GLN 258 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3hi1 s LEU 259 N 0.00 3.36 0.02 1.08 1.43 -1.26 -1.12 118.68 122.19 3hi1 s LEU 259 Ca 0.00 -0.16 -0.30 0.00 -1.03 0.00 0.00 54.13 52.64 3hi1 s LEU 259 Cb 0.00 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 3hi1 s LEU 259 CO 0.00 0.07 0.96 -0.76 0.23 0.00 0.00 176.35 176.85 3hi1 s LEU 260 N 0.99 4.39 0.07 1.79 1.43 0.14 -4.81 118.68 122.69 3hi1 s LEU 260 Ca 0.02 1.67 0.10 0.00 -1.03 0.00 0.00 54.13 54.89 3hi1 s LEU 260 Cb -0.14 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.49 3hi1 s LEU 260 CO 0.02 -0.21 -0.26 -0.76 0.23 0.00 0.00 176.35 175.37 3hi1 s LEU 261 N 0.79 2.21 -1.42 1.79 1.43 -1.26 -1.12 118.68 121.10 3hi1 s LEU 261 Ca 0.50 -0.63 0.00 0.00 -1.03 0.00 0.00 54.13 52.97 3hi1 s LEU 261 Cb -0.21 -1.24 0.00 0.00 0.03 0.00 0.00 46.19 44.77 3hi1 s LEU 261 CO 0.28 0.23 0.00 0.59 0.23 0.00 0.00 176.35 177.67 3hi1 n ASN 262 N 1.52 -4.35 -2.00 2.29 3.02 0.48 -4.62 115.26 111.60 3hi1 n ASN 262 Ca -0.17 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 3hi1 n ASN 262 Cb 0.52 -3.78 0.00 0.00 -0.61 0.00 0.00 39.78 35.91 3hi1 n ASN 262 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hi1 n GLY 263 N -0.64 0.65 3.80 7.41 0.00 -1.26 -4.91 105.19 110.25 3hi1 n GLY 263 Ca -0.17 -1.94 -0.35 0.00 0.00 0.00 0.00 46.02 43.56 3hi1 n GLY 263 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hi1 s SER 264 N -1.00 7.10 0.00 1.61 0.01 -1.26 -4.88 113.70 115.29 3hi1 s SER 264 Ca 0.00 1.77 -0.07 0.00 1.31 0.00 0.00 55.95 58.97 3hi1 s SER 264 Cb 0.00 -2.56 -0.05 0.00 0.21 0.00 0.00 66.02 63.62 3hi1 s SER 264 CO 0.00 -0.24 0.26 -0.76 0.41 0.00 0.00 173.24 172.91 3hi1 s LEU 265 N -2.66 4.37 0.20 2.44 1.43 -1.26 -4.74 118.68 118.46 3hi1 s LEU 265 Ca 0.57 0.56 -0.33 0.00 -1.03 0.00 0.00 54.13 53.90 3hi1 s LEU 265 Cb -0.14 -2.65 -0.13 0.00 0.03 0.00 0.00 46.19 43.30 3hi1 s LEU 265 CO 0.18 0.26 1.60 0.00 0.23 0.00 0.00 176.35 178.62 3hi1 n ALA 266 N 1.15 1.86 -0.15 4.21 0.00 0.21 -4.87 120.51 122.92 3hi1 n ALA 266 Ca -0.12 0.42 -0.04 0.00 0.00 0.00 0.00 53.44 53.71 3hi1 n ALA 266 Cb 0.53 -2.40 0.03 0.00 0.00 0.00 0.00 19.45 17.61 3hi1 n ALA 266 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3hi1 h GLU 267 N 5.83 -0.01 0.00 0.00 4.81 -1.92 -3.39 114.58 119.90 3hi1 h GLU 267 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3hi1 h GLU 267 Cb 1.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.62 3hi1 h GLU 267 CO 0.88 -0.01 0.00 0.39 -0.73 0.00 0.00 179.01 179.55 3hi1 n GLU 268 N -5.35 0.00 -4.65 1.92 1.02 -1.26 -5.06 120.64 107.26 3hi1 n GLU 268 Ca 0.04 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.88 3hi1 n GLU 268 Cb 0.25 -0.07 -0.10 0.00 -0.02 0.00 0.00 31.44 31.51 3hi1 n GLU 268 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3hi1 s GLU 269 N -0.49 2.02 0.13 3.49 8.01 -1.26 -4.84 118.70 125.77 3hi1 s GLU 269 Ca 0.00 -2.21 -0.35 0.00 0.01 0.00 0.00 54.97 52.43 3hi1 s GLU 269 Cb 0.00 -1.49 -0.16 0.00 -4.31 0.00 0.00 34.13 28.18 3hi1 s GLU 269 CO 0.00 -0.20 1.36 -0.89 0.01 0.00 0.00 175.26 175.54 3hi1 n ILE 270 N -1.05 0.26 -4.90 -1.63 2.08 -1.26 -4.56 119.36 108.30 3hi1 n ILE 270 Ca -0.10 -0.06 -0.27 0.00 0.56 0.00 0.00 62.75 62.87 3hi1 n ILE 270 Cb 0.67 -1.03 -0.16 0.00 -0.75 0.00 0.00 39.64 38.37 3hi1 n ILE 270 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 3hi1 s VAL 271 N 0.39 1.53 0.14 1.39 1.01 -0.67 -4.99 120.40 119.19 3hi1 s VAL 271 Ca 0.80 -0.76 0.10 0.00 0.00 0.00 0.00 61.98 62.12 3hi1 s VAL 271 Cb -0.85 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 3hi1 s VAL 271 CO 0.46 0.44 -0.23 0.27 0.00 0.00 0.00 175.10 176.04 3hi1 s ILE 272 N 0.12 2.49 -0.02 2.22 -4.36 -1.26 -0.14 121.20 120.25 3hi1 s ILE 272 Ca -0.07 -1.71 -0.04 0.00 -0.26 0.00 0.00 60.65 58.56 3hi1 s ILE 272 Cb -0.13 -2.13 0.00 0.00 1.25 0.00 0.00 42.46 41.45 3hi1 s ILE 272 CO 0.03 0.06 0.10 -0.13 0.24 0.00 0.00 174.94 175.24 3hi1 s ARG 273 N -2.20 0.27 -0.13 0.37 0.52 -0.28 -4.97 118.95 112.52 3hi1 s ARG 273 Ca 0.17 -0.12 -0.20 0.00 -0.52 0.00 0.00 55.73 55.06 3hi1 s ARG 273 Cb -0.10 0.11 0.05 0.00 0.52 0.00 0.00 34.95 35.53 3hi1 s ARG 273 CO 0.08 -0.05 0.50 0.45 0.02 0.00 0.00 175.30 176.30 3hi1 s SER 274 N -0.59 -0.49 0.44 0.23 0.15 -1.26 -0.08 113.70 112.09 3hi1 s SER 274 Ca -0.07 0.80 0.30 0.00 0.70 0.00 0.00 55.95 57.69 3hi1 s SER 274 Cb -0.04 0.82 1.47 0.00 -1.71 0.00 0.00 66.02 66.56 3hi1 s SER 274 CO 0.00 -0.30 1.92 -0.08 1.20 0.00 0.00 173.24 175.98 3hi1 h GLU 275 N 4.65 0.00 -1.56 5.44 4.81 -1.92 -3.41 114.58 122.59 3hi1 h GLU 275 Ca -0.28 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.06 3hi1 h GLU 275 Cb 1.17 0.00 -0.27 0.00 0.63 0.00 0.00 28.75 30.28 3hi1 h GLU 275 CO 0.26 0.00 0.37 1.21 -0.73 0.00 0.00 179.01 180.12 3hi1 s ASN 276 N -4.72 -0.52 0.20 1.04 3.84 -1.26 -5.02 114.94 108.49 3hi1 s ASN 276 Ca -0.00 0.85 0.20 0.00 0.21 0.00 0.00 52.86 54.12 3hi1 s ASN 276 Cb 0.09 1.19 0.01 0.00 -0.55 0.00 0.00 41.25 41.99 3hi1 s ASN 276 CO 0.38 -0.13 1.08 -0.26 -2.79 0.00 0.00 177.10 175.37 3hi1 h PHE 277 N 5.97 0.00 0.08 0.43 -1.00 -1.95 -3.21 116.94 117.26 3hi1 h PHE 277 Ca -0.28 0.00 -0.25 0.00 2.81 0.00 0.00 57.97 60.25 3hi1 h PHE 277 Cb 1.19 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.75 3hi1 h PHE 277 CO 0.13 0.21 -1.14 1.15 -1.61 0.00 0.00 178.31 177.05 3hi1 h THR 278 N 0.00 1.55 -2.64 -1.55 2.02 -1.98 -3.41 112.91 106.90 3hi1 h THR 278 Ca -0.05 -3.10 -0.55 0.00 0.77 0.00 0.00 66.41 63.49 3hi1 h THR 278 Cb 1.21 2.87 -0.08 0.00 -1.74 0.00 0.00 68.15 70.40 3hi1 h THR 278 CO 0.02 0.90 1.01 0.21 0.37 0.00 0.00 175.52 178.03 3hi1 s ASN 279 N -7.02 6.25 0.32 4.18 3.84 -1.21 -4.85 114.94 116.44 3hi1 s ASN 279 Ca -0.03 -0.30 0.26 0.00 0.21 0.00 0.00 52.86 53.01 3hi1 s ASN 279 Cb 0.08 -2.55 1.04 0.00 -0.55 0.00 0.00 41.25 39.27 3hi1 s ASN 279 CO 0.86 -1.71 1.77 -0.55 -2.79 0.00 0.00 177.10 174.69 3hi1 h ASN 280 N 9.85 0.00 -0.65 -4.21 -1.07 -1.80 -2.68 115.58 115.03 3hi1 h ASN 280 Ca -0.27 0.00 -0.08 0.00 0.07 0.00 0.00 56.30 56.01 3hi1 h ASN 280 Cb 1.05 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 37.28 3hi1 h ASN 280 CO 1.24 0.00 0.08 0.00 0.07 0.00 0.00 177.43 178.82 3hi1 h ALA 281 N 2.22 0.90 -2.85 4.14 0.00 -1.89 -3.34 119.26 118.45 3hi1 h ALA 281 Ca 0.00 -0.28 -0.52 0.00 0.00 0.00 0.00 54.91 54.10 3hi1 h ALA 281 Cb 0.43 -0.25 0.06 0.00 0.00 0.00 0.00 17.79 18.04 3hi1 h ALA 281 CO 0.00 0.67 0.66 0.15 0.00 0.00 0.00 179.25 180.73 3hi1 s LYS 282 N -5.15 4.33 0.58 0.00 -0.14 -1.01 -4.97 119.74 113.38 3hi1 s LYS 282 Ca -0.12 2.24 -0.17 0.00 -1.36 0.00 0.00 55.97 56.55 3hi1 s LYS 282 Cb 0.14 -3.08 -0.04 0.00 -1.68 0.00 0.00 37.83 33.17 3hi1 s LYS 282 CO 0.85 -0.24 1.09 0.99 -0.76 0.00 0.00 175.35 177.28 3hi1 s THR 283 N -0.89 3.47 -0.20 2.17 2.01 -1.26 -4.75 115.64 116.18 3hi1 s THR 283 Ca 0.51 0.79 -0.04 0.00 0.31 0.00 0.00 61.69 63.26 3hi1 s THR 283 Cb -0.40 -3.29 -0.02 0.00 0.01 0.00 0.00 72.50 68.80 3hi1 s THR 283 CO 0.51 -0.32 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.45 3hi1 s ILE 284 N -2.15 3.55 -0.28 1.82 1.01 0.18 -4.27 121.20 121.06 3hi1 s ILE 284 Ca 0.68 -0.45 -0.12 0.00 0.00 0.00 0.00 60.65 60.76 3hi1 s ILE 284 Cb -0.20 -2.59 -0.05 0.00 0.01 0.00 0.00 42.46 39.63 3hi1 s ILE 284 CO 0.32 0.44 0.22 -0.63 0.00 0.00 0.00 174.94 175.30 3hi1 s ILE 285 N 1.10 5.29 -0.11 2.92 1.01 0.88 -0.36 121.20 131.93 3hi1 s ILE 285 Ca 0.02 0.24 -0.16 0.00 0.00 0.00 0.00 60.65 60.75 3hi1 s ILE 285 Cb -0.15 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 38.72 3hi1 s ILE 285 CO -0.00 0.23 0.38 -0.69 0.00 0.00 0.00 174.94 174.87 3hi1 s VAL 286 N 1.81 5.21 -0.23 2.92 1.01 0.08 -1.12 120.40 130.08 3hi1 s VAL 286 Ca 0.08 0.75 0.01 0.00 0.00 0.00 0.00 61.98 62.83 3hi1 s VAL 286 Cb -0.16 -3.71 0.04 0.00 0.00 0.00 0.00 36.38 32.54 3hi1 s VAL 286 CO 0.11 0.40 -0.13 -1.58 0.00 0.00 0.00 175.10 173.90 3hi1 s GLN 287 N 0.23 2.66 0.33 2.72 0.74 0.81 -2.02 119.66 125.12 3hi1 s GLN 287 Ca 0.21 -1.07 -0.26 0.00 0.05 0.00 0.00 55.36 54.30 3hi1 s GLN 287 Cb -0.14 -2.79 -0.10 0.00 1.10 0.00 0.00 33.01 31.08 3hi1 s GLN 287 CO 0.08 -0.39 0.94 -0.51 -0.55 0.00 0.00 175.29 174.86 3hi1 s LEU 288 N 1.22 4.33 0.18 3.68 1.43 -0.95 -1.68 118.68 126.90 3hi1 s LEU 288 Ca -0.02 1.83 0.23 0.00 -1.03 0.00 0.00 54.13 55.15 3hi1 s LEU 288 Cb -0.17 -4.03 0.19 0.00 0.03 0.00 0.00 46.19 42.22 3hi1 s LEU 288 CO -0.08 -0.07 1.22 -0.55 0.23 0.00 0.00 176.35 177.10 3hi1 h ASN 289 N 3.14 0.00 -3.20 2.29 -1.07 -1.80 0.60 115.58 115.53 3hi1 h ASN 289 Ca -0.47 -0.10 -0.53 0.00 0.07 0.00 0.00 56.30 55.27 3hi1 h ASN 289 Cb 1.19 0.00 -0.37 0.00 -2.07 0.00 0.00 38.32 37.07 3hi1 h ASN 289 CO 0.65 0.05 -0.80 -0.70 0.07 0.00 0.00 177.43 176.70 3hi1 s GLU 290 N -3.26 1.53 0.54 4.14 2.12 -1.26 -4.61 118.70 117.90 3hi1 s GLU 290 Ca 0.03 -0.30 -0.21 0.00 0.36 0.00 0.00 54.97 54.86 3hi1 s GLU 290 Cb 0.11 -1.66 -0.05 0.00 0.26 0.00 0.00 34.13 32.79 3hi1 s GLU 290 CO 0.75 -0.29 1.23 0.45 -0.54 0.00 0.00 175.26 176.86 3hi1 s SER 291 N 1.69 5.50 -0.18 -1.70 0.15 -1.26 -4.96 113.70 112.94 3hi1 s SER 291 Ca 0.04 2.46 0.01 0.00 0.70 0.00 0.00 55.95 59.16 3hi1 s SER 291 Cb -0.13 -2.61 0.02 0.00 -1.71 0.00 0.00 66.02 61.59 3hi1 s SER 291 CO -0.08 -1.39 -0.20 -0.69 1.20 0.00 0.00 173.24 172.08 3hi1 s VAL 292 N -1.51 2.12 0.55 4.45 1.01 -0.93 -4.94 120.40 121.16 3hi1 s VAL 292 Ca 0.72 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 61.60 3hi1 s VAL 292 Cb -0.32 -1.89 -0.06 0.00 0.00 0.00 0.00 36.38 34.12 3hi1 s VAL 292 CO 0.37 0.54 1.04 -0.69 0.00 0.00 0.00 175.10 176.36 3hi1 s VAL 293 N 1.22 3.87 -0.26 2.92 1.01 -1.26 -0.42 120.40 127.48 3hi1 s VAL 293 Ca 0.03 0.97 -0.02 0.00 0.00 0.00 0.00 61.98 62.96 3hi1 s VAL 293 Cb -0.13 -3.43 0.15 0.00 0.00 0.00 0.00 36.38 32.96 3hi1 s VAL 293 CO -0.11 -0.44 0.47 -0.51 0.00 0.00 0.00 175.10 174.51 3hi1 s ILE 294 N -2.32 -0.76 -0.17 2.22 2.07 -0.42 -4.46 121.20 117.36 3hi1 s ILE 294 Ca 0.64 -0.03 -0.15 0.00 -1.41 0.00 0.00 60.65 59.70 3hi1 s ILE 294 Cb -0.16 -0.88 -0.04 0.00 0.13 0.00 0.00 42.46 41.51 3hi1 s ILE 294 CO 0.31 -0.07 0.35 0.20 -1.91 0.00 0.00 174.94 173.82 3hi1 s ASN 295 N 2.67 6.46 0.01 4.50 -0.87 -0.93 -1.05 114.94 125.72 3hi1 s ASN 295 Ca 0.15 0.54 0.06 0.00 -1.57 0.00 0.00 52.86 52.03 3hi1 s ASN 295 Cb -0.15 -2.21 -0.02 0.00 -0.02 0.00 0.00 41.25 38.85 3hi1 s ASN 295 CO -0.18 0.03 -0.18 0.00 -2.57 0.00 0.00 177.10 174.20 3hi1 s THR 297 N -0.55 0.30 0.27 0.00 -4.23 -1.08 -3.56 115.64 106.78 3hi1 s THR 297 Ca 0.06 -1.64 0.09 0.00 -1.18 0.00 0.00 61.69 59.02 3hi1 s THR 297 Cb -0.07 -1.29 -0.04 0.00 1.34 0.00 0.00 72.50 72.44 3hi1 s THR 297 CO 0.00 -0.86 0.08 -0.13 -0.54 0.00 0.00 174.62 173.17 3hi1 s ARG 298 N -3.36 2.52 0.25 3.99 0.52 -1.26 -3.02 118.95 118.58 3hi1 s ARG 298 Ca 0.03 -1.30 -0.30 0.00 -0.52 0.00 0.00 55.73 53.64 3hi1 s ARG 298 Cb 0.04 -2.30 -0.09 0.00 0.52 0.00 0.00 34.95 33.11 3hi1 s ARG 298 CO -0.07 0.35 1.19 -1.25 0.02 0.00 0.00 175.30 175.55 3hi1 s PRO 299 N -3.75 4.51 -1.09 3.54 0.04 -1.26 -4.60 135.00 132.39 3hi1 s PRO 299 Ca 0.33 1.93 -0.22 0.00 0.04 0.00 0.00 61.00 63.07 3hi1 s PRO 299 Cb -0.07 -3.19 -0.01 0.00 0.04 0.00 0.00 34.50 31.28 3hi1 s PRO 299 CO 0.22 -0.02 1.78 -0.80 0.04 0.00 0.00 177.00 178.22 3hi1 s ASN 300 N -0.31 5.80 -1.22 6.66 -0.87 -1.26 -5.01 114.94 118.72 3hi1 s ASN 300 Ca 0.50 -1.49 -0.05 0.00 -1.57 0.00 0.00 52.86 50.25 3hi1 s ASN 300 Cb -0.34 -2.57 0.14 0.00 -0.02 0.00 0.00 41.25 38.46 3hi1 s ASN 300 CO 0.41 -2.20 2.35 -3.20 -2.57 0.00 0.00 177.10 171.89 3hi1 n ASN 301 N 11.68 7.87 0.00 -1.22 2.85 -1.26 -5.26 115.26 129.92 3hi1 n ASN 301 Ca 0.41 -3.22 0.00 0.00 -0.11 0.00 0.00 54.58 51.67 3hi1 n ASN 301 Cb 0.48 -1.33 0.00 0.00 1.24 0.00 0.00 39.78 40.17 3hi1 n ASN 301 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 3hi1 n ARG 327 N 1.44 0.00 -3.66 1.20 1.74 -1.26 -5.27 116.66 110.85 3hi1 n ARG 327 Ca 0.60 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.62 3hi1 n ARG 327 Cb 0.27 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.64 3hi1 n ARG 327 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 3hi1 s GLN 328 N 0.00 0.53 -0.44 5.56 0.00 -1.26 -4.98 119.66 119.07 3hi1 s GLN 328 Ca 0.00 1.22 -0.02 0.00 -0.00 0.00 0.00 55.36 56.55 3hi1 s GLN 328 Cb 0.00 0.45 -0.03 0.00 0.00 0.00 0.00 33.01 33.43 3hi1 s GLN 328 CO 0.00 -0.19 0.39 0.00 0.00 0.00 0.00 175.29 175.48 3hi1 n ALA 329 N 4.99 -1.31 -3.26 2.60 0.00 -1.24 -4.80 120.51 117.49 3hi1 n ALA 329 Ca -0.15 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3hi1 n ALA 329 Cb 0.52 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 17.32 3hi1 n ALA 329 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 3hi1 n HIS 330 N -2.23 0.00 -3.79 0.00 1.44 -1.17 -1.98 115.22 107.50 3hi1 n HIS 330 Ca -0.03 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.55 3hi1 n HIS 330 Cb 0.55 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.53 3hi1 n HIS 330 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3hi1 s ASN 332 N 0.53 5.13 -0.21 0.00 -0.87 -0.09 -1.63 114.94 117.80 3hi1 s ASN 332 Ca -0.04 -0.32 -0.21 0.00 -1.57 0.00 0.00 52.86 50.72 3hi1 s ASN 332 Cb -0.05 -1.20 0.06 0.00 -0.02 0.00 0.00 41.25 40.03 3hi1 s ASN 332 CO -0.03 0.04 0.59 -0.22 -2.57 0.00 0.00 177.10 174.92 3hi1 s LEU 333 N -3.32 -0.26 -0.35 0.60 2.96 -0.95 -2.19 118.68 115.16 3hi1 s LEU 333 Ca 0.30 1.15 -0.29 0.00 -0.22 0.00 0.00 54.13 55.08 3hi1 s LEU 333 Cb -0.09 2.05 -0.01 0.00 0.50 0.00 0.00 46.19 48.64 3hi1 s LEU 333 CO 0.22 -0.23 1.63 -0.55 -1.32 0.00 0.00 176.35 176.09 3hi1 s SER 334 N 0.21 6.12 0.02 3.68 0.15 -1.26 -1.05 113.70 121.57 3hi1 s SER 334 Ca -0.01 1.16 -0.10 0.00 0.70 0.00 0.00 55.95 57.71 3hi1 s SER 334 Cb -0.04 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 61.69 3hi1 s SER 334 CO 0.01 -1.55 1.15 0.50 1.20 0.00 0.00 173.24 174.55 3hi1 h LYS 335 N 11.77 -0.32 -0.14 5.44 3.64 -1.86 -0.70 116.57 134.40 3hi1 h LYS 335 Ca -0.31 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.13 3hi1 h LYS 335 Cb 1.14 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 3hi1 h LYS 335 CO 1.05 -0.21 0.22 1.79 -2.27 0.00 0.00 179.45 180.02 3hi1 h THR 336 N -0.33 0.30 -0.01 1.00 1.35 -1.91 0.29 112.91 113.59 3hi1 h THR 336 Ca -0.03 0.00 -0.26 0.00 -0.55 0.00 0.00 66.41 65.56 3hi1 h THR 336 Cb 0.26 0.81 0.02 0.00 -1.73 0.00 0.00 68.15 67.52 3hi1 h THR 336 CO 0.04 0.00 -1.02 -0.61 -0.25 0.00 0.00 175.52 173.68 3hi1 h GLN 337 N 0.00 0.71 0.03 4.72 4.15 -1.92 -2.48 115.11 120.32 3hi1 h GLN 337 Ca 0.06 -0.74 -0.00 0.00 0.77 0.00 0.00 58.65 58.74 3hi1 h GLN 337 Cb 0.50 0.21 0.00 0.00 0.21 0.00 0.00 27.48 28.39 3hi1 h GLN 337 CO -0.00 1.32 -0.01 2.35 -1.93 0.00 0.00 178.83 180.55 3hi1 h TRP 338 N 0.41 -0.04 -0.75 3.99 2.91 0.10 -2.23 115.95 120.35 3hi1 h TRP 338 Ca -0.12 -0.00 0.14 0.00 1.13 0.00 0.00 58.89 60.03 3hi1 h TRP 338 Cb 1.67 0.01 -0.09 0.00 -0.51 0.00 0.00 29.16 30.24 3hi1 h TRP 338 CO 0.10 0.50 0.30 0.93 -1.03 0.00 0.00 178.44 179.25 3hi1 h GLU 339 N -0.61 0.44 -0.64 2.65 5.08 -1.05 0.24 114.58 120.69 3hi1 h GLU 339 Ca -0.00 -0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.45 3hi1 h GLU 339 Cb 0.56 -0.10 -0.09 0.00 0.50 0.00 0.00 28.75 29.62 3hi1 h GLU 339 CO 0.01 0.29 0.14 -0.97 -1.00 0.00 0.00 179.01 177.48 3hi1 h ASN 340 N 0.45 0.01 0.05 1.42 -1.24 -1.40 -2.07 115.58 112.81 3hi1 h ASN 340 Ca 0.41 0.12 -0.00 0.00 0.71 0.00 0.00 56.30 57.53 3hi1 h ASN 340 Cb 0.60 0.16 0.00 0.00 0.73 0.00 0.00 38.32 39.81 3hi1 h ASN 340 CO -0.39 0.00 -0.02 0.74 -1.29 0.00 0.00 177.43 176.47 3hi1 h THR 341 N 0.27 1.05 -0.73 -3.57 2.02 0.05 -1.92 112.91 110.07 3hi1 h THR 341 Ca 0.34 -0.31 0.13 0.00 0.77 0.00 0.00 66.41 67.33 3hi1 h THR 341 Cb 0.52 1.25 -0.09 0.00 -1.74 0.00 0.00 68.15 68.10 3hi1 h THR 341 CO -0.43 0.08 0.31 -0.07 0.37 0.00 0.00 175.52 175.78 3hi1 h LEU 342 N -0.20 0.32 -0.29 2.58 3.38 -0.89 0.91 115.31 121.11 3hi1 h LEU 342 Ca -0.01 0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.08 3hi1 h LEU 342 Cb 0.18 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3hi1 h LEU 342 CO 0.01 0.14 0.15 -0.33 0.09 0.00 0.00 178.44 178.51 3hi1 h GLU 343 N 0.48 0.30 -0.80 1.13 5.08 -1.18 0.13 114.58 119.72 3hi1 h GLU 343 Ca 0.39 -0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.78 3hi1 h GLU 343 Cb 0.55 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.68 3hi1 h GLU 343 CO -0.36 0.20 0.53 1.96 -1.00 0.00 0.00 179.01 180.33 3hi1 h GLN 344 N 0.31 0.91 0.09 2.33 1.08 -0.25 -1.75 115.11 117.83 3hi1 h GLN 344 Ca 0.12 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.26 3hi1 h GLN 344 Cb 0.03 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.26 3hi1 h GLN 344 CO -0.08 0.60 -0.04 0.82 -0.95 0.00 0.00 178.83 179.18 3hi1 h ILE 345 N 0.94 1.14 -0.86 2.54 2.04 -0.32 -3.00 117.51 119.98 3hi1 h ILE 345 Ca 0.33 -0.92 0.22 0.00 1.00 0.00 0.00 64.86 65.49 3hi1 h ILE 345 Cb 0.13 1.72 -0.14 0.00 -0.74 0.00 0.00 36.82 37.80 3hi1 h ILE 345 CO -0.11 0.22 0.19 0.00 0.00 0.00 0.00 178.15 178.46 3hi1 h ALA 346 N 0.30 1.19 -0.12 1.87 0.00 -0.25 0.14 119.26 122.39 3hi1 h ALA 346 Ca -0.01 0.23 0.04 0.00 0.00 0.00 0.00 54.91 55.16 3hi1 h ALA 346 Cb 0.46 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 3hi1 h ALA 346 CO 0.02 -0.46 -0.13 0.82 0.00 0.00 0.00 179.25 179.50 3hi1 h ILE 347 N 0.19 0.63 0.00 0.00 2.04 -1.30 -0.14 117.51 118.94 3hi1 h ILE 347 Ca 0.53 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.39 3hi1 h ILE 347 Cb 1.04 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 37.75 3hi1 h ILE 347 CO -0.66 0.00 -0.01 0.11 0.00 0.00 0.00 178.15 177.59 3hi1 h LYS 348 N -0.17 0.00 0.16 2.37 1.79 -0.61 -0.96 116.57 119.15 3hi1 h LYS 348 Ca 0.09 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 58.22 3hi1 h LYS 348 Cb 0.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 3hi1 h LYS 348 CO -0.22 0.01 -1.73 -0.07 -1.08 0.00 0.00 179.45 176.36 3hi1 h LEU 349 N 0.00 0.53 -0.76 2.94 3.38 -0.51 -3.00 115.31 117.89 3hi1 h LEU 349 Ca -0.00 -0.92 0.07 0.00 0.09 0.00 0.00 57.88 57.11 3hi1 h LEU 349 Cb 0.09 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.61 3hi1 h LEU 349 CO 0.00 1.77 0.44 0.11 0.09 0.00 0.00 178.44 180.85 3hi1 h LYS 350 N 0.00 0.78 -0.88 1.13 1.57 -0.30 0.49 116.57 119.36 3hi1 h LYS 350 Ca -0.35 -0.05 0.08 0.00 -1.87 0.00 0.00 60.65 58.46 3hi1 h LYS 350 Cb 2.01 -0.18 -0.07 0.00 0.08 0.00 0.00 32.23 34.08 3hi1 h LYS 350 CO 0.13 0.51 0.54 0.93 -0.57 0.00 0.00 179.45 180.99 3hi1 h GLU 351 N 0.80 0.91 0.00 3.15 5.08 -1.31 0.20 114.58 123.42 3hi1 h GLU 351 Ca 0.34 -0.05 -0.20 0.00 -1.00 0.00 0.00 59.36 58.45 3hi1 h GLU 351 Cb 0.21 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 3hi1 h GLU 351 CO -0.19 0.60 -0.93 0.37 -1.00 0.00 0.00 179.01 177.87 3hi1 h GLN 352 N 0.94 0.00 -0.05 2.33 5.75 -0.83 -3.34 115.11 119.91 3hi1 h GLN 352 Ca 0.40 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.89 3hi1 h GLN 352 Cb 0.26 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.81 3hi1 h GLN 352 CO -0.20 0.93 -0.06 1.19 -2.65 0.00 0.00 178.83 178.04 3hi1 n PHE 353 N -3.33 0.19 -0.92 3.99 3.01 0.15 -5.05 117.46 115.50 3hi1 n PHE 353 Ca 0.00 -1.06 0.00 0.00 1.01 0.00 0.00 57.45 57.41 3hi1 n PHE 353 Cb 0.91 -0.20 0.00 0.00 -0.01 0.00 0.00 39.48 40.18 3hi1 n PHE 353 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hi1 n GLY 354 N -1.25 -3.38 0.25 1.37 0.00 0.05 -4.80 105.19 97.43 3hi1 n GLY 354 Ca 0.18 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.59 3hi1 n GLY 354 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3hi1 n ASN 355 N 0.17 0.38 -0.64 1.61 0.23 0.48 -2.60 115.26 114.89 3hi1 n ASN 355 Ca 0.00 -1.51 0.08 0.00 -0.53 0.00 0.00 54.58 52.63 3hi1 n ASN 355 Cb 0.00 -0.19 0.27 0.00 -2.08 0.00 0.00 39.78 37.78 3hi1 n ASN 355 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 3hi1 n ASN 356 N -0.19 1.89 -4.79 0.53 6.94 -1.26 -4.91 115.26 113.46 3hi1 n ASN 356 Ca 0.00 -1.86 -0.25 0.00 -0.02 0.00 0.00 54.58 52.45 3hi1 n ASN 356 Cb 0.09 -0.18 -0.05 0.00 -2.36 0.00 0.00 39.78 37.28 3hi1 n ASN 356 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3hi1 s LYS 357 N -1.64 2.87 -0.18 -3.83 1.02 -1.07 -4.94 119.74 111.98 3hi1 s LYS 357 Ca 0.29 -0.92 -0.08 0.00 0.02 0.00 0.00 55.97 55.28 3hi1 s LYS 357 Cb 0.15 -2.61 -0.04 0.00 -0.52 0.00 0.00 37.83 34.81 3hi1 s LYS 357 CO 0.22 0.47 0.09 0.99 -0.92 0.00 0.00 175.35 176.20 3hi1 s THR 358 N -1.82 5.05 -0.17 2.17 2.01 0.31 -4.95 115.64 118.25 3hi1 s THR 358 Ca 0.31 0.06 -0.09 0.00 0.31 0.00 0.00 61.69 62.28 3hi1 s THR 358 Cb -0.10 -3.27 -0.05 0.00 0.01 0.00 0.00 72.50 69.10 3hi1 s THR 358 CO 0.23 0.48 0.13 -0.63 -0.69 0.00 0.00 174.62 174.14 3hi1 s ILE 359 N 0.13 5.39 0.00 1.82 1.09 -1.26 -1.34 121.20 127.03 3hi1 s ILE 359 Ca 0.07 0.18 0.03 0.00 -1.10 0.00 0.00 60.65 59.82 3hi1 s ILE 359 Cb -0.12 -3.42 -0.01 0.00 -1.06 0.00 0.00 42.46 37.85 3hi1 s ILE 359 CO -0.00 0.50 -0.08 -0.63 -0.10 0.00 0.00 174.94 174.62 3hi1 s ILE 360 N -0.09 0.66 -0.17 2.92 -1.09 -0.49 -4.88 121.20 118.07 3hi1 s ILE 360 Ca 0.10 -0.44 -0.04 0.00 -2.23 0.00 0.00 60.65 58.04 3hi1 s ILE 360 Cb -0.11 -0.57 -0.03 0.00 -1.58 0.00 0.00 42.46 40.17 3hi1 s ILE 360 CO 0.00 0.13 -0.02 -0.36 -1.23 0.00 0.00 174.94 173.46 3hi1 s PHE 361 N -0.31 3.05 0.12 3.97 0.40 -1.26 -1.05 117.98 122.90 3hi1 s PHE 361 Ca 0.02 -0.29 0.10 0.00 -0.60 0.00 0.00 56.93 56.15 3hi1 s PHE 361 Cb -0.04 -2.00 -0.04 0.00 0.51 0.00 0.00 43.02 41.45 3hi1 s PHE 361 CO -0.00 -0.06 -0.22 -0.80 0.70 0.00 0.00 175.22 174.84 3hi1 s ASN 362 N 0.50 3.61 1.03 1.36 -0.87 0.30 -3.14 114.94 117.74 3hi1 s ASN 362 Ca -0.02 -0.64 -0.11 0.00 -1.57 0.00 0.00 52.86 50.52 3hi1 s ASN 362 Cb -0.14 -0.39 0.21 0.00 -0.02 0.00 0.00 41.25 40.90 3hi1 s ASN 362 CO 0.02 0.19 1.07 -2.65 -2.57 0.00 0.00 177.10 173.16 3hi1 n PRO 363 N 0.91 -1.34 -2.12 -0.60 -0.02 -0.75 -4.14 135.00 126.95 3hi1 n PRO 363 Ca -0.17 -0.34 -0.39 0.00 -2.02 0.00 0.00 63.50 60.58 3hi1 n PRO 363 Cb 0.53 -2.27 -0.01 0.00 -0.02 0.00 0.00 33.50 31.72 3hi1 n PRO 363 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3hi1 s SER 364 N -2.52 6.39 0.09 2.55 0.15 -1.26 -4.75 113.70 114.34 3hi1 s SER 364 Ca 0.67 2.58 0.00 0.00 0.70 0.00 0.00 55.95 59.90 3hi1 s SER 364 Cb -0.24 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.44 3hi1 s SER 364 CO 0.61 -0.79 0.00 -1.54 1.20 0.00 0.00 173.24 172.72 3hi1 n SER 365 N 0.15 0.00 -4.55 5.45 3.41 -1.26 -4.99 113.62 111.82 3hi1 n SER 365 Ca 0.04 -0.11 -0.37 0.00 -0.26 0.00 0.00 58.87 58.17 3hi1 n SER 365 Cb 0.44 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.45 3hi1 n SER 365 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hi1 n GLY 366 N 5.00 -0.83 0.00 5.00 0.00 -1.26 -4.78 105.19 108.32 3hi1 n GLY 366 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.80 3hi1 n GLY 366 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hi1 n GLY 367 N 1.44 -1.64 3.72 -0.02 0.00 -1.26 -4.97 105.19 102.46 3hi1 n GLY 367 Ca 0.13 -1.20 -0.34 0.00 0.00 0.00 0.00 46.02 44.60 3hi1 n GLY 367 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hi1 s ASP 368 N -3.22 4.23 0.16 1.61 -0.00 -1.26 -4.76 116.67 113.43 3hi1 s ASP 368 Ca 0.00 2.38 -0.16 0.00 -0.00 0.00 0.00 52.55 54.77 3hi1 s ASP 368 Cb 0.00 -2.59 0.08 0.00 -0.00 0.00 0.00 42.92 40.41 3hi1 s ASP 368 CO 0.00 -2.24 1.73 -0.65 -0.00 0.00 0.00 175.17 174.01 3hi1 h PRO 369 N -0.22 0.21 -0.70 8.23 0.11 -1.99 -0.52 132.00 137.12 3hi1 h PRO 369 Ca -0.48 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.64 3hi1 h PRO 369 Cb 1.30 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.33 3hi1 h PRO 369 CO 0.50 0.14 0.46 0.93 -0.21 0.00 0.00 178.00 179.82 3hi1 h GLU 370 N 0.21 0.85 -0.22 1.05 3.07 -1.91 0.05 114.58 117.68 3hi1 h GLU 370 Ca 0.18 -0.05 -0.20 0.00 -0.50 0.00 0.00 59.36 58.78 3hi1 h GLU 370 Cb 0.20 -0.19 0.01 0.00 -0.84 0.00 0.00 28.75 27.92 3hi1 h GLU 370 CO -0.22 0.56 -0.66 0.82 -1.40 0.00 0.00 179.01 178.11 3hi1 h ILE 371 N 0.88 1.28 -0.10 3.13 1.08 -1.67 -3.32 117.51 118.78 3hi1 h ILE 371 Ca 0.27 -1.84 -0.07 0.00 -0.39 0.00 0.00 64.86 62.83 3hi1 h ILE 371 Cb 0.01 1.81 0.00 0.00 -3.07 0.00 0.00 36.82 35.56 3hi1 h ILE 371 CO -0.07 0.59 -0.20 0.58 -0.69 0.00 0.00 178.15 178.36 3hi1 h VAL 372 N 0.60 1.39 -3.91 1.67 2.07 -0.60 -3.43 116.25 114.03 3hi1 h VAL 372 Ca -0.02 -1.48 -0.47 0.00 0.82 0.00 0.00 66.70 65.55 3hi1 h VAL 372 Cb 1.28 2.11 0.07 0.00 -1.52 0.00 0.00 31.29 33.23 3hi1 h VAL 372 CO 0.14 0.43 0.26 0.42 0.02 0.00 0.00 177.57 178.83 3hi1 s THR 373 N -4.00 2.83 -0.58 2.57 -4.23 -0.04 -4.65 115.64 107.54 3hi1 s THR 373 Ca -0.14 -0.06 -0.24 0.00 -1.18 0.00 0.00 61.69 60.07 3hi1 s THR 373 Cb 0.04 -3.20 0.05 0.00 1.34 0.00 0.00 72.50 70.73 3hi1 s THR 373 CO 0.75 -0.23 0.95 -2.28 -0.54 0.00 0.00 174.62 173.27 3hi1 s HIS 374 N -3.22 2.76 0.30 3.99 2.46 -0.42 -4.76 115.29 116.39 3hi1 s HIS 374 Ca 0.58 -0.17 0.08 0.00 0.47 0.00 0.00 55.06 56.02 3hi1 s HIS 374 Cb -0.11 -4.12 -0.03 0.00 -0.13 0.00 0.00 32.58 28.18 3hi1 s HIS 374 CO 0.46 -1.44 0.21 -1.54 -2.47 0.00 0.00 174.74 169.97 3hi1 s SER 375 N 3.07 5.24 -0.12 9.88 1.04 -1.25 -0.93 113.70 130.63 3hi1 s SER 375 Ca 0.28 -0.44 -0.32 0.00 0.48 0.00 0.00 55.95 55.94 3hi1 s SER 375 Cb -0.14 -1.10 0.13 0.00 0.10 0.00 0.00 66.02 65.01 3hi1 s SER 375 CO 0.17 -0.19 1.08 0.72 0.98 0.00 0.00 173.24 175.99 3hi1 s PHE 376 N -2.25 -0.23 0.39 5.02 -0.71 -0.47 -1.59 117.98 118.14 3hi1 s PHE 376 Ca 0.37 0.18 -0.21 0.00 -1.04 0.00 0.00 56.93 56.23 3hi1 s PHE 376 Cb -0.06 0.52 -0.10 0.00 -1.21 0.00 0.00 43.02 42.16 3hi1 s PHE 376 CO 0.25 -0.33 0.92 1.21 -1.34 0.00 0.00 175.22 175.92 3hi1 s ASN 377 N -2.13 6.99 -0.47 1.98 2.47 -0.68 -0.86 114.94 122.24 3hi1 s ASN 377 Ca 0.07 1.66 0.06 0.00 0.42 0.00 0.00 52.86 55.06 3hi1 s ASN 377 Cb -0.01 -2.52 0.20 0.00 -1.45 0.00 0.00 41.25 37.47 3hi1 s ASN 377 CO -0.06 -0.28 0.61 0.00 -3.72 0.00 0.00 177.10 173.65 3hi1 n GLY 379 N 2.52 0.36 0.59 0.00 0.00 -1.22 -3.34 105.19 104.09 3hi1 n GLY 379 Ca 0.21 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3hi1 n GLY 379 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hi1 n GLY 380 N -1.47 0.60 3.57 -0.02 0.00 -1.22 -4.67 105.19 101.98 3hi1 n GLY 380 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 3hi1 n GLY 380 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hi1 s GLU 381 N -0.80 2.88 -0.18 1.61 2.02 -1.21 -3.73 118.70 119.29 3hi1 s GLU 381 Ca 0.00 -0.55 -0.02 0.00 0.02 0.00 0.00 54.97 54.42 3hi1 s GLU 381 Cb 0.00 -2.63 -0.01 0.00 0.10 0.00 0.00 34.13 31.59 3hi1 s GLU 381 CO 0.00 0.60 -0.09 -0.06 0.02 0.00 0.00 175.26 175.74 3hi1 s PHE 382 N -0.64 2.90 0.22 1.61 0.40 0.24 0.19 117.98 122.90 3hi1 s PHE 382 Ca 0.10 -0.82 -0.20 0.00 -0.60 0.00 0.00 56.93 55.41 3hi1 s PHE 382 Cb -0.12 -1.98 -0.08 0.00 0.51 0.00 0.00 43.02 41.35 3hi1 s PHE 382 CO 0.02 -0.39 0.72 -0.06 0.70 0.00 0.00 175.22 176.21 3hi1 s PHE 383 N 0.94 3.65 -0.09 0.36 0.40 -0.04 0.53 117.98 123.72 3hi1 s PHE 383 Ca -0.01 1.39 0.02 0.00 -0.60 0.00 0.00 56.93 57.73 3hi1 s PHE 383 Cb -0.15 -2.62 0.01 0.00 0.51 0.00 0.00 43.02 40.78 3hi1 s PHE 383 CO -0.00 0.34 -0.16 0.71 0.70 0.00 0.00 175.22 176.81 3hi1 s TYR 384 N -1.52 1.90 -0.09 0.36 1.51 0.99 -1.36 117.35 119.14 3hi1 s TYR 384 Ca 0.43 -0.82 -0.00 0.00 -1.01 0.00 0.00 57.07 55.67 3hi1 s TYR 384 Cb -0.17 -1.36 0.02 0.00 -0.11 0.00 0.00 41.96 40.35 3hi1 s TYR 384 CO 0.21 -0.40 -0.06 0.00 -1.11 0.00 0.00 175.55 174.19 3hi1 s ASN 386 N 1.52 5.11 -0.34 0.00 3.84 -0.89 -1.30 114.94 122.89 3hi1 s ASN 386 Ca 0.00 1.20 0.09 0.00 0.21 0.00 0.00 52.86 54.36 3hi1 s ASN 386 Cb -0.13 -2.51 0.72 0.00 -0.55 0.00 0.00 41.25 38.77 3hi1 s ASN 386 CO -0.05 -2.34 1.80 -1.54 -2.79 0.00 0.00 177.10 172.19 3hi1 n SER 387 N 13.23 4.49 -0.34 -4.21 3.41 -1.26 -4.45 113.62 124.49 3hi1 n SER 387 Ca 0.29 -3.32 0.08 0.00 -0.26 0.00 0.00 58.87 55.66 3hi1 n SER 387 Cb 0.50 -0.75 0.27 0.00 -0.26 0.00 0.00 64.21 63.97 3hi1 n SER 387 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3hi1 h THR 388 N 2.25 0.90 0.00 6.66 2.02 -1.94 0.23 112.91 123.03 3hi1 h THR 388 Ca 0.33 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 67.19 3hi1 h THR 388 Cb 2.38 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.68 3hi1 h THR 388 CO 0.78 0.17 0.00 1.56 0.37 0.00 0.00 175.52 178.40 3hi1 h GLN 389 N 0.93 0.00 0.00 6.66 4.20 -1.97 -2.97 115.11 121.96 3hi1 h GLN 389 Ca 0.49 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.20 3hi1 h GLN 389 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 3hi1 h GLN 389 CO -0.25 0.00 -0.83 -0.07 -0.67 0.00 0.00 178.83 177.01 3hi1 h LEU 390 N 0.00 0.00 -4.88 1.46 3.38 -1.28 -3.39 115.31 110.59 3hi1 h LEU 390 Ca 0.00 -0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.51 3hi1 h LEU 390 Cb 0.51 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.85 3hi1 h LEU 390 CO 0.00 0.00 -1.02 0.49 0.09 0.00 0.00 178.44 178.00 3hi1 n PHE 391 N -2.74 1.99 -3.53 1.13 3.01 -1.09 -4.91 117.46 111.32 3hi1 n PHE 391 Ca 0.01 -2.99 -0.29 0.00 1.01 0.00 0.00 57.45 55.19 3hi1 n PHE 391 Cb 0.55 -0.28 -0.12 0.00 -0.01 0.00 0.00 39.48 39.61 3hi1 n PHE 391 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 3hi1 s THR 392 N -3.99 0.44 0.05 4.37 -4.23 -1.23 -1.81 115.64 109.25 3hi1 s THR 392 Ca 0.36 -1.85 0.08 0.00 -1.18 0.00 0.00 61.69 59.10 3hi1 s THR 392 Cb 0.43 -1.33 -0.03 0.00 1.34 0.00 0.00 72.50 72.91 3hi1 s THR 392 CO -0.05 -0.95 -0.23 0.86 -0.54 0.00 0.00 174.62 173.71 3hi1 s TRP 393 N 0.97 2.02 0.02 3.99 -0.00 -1.19 -5.00 118.94 119.76 3hi1 s TRP 393 Ca 0.17 -0.39 -0.02 0.00 -0.00 0.00 0.00 56.10 55.86 3hi1 s TRP 393 Cb -0.23 -1.19 0.01 0.00 -0.00 0.00 0.00 33.47 32.06 3hi1 s TRP 393 CO -0.02 0.13 0.12 0.09 -0.00 0.00 0.00 176.95 177.27 3hi1 n ASN 394 N 1.72 -0.21 -4.21 5.86 3.02 -1.26 -4.17 115.26 116.01 3hi1 n ASN 394 Ca -0.17 -1.11 -0.39 0.00 -0.03 0.00 0.00 54.58 52.87 3hi1 n ASN 394 Cb 0.53 0.34 -0.10 0.00 -0.61 0.00 0.00 39.78 39.93 3hi1 n ASN 394 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3hi1 s ASP 395 N -1.28 5.50 -0.23 6.41 1.11 -1.26 -5.12 116.67 121.79 3hi1 s ASP 395 Ca 0.03 -1.73 -0.03 0.00 0.18 0.00 0.00 52.55 50.99 3hi1 s ASP 395 Cb -0.00 -1.93 0.12 0.00 1.07 0.00 0.00 42.92 42.18 3hi1 s ASP 395 CO 0.01 -0.56 0.33 -0.13 1.18 0.00 0.00 175.17 176.00 3hi1 s ARG 412 N 1.32 0.30 -0.29 8.23 3.00 -1.26 -5.33 118.95 124.92 3hi1 s ARG 412 Ca 0.04 0.43 -0.13 0.00 0.00 0.00 0.00 55.73 56.07 3hi1 s ARG 412 Cb -0.24 -0.69 0.12 0.00 0.00 0.00 0.00 34.95 34.14 3hi1 s ARG 412 CO -0.01 -0.65 0.72 1.21 0.00 0.00 0.00 175.30 176.57 3hi1 s ASN 413 N 2.48 -0.98 -0.09 0.23 3.84 -1.25 -3.69 114.94 115.48 3hi1 s ASN 413 Ca 0.11 1.43 0.02 0.00 0.21 0.00 0.00 52.86 54.63 3hi1 s ASN 413 Cb -0.15 1.83 0.01 0.00 -0.55 0.00 0.00 41.25 42.38 3hi1 s ASN 413 CO -0.15 -0.21 -0.16 -0.63 -2.79 0.00 0.00 177.10 173.16 3hi1 s ILE 414 N 2.27 1.51 -0.16 -5.21 1.01 -0.21 -4.75 121.20 115.65 3hi1 s ILE 414 Ca -0.07 -0.68 -0.01 0.00 0.00 0.00 0.00 60.65 59.89 3hi1 s ILE 414 Cb -0.08 -1.35 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 3hi1 s ILE 414 CO -0.19 0.44 -0.12 -0.89 0.00 0.00 0.00 174.94 174.18 3hi1 s THR 415 N 0.71 2.99 -0.16 2.92 2.01 -1.26 -2.25 115.64 120.60 3hi1 s THR 415 Ca -0.13 -0.66 -0.07 0.00 0.31 0.00 0.00 61.69 61.14 3hi1 s THR 415 Cb -0.16 -2.29 -0.04 0.00 0.01 0.00 0.00 72.50 70.02 3hi1 s THR 415 CO 0.03 0.50 0.09 -0.76 -0.69 0.00 0.00 174.62 173.79 3hi1 s LEU 416 N 0.84 4.06 -0.16 4.42 1.43 -0.65 -4.96 118.68 123.66 3hi1 s LEU 416 Ca -0.04 0.24 -0.29 0.00 -1.03 0.00 0.00 54.13 53.01 3hi1 s LEU 416 Cb -0.15 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 3hi1 s LEU 416 CO 0.00 0.27 1.16 -2.16 0.23 0.00 0.00 176.35 175.85 3hi1 s PRO 417 N -0.19 4.28 0.11 1.29 0.04 -1.26 -2.82 135.00 136.45 3hi1 s PRO 417 Ca 0.09 1.54 0.10 0.00 0.04 0.00 0.00 61.00 62.77 3hi1 s PRO 417 Cb -0.12 -3.67 -0.04 0.00 0.04 0.00 0.00 34.50 30.71 3hi1 s PRO 417 CO 0.01 -0.61 -0.25 0.00 0.04 0.00 0.00 177.00 176.20 3hi1 s ARG 419 N -1.94 1.64 -0.23 0.00 0.52 0.04 -4.67 118.95 114.30 3hi1 s ARG 419 Ca 0.11 -1.31 -0.03 0.00 -0.52 0.00 0.00 55.73 53.99 3hi1 s ARG 419 Cb -0.10 -2.00 0.01 0.00 0.52 0.00 0.00 34.95 33.38 3hi1 s ARG 419 CO 0.05 0.45 -0.06 0.42 0.02 0.00 0.00 175.30 176.18 3hi1 s ILE 420 N -1.27 3.08 -0.26 1.52 1.01 -1.26 -0.01 121.20 124.02 3hi1 s ILE 420 Ca 0.18 -0.75 -0.12 0.00 0.00 0.00 0.00 60.65 59.95 3hi1 s ILE 420 Cb -0.10 -2.47 -0.05 0.00 0.01 0.00 0.00 42.46 39.86 3hi1 s ILE 420 CO 0.09 0.33 0.25 -0.75 0.00 0.00 0.00 174.94 174.86 3hi1 s LYS 421 N 1.40 4.01 0.03 2.79 2.20 0.19 -4.91 119.74 125.46 3hi1 s LYS 421 Ca 0.03 -0.17 -0.16 0.00 -0.36 0.00 0.00 55.97 55.31 3hi1 s LYS 421 Cb -0.15 -3.63 -0.06 0.00 -1.51 0.00 0.00 37.83 32.48 3hi1 s LYS 421 CO -0.04 -0.15 0.47 -0.65 -0.36 0.00 0.00 175.35 174.61 3hi1 s GLN 422 N 1.68 4.01 -0.30 4.03 -0.21 -1.26 -0.60 119.66 127.01 3hi1 s GLN 422 Ca 0.10 0.52 -0.36 0.00 0.02 0.00 0.00 55.36 55.64 3hi1 s GLN 422 Cb -0.15 -3.21 -0.12 0.00 1.00 0.00 0.00 33.01 30.52 3hi1 s GLN 422 CO 0.09 0.66 2.05 -0.89 -2.12 0.00 0.00 175.29 175.08 3hi1 n ILE 423 N 1.71 0.27 -2.05 1.08 5.41 -1.24 -4.82 119.36 119.72 3hi1 n ILE 423 Ca -0.12 -0.19 -0.28 0.00 1.00 0.00 0.00 62.75 63.16 3hi1 n ILE 423 Cb 0.52 -1.57 -0.06 0.00 -0.71 0.00 0.00 39.64 37.82 3hi1 n ILE 423 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 3hi1 n ILE 424 N 6.31 1.91 -0.95 1.39 5.41 -1.26 -4.81 119.36 127.36 3hi1 n ILE 424 Ca 0.35 -1.98 -0.40 0.00 1.00 0.00 0.00 62.75 61.73 3hi1 n ILE 424 Cb 0.21 -2.17 -0.07 0.00 -0.71 0.00 0.00 39.64 36.90 3hi1 n ILE 424 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3hi1 n ASN 425 N 14.36 0.63 -0.15 4.38 4.13 -1.26 -4.77 115.26 132.58 3hi1 n ASN 425 Ca 0.45 0.61 -0.12 0.00 1.68 0.00 0.00 54.58 57.20 3hi1 n ASN 425 Cb 0.46 -0.55 -0.01 0.00 -1.54 0.00 0.00 39.78 38.15 3hi1 n ASN 425 CO 0.00 0.00 0.00 -0.03 0.28 0.00 0.00 177.26 177.51 3hi1 h MET 426 N 4.07 0.91 -5.41 3.52 4.05 -1.94 -3.43 114.93 116.71 3hi1 h MET 426 Ca -0.19 -0.39 -0.61 0.00 -0.28 0.00 0.00 59.70 58.23 3hi1 h MET 426 Cb 0.86 -0.03 -0.12 0.00 -0.80 0.00 0.00 31.60 31.51 3hi1 h MET 426 CO 0.63 1.05 -0.15 -1.58 0.23 0.00 0.00 176.91 177.09 3hi1 s TRP 427 N -4.65 3.35 0.00 1.39 0.52 -1.26 -5.01 118.94 113.28 3hi1 s TRP 427 Ca -0.12 0.63 0.00 0.00 0.02 0.00 0.00 56.10 56.63 3hi1 s TRP 427 Cb 0.11 -2.58 0.00 0.00 -1.15 0.00 0.00 33.47 29.85 3hi1 s TRP 427 CO 0.85 -0.09 0.00 1.04 0.02 0.00 0.00 176.95 178.78 3hi1 n GLN 428 N 4.77 0.00 -3.16 4.98 1.13 -1.26 -4.98 117.38 118.85 3hi1 n GLN 428 Ca -0.07 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.99 3hi1 n GLN 428 Cb 0.51 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.86 3hi1 n GLN 428 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 3hi1 n GLU 429 N -0.61 -2.38 -3.86 -1.09 2.13 -1.26 -4.99 120.64 108.58 3hi1 n GLU 429 Ca 0.00 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.51 3hi1 n GLU 429 Cb 0.00 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.72 3hi1 n GLU 429 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3hi1 n VAL 430 N 0.47 -3.35 -3.03 6.31 0.31 -1.26 -4.94 118.33 112.83 3hi1 n VAL 430 Ca 0.00 -0.20 -0.23 0.00 -0.01 0.00 0.00 64.34 63.90 3hi1 n VAL 430 Cb 0.00 -2.86 -0.03 0.00 -0.91 0.00 0.00 33.84 30.04 3hi1 n VAL 430 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hi1 n GLY 431 N -1.78 4.69 0.43 2.92 0.00 -1.26 -4.81 105.19 105.38 3hi1 n GLY 431 Ca -0.25 -2.29 0.12 0.00 0.00 0.00 0.00 46.02 43.60 3hi1 n GLY 431 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3hi1 n LYS 432 N -0.02 1.22 0.00 1.61 3.00 -1.26 -3.95 118.16 118.76 3hi1 n LYS 432 Ca 0.28 -0.87 0.00 0.00 -0.00 0.00 0.00 58.31 57.72 3hi1 n LYS 432 Cb 0.52 -1.48 0.00 0.00 0.00 0.00 0.00 35.03 34.07 3hi1 n LYS 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3hi1 n ALA 433 N -0.13 1.88 0.00 3.14 0.00 -1.26 -3.31 120.51 120.84 3hi1 n ALA 433 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3hi1 n ALA 433 Cb 0.41 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.86 3hi1 n ALA 433 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3hi1 n MET 434 N 0.22 0.00 0.00 0.00 2.81 -1.25 -5.16 117.12 113.73 3hi1 n MET 434 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 3hi1 n MET 434 Cb 0.15 -0.28 0.00 0.00 -0.71 0.00 0.00 33.22 32.38 3hi1 n MET 434 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 3hi1 n TYR 435 N -0.56 -0.48 -4.01 2.03 9.36 -1.21 -4.96 117.16 117.33 3hi1 n TYR 435 Ca 0.00 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 60.92 3hi1 n TYR 435 Cb 0.00 0.00 -0.05 0.00 -0.63 0.00 0.00 39.34 38.66 3hi1 n TYR 435 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3hi1 s ALA 436 N -1.23 3.71 -0.49 2.98 0.00 -1.26 -4.90 121.76 120.57 3hi1 s ALA 436 Ca 0.00 -0.98 -0.17 0.00 0.00 0.00 0.00 51.96 50.81 3hi1 s ALA 436 Cb 0.00 -1.56 0.07 0.00 0.00 0.00 0.00 23.12 21.63 3hi1 s ALA 436 CO 0.00 0.74 0.48 -1.25 0.00 0.00 0.00 175.76 175.72 3hi1 s PRO 437 N -2.54 3.03 -0.23 0.00 0.04 -1.26 -4.93 135.00 129.11 3hi1 s PRO 437 Ca 0.31 -1.20 -0.15 0.00 0.04 0.00 0.00 61.00 60.01 3hi1 s PRO 437 Cb -0.12 -4.12 -0.17 0.00 0.04 0.00 0.00 34.50 30.12 3hi1 s PRO 437 CO 0.24 -1.10 -0.01 -0.35 0.04 0.00 0.00 177.00 175.82 3hi1 n PRO 438 N 5.54 0.61 -1.13 0.56 -0.04 -1.26 -4.75 135.00 134.52 3hi1 n PRO 438 Ca -0.10 0.39 -0.28 0.00 -0.04 0.00 0.00 63.50 63.46 3hi1 n PRO 438 Cb 0.44 -1.63 -0.07 0.00 -0.04 0.00 0.00 33.50 32.20 3hi1 n PRO 438 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 3hi1 n ILE 439 N -4.14 3.65 -3.47 0.52 5.41 -1.26 -4.64 119.36 115.42 3hi1 n ILE 439 Ca -0.41 -2.09 -0.29 0.00 1.00 0.00 0.00 62.75 60.96 3hi1 n ILE 439 Cb 0.83 -2.36 -0.12 0.00 -0.71 0.00 0.00 39.64 37.28 3hi1 n ILE 439 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 3hi1 s ARG 440 N 1.96 0.48 -0.19 0.38 0.52 -1.26 -4.67 118.95 116.16 3hi1 s ARG 440 Ca 0.65 -1.18 0.00 0.00 -0.52 0.00 0.00 55.73 54.68 3hi1 s ARG 440 Cb 0.21 -1.26 -0.12 0.00 0.52 0.00 0.00 34.95 34.30 3hi1 s ARG 440 CO -0.04 -1.18 -0.18 0.41 0.02 0.00 0.00 175.30 174.34 3hi1 n GLY 441 N 4.26 -0.27 3.91 -3.53 0.00 -1.26 -4.72 105.19 103.58 3hi1 n GLY 441 Ca 0.09 -0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 3hi1 n GLY 441 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hi1 s GLN 442 N -2.38 3.55 0.52 1.61 0.74 -1.26 -5.18 119.66 117.26 3hi1 s GLN 442 Ca -0.26 -0.25 0.03 0.00 0.05 0.00 0.00 55.36 54.93 3hi1 s GLN 442 Cb 0.07 -2.87 0.03 0.00 1.10 0.00 0.00 33.01 31.33 3hi1 s GLN 442 CO 0.44 0.46 0.21 -0.89 -0.55 0.00 0.00 175.29 174.96 3hi1 n ILE 443 N -0.20 0.00 -4.18 -2.34 5.41 -1.26 -5.16 119.36 111.63 3hi1 n ILE 443 Ca -0.04 -2.24 -0.16 0.00 1.00 0.00 0.00 62.75 61.31 3hi1 n ILE 443 Cb 0.52 0.20 -0.11 0.00 -0.71 0.00 0.00 39.64 39.55 3hi1 n ILE 443 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3hi1 s ARG 444 N -4.02 0.86 -0.04 0.38 3.03 -1.26 -4.99 118.95 112.90 3hi1 s ARG 444 Ca 0.16 -1.10 0.14 0.00 2.03 0.00 0.00 55.73 56.96 3hi1 s ARG 444 Cb -0.01 -0.67 0.42 0.00 -1.03 0.00 0.00 34.95 33.66 3hi1 s ARG 444 CO 0.10 0.12 1.35 0.00 -1.13 0.00 0.00 175.30 175.75 3hi1 n SER 446 N 0.50 2.12 -1.81 0.00 3.41 -1.26 -4.57 113.62 112.01 3hi1 n SER 446 Ca 0.16 0.85 -0.06 0.00 -0.26 0.00 0.00 58.87 59.56 3hi1 n SER 446 Cb 0.58 -1.14 -0.01 0.00 -0.26 0.00 0.00 64.21 63.37 3hi1 n SER 446 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3hi1 n SER 447 N 6.82 -0.51 -4.34 4.04 3.41 -0.22 -4.95 113.62 117.87 3hi1 n SER 447 Ca 0.34 -1.77 -0.36 0.00 -0.26 0.00 0.00 58.87 56.82 3hi1 n SER 447 Cb 0.13 0.97 -0.13 0.00 -0.26 0.00 0.00 64.21 64.92 3hi1 n SER 447 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3hi1 s ASN 448 N -1.87 4.59 -0.41 4.04 0.01 -1.26 -1.30 114.94 118.75 3hi1 s ASN 448 Ca 0.12 -0.41 -0.27 0.00 -0.71 0.00 0.00 52.86 51.59 3hi1 s ASN 448 Cb -0.00 -1.80 0.02 0.00 0.41 0.00 0.00 41.25 39.88 3hi1 s ASN 448 CO 0.09 -0.05 0.99 -0.63 -1.51 0.00 0.00 177.10 175.99 3hi1 s ILE 449 N 1.51 4.46 -0.20 0.60 1.01 0.45 0.18 121.20 129.21 3hi1 s ILE 449 Ca 0.05 1.18 0.03 0.00 0.00 0.00 0.00 60.65 61.90 3hi1 s ILE 449 Cb -0.15 -4.43 0.07 0.00 0.01 0.00 0.00 42.46 37.97 3hi1 s ILE 449 CO -0.01 -0.70 1.06 0.35 0.00 0.00 0.00 174.94 175.64 3hi1 n THR 450 N 6.25 1.02 0.00 2.92 -2.24 -0.27 -2.19 114.28 119.77 3hi1 n THR 450 Ca 0.09 -1.02 0.00 0.00 -2.27 0.00 0.00 64.05 60.85 3hi1 n THR 450 Cb 0.48 0.49 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 3hi1 n THR 450 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hi1 n GLY 451 N -0.29 0.51 3.05 3.38 0.00 -1.09 -2.25 105.19 108.50 3hi1 n GLY 451 Ca 0.03 -0.86 -0.10 0.00 0.00 0.00 0.00 46.02 45.10 3hi1 n GLY 451 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hi1 s LEU 452 N 0.00 2.35 -0.18 0.99 1.02 -0.86 0.24 118.68 122.24 3hi1 s LEU 452 Ca 0.00 -0.72 -0.03 0.00 0.02 0.00 0.00 54.13 53.40 3hi1 s LEU 452 Cb 0.00 0.04 -0.02 0.00 0.02 0.00 0.00 46.19 46.24 3hi1 s LEU 452 CO 0.00 -0.38 -0.05 -0.76 0.02 0.00 0.00 176.35 175.17 3hi1 s LEU 453 N -2.10 2.99 0.14 1.79 1.43 -0.28 -0.74 118.68 121.91 3hi1 s LEU 453 Ca -0.05 -0.29 0.06 0.00 -1.03 0.00 0.00 54.13 52.83 3hi1 s LEU 453 Cb -0.03 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.42 3hi1 s LEU 453 CO -0.04 0.08 -0.14 -0.76 0.23 0.00 0.00 176.35 175.72 3hi1 s LEU 454 N 0.91 2.44 0.04 1.79 1.43 0.51 -3.36 118.68 122.43 3hi1 s LEU 454 Ca -0.01 -0.86 0.02 0.00 -1.03 0.00 0.00 54.13 52.25 3hi1 s LEU 454 Cb -0.15 -0.56 -0.02 0.00 0.03 0.00 0.00 46.19 45.49 3hi1 s LEU 454 CO 0.01 -0.16 -0.07 0.42 0.23 0.00 0.00 176.35 176.78 3hi1 s THR 455 N -2.37 0.44 0.03 5.49 -4.23 -0.81 0.48 115.64 114.67 3hi1 s THR 455 Ca 0.12 -1.05 0.03 0.00 -1.18 0.00 0.00 61.69 59.61 3hi1 s THR 455 Cb -0.04 -0.54 -0.04 0.00 1.34 0.00 0.00 72.50 73.23 3hi1 s THR 455 CO 0.03 -0.41 -0.03 -0.60 -0.54 0.00 0.00 174.62 173.07 3hi1 s ARG 456 N -1.58 2.61 0.38 3.99 3.52 -1.25 -1.70 118.95 124.92 3hi1 s ARG 456 Ca -0.11 -0.73 -0.17 0.00 -0.13 0.00 0.00 55.73 54.59 3hi1 s ARG 456 Cb -0.10 -2.56 -0.09 0.00 -1.56 0.00 0.00 34.95 30.64 3hi1 s ARG 456 CO 0.00 0.59 0.83 -0.51 -0.81 0.00 0.00 175.30 175.40 3hi1 s ASP 457 N -1.77 6.80 -0.38 -2.12 1.11 -0.90 -4.75 116.67 114.67 3hi1 s ASP 457 Ca 0.21 1.43 0.01 0.00 0.18 0.00 0.00 52.55 54.38 3hi1 s ASP 457 Cb -0.11 -2.43 0.15 0.00 1.07 0.00 0.00 42.92 41.59 3hi1 s ASP 457 CO 0.12 -0.30 0.26 -0.83 1.18 0.00 0.00 175.17 175.59 3hi1 s GLY 458 N -2.38 1.00 0.25 0.21 0.00 -1.26 -4.77 107.32 100.37 3hi1 s GLY 458 Ca 0.57 -2.09 0.10 0.00 0.00 0.00 0.00 44.72 43.30 3hi1 s GLY 458 CO 0.18 2.08 -0.09 -0.32 0.00 0.00 0.00 173.10 174.95 3hi1 s GLY 459 N 0.70 1.73 0.23 0.20 0.00 -1.26 -5.04 107.32 103.89 3hi1 s GLY 459 Ca 0.23 -1.68 -0.07 0.00 0.00 0.00 0.00 44.72 43.20 3hi1 s GLY 459 CO -0.06 -1.74 1.81 1.70 0.00 0.00 0.00 173.10 174.81 3hi1 h LYS 460 N 2.25 0.73 -2.73 2.90 1.63 -2.05 -3.26 116.57 116.04 3hi1 h LYS 460 Ca -0.44 -0.04 -0.80 0.00 -0.85 0.00 0.00 60.65 58.52 3hi1 h LYS 460 Cb 1.24 -0.16 -0.26 0.00 -0.60 0.00 0.00 32.23 32.45 3hi1 h LYS 460 CO 0.58 0.48 1.07 -0.25 -3.45 0.00 0.00 179.45 177.88 3hi1 n ASP 461 N -4.76 6.71 -3.84 4.20 8.00 -1.26 -4.87 116.55 120.73 3hi1 n ASP 461 Ca 0.11 -3.46 -0.26 0.00 0.71 0.00 0.00 54.79 51.89 3hi1 n ASP 461 Cb 0.23 -1.26 -0.17 0.00 -0.02 0.00 0.00 41.12 39.90 3hi1 n ASP 461 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3hi1 s THR 462 N -2.93 0.77 -0.22 -3.53 -4.23 -1.23 -5.11 115.64 99.16 3hi1 s THR 462 Ca 0.36 -0.25 0.01 0.00 -1.18 0.00 0.00 61.69 60.62 3hi1 s THR 462 Cb 0.11 -0.92 0.03 0.00 1.34 0.00 0.00 72.50 73.05 3hi1 s THR 462 CO 0.01 0.22 -0.15 0.20 -0.54 0.00 0.00 174.62 174.36 3hi1 s ASN 463 N 1.80 3.73 0.00 3.99 -0.87 -1.26 -4.57 114.94 117.75 3hi1 s ASN 463 Ca 0.03 -0.92 0.00 0.00 -1.57 0.00 0.00 52.86 50.41 3hi1 s ASN 463 Cb -0.14 -1.53 0.00 0.00 -0.02 0.00 0.00 41.25 39.56 3hi1 s ASN 463 CO -0.07 -0.08 0.00 0.61 -2.57 0.00 0.00 177.10 174.99 3hi1 n GLY 464 N 4.57 0.00 3.59 0.66 0.00 -1.26 -4.83 105.19 107.92 3hi1 n GLY 464 Ca -0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 3hi1 n GLY 464 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3hi1 s THR 465 N -0.57 4.56 -0.08 2.61 -1.32 -1.26 -0.53 115.64 119.05 3hi1 s THR 465 Ca 0.00 -0.11 0.03 0.00 -1.21 0.00 0.00 61.69 60.40 3hi1 s THR 465 Cb 0.00 -3.05 0.00 0.00 -1.51 0.00 0.00 72.50 67.94 3hi1 s THR 465 CO 0.00 0.46 -0.19 -1.61 -2.21 0.00 0.00 174.62 171.07 3hi1 s GLU 466 N 0.48 2.36 -0.11 7.08 0.41 -0.45 -4.82 118.70 123.65 3hi1 s GLU 466 Ca 0.02 -0.67 -0.03 0.00 -0.41 0.00 0.00 54.97 53.88 3hi1 s GLU 466 Cb -0.13 -1.86 -0.03 0.00 -1.78 0.00 0.00 34.13 30.32 3hi1 s GLU 466 CO 0.01 0.13 0.02 0.42 -0.49 0.00 0.00 175.26 175.35 3hi1 s ILE 467 N 0.42 4.45 0.05 -1.63 1.01 -1.26 -1.39 121.20 122.86 3hi1 s ILE 467 Ca -0.15 -0.18 0.07 0.00 0.00 0.00 0.00 60.65 60.39 3hi1 s ILE 467 Cb -0.16 -2.91 -0.03 0.00 0.01 0.00 0.00 42.46 39.37 3hi1 s ILE 467 CO 0.06 0.57 -0.19 -0.36 0.00 0.00 0.00 174.94 175.02 3hi1 s PHE 468 N -0.54 1.68 0.20 3.97 0.40 -0.21 -2.11 117.98 121.37 3hi1 s PHE 468 Ca 0.10 -0.38 0.01 0.00 -0.60 0.00 0.00 56.93 56.05 3hi1 s PHE 468 Cb -0.12 -0.98 -0.05 0.00 0.51 0.00 0.00 43.02 42.38 3hi1 s PHE 468 CO 0.02 0.10 0.06 1.03 0.70 0.00 0.00 175.22 177.14 3hi1 s ARG 469 N -1.30 1.19 0.00 0.44 0.52 -0.69 -0.54 118.95 118.57 3hi1 s ARG 469 Ca 0.06 -1.61 0.24 0.00 -0.52 0.00 0.00 55.73 53.91 3hi1 s ARG 469 Cb -0.09 -0.07 0.27 0.00 0.52 0.00 0.00 34.95 35.58 3hi1 s ARG 469 CO 0.02 -0.25 1.29 -0.35 0.02 0.00 0.00 175.30 176.03 3hi1 n PRO 470 N -0.29 1.87 -4.39 3.54 -0.04 -1.26 -1.93 135.00 132.49 3hi1 n PRO 470 Ca -0.03 -1.48 -0.27 0.00 -0.04 0.00 0.00 63.50 61.68 3hi1 n PRO 470 Cb 0.65 -1.47 -0.17 0.00 -0.04 0.00 0.00 33.50 32.47 3hi1 n PRO 470 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3hi1 s GLY 471 N -2.16 0.91 -0.25 0.55 0.00 -1.21 -3.87 107.32 101.30 3hi1 s GLY 471 Ca 0.26 -0.58 -0.03 0.00 0.00 0.00 0.00 44.72 44.37 3hi1 s GLY 471 CO 0.39 0.30 0.18 -0.32 0.00 0.00 0.00 173.10 173.65 3hi1 s GLY 472 N 1.01 0.21 0.00 0.20 0.00 -1.26 -4.42 107.32 103.07 3hi1 s GLY 472 Ca -0.07 -0.47 0.00 0.00 0.00 0.00 0.00 44.72 44.18 3hi1 s GLY 472 CO -0.01 2.16 0.00 0.61 0.00 0.00 0.00 173.10 175.86 3hi1 n GLY 473 N 5.28 -0.72 1.07 0.20 0.00 -1.26 -4.83 105.19 104.93 3hi1 n GLY 473 Ca -0.05 -1.22 -0.07 0.00 0.00 0.00 0.00 46.02 44.68 3hi1 n GLY 473 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hi1 n ASP 474 N 0.67 1.41 0.25 1.61 5.75 -1.26 -5.04 116.55 119.95 3hi1 n ASP 474 Ca 0.00 -1.52 0.15 0.00 -0.01 0.00 0.00 54.79 53.40 3hi1 n ASP 474 Cb 0.00 -0.02 0.48 0.00 -1.03 0.00 0.00 41.12 40.55 3hi1 n ASP 474 CO 0.00 0.00 0.00 0.24 -0.11 0.00 0.00 177.20 177.33 3hi1 h MET 475 N 0.00 0.00 -0.99 0.11 2.86 -1.91 -2.47 114.93 112.53 3hi1 h MET 475 Ca -0.10 0.00 0.25 0.00 -2.06 0.00 0.00 59.70 57.79 3hi1 h MET 475 Cb 0.36 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.94 3hi1 h MET 475 CO 0.15 0.03 0.65 0.00 1.06 0.00 0.00 176.91 178.81 3hi1 h ARG 476 N 0.00 0.35 0.00 1.72 3.08 -1.96 0.54 114.38 118.11 3hi1 h ARG 476 Ca -0.00 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3hi1 h ARG 476 Cb 0.71 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 3hi1 h ARG 476 CO 0.00 0.23 -0.07 -0.44 -1.07 0.00 0.00 179.97 178.63 3hi1 h ASP 477 N 0.36 0.00 0.99 7.04 3.32 -1.80 0.11 116.42 126.44 3hi1 h ASP 477 Ca 0.54 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.54 3hi1 h ASP 477 Cb 1.44 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.00 3hi1 h ASP 477 CO -0.22 0.07 -0.47 0.78 -1.72 0.00 0.00 179.24 177.68 3hi1 h ASN 478 N 0.00 -1.12 -0.70 6.45 2.35 -0.08 -2.44 115.58 120.03 3hi1 h ASN 478 Ca -0.00 0.04 0.11 0.00 -0.55 0.00 0.00 56.30 55.90 3hi1 h ASN 478 Cb 0.13 0.29 -0.08 0.00 0.05 0.00 0.00 38.32 38.71 3hi1 h ASN 478 CO 0.01 -0.79 0.31 -0.50 -1.65 0.00 0.00 177.43 174.80 3hi1 h TRP 479 N -1.36 0.54 -0.99 1.19 -0.00 -1.34 0.39 115.95 114.38 3hi1 h TRP 479 Ca -0.14 0.03 0.26 0.00 -0.00 0.00 0.00 58.89 59.04 3hi1 h TRP 479 Cb 1.02 -0.13 -0.07 0.00 -0.00 0.00 0.00 29.16 29.98 3hi1 h TRP 479 CO 0.00 0.14 0.67 -0.09 -0.00 0.00 0.00 178.44 179.16 3hi1 h ARG 480 N 0.50 0.27 0.00 0.49 2.43 -0.67 0.13 114.38 117.53 3hi1 h ARG 480 Ca 0.36 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 3hi1 h ARG 480 Cb 0.46 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 3hi1 h ARG 480 CO -0.33 0.18 0.00 0.66 -1.51 0.00 0.00 179.97 178.97 3hi1 h SER 481 N 0.28 0.00 0.07 -3.80 4.64 -0.42 -2.03 113.55 112.29 3hi1 h SER 481 Ca 0.52 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.48 3hi1 h SER 481 Cb 1.54 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.57 3hi1 h SER 481 CO -0.17 0.00 -2.30 -0.62 -0.87 0.00 0.00 176.83 172.87 3hi1 n GLU 482 N -2.97 0.68 0.00 4.77 -0.58 0.35 -4.46 120.64 118.43 3hi1 n GLU 482 Ca 0.02 0.08 0.14 0.00 -0.42 0.00 0.00 57.16 56.97 3hi1 n GLU 482 Cb 0.35 -1.57 0.43 0.00 -0.57 0.00 0.00 31.44 30.08 3hi1 n GLU 482 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3hi1 n LEU 483 N -2.94 1.78 -0.27 -4.62 4.77 -0.58 -4.45 117.00 110.69 3hi1 n LEU 483 Ca -0.34 -0.59 0.12 0.00 -0.03 0.00 0.00 56.01 55.18 3hi1 n LEU 483 Cb 1.10 -0.01 0.38 0.00 -2.33 0.00 0.00 43.42 42.57 3hi1 n LEU 483 CO 0.39 0.30 1.22 0.10 -1.33 0.00 0.00 177.39 178.07 3hi1 h TYR 484 N 2.77 0.82 -0.26 -1.77 -0.00 -1.59 -0.95 116.97 115.99 3hi1 h TYR 484 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 58.73 58.75 3hi1 h TYR 484 Cb 0.60 -0.26 0.00 0.00 0.00 0.00 0.00 36.73 37.08 3hi1 h TYR 484 CO 0.00 0.29 0.00 0.36 -0.00 0.00 0.00 178.16 178.81 3hi1 n LYS 485 N -4.57 1.61 -4.45 0.10 2.85 -1.26 -4.58 118.16 107.86 3hi1 n LYS 485 Ca 0.18 -0.93 -0.24 0.00 -1.05 0.00 0.00 58.31 56.27 3hi1 n LYS 485 Cb 0.49 -1.21 -0.10 0.00 -0.65 0.00 0.00 35.03 33.56 3hi1 n LYS 485 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3hi1 s TYR 486 N -1.65 2.21 -0.17 5.58 1.51 -0.36 -0.83 117.35 123.62 3hi1 s TYR 486 Ca 0.17 -0.37 -0.22 0.00 -1.01 0.00 0.00 57.07 55.65 3hi1 s TYR 486 Cb 0.09 -0.98 0.06 0.00 -0.11 0.00 0.00 41.96 41.02 3hi1 s TYR 486 CO 0.12 0.64 0.58 0.21 -1.11 0.00 0.00 175.55 175.99 3hi1 s LYS 487 N -3.40 0.76 -0.06 -0.62 2.20 -0.69 -4.94 119.74 112.98 3hi1 s LYS 487 Ca 0.28 0.63 -0.07 0.00 -0.36 0.00 0.00 55.97 56.45 3hi1 s LYS 487 Cb -0.05 0.36 -0.04 0.00 -1.51 0.00 0.00 37.83 36.59 3hi1 s LYS 487 CO 0.13 -0.14 0.19 0.54 -0.36 0.00 0.00 175.35 175.72 3hi1 s VAL 488 N -0.10 5.42 0.05 4.02 0.11 -1.26 -0.24 120.40 128.40 3hi1 s VAL 488 Ca -0.03 0.17 -0.27 0.00 -2.93 0.00 0.00 61.98 58.91 3hi1 s VAL 488 Cb -0.03 -3.48 0.07 0.00 -1.53 0.00 0.00 36.38 31.40 3hi1 s VAL 488 CO 0.03 0.51 0.65 0.54 -3.33 0.00 0.00 175.10 173.50 3hi1 s VAL 489 N -1.15 0.00 0.31 2.04 0.11 0.14 -4.96 120.40 116.89 3hi1 s VAL 489 Ca 0.21 0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 59.18 3hi1 s VAL 489 Cb -0.13 -1.00 -0.06 0.00 -1.53 0.00 0.00 36.38 33.66 3hi1 s VAL 489 CO 0.10 0.00 0.62 -0.75 -3.33 0.00 0.00 175.10 171.74 3hi1 s LYS 490 N -2.51 3.71 -0.03 1.54 2.20 -1.26 -0.59 119.74 122.79 3hi1 s LYS 490 Ca -0.04 0.19 0.02 0.00 -0.36 0.00 0.00 55.97 55.77 3hi1 s LYS 490 Cb -0.01 -2.57 -0.03 0.00 -1.51 0.00 0.00 37.83 33.71 3hi1 s LYS 490 CO -0.02 0.16 -0.06 0.42 -0.36 0.00 0.00 175.35 175.49 3hi1 s ILE 491 N -2.12 3.76 0.00 5.43 -1.09 0.82 -4.88 121.20 123.12 3hi1 s ILE 491 Ca 0.47 -0.61 0.00 0.00 -2.23 0.00 0.00 60.65 58.28 3hi1 s ILE 491 Cb -0.11 -2.60 0.00 0.00 -1.58 0.00 0.00 42.46 38.17 3hi1 s ILE 491 CO 0.29 0.49 0.00 -1.84 -1.23 0.00 0.00 174.94 172.64