#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ibj n SER 86 N 0.00 0.96 0.08 0.00 7.64 -1.26 -4.72 113.62 116.32 1ibj n SER 86 Ca 0.00 0.59 -0.13 0.00 1.01 0.00 0.00 58.87 60.34 1ibj n SER 86 Cb 0.00 -1.50 -0.08 0.00 -1.01 0.00 0.00 64.21 61.62 1ibj n SER 86 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1ibj h VAL 87 N -0.86 0.97 -0.86 0.44 2.07 -2.01 0.80 116.25 116.80 1ibj h VAL 87 Ca -0.46 -0.28 0.22 0.00 0.82 0.00 0.00 66.70 67.00 1ibj h VAL 87 Cb 1.30 1.15 -0.14 0.00 -1.52 0.00 0.00 31.29 32.09 1ibj h VAL 87 CO 0.46 0.07 0.21 0.28 0.02 0.00 0.00 177.57 178.60 1ibj h SER 88 N -0.27 -0.04 -0.14 0.57 0.02 -1.98 0.46 113.55 112.17 1ibj h SER 88 Ca -0.01 0.20 -0.14 0.00 -0.84 0.00 0.00 61.79 60.99 1ibj h SER 88 Cb 0.22 0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 1ibj h SER 88 CO 0.02 -0.15 -0.40 0.74 -1.14 0.00 0.00 176.83 175.90 1ibj h THR 89 N 0.20 1.29 -0.44 -2.27 2.02 -1.73 -3.16 112.91 108.82 1ibj h THR 89 Ca 0.53 -1.57 -0.14 0.00 0.77 0.00 0.00 66.41 66.01 1ibj h THR 89 Cb 1.05 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.95 1ibj h THR 89 CO -0.65 0.50 -0.27 0.25 0.37 0.00 0.00 175.52 175.72 1ibj h LEU 90 N 0.55 1.00 -1.59 2.58 5.85 0.51 -3.24 115.31 120.98 1ibj h LEU 90 Ca 0.05 -0.42 0.23 0.00 0.84 0.00 0.00 57.88 58.58 1ibj h LEU 90 Cb 0.92 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.61 1ibj h LEU 90 CO 0.08 1.20 0.63 -0.07 -0.34 0.00 0.00 178.44 179.94 1ibj h LEU 91 N 0.80 0.33 -0.68 2.25 3.38 -0.86 -0.33 115.31 120.19 1ibj h LEU 91 Ca 0.09 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1ibj h LEU 91 Cb 0.85 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1ibj h LEU 91 CO 0.08 0.11 -0.27 1.33 0.09 0.00 0.00 178.44 179.78 1ibj n VAL 92 N -4.48 0.00 -1.69 1.22 0.24 -1.22 -4.56 118.33 107.84 1ibj n VAL 92 Ca 0.20 -0.18 -0.42 0.00 -2.04 0.00 0.00 64.34 61.91 1ibj n VAL 92 Cb 0.80 0.61 -0.03 0.00 -1.47 0.00 0.00 33.84 33.75 1ibj n VAL 92 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1ibj n ASN 93 N -0.39 4.09 -4.35 -1.34 5.15 -0.14 -4.94 115.26 113.34 1ibj n ASN 93 Ca 0.12 0.98 -0.44 0.00 -0.60 0.00 0.00 54.58 54.64 1ibj n ASN 93 Cb 0.38 -1.55 -0.07 0.00 -0.53 0.00 0.00 39.78 38.01 1ibj n ASN 93 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1ibj s LEU 94 N 2.88 5.71 -0.94 1.20 2.96 -1.26 -5.00 118.68 124.24 1ibj s LEU 94 Ca 0.82 -1.47 -0.01 0.00 -0.22 0.00 0.00 54.13 53.26 1ibj s LEU 94 Cb -0.47 -2.16 0.29 0.00 0.50 0.00 0.00 46.19 44.34 1ibj s LEU 94 CO 0.37 -0.69 1.25 -0.90 -1.32 0.00 0.00 176.35 175.07 1ibj n ASP 95 N 5.18 5.58 -4.16 3.68 5.68 -1.26 -4.96 116.55 126.29 1ibj n ASP 95 Ca -0.12 -3.43 -0.39 0.00 -0.50 0.00 0.00 54.79 50.35 1ibj n ASP 95 Cb 0.43 -1.08 -0.06 0.00 -1.14 0.00 0.00 41.12 39.27 1ibj n ASP 95 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 1ibj s ASN 96 N -2.01 5.94 0.29 -1.12 0.01 -1.26 -4.90 114.94 111.88 1ibj s ASN 96 Ca 0.34 -3.24 -0.02 0.00 -0.71 0.00 0.00 52.86 49.23 1ibj s ASN 96 Cb 0.08 -1.96 0.43 0.00 0.41 0.00 0.00 41.25 40.21 1ibj s ASN 96 CO 0.07 -0.32 1.95 0.07 -1.51 0.00 0.00 177.10 177.36 1ibj h LYS 97 N 6.71 1.12 -0.64 -0.60 2.10 -2.03 -3.02 116.57 120.20 1ibj h LYS 97 Ca 0.09 -0.07 -0.05 0.00 -2.00 0.00 0.00 60.65 58.63 1ibj h LYS 97 Cb 0.90 -0.25 -0.03 0.00 -0.90 0.00 0.00 32.23 31.95 1ibj h LYS 97 CO 0.80 0.74 0.21 0.27 -2.00 0.00 0.00 179.45 179.47 1ibj h PHE 98 N 1.15 0.98 -2.87 0.07 -5.15 -2.02 -3.44 116.94 105.65 1ibj h PHE 98 Ca 0.33 -0.08 -0.57 0.00 -0.20 0.00 0.00 57.97 57.46 1ibj h PHE 98 Cb -0.07 -0.29 -0.04 0.00 0.22 0.00 0.00 35.95 35.78 1ibj h PHE 98 CO -0.00 0.77 1.18 0.34 -2.00 0.00 0.00 178.31 178.61 1ibj s ASP 99 N -6.50 6.13 0.52 -0.68 2.15 -1.14 -4.91 116.67 112.24 1ibj s ASP 99 Ca -0.11 1.23 0.20 0.00 0.43 0.00 0.00 52.55 54.30 1ibj s ASP 99 Cb 0.16 -2.53 1.36 0.00 -0.30 0.00 0.00 42.92 41.61 1ibj s ASP 99 CO 0.81 -1.53 2.14 -0.65 -0.17 0.00 0.00 175.17 175.77 1ibj h PRO 100 N 11.76 0.00 -0.46 4.34 0.11 -1.89 -3.08 132.00 142.78 1ibj h PRO 100 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1ibj h PRO 100 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1ibj h PRO 100 CO 1.04 0.04 0.00 1.19 -0.21 0.00 0.00 178.00 180.06 1ibj n PHE 101 N -4.29 0.61 -4.20 0.65 0.99 -1.26 -5.01 117.46 104.95 1ibj n PHE 101 Ca -0.03 -0.39 -0.34 0.00 -0.00 0.00 0.00 57.45 56.69 1ibj n PHE 101 Cb 0.12 -0.01 -0.06 0.00 -1.00 0.00 0.00 39.48 38.54 1ibj n PHE 101 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 1ibj n ASP 102 N 1.17 -0.60 -4.73 4.37 8.00 -1.17 -4.91 116.55 118.68 1ibj n ASP 102 Ca 0.18 -1.24 -0.34 0.00 0.71 0.00 0.00 54.79 54.09 1ibj n ASP 102 Cb 0.53 -1.84 0.08 0.00 -0.02 0.00 0.00 41.12 39.86 1ibj n ASP 102 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ibj s ALA 103 N -4.10 2.23 -0.15 2.24 0.00 -1.26 -4.89 121.76 115.83 1ibj s ALA 103 Ca 0.13 0.88 0.29 0.00 0.00 0.00 0.00 51.96 53.26 1ibj s ALA 103 Cb -0.07 -3.45 0.93 0.00 0.00 0.00 0.00 23.12 20.53 1ibj s ALA 103 CO 0.98 -1.70 1.82 0.52 0.00 0.00 0.00 175.76 177.38 1ibj h MET 104 N -0.06 0.00 -6.44 0.00 0.00 -2.03 -3.43 114.93 102.97 1ibj h MET 104 Ca -0.48 0.00 -0.69 0.00 0.00 0.00 0.00 59.70 58.53 1ibj h MET 104 Cb 1.29 0.00 -0.24 0.00 0.00 0.00 0.00 31.60 32.65 1ibj h MET 104 CO 0.51 0.00 -0.80 0.45 0.00 0.00 0.00 176.91 177.07 1ibj s SER 105 N -5.85 3.82 0.12 1.22 0.15 -1.26 -4.99 113.70 106.91 1ibj s SER 105 Ca 0.04 -0.30 -0.31 0.00 0.70 0.00 0.00 55.95 56.07 1ibj s SER 105 Cb 0.07 -0.70 -0.09 0.00 -1.71 0.00 0.00 66.02 63.59 1ibj s SER 105 CO 0.59 0.31 1.63 -0.89 1.20 0.00 0.00 173.24 176.08 1ibj s THR 106 N -0.78 2.80 0.23 6.45 2.01 -1.26 -4.93 115.64 120.17 1ibj s THR 106 Ca 0.12 0.43 -0.32 0.00 0.31 0.00 0.00 61.69 62.24 1ibj s THR 106 Cb -0.10 -3.28 -0.12 0.00 0.01 0.00 0.00 72.50 69.01 1ibj s THR 106 CO 0.02 0.02 1.67 -2.65 -0.69 0.00 0.00 174.62 172.99 1ibj n PRO 107 N 4.84 2.71 -3.00 4.92 -0.02 -1.26 -4.94 135.00 138.25 1ibj n PRO 107 Ca 0.15 0.97 -0.41 0.00 -2.02 0.00 0.00 63.50 62.19 1ibj n PRO 107 Cb 0.39 -2.80 -0.05 0.00 -0.02 0.00 0.00 33.50 31.02 1ibj n PRO 107 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1ibj s LEU 108 N 0.65 4.07 -1.18 2.45 2.96 -1.26 -4.53 118.68 121.84 1ibj s LEU 108 Ca 0.72 0.87 -0.10 0.00 -0.22 0.00 0.00 54.13 55.41 1ibj s LEU 108 Cb -0.51 -3.02 0.23 0.00 0.50 0.00 0.00 46.19 43.38 1ibj s LEU 108 CO 0.38 -0.44 1.44 -1.22 -1.32 0.00 0.00 176.35 175.19 1ibj n TYR 109 N 5.84 4.16 -2.61 5.38 4.02 -1.26 -4.93 117.16 127.76 1ibj n TYR 109 Ca 0.02 -3.26 -0.42 0.00 -0.01 0.00 0.00 57.90 54.23 1ibj n TYR 109 Cb 0.48 -1.83 -0.02 0.00 -0.02 0.00 0.00 39.34 37.96 1ibj n TYR 109 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 1ibj s GLN 110 N -0.30 3.78 0.00 -0.72 2.00 -1.26 -4.85 119.66 118.31 1ibj s GLN 110 Ca 0.37 -1.60 -0.25 0.00 -2.00 0.00 0.00 55.36 51.88 1ibj s GLN 110 Cb -0.01 -5.39 0.05 0.00 0.80 0.00 0.00 33.01 28.46 1ibj s GLN 110 CO -0.00 -2.18 0.55 -0.08 -0.50 0.00 0.00 175.29 173.08 1ibj s THR 111 N 4.35 0.02 -0.22 -0.34 -1.32 -1.26 -5.07 115.64 111.80 1ibj s THR 111 Ca 0.48 -0.18 0.05 0.00 -1.21 0.00 0.00 61.69 60.84 1ibj s THR 111 Cb 0.01 -0.92 -0.20 0.00 -1.51 0.00 0.00 72.50 69.88 1ibj s THR 111 CO -0.02 -0.10 -0.05 0.00 -2.21 0.00 0.00 174.62 172.24 1ibj n ALA 112 N 0.74 1.40 -2.45 11.08 0.00 -1.26 -4.60 120.51 125.42 1ibj n ALA 112 Ca -0.19 -1.10 -0.22 0.00 0.00 0.00 0.00 53.44 51.93 1ibj n ALA 112 Cb 0.58 -0.21 -0.10 0.00 0.00 0.00 0.00 19.45 19.72 1ibj n ALA 112 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ibj s THR 113 N -2.52 2.05 0.08 0.00 -4.23 -1.26 -1.00 115.64 108.76 1ibj s THR 113 Ca -0.26 -2.25 0.06 0.00 -1.18 0.00 0.00 61.69 58.06 1ibj s THR 113 Cb 0.08 -2.35 -0.03 0.00 1.34 0.00 0.00 72.50 71.54 1ibj s THR 113 CO 0.68 -0.38 -0.16 -0.36 -0.54 0.00 0.00 174.62 173.87 1ibj s PHE 114 N -2.76 1.36 0.21 3.99 0.40 -1.06 -4.96 117.98 115.17 1ibj s PHE 114 Ca 0.29 -0.45 -0.30 0.00 -0.60 0.00 0.00 56.93 55.87 1ibj s PHE 114 Cb -0.00 -0.76 -0.08 0.00 0.51 0.00 0.00 43.02 42.69 1ibj s PHE 114 CO 0.13 0.09 1.03 0.15 0.70 0.00 0.00 175.22 177.32 1ibj s LYS 115 N -1.78 4.70 0.32 0.44 1.02 -1.26 -4.77 119.74 118.41 1ibj s LYS 115 Ca 0.00 1.64 -0.14 0.00 0.02 0.00 0.00 55.97 57.49 1ibj s LYS 115 Cb -0.10 -3.27 -0.08 0.00 -0.52 0.00 0.00 37.83 33.86 1ibj s LYS 115 CO 0.03 0.26 0.72 -0.65 -0.92 0.00 0.00 175.35 174.79 1ibj s GLN 116 N -0.84 3.95 0.43 1.68 -1.52 -1.26 -4.77 119.66 117.33 1ibj s GLN 116 Ca 0.45 0.60 0.23 0.00 -1.95 0.00 0.00 55.36 54.68 1ibj s GLN 116 Cb -0.28 -2.45 0.90 0.00 -0.22 0.00 0.00 33.01 30.96 1ibj s GLN 116 CO 0.35 0.15 1.83 -1.00 -0.25 0.00 0.00 175.29 176.36 1ibj h PRO 117 N 2.15 0.00 -3.28 2.91 0.13 -1.84 -3.47 132.00 128.60 1ibj h PRO 117 Ca -0.48 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.57 1ibj h PRO 117 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1ibj h PRO 117 CO 0.66 0.26 0.16 -1.54 -0.23 0.00 0.00 178.00 177.31 1ibj s SER 118 N -6.28 0.26 0.35 1.44 1.04 -1.25 -5.04 113.70 104.23 1ibj s SER 118 Ca -0.00 -1.25 0.17 0.00 0.48 0.00 0.00 55.95 55.35 1ibj s SER 118 Cb 0.11 0.81 0.58 0.00 0.10 0.00 0.00 66.02 67.62 1ibj s SER 118 CO 0.65 -1.61 1.69 0.00 0.98 0.00 0.00 173.24 174.95 1ibj h ALA 119 N 2.02 0.95 0.03 5.32 0.00 -2.03 -3.35 119.26 122.20 1ibj h ALA 119 Ca -0.32 -0.38 -0.37 0.00 0.00 0.00 0.00 54.91 53.84 1ibj h ALA 119 Cb 1.25 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.92 1ibj h ALA 119 CO 0.41 0.53 -2.10 -0.89 0.00 0.00 0.00 179.25 177.19 1ibj n ILE 120 N -3.53 1.59 -4.00 0.00 -0.00 -1.26 -5.00 119.36 107.16 1ibj n ILE 120 Ca -0.00 -0.43 -0.28 0.00 -0.00 0.00 0.00 62.75 62.04 1ibj n ILE 120 Cb 0.55 -1.75 -0.05 0.00 -0.00 0.00 0.00 39.64 38.39 1ibj n ILE 120 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.55 174.72 1ibj s GLU 121 N -2.49 3.16 0.75 0.38 1.03 -1.26 -5.12 118.70 115.15 1ibj s GLU 121 Ca -0.31 -0.67 -0.04 0.00 0.03 0.00 0.00 54.97 53.98 1ibj s GLU 121 Cb 0.09 -2.83 0.12 0.00 -0.80 0.00 0.00 34.13 30.71 1ibj s GLU 121 CO 0.62 0.54 1.04 -0.80 -1.33 0.00 0.00 175.26 175.32 1ibj s ASN 122 N -2.88 4.27 0.48 0.83 -0.87 -1.26 -3.77 114.94 111.73 1ibj s ASN 122 Ca 0.32 -0.08 0.04 0.00 -1.57 0.00 0.00 52.86 51.57 1ibj s ASN 122 Cb -0.11 -0.32 0.04 0.00 -0.02 0.00 0.00 41.25 40.83 1ibj s ASN 122 CO 0.26 -1.92 0.34 0.61 -2.57 0.00 0.00 177.10 173.82 1ibj n GLY 123 N -2.98 2.83 0.39 0.66 0.00 -1.26 -4.69 105.19 100.13 1ibj n GLY 123 Ca 0.13 -2.29 0.19 0.00 0.00 0.00 0.00 46.02 44.05 1ibj n GLY 123 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ibj h PRO 124 N 0.00 0.26 -5.19 1.61 0.11 -2.00 -3.41 132.00 123.39 1ibj h PRO 124 Ca -0.31 -0.02 -0.36 0.00 0.11 0.00 0.00 66.00 65.43 1ibj h PRO 124 Cb 1.12 -0.06 -0.15 0.00 0.11 0.00 0.00 31.00 32.02 1ibj h PRO 124 CO 0.49 0.17 -0.72 0.71 -0.21 0.00 0.00 178.00 178.44 1ibj s TYR 125 N -5.27 1.37 0.00 0.65 1.51 -1.26 -5.03 117.35 109.32 1ibj s TYR 125 Ca -0.07 -0.72 0.00 0.00 -1.01 0.00 0.00 57.07 55.27 1ibj s TYR 125 Cb 0.21 -0.68 0.00 0.00 -0.11 0.00 0.00 41.96 41.38 1ibj s TYR 125 CO 0.76 0.15 0.00 -0.40 -1.11 0.00 0.00 175.55 174.95 1ibj n ASP 126 N -0.24 0.00 -3.66 2.29 3.85 -1.26 -4.76 116.55 112.77 1ibj n ASP 126 Ca -0.10 0.00 -0.06 0.00 -0.71 0.00 0.00 54.79 53.92 1ibj n ASP 126 Cb 0.61 0.00 -0.07 0.00 -1.35 0.00 0.00 41.12 40.30 1ibj n ASP 126 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.20 175.72 1ibj s TYR 127 N -1.00 -1.00 0.63 2.11 5.04 -1.26 -2.55 117.35 119.32 1ibj s TYR 127 Ca 0.00 1.87 0.27 0.00 -2.44 0.00 0.00 57.07 56.77 1ibj s TYR 127 Cb 0.00 0.53 1.44 0.00 0.35 0.00 0.00 41.96 44.28 1ibj s TYR 127 CO 0.00 -0.53 1.83 1.15 -1.34 0.00 0.00 175.55 176.66 1ibj h THR 128 N 5.83 0.14 -0.04 4.34 2.02 -1.15 1.48 112.91 125.54 1ibj h THR 128 Ca -0.22 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 66.81 1ibj h THR 128 Cb 1.14 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 1ibj h THR 128 CO 0.15 0.00 -0.66 -0.09 0.37 0.00 0.00 175.52 175.29 1ibj h ARG 129 N 0.00 0.16 0.13 6.66 2.43 -1.95 -3.18 114.38 118.63 1ibj h ARG 129 Ca 0.10 -0.13 -0.29 0.00 -0.81 0.00 0.00 59.98 58.85 1ibj h ARG 129 Cb 1.01 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1ibj h ARG 129 CO -0.00 0.76 -1.33 0.77 -1.51 0.00 0.00 179.97 178.66 1ibj h SER 130 N 0.12 0.43 0.00 -3.80 0.02 0.17 -3.42 113.55 107.06 1ibj h SER 130 Ca -0.01 -0.49 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1ibj h SER 130 Cb 1.18 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.58 1ibj h SER 130 CO 0.10 1.39 0.00 0.61 -1.14 0.00 0.00 176.83 177.79 1ibj n GLY 131 N 1.57 1.45 3.41 -3.77 0.00 -0.61 -4.98 105.19 102.27 1ibj n GLY 131 Ca -0.11 -0.59 -0.14 0.00 0.00 0.00 0.00 46.02 45.19 1ibj n GLY 131 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ibj s ASN 132 N 0.00 -0.53 0.24 1.61 3.84 -1.26 -3.70 114.94 115.13 1ibj s ASN 132 Ca 0.00 1.01 -0.05 0.00 0.21 0.00 0.00 52.86 54.02 1ibj s ASN 132 Cb 0.00 1.02 0.35 0.00 -0.55 0.00 0.00 41.25 42.08 1ibj s ASN 132 CO 0.00 -0.19 1.82 -0.65 -2.79 0.00 0.00 177.10 175.28 1ibj h PRO 133 N 5.25 0.78 -0.31 0.43 0.11 -1.96 -0.14 132.00 136.16 1ibj h PRO 133 Ca -0.28 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.76 1ibj h PRO 133 Cb 1.17 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1ibj h PRO 133 CO 0.19 0.52 0.10 1.15 -0.21 0.00 0.00 178.00 179.74 1ibj h THR 134 N 0.80 1.20 -0.05 -1.15 2.02 -1.90 -1.43 112.91 112.40 1ibj h THR 134 Ca 0.37 -0.66 -0.08 0.00 0.77 0.00 0.00 66.41 66.81 1ibj h THR 134 Cb 0.29 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 1ibj h THR 134 CO -0.22 0.22 -0.35 -0.09 0.37 0.00 0.00 175.52 175.45 1ibj h ARG 135 N 0.34 0.11 -0.43 6.66 2.43 -1.80 -2.49 114.38 119.20 1ibj h ARG 135 Ca 0.10 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.13 1ibj h ARG 135 Cb 0.25 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1ibj h ARG 135 CO -0.00 0.44 -0.12 -0.44 -1.51 0.00 0.00 179.97 178.34 1ibj h ASP 136 N 0.09 0.86 -0.47 -3.80 3.32 -0.85 0.58 116.42 116.15 1ibj h ASP 136 Ca 0.01 -0.37 0.04 0.00 0.02 0.00 0.00 57.03 56.73 1ibj h ASP 136 Cb 0.66 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 1ibj h ASP 136 CO 0.05 1.03 0.31 0.00 -1.72 0.00 0.00 179.24 178.91 1ibj h ALA 137 N 0.85 1.84 0.14 3.45 0.00 -0.80 -1.06 119.26 123.68 1ibj h ALA 137 Ca 0.11 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.74 1ibj h ALA 137 Cb 0.67 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1ibj h ALA 137 CO 0.05 0.10 -1.23 1.25 0.00 0.00 0.00 179.25 179.41 1ibj h LEU 138 N 0.48 0.47 -1.83 0.00 5.85 -1.30 -2.85 115.31 116.13 1ibj h LEU 138 Ca 0.19 -0.90 0.02 0.00 0.84 0.00 0.00 57.88 58.03 1ibj h LEU 138 Cb 0.17 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1ibj h LEU 138 CO -0.05 1.56 0.15 -0.33 -0.34 0.00 0.00 178.44 179.43 1ibj h GLU 139 N -0.26 0.23 -0.08 1.25 5.08 -0.72 -1.22 114.58 118.86 1ibj h GLU 139 Ca -0.25 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.01 1ibj h GLU 139 Cb 1.78 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.98 1ibj h GLU 139 CO 0.12 0.15 -0.29 1.03 -1.00 0.00 0.00 179.01 179.02 1ibj h SER 140 N 0.23 0.39 -0.22 1.42 0.87 -1.27 -2.35 113.55 112.62 1ibj h SER 140 Ca 0.09 -0.62 0.02 0.00 -1.23 0.00 0.00 61.79 60.05 1ibj h SER 140 Cb 0.06 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 1ibj h SER 140 CO -0.02 0.95 0.07 0.25 -0.53 0.00 0.00 176.83 177.55 1ibj h LEU 141 N -0.14 0.07 -1.82 2.23 5.85 -1.20 -1.83 115.31 118.47 1ibj h LEU 141 Ca -0.01 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.81 1ibj h LEU 141 Cb 0.92 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 1ibj h LEU 141 CO 0.06 0.07 0.28 -0.07 -0.34 0.00 0.00 178.44 178.43 1ibj h LEU 142 N 0.17 0.19 -0.15 2.25 3.38 -1.26 0.95 115.31 120.83 1ibj h LEU 142 Ca 0.10 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.91 1ibj h LEU 142 Cb 0.07 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 40.79 1ibj h LEU 142 CO -0.10 0.12 -0.54 0.00 0.09 0.00 0.00 178.44 178.01 1ibj h ALA 143 N 1.79 0.26 -0.22 1.53 0.00 -1.00 -2.52 119.26 119.11 1ibj h ALA 143 Ca 0.18 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 1ibj h ALA 143 Cb 0.45 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1ibj h ALA 143 CO -0.03 0.47 0.06 0.87 0.00 0.00 0.00 179.25 180.61 1ibj h LYS 144 N 0.28 0.34 -0.98 0.00 1.57 -0.35 -0.50 116.57 116.93 1ibj h LYS 144 Ca -0.03 -0.08 0.09 0.00 -1.87 0.00 0.00 60.65 58.77 1ibj h LYS 144 Cb 1.17 -0.05 -0.08 0.00 0.08 0.00 0.00 32.23 33.35 1ibj h LYS 144 CO 0.11 0.45 0.62 -0.07 -0.57 0.00 0.00 179.45 179.99 1ibj h LEU 145 N 0.17 0.94 -1.47 2.94 3.38 -0.89 -2.59 115.31 117.79 1ibj h LEU 145 Ca 0.07 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1ibj h LEU 145 Cb 0.26 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1ibj h LEU 145 CO -0.00 0.55 0.00 0.47 0.09 0.00 0.00 178.44 179.55 1ibj n ASP 146 N -4.59 2.24 -3.69 -0.43 9.92 -0.95 -4.93 116.55 114.12 1ibj n ASP 146 Ca 0.17 -1.76 -0.23 0.00 -0.53 0.00 0.00 54.79 52.44 1ibj n ASP 146 Cb 0.27 -0.08 0.05 0.00 -0.64 0.00 0.00 41.12 40.72 1ibj n ASP 146 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1ibj n LYS 147 N 0.72 -5.63 -4.11 -1.24 4.76 -0.32 -4.64 118.16 107.70 1ibj n LYS 147 Ca 0.17 0.67 -0.22 0.00 -2.87 0.00 0.00 58.31 56.06 1ibj n LYS 147 Cb 0.45 -5.43 -0.05 0.00 -1.84 0.00 0.00 35.03 28.16 1ibj n LYS 147 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ibj s ALA 148 N -3.51 3.50 0.09 7.82 0.00 -0.49 -4.93 121.76 124.24 1ibj s ALA 148 Ca 0.20 -1.60 -0.15 0.00 0.00 0.00 0.00 51.96 50.42 1ibj s ALA 148 Cb -0.10 -1.03 -0.12 0.00 0.00 0.00 0.00 23.12 21.87 1ibj s ALA 148 CO 0.79 0.18 1.36 -0.44 0.00 0.00 0.00 175.76 177.65 1ibj h ASP 149 N 1.57 0.79 -5.02 0.00 3.32 -0.68 -3.43 116.42 112.97 1ibj h ASP 149 Ca -0.46 -0.54 -0.09 0.00 0.02 0.00 0.00 57.03 55.96 1ibj h ASP 149 Cb 1.25 -0.23 -0.18 0.00 0.22 0.00 0.00 39.33 40.39 1ibj h ASP 149 CO 0.61 1.19 -0.13 -0.13 -1.72 0.00 0.00 179.24 179.06 1ibj s ARG 150 N -4.07 0.87 0.17 3.56 0.52 -1.16 -5.05 118.95 113.78 1ibj s ARG 150 Ca -0.12 -0.28 0.08 0.00 -0.52 0.00 0.00 55.73 54.88 1ibj s ARG 150 Cb 0.08 0.39 -0.04 0.00 0.52 0.00 0.00 34.95 35.90 1ibj s ARG 150 CO 0.85 -0.28 -0.16 0.00 0.02 0.00 0.00 175.30 175.73 1ibj s ALA 151 N -2.12 1.88 0.00 2.13 0.00 -1.26 -1.18 121.76 121.22 1ibj s ALA 151 Ca -0.08 -1.50 0.01 0.00 0.00 0.00 0.00 51.96 50.40 1ibj s ALA 151 Cb -0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.97 1ibj s ALA 151 CO 0.00 0.15 -0.05 -0.06 0.00 0.00 0.00 175.76 175.80 1ibj s PHE 152 N -2.37 0.43 -0.15 0.00 0.40 0.20 -4.84 117.98 111.64 1ibj s PHE 152 Ca 0.16 -0.14 -0.03 0.00 -0.60 0.00 0.00 56.93 56.32 1ibj s PHE 152 Cb -0.04 -0.27 -0.02 0.00 0.51 0.00 0.00 43.02 43.19 1ibj s PHE 152 CO 0.06 -0.02 -0.06 0.00 0.70 0.00 0.00 175.22 175.90 1ibj s PHE 154 N 0.39 2.44 0.60 0.00 0.40 0.52 -1.01 117.98 121.32 1ibj s PHE 154 Ca -0.05 -0.29 0.28 0.00 -0.60 0.00 0.00 56.93 56.26 1ibj s PHE 154 Cb -0.15 -1.11 1.25 0.00 0.51 0.00 0.00 43.02 43.53 1ibj s PHE 154 CO 0.03 0.62 1.65 0.00 0.70 0.00 0.00 175.22 178.23 1ibj h THR 155 N 2.44 0.19 -2.11 0.64 1.03 -1.06 -0.92 112.91 113.13 1ibj h THR 155 Ca -0.43 0.00 0.22 0.00 -0.01 0.00 0.00 66.41 66.19 1ibj h THR 155 Cb 1.24 0.37 -0.09 0.00 -1.07 0.00 0.00 68.15 68.60 1ibj h THR 155 CO 0.57 0.00 0.58 -0.94 -0.01 0.00 0.00 175.52 175.72 1ibj s SER 156 N -4.45 -0.14 0.12 0.00 1.04 -1.26 -3.72 113.70 105.30 1ibj s SER 156 Ca -0.03 -0.35 -0.28 0.00 0.48 0.00 0.00 55.95 55.77 1ibj s SER 156 Cb 0.14 0.40 -0.06 0.00 0.10 0.00 0.00 66.02 66.60 1ibj s SER 156 CO 0.50 -0.75 1.61 1.23 0.98 0.00 0.00 173.24 176.80 1ibj h GLY 157 N 2.00 -0.62 0.72 7.32 0.00 -1.81 -2.34 103.07 108.34 1ibj h GLY 157 Ca -0.26 0.43 0.12 0.00 0.00 0.00 0.00 47.33 47.62 1ibj h GLY 157 CO 0.27 -0.24 0.52 -0.33 0.00 0.00 0.00 176.54 176.76 1ibj h MET 158 N -0.52 0.58 -0.74 4.80 2.86 -1.94 -0.86 114.93 119.13 1ibj h MET 158 Ca 0.05 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 1ibj h MET 158 Cb 0.59 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 1ibj h MET 158 CO -0.28 0.39 0.31 0.00 1.06 0.00 0.00 176.91 178.39 1ibj h ALA 159 N 1.62 1.16 -0.39 6.32 0.00 -1.82 0.25 119.26 126.40 1ibj h ALA 159 Ca 0.38 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 1ibj h ALA 159 Cb 0.65 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1ibj h ALA 159 CO -0.15 0.62 -0.07 0.00 0.00 0.00 0.00 179.25 179.65 1ibj h ALA 160 N 1.27 0.54 -0.18 0.00 0.00 -0.85 0.42 119.26 120.46 1ibj h ALA 160 Ca 0.25 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1ibj h ALA 160 Cb 0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1ibj h ALA 160 CO -0.02 0.38 -0.37 -0.07 0.00 0.00 0.00 179.25 179.17 1ibj h LEU 161 N 0.55 0.41 -0.60 0.00 3.38 -0.93 -1.97 115.31 116.14 1ibj h LEU 161 Ca 0.10 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.78 1ibj h LEU 161 Cb 0.57 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1ibj h LEU 161 CO 0.03 0.75 -0.29 -1.28 0.09 0.00 0.00 178.44 177.74 1ibj h SER 162 N 0.34 0.82 0.01 -0.43 0.87 -0.22 -2.29 113.55 112.64 1ibj h SER 162 Ca 0.04 -0.33 -0.00 0.00 -1.23 0.00 0.00 61.79 60.27 1ibj h SER 162 Cb 0.80 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.53 1ibj h SER 162 CO 0.06 1.06 -0.00 0.00 -0.53 0.00 0.00 176.83 177.42 1ibj h ALA 163 N 0.99 -0.01 -0.86 6.23 0.00 -0.46 -2.35 119.26 122.81 1ibj h ALA 163 Ca 0.08 -0.19 0.22 0.00 0.00 0.00 0.00 54.91 55.02 1ibj h ALA 163 Cb 0.83 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.48 1ibj h ALA 163 CO 0.07 -0.32 0.19 0.28 0.00 0.00 0.00 179.25 179.47 1ibj h VAL 164 N -0.38 0.32 -0.59 0.00 2.07 -1.31 0.65 116.25 117.01 1ibj h VAL 164 Ca -0.00 -0.07 0.07 0.00 0.82 0.00 0.00 66.70 67.52 1ibj h VAL 164 Cb 0.38 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 1ibj h VAL 164 CO 0.00 0.03 0.39 0.74 0.02 0.00 0.00 177.57 178.76 1ibj h THR 165 N 0.19 0.97 -0.02 2.57 2.02 -1.21 -1.99 112.91 115.44 1ibj h THR 165 Ca 0.53 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.53 1ibj h THR 165 Cb 1.04 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 1ibj h THR 165 CO -0.66 0.09 0.00 1.41 0.37 0.00 0.00 175.52 176.74 1ibj n HIS 166 N -4.48 0.06 -0.00 3.16 8.25 0.23 -2.57 115.22 119.86 1ibj n HIS 166 Ca 0.09 -0.02 0.07 0.00 -0.26 0.00 0.00 57.72 57.59 1ibj n HIS 166 Cb 0.27 -0.05 -0.13 0.00 1.12 0.00 0.00 29.99 31.19 1ibj n HIS 166 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1ibj n LEU 167 N -0.22 0.22 -4.49 2.41 7.94 -0.75 -4.85 117.00 117.26 1ibj n LEU 167 Ca 0.01 0.09 -0.42 0.00 -1.11 0.00 0.00 56.01 54.58 1ibj n LEU 167 Cb 0.14 0.08 -0.10 0.00 0.53 0.00 0.00 43.42 44.07 1ibj n LEU 167 CO 0.01 0.06 -0.04 -0.63 -1.11 0.00 0.00 177.39 175.68 1ibj s ILE 168 N -3.27 5.23 1.28 1.96 1.01 -1.06 -5.07 121.20 121.27 1ibj s ILE 168 Ca -0.07 -0.41 -0.19 0.00 0.00 0.00 0.00 60.65 59.98 1ibj s ILE 168 Cb 0.11 -3.88 0.32 0.00 0.01 0.00 0.00 42.46 39.02 1ibj s ILE 168 CO 0.87 -0.23 1.01 -0.54 0.00 0.00 0.00 174.94 176.05 1ibj s LYS 169 N 1.81 -1.81 0.03 2.79 1.02 -1.26 -4.89 119.74 117.43 1ibj s LYS 169 Ca 0.07 0.25 -0.34 0.00 0.02 0.00 0.00 55.97 55.98 1ibj s LYS 169 Cb -0.18 -1.50 -0.13 0.00 -0.52 0.00 0.00 37.83 35.51 1ibj s LYS 169 CO 0.11 -4.17 1.75 0.27 -0.92 0.00 0.00 175.35 172.39 1ibj n ASN 170 N -5.14 3.32 -0.73 2.83 6.94 -1.26 -2.64 115.26 118.58 1ibj n ASN 170 Ca 0.10 1.02 -0.09 0.00 -0.02 0.00 0.00 54.58 55.58 1ibj n ASN 170 Cb 0.58 -1.40 -0.04 0.00 -2.36 0.00 0.00 39.78 36.56 1ibj n ASN 170 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ibj n GLY 171 N 3.96 1.10 2.36 4.83 0.00 0.53 -4.89 105.19 113.07 1ibj n GLY 171 Ca 0.20 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 1ibj n GLY 171 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ibj n GLU 172 N -2.71 0.36 -5.18 1.61 1.02 -1.08 -4.81 120.64 109.85 1ibj n GLU 172 Ca -0.09 -1.73 -0.30 0.00 -0.02 0.00 0.00 57.16 55.02 1ibj n GLU 172 Cb 0.31 -0.32 -0.16 0.00 -0.02 0.00 0.00 31.44 31.25 1ibj n GLU 172 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1ibj s GLU 173 N -3.89 2.03 -0.17 3.49 2.12 -0.43 -0.28 118.70 121.57 1ibj s GLU 173 Ca 0.39 -0.84 0.01 0.00 0.36 0.00 0.00 54.97 54.88 1ibj s GLU 173 Cb -0.02 -1.90 0.02 0.00 0.26 0.00 0.00 34.13 32.49 1ibj s GLU 173 CO 0.26 0.47 -0.16 0.42 -0.54 0.00 0.00 175.26 175.71 1ibj s ILE 174 N -0.45 1.81 -0.27 -3.70 1.01 0.21 -1.15 121.20 118.65 1ibj s ILE 174 Ca 0.06 -0.82 -0.07 0.00 0.00 0.00 0.00 60.65 59.82 1ibj s ILE 174 Cb -0.10 -1.68 -0.01 0.00 0.01 0.00 0.00 42.46 40.68 1ibj s ILE 174 CO 0.00 0.46 0.08 -0.69 0.00 0.00 0.00 174.94 174.79 1ibj s VAL 175 N 1.38 4.14 -0.04 2.92 1.01 -0.13 -0.64 120.40 129.05 1ibj s VAL 175 Ca 0.04 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1ibj s VAL 175 Cb -0.13 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.24 1ibj s VAL 175 CO -0.11 0.21 -0.02 0.00 0.00 0.00 0.00 175.10 175.17 1ibj s ALA 176 N 1.56 0.48 1.00 5.51 0.00 -0.85 -0.95 121.76 128.50 1ibj s ALA 176 Ca 0.05 0.07 -0.23 0.00 0.00 0.00 0.00 51.96 51.85 1ibj s ALA 176 Cb -0.16 -0.36 -0.18 0.00 0.00 0.00 0.00 23.12 22.43 1ibj s ALA 176 CO 0.03 -0.03 -1.20 0.41 0.00 0.00 0.00 175.76 174.97 1ibj n GLY 177 N 4.06 -3.81 0.10 0.00 0.00 -0.97 -2.64 105.19 101.94 1ibj n GLY 177 Ca -0.26 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.17 1ibj n GLY 177 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ibj h ASP 178 N -1.00 0.27 -1.00 1.61 3.32 0.10 -3.37 116.42 116.36 1ibj h ASP 178 Ca -0.41 -0.41 0.03 0.00 0.02 0.00 0.00 57.03 56.25 1ibj h ASP 178 Cb 1.35 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 40.75 1ibj h ASP 178 CO 0.22 1.35 0.66 -2.24 -1.72 0.00 0.00 179.24 177.50 1ibj h ASP 179 N 0.05 1.11 -0.08 6.45 3.04 -1.91 -3.47 116.42 121.61 1ibj h ASP 179 Ca -0.24 -0.02 -0.07 0.00 -3.24 0.00 0.00 57.03 53.46 1ibj h ASP 179 Cb 1.99 -0.26 0.00 0.00 -1.04 0.00 0.00 39.33 40.02 1ibj h ASP 179 CO 0.13 0.77 0.05 0.52 -2.04 0.00 0.00 179.24 178.67 1ibj n VAL 180 N -4.43 0.00 -0.86 4.15 0.31 -1.26 -4.73 118.33 111.52 1ibj n VAL 180 Ca 0.13 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.17 1ibj n VAL 180 Cb 0.07 -0.03 -0.01 0.00 -0.91 0.00 0.00 33.84 32.95 1ibj n VAL 180 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ibj n TYR 181 N 0.29 -0.69 -0.09 3.52 9.36 -1.26 -4.25 117.16 124.05 1ibj n TYR 181 Ca 0.02 0.53 -0.02 0.00 3.32 0.00 0.00 57.90 61.75 1ibj n TYR 181 Cb -0.00 -1.20 -0.02 0.00 -0.63 0.00 0.00 39.34 37.49 1ibj n TYR 181 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1ibj n GLY 182 N 1.34 -2.48 0.36 2.98 0.00 -1.26 0.07 105.19 106.20 1ibj n GLY 182 Ca 0.10 0.61 0.17 0.00 0.00 0.00 0.00 46.02 46.89 1ibj n GLY 182 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ibj h GLY 183 N 0.00 0.19 1.51 -0.02 0.00 -2.00 0.15 103.07 102.91 1ibj h GLY 183 Ca 0.03 -0.05 -0.18 0.00 0.00 0.00 0.00 47.33 47.13 1ibj h GLY 183 CO -0.19 0.03 -0.66 1.76 0.00 0.00 0.00 176.54 177.47 1ibj h SER 184 N 0.13 0.57 0.88 0.19 0.02 -1.08 -1.78 113.55 112.48 1ibj h SER 184 Ca 0.24 -0.34 -0.04 0.00 -0.84 0.00 0.00 61.79 60.80 1ibj h SER 184 Cb 0.78 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.16 1ibj h SER 184 CO -0.03 1.07 -0.46 -0.78 -1.14 0.00 0.00 176.83 175.49 1ibj h ASP 185 N 0.35 -1.12 -0.66 3.07 -0.00 0.24 0.13 116.42 118.43 1ibj h ASP 185 Ca -0.02 0.05 0.14 0.00 -0.00 0.00 0.00 57.03 57.20 1ibj h ASP 185 Cb 1.23 0.30 -0.11 0.00 -0.00 0.00 0.00 39.33 40.75 1ibj h ASP 185 CO 0.12 -0.76 0.02 -0.09 -0.00 0.00 0.00 179.24 178.53 1ibj h ARG 186 N -1.23 0.13 -0.52 0.28 2.43 -1.20 0.13 114.38 114.38 1ibj h ARG 186 Ca -0.12 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.02 1ibj h ARG 186 Cb 0.96 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.46 1ibj h ARG 186 CO 0.17 0.08 0.24 1.25 -1.51 0.00 0.00 179.97 180.21 1ibj h LEU 187 N 0.13 0.66 -0.36 3.80 5.85 -1.07 0.78 115.31 125.10 1ibj h LEU 187 Ca 0.35 -0.07 -0.18 0.00 0.84 0.00 0.00 57.88 58.82 1ibj h LEU 187 Cb 0.58 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1ibj h LEU 187 CO -0.55 0.58 -0.82 -0.07 -0.34 0.00 0.00 178.44 177.23 1ibj h LEU 188 N 0.74 0.17 0.00 2.25 3.38 0.17 -1.72 115.31 120.29 1ibj h LEU 188 Ca 0.18 -0.13 -0.18 0.00 0.09 0.00 0.00 57.88 57.84 1ibj h LEU 188 Cb 0.10 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1ibj h LEU 188 CO -0.02 0.91 -1.96 -1.54 0.09 0.00 0.00 178.44 175.92 1ibj n SER 189 N -3.66 0.26 -0.00 -0.43 3.41 0.11 -4.49 113.62 108.83 1ibj n SER 189 Ca -0.02 0.11 0.02 0.00 -0.26 0.00 0.00 58.87 58.72 1ibj n SER 189 Cb 0.77 1.08 -0.02 0.00 -0.26 0.00 0.00 64.21 65.78 1ibj n SER 189 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ibj n GLN 190 N -2.63 3.06 -0.05 4.33 6.02 0.24 -4.67 117.38 123.69 1ibj n GLN 190 Ca -0.16 -0.02 -0.08 0.00 -0.01 0.00 0.00 57.00 56.73 1ibj n GLN 190 Cb 0.86 -0.87 -0.04 0.00 1.02 0.00 0.00 30.24 31.21 1ibj n GLN 190 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1ibj n VAL 191 N -1.35 0.57 -0.27 5.09 0.31 -1.10 -4.55 118.33 117.03 1ibj n VAL 191 Ca 0.00 -0.20 0.01 0.00 -0.01 0.00 0.00 64.34 64.14 1ibj n VAL 191 Cb 0.08 -1.04 0.22 0.00 -0.91 0.00 0.00 33.84 32.19 1ibj n VAL 191 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1ibj h VAL 192 N -0.09 1.17 -0.72 2.52 2.07 -1.54 -2.36 116.25 117.29 1ibj h VAL 192 Ca -0.23 -0.37 0.04 0.00 0.82 0.00 0.00 66.70 66.96 1ibj h VAL 192 Cb 1.32 -0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1ibj h VAL 192 CO -0.07 0.20 0.43 -0.65 0.02 0.00 0.00 177.57 177.50 1ibj h PRO 193 N 1.08 0.80 0.00 1.57 0.11 -1.79 -2.12 132.00 131.64 1ibj h PRO 193 Ca 0.32 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.38 1ibj h PRO 193 Cb -0.03 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 30.90 1ibj h PRO 193 CO -0.09 0.53 0.57 0.00 -0.21 0.00 0.00 178.00 178.80 1ibj h ARG 194 N 0.82 0.00 -0.40 1.05 3.08 -1.66 0.62 114.38 117.89 1ibj h ARG 194 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1ibj h ARG 194 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1ibj h ARG 194 CO -0.14 0.00 0.00 0.43 -1.07 0.00 0.00 179.97 179.19 1ibj n SER 195 N -2.24 3.45 0.00 7.04 7.64 -0.80 -4.93 113.62 123.78 1ibj n SER 195 Ca -0.01 -1.99 0.00 0.00 1.01 0.00 0.00 58.87 57.88 1ibj n SER 195 Cb 0.59 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 1ibj n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ibj n GLY 196 N 1.51 0.61 3.73 0.23 0.00 0.22 -3.70 105.19 107.79 1ibj n GLY 196 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1ibj n GLY 196 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ibj s VAL 197 N -2.63 4.46 -0.15 1.61 1.01 -1.24 -0.35 120.40 123.11 1ibj s VAL 197 Ca 0.00 2.07 -0.08 0.00 0.00 0.00 0.00 61.98 63.96 1ibj s VAL 197 Cb 0.00 -4.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 1ibj s VAL 197 CO 0.00 0.34 0.14 -0.69 0.00 0.00 0.00 175.10 174.89 1ibj s VAL 198 N -0.13 5.47 -0.16 2.92 1.01 0.62 -4.18 120.40 125.95 1ibj s VAL 198 Ca 0.46 0.21 0.01 0.00 0.00 0.00 0.00 61.98 62.67 1ibj s VAL 198 Cb -0.24 -3.43 0.01 0.00 0.00 0.00 0.00 36.38 32.73 1ibj s VAL 198 CO 0.30 0.56 -0.19 -0.69 0.00 0.00 0.00 175.10 175.07 1ibj s VAL 199 N -0.54 2.21 -0.11 2.92 1.01 -1.26 0.64 120.40 125.27 1ibj s VAL 199 Ca 0.13 -0.91 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 1ibj s VAL 199 Cb -0.12 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 1ibj s VAL 199 CO 0.02 0.53 -0.03 -0.54 0.00 0.00 0.00 175.10 175.08 1ibj s LYS 200 N 1.03 3.21 -0.15 2.72 1.02 0.19 -4.98 119.74 122.77 1ibj s LYS 200 Ca -0.02 -0.49 -0.04 0.00 0.02 0.00 0.00 55.97 55.44 1ibj s LYS 200 Cb -0.14 -2.79 -0.03 0.00 -0.52 0.00 0.00 37.83 34.34 1ibj s LYS 200 CO -0.06 0.51 -0.01 1.03 -0.92 0.00 0.00 175.35 175.90 1ibj s ARG 201 N -0.35 3.68 0.13 1.68 1.81 -1.26 -2.01 118.95 122.63 1ibj s ARG 201 Ca 0.06 -0.46 0.04 0.00 -1.72 0.00 0.00 55.73 53.65 1ibj s ARG 201 Cb -0.12 -2.98 -0.04 0.00 -0.45 0.00 0.00 34.95 31.35 1ibj s ARG 201 CO 0.02 0.30 -0.09 0.08 -0.68 0.00 0.00 175.30 174.93 1ibj s VAL 202 N 0.23 1.02 -1.15 3.52 1.01 -1.08 -4.86 120.40 119.08 1ibj s VAL 202 Ca -0.00 -1.96 -0.12 0.00 0.00 0.00 0.00 61.98 59.90 1ibj s VAL 202 Cb -0.13 -1.72 0.21 0.00 0.00 0.00 0.00 36.38 34.73 1ibj s VAL 202 CO 0.02 -0.74 1.28 0.21 0.00 0.00 0.00 175.10 175.87 1ibj s ASN 203 N -3.01 7.15 0.00 3.32 3.04 -1.26 0.15 114.94 124.33 1ibj s ASN 203 Ca 0.14 -3.19 0.00 0.00 0.04 0.00 0.00 52.86 49.85 1ibj s ASN 203 Cb 0.02 -2.32 0.00 0.00 -1.54 0.00 0.00 41.25 37.41 1ibj s ASN 203 CO -0.01 -0.58 0.37 0.35 -3.04 0.00 0.00 177.10 174.20 1ibj n THR 204 N 3.90 0.25 0.32 -5.21 -2.24 -1.26 -1.02 114.28 109.02 1ibj n THR 204 Ca 0.31 0.24 0.12 0.00 -2.27 0.00 0.00 64.05 62.45 1ibj n THR 204 Cb 0.42 -1.24 0.18 0.00 -2.10 0.00 0.00 70.33 67.59 1ibj n THR 204 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1ibj h THR 205 N 0.00 0.00 -3.58 4.28 1.35 -1.90 -3.41 112.91 109.64 1ibj h THR 205 Ca 0.00 -0.83 -0.75 0.00 -0.55 0.00 0.00 66.41 64.28 1ibj h THR 205 Cb 0.36 1.68 -0.31 0.00 -1.73 0.00 0.00 68.15 68.15 1ibj h THR 205 CO 0.00 0.00 0.02 -0.54 -0.25 0.00 0.00 175.52 174.75 1ibj s LYS 206 N -3.22 3.41 0.28 4.72 1.02 -0.19 -4.90 119.74 120.87 1ibj s LYS 206 Ca 0.06 -2.85 0.18 0.00 0.02 0.00 0.00 55.97 53.38 1ibj s LYS 206 Cb 0.08 -4.17 0.98 0.00 -0.52 0.00 0.00 37.83 34.20 1ibj s LYS 206 CO 0.69 -1.25 1.09 1.28 -0.92 0.00 0.00 175.35 176.24 1ibj n LEU 207 N 3.16 0.20 0.32 3.17 4.77 -1.26 -0.43 117.00 126.93 1ibj n LEU 207 Ca 0.17 1.07 -0.16 0.00 -0.03 0.00 0.00 56.01 57.05 1ibj n LEU 207 Cb 0.41 -0.52 -0.08 0.00 -2.33 0.00 0.00 43.42 40.89 1ibj n LEU 207 CO 0.37 -1.18 0.53 0.44 -1.33 0.00 0.00 177.39 176.21 1ibj h ASP 208 N 0.00 -1.09 -0.70 -1.43 3.32 -1.95 0.49 116.42 115.05 1ibj h ASP 208 Ca 0.60 0.07 0.13 0.00 0.02 0.00 0.00 57.03 57.85 1ibj h ASP 208 Cb 1.74 0.33 -0.13 0.00 0.22 0.00 0.00 39.33 41.49 1ibj h ASP 208 CO -0.44 -0.61 -0.27 -0.33 -1.72 0.00 0.00 179.24 175.87 1ibj h GLU 209 N -0.96 -0.07 -0.31 3.56 5.08 -1.10 1.44 114.58 122.23 1ibj h GLU 209 Ca -0.08 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.35 1ibj h GLU 209 Cb 0.79 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.99 1ibj h GLU 209 CO 0.04 -0.05 -0.11 0.28 -1.00 0.00 0.00 179.01 178.18 1ibj h VAL 210 N -0.07 0.62 0.55 3.13 2.07 -1.25 0.86 116.25 122.16 1ibj h VAL 210 Ca 0.30 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.81 1ibj h VAL 210 Cb 0.55 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1ibj h VAL 210 CO -0.75 0.00 -0.48 0.00 0.02 0.00 0.00 177.57 176.36 1ibj h ALA 211 N 1.23 -1.17 -0.94 1.67 0.00 0.43 -1.79 119.26 118.69 1ibj h ALA 211 Ca 0.15 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 55.09 1ibj h ALA 211 Cb 0.28 0.69 -0.12 0.00 0.00 0.00 0.00 17.79 18.64 1ibj h ALA 211 CO -0.34 -1.18 0.49 0.00 0.00 0.00 0.00 179.25 178.22 1ibj h ALA 212 N -1.01 1.57 0.00 0.00 0.00 0.24 -2.11 119.26 117.95 1ibj h ALA 212 Ca -0.07 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1ibj h ALA 212 Cb 0.86 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1ibj h ALA 212 CO -0.02 -0.27 -0.22 0.00 0.00 0.00 0.00 179.25 178.74 1ibj h ALA 213 N 1.70 0.89 -1.71 0.00 0.00 0.11 -3.43 119.26 116.82 1ibj h ALA 213 Ca 0.58 -0.20 -0.64 0.00 0.00 0.00 0.00 54.91 54.66 1ibj h ALA 213 Cb 1.07 -0.03 -0.15 0.00 0.00 0.00 0.00 17.79 18.67 1ibj h ALA 213 CO -0.48 0.27 0.47 0.42 0.00 0.00 0.00 179.25 179.93 1ibj s ILE 214 N -3.26 4.41 0.00 0.00 1.01 -0.70 -4.97 121.20 117.68 1ibj s ILE 214 Ca 0.04 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 60.26 1ibj s ILE 214 Cb 0.07 -4.64 0.00 0.00 0.01 0.00 0.00 42.46 37.90 1ibj s ILE 214 CO 0.68 -1.38 0.00 0.61 0.00 0.00 0.00 174.94 174.85 1ibj n GLY 215 N 5.31 1.86 0.14 6.18 0.00 -1.26 -4.99 105.19 112.43 1ibj n GLY 215 Ca -0.04 -1.86 0.06 0.00 0.00 0.00 0.00 46.02 44.17 1ibj n GLY 215 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ibj h PRO 216 N 0.00 0.00 0.00 1.61 0.11 -1.95 -3.32 132.00 128.45 1ibj h PRO 216 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1ibj h PRO 216 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1ibj h PRO 216 CO 0.00 0.24 -0.52 1.04 -0.21 0.00 0.00 178.00 178.55 1ibj n GLN 217 N -3.00 0.03 -1.88 1.05 1.13 -1.26 -4.90 117.38 108.55 1ibj n GLN 217 Ca -0.01 0.01 -0.42 0.00 -1.94 0.00 0.00 57.00 54.63 1ibj n GLN 217 Cb 0.68 -1.52 -0.03 0.00 0.11 0.00 0.00 30.24 29.48 1ibj n GLN 217 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1ibj s THR 218 N -3.02 3.36 -0.18 5.09 2.01 -1.25 -1.31 115.64 120.34 1ibj s THR 218 Ca 0.10 0.42 0.06 0.00 0.31 0.00 0.00 61.69 62.59 1ibj s THR 218 Cb 0.17 -3.31 -0.08 0.00 0.01 0.00 0.00 72.50 69.29 1ibj s THR 218 CO 0.70 -0.08 0.21 0.29 -0.69 0.00 0.00 174.62 175.05 1ibj n LYS 219 N 7.56 3.07 -3.73 4.92 4.76 -0.30 -4.10 118.16 130.33 1ibj n LYS 219 Ca 0.20 -0.02 -0.14 0.00 -2.87 0.00 0.00 58.31 55.47 1ibj n LYS 219 Cb 0.43 -0.93 -0.15 0.00 -1.84 0.00 0.00 35.03 32.54 1ibj n LYS 219 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1ibj s LEU 220 N -2.75 0.56 -0.17 -0.35 2.96 -1.18 0.01 118.68 117.75 1ibj s LEU 220 Ca 0.00 0.31 -0.03 0.00 -0.22 0.00 0.00 54.13 54.20 1ibj s LEU 220 Cb 0.04 0.36 -0.02 0.00 0.50 0.00 0.00 46.19 47.07 1ibj s LEU 220 CO 0.25 -0.17 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.36 1ibj s VAL 221 N 1.40 3.44 -0.32 1.68 1.01 0.71 -0.96 120.40 127.35 1ibj s VAL 221 Ca -0.07 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.44 1ibj s VAL 221 Cb -0.12 -2.51 0.09 0.00 0.00 0.00 0.00 36.38 33.85 1ibj s VAL 221 CO -0.06 0.48 0.04 0.86 0.00 0.00 0.00 175.10 176.41 1ibj s TRP 222 N 0.78 3.24 0.60 5.22 -0.11 -0.13 -0.26 118.94 128.29 1ibj s TRP 222 Ca -0.03 -2.62 0.05 0.00 1.22 0.00 0.00 56.10 54.73 1ibj s TRP 222 Cb -0.15 -2.51 0.08 0.00 -1.50 0.00 0.00 33.47 29.40 1ibj s TRP 222 CO 0.02 -0.92 0.83 -0.51 -4.62 0.00 0.00 176.95 171.74 1ibj s LEU 223 N 1.09 3.15 -0.30 5.86 1.02 -0.53 -2.30 118.68 126.67 1ibj s LEU 223 Ca 0.08 -0.56 -0.14 0.00 0.02 0.00 0.00 54.13 53.52 1ibj s LEU 223 Cb -0.19 -1.99 0.18 0.00 0.02 0.00 0.00 46.19 44.21 1ibj s LEU 223 CO -0.11 -1.41 1.07 -0.70 0.02 0.00 0.00 176.35 175.22 1ibj s GLU 224 N -4.78 0.18 -0.14 1.70 2.12 -1.26 -3.01 118.70 113.50 1ibj s GLU 224 Ca 0.62 0.33 -0.06 0.00 0.36 0.00 0.00 54.97 56.21 1ibj s GLU 224 Cb -0.07 0.18 0.06 0.00 0.26 0.00 0.00 34.13 34.57 1ibj s GLU 224 CO 0.40 -0.17 0.31 0.45 -0.54 0.00 0.00 175.26 175.71 1ibj s SER 225 N 2.87 -0.23 0.82 -1.70 0.15 -1.26 -4.00 113.70 110.35 1ibj s SER 225 Ca -0.02 0.69 -0.11 0.00 0.70 0.00 0.00 55.95 57.21 1ibj s SER 225 Cb -0.09 0.65 0.09 0.00 -1.71 0.00 0.00 66.02 64.96 1ibj s SER 225 CO -0.11 -0.19 1.14 -2.84 1.20 0.00 0.00 173.24 172.43 1ibj s PRO 226 N 1.63 1.73 0.55 5.44 0.02 -1.26 -4.92 135.00 138.19 1ibj s PRO 226 Ca -0.07 1.47 -0.07 0.00 0.02 0.00 0.00 61.00 62.35 1ibj s PRO 226 Cb -0.10 -1.81 -0.02 0.00 0.02 0.00 0.00 34.50 32.59 1ibj s PRO 226 CO -0.10 -2.09 0.88 0.95 -0.33 0.00 0.00 177.00 176.31 1ibj s THR 227 N -2.58 4.35 -0.13 0.99 -4.23 -0.90 -4.80 115.64 108.35 1ibj s THR 227 Ca 0.67 0.24 -0.02 0.00 -1.18 0.00 0.00 61.69 61.39 1ibj s THR 227 Cb -0.22 -3.70 -0.03 0.00 1.34 0.00 0.00 72.50 69.90 1ibj s THR 227 CO 0.54 -0.74 -0.06 0.21 -0.54 0.00 0.00 174.62 174.03 1ibj s ASN 228 N -4.20 4.67 0.00 3.99 2.47 -1.26 -0.47 114.94 120.13 1ibj s ASN 228 Ca 0.51 -0.12 0.19 0.00 0.42 0.00 0.00 52.86 53.86 1ibj s ASN 228 Cb -0.11 -1.61 0.24 0.00 -1.45 0.00 0.00 41.25 38.33 1ibj s ASN 228 CO 0.47 0.22 1.19 -0.81 -3.72 0.00 0.00 177.10 174.44 1ibj n PRO 229 N 3.18 1.93 0.26 0.43 -0.04 -1.26 -4.88 135.00 134.63 1ibj n PRO 229 Ca -0.18 -1.84 0.14 0.00 -0.04 0.00 0.00 63.50 61.59 1ibj n PRO 229 Cb 0.53 -1.39 0.70 0.00 -0.04 0.00 0.00 33.50 33.29 1ibj n PRO 229 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ibj h ARG 230 N 3.72 0.00 -3.48 0.54 -0.00 -1.89 -3.40 114.38 109.87 1ibj h ARG 230 Ca 0.00 0.00 -0.18 0.00 -0.50 0.00 0.00 59.98 59.30 1ibj h ARG 230 Cb 0.83 0.00 0.07 0.00 0.00 0.00 0.00 29.97 30.87 1ibj h ARG 230 CO 0.00 0.10 -0.34 1.04 0.00 0.00 0.00 179.97 180.77 1ibj n GLN 231 N -3.35 -3.52 -2.64 0.04 1.13 0.38 -4.67 117.38 104.74 1ibj n GLN 231 Ca -0.01 0.40 -0.41 0.00 -1.94 0.00 0.00 57.00 55.04 1ibj n GLN 231 Cb 0.29 -4.10 -0.05 0.00 0.11 0.00 0.00 30.24 26.49 1ibj n GLN 231 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1ibj s GLN 232 N -5.21 4.70 -0.18 -1.09 -1.52 -1.26 -4.59 119.66 110.51 1ibj s GLN 232 Ca 0.16 1.58 -0.09 0.00 -1.95 0.00 0.00 55.36 55.06 1ibj s GLN 232 Cb -0.07 -3.31 -0.05 0.00 -0.22 0.00 0.00 33.01 29.37 1ibj s GLN 232 CO 0.35 0.24 0.11 0.42 -0.25 0.00 0.00 175.29 176.16 1ibj s ILE 233 N -0.45 5.24 0.15 1.08 -1.09 -1.26 -2.11 121.20 122.76 1ibj s ILE 233 Ca 0.46 0.13 0.08 0.00 -2.23 0.00 0.00 60.65 59.08 1ibj s ILE 233 Cb -0.27 -3.37 -0.04 0.00 -1.58 0.00 0.00 42.46 37.21 1ibj s ILE 233 CO 0.33 0.47 -0.06 -0.44 -1.23 0.00 0.00 174.94 174.01 1ibj s SER 234 N 0.14 4.50 -0.56 3.58 0.01 -1.26 -4.77 113.70 115.35 1ibj s SER 234 Ca 0.08 -0.43 -0.23 0.00 1.31 0.00 0.00 55.95 56.68 1ibj s SER 234 Cb -0.11 -0.88 0.05 0.00 0.21 0.00 0.00 66.02 65.29 1ibj s SER 234 CO -0.01 0.13 0.87 -0.62 0.41 0.00 0.00 173.24 174.02 1ibj s ASP 235 N -2.62 6.28 0.31 2.44 -1.08 -1.26 -4.90 116.67 115.83 1ibj s ASP 235 Ca 0.24 -0.62 0.15 0.00 -0.52 0.00 0.00 52.55 51.80 1ibj s ASP 235 Cb -0.10 -2.40 0.43 0.00 -1.46 0.00 0.00 42.92 39.40 1ibj s ASP 235 CO 0.16 -1.19 1.62 0.40 0.52 0.00 0.00 175.17 176.68 1ibj h ILE 236 N 5.97 1.11 -0.32 4.11 2.04 -1.97 -2.64 117.51 125.82 1ibj h ILE 236 Ca -0.27 -1.95 -0.11 0.00 1.00 0.00 0.00 64.86 63.53 1ibj h ILE 236 Cb 1.08 2.13 -0.01 0.00 -0.74 0.00 0.00 36.82 39.28 1ibj h ILE 236 CO 1.08 0.51 -0.23 0.03 0.00 0.00 0.00 178.15 179.53 1ibj h ARG 237 N 0.00 0.73 -0.02 2.37 3.08 -1.91 -2.69 114.38 115.93 1ibj h ARG 237 Ca -0.01 -0.35 -0.17 0.00 0.07 0.00 0.00 59.98 59.53 1ibj h ARG 237 Cb 1.09 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.12 1ibj h ARG 237 CO 0.07 0.96 -0.74 0.87 -1.07 0.00 0.00 179.97 180.06 1ibj h LYS 238 N 0.49 0.14 -0.10 0.04 1.57 -1.86 -2.89 116.57 113.95 1ibj h LYS 238 Ca 0.06 -0.12 -0.18 0.00 -1.87 0.00 0.00 60.65 58.54 1ibj h LYS 238 Cb 0.79 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 1ibj h LYS 238 CO 0.06 0.82 -0.67 0.82 -0.57 0.00 0.00 179.45 179.91 1ibj h ILE 239 N 0.09 1.36 -0.62 1.86 2.04 -1.53 -3.02 117.51 117.69 1ibj h ILE 239 Ca -0.02 -2.03 -0.07 0.00 1.00 0.00 0.00 64.86 63.74 1ibj h ILE 239 Cb 1.31 2.01 -0.03 0.00 -0.74 0.00 0.00 36.82 39.37 1ibj h ILE 239 CO 0.11 0.62 0.11 0.28 0.00 0.00 0.00 178.15 179.26 1ibj h SER 240 N 0.31 0.96 -0.44 1.72 0.02 -1.41 -2.51 113.55 112.19 1ibj h SER 240 Ca -0.02 -0.21 -0.08 0.00 -0.84 0.00 0.00 61.79 60.64 1ibj h SER 240 Cb 1.23 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.51 1ibj h SER 240 CO 0.12 0.95 -0.04 1.05 -1.14 0.00 0.00 176.83 177.77 1ibj h GLU 241 N 0.95 0.80 0.75 3.45 4.11 -1.52 -0.93 114.58 122.20 1ibj h GLU 241 Ca 0.19 -0.28 -0.03 0.00 0.07 0.00 0.00 59.36 59.31 1ibj h GLU 241 Cb 0.40 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1ibj h GLU 241 CO 0.01 0.89 -0.40 0.52 0.07 0.00 0.00 179.01 180.09 1ibj h MET 242 N 0.64 -1.03 -0.54 1.06 2.86 -1.43 0.53 114.93 117.02 1ibj h MET 242 Ca 0.12 0.07 0.06 0.00 -2.06 0.00 0.00 59.70 57.89 1ibj h MET 242 Cb 0.55 0.23 -0.05 0.00 0.06 0.00 0.00 31.60 32.39 1ibj h MET 242 CO 0.03 -0.69 0.26 0.00 1.06 0.00 0.00 176.91 177.57 1ibj h ALA 243 N -0.85 0.70 -0.42 6.32 0.00 -1.50 -1.37 119.26 122.14 1ibj h ALA 243 Ca -0.10 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1ibj h ALA 243 Cb 0.84 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1ibj h ALA 243 CO 0.14 -0.11 0.09 0.45 0.00 0.00 0.00 179.25 179.83 1ibj h HIS 244 N 0.49 0.64 0.00 0.00 3.86 -1.05 0.32 115.15 119.42 1ibj h HIS 244 Ca 0.25 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.41 1ibj h HIS 244 Cb 0.20 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.48 1ibj h HIS 244 CO -0.12 0.56 0.00 0.00 0.86 0.00 0.00 177.93 179.23 1ibj n ALA 245 N -2.47 2.12 0.00 2.45 0.00 0.17 -0.80 120.51 121.98 1ibj n ALA 245 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1ibj n ALA 245 Cb 0.20 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.36 1ibj n ALA 245 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ibj n GLN 246 N -1.07 0.84 -2.11 0.00 1.13 0.95 -5.00 117.38 112.11 1ibj n GLN 246 Ca 0.12 -0.97 -0.11 0.00 -1.94 0.00 0.00 57.00 54.10 1ibj n GLN 246 Cb 0.08 -1.00 -0.01 0.00 0.11 0.00 0.00 30.24 29.42 1ibj n GLN 246 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ibj n GLY 247 N -0.21 0.06 3.90 1.08 0.00 0.02 -4.88 105.19 105.17 1ibj n GLY 247 Ca 0.00 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 1ibj n GLY 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ibj s ALA 248 N -2.55 3.96 0.34 4.61 0.00 -0.09 -4.83 121.76 123.21 1ibj s ALA 248 Ca 0.00 -0.86 -0.22 0.00 0.00 0.00 0.00 51.96 50.89 1ibj s ALA 248 Cb 0.00 -1.79 -0.10 0.00 0.00 0.00 0.00 23.12 21.23 1ibj s ALA 248 CO 0.00 0.82 0.88 -0.51 0.00 0.00 0.00 175.76 176.95 1ibj s LEU 249 N -2.48 4.16 -0.18 0.00 1.43 0.10 -4.18 118.68 117.53 1ibj s LEU 249 Ca 0.34 1.63 -0.00 0.00 -1.03 0.00 0.00 54.13 55.07 1ibj s LEU 249 Cb -0.13 -4.14 0.01 0.00 0.03 0.00 0.00 46.19 41.95 1ibj s LEU 249 CO 0.27 -0.18 -0.15 -0.69 0.23 0.00 0.00 176.35 175.84 1ibj s VAL 250 N -1.86 2.59 -0.13 -1.59 1.01 -1.26 -0.21 120.40 118.95 1ibj s VAL 250 Ca 0.54 -0.77 -0.03 0.00 0.00 0.00 0.00 61.98 61.71 1ibj s VAL 250 Cb -0.14 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.10 1ibj s VAL 250 CO 0.19 0.50 -0.01 -0.22 0.00 0.00 0.00 175.10 175.56 1ibj s LEU 251 N 1.16 3.47 -0.15 3.92 2.96 0.65 -0.15 118.68 130.52 1ibj s LEU 251 Ca 0.01 0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.94 1ibj s LEU 251 Cb -0.14 -1.82 0.02 0.00 0.50 0.00 0.00 46.19 44.75 1ibj s LEU 251 CO -0.06 0.26 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.41 1ibj s VAL 252 N -0.15 1.56 -0.68 1.68 1.01 -0.47 -1.45 120.40 121.89 1ibj s VAL 252 Ca 0.04 -0.66 -0.24 0.00 0.00 0.00 0.00 61.98 61.13 1ibj s VAL 252 Cb -0.13 -1.48 0.06 0.00 0.00 0.00 0.00 36.38 34.83 1ibj s VAL 252 CO 0.02 0.42 1.04 -0.62 0.00 0.00 0.00 175.10 175.96 1ibj s ASP 253 N 1.49 6.17 -0.14 3.32 -1.08 -1.16 -0.21 116.67 125.06 1ibj s ASP 253 Ca 0.04 -0.84 0.11 0.00 -0.52 0.00 0.00 52.55 51.34 1ibj s ASP 253 Cb -0.13 -2.45 0.56 0.00 -1.46 0.00 0.00 42.92 39.44 1ibj s ASP 253 CO -0.10 -1.53 1.39 -3.20 0.52 0.00 0.00 175.17 172.24 1ibj n ASN 254 N 8.11 4.08 -0.30 -0.34 5.15 0.23 -4.60 115.26 127.59 1ibj n ASN 254 Ca -0.02 -2.54 0.08 0.00 -0.60 0.00 0.00 54.58 51.50 1ibj n ASN 254 Cb 0.46 -0.58 0.19 0.00 -0.53 0.00 0.00 39.78 39.32 1ibj n ASN 254 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1ibj h SER 255 N 2.89 -0.51 1.13 1.20 0.02 -1.88 -0.19 113.55 116.21 1ibj h SER 255 Ca 0.00 0.24 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1ibj h SER 255 Cb 1.39 0.44 0.00 0.00 0.14 0.00 0.00 62.40 64.38 1ibj h SER 255 CO 0.29 -0.26 0.00 -0.29 -1.14 0.00 0.00 176.83 175.42 1ibj h ILE 256 N 0.05 0.00 0.00 3.27 2.10 -1.94 -3.32 117.51 117.67 1ibj h ILE 256 Ca 0.48 -0.38 -0.38 0.00 1.08 0.00 0.00 64.86 65.65 1ibj h ILE 256 Cb 0.87 1.26 -0.07 0.00 -1.09 0.00 0.00 36.82 37.79 1ibj h ILE 256 CO -0.81 0.00 -2.43 0.23 -1.08 0.00 0.00 178.15 174.06 1ibj n MET 257 N -2.32 0.61 -1.11 2.19 2.81 -0.43 -4.74 117.12 114.13 1ibj n MET 257 Ca 0.04 0.16 0.14 0.00 -1.81 0.00 0.00 57.70 56.22 1ibj n MET 257 Cb 0.34 -1.49 -0.07 0.00 -0.71 0.00 0.00 33.22 31.29 1ibj n MET 257 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1ibj n SER 258 N -3.38 -6.31 0.27 7.83 3.41 -0.21 -4.08 113.62 111.15 1ibj n SER 258 Ca -0.45 0.99 0.14 0.00 -0.26 0.00 0.00 58.87 59.28 1ibj n SER 258 Cb 0.95 -3.73 0.73 0.00 -0.26 0.00 0.00 64.21 61.90 1ibj n SER 258 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1ibj h PRO 259 N -1.08 0.00 -0.63 4.33 0.11 -1.89 -2.89 132.00 129.96 1ibj h PRO 259 Ca -0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1ibj h PRO 259 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1ibj h PRO 259 CO 0.05 0.00 0.00 1.33 -0.21 0.00 0.00 178.00 179.17 1ibj n VAL 260 N -2.62 1.42 0.00 3.15 0.24 -1.26 -4.27 118.33 115.00 1ibj n VAL 260 Ca -0.02 -0.93 0.00 0.00 -2.04 0.00 0.00 64.34 61.35 1ibj n VAL 260 Cb 0.27 0.07 0.00 0.00 -1.47 0.00 0.00 33.84 32.71 1ibj n VAL 260 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1ibj n LEU 261 N 0.89 0.00 -3.61 1.34 4.77 -1.09 -4.85 117.00 114.45 1ibj n LEU 261 Ca 0.21 -0.01 -0.12 0.00 -0.03 0.00 0.00 56.01 56.06 1ibj n LEU 261 Cb 0.73 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.75 1ibj n LEU 261 CO 0.19 0.00 0.61 -0.55 -1.33 0.00 0.00 177.39 176.31 1ibj s SER 262 N -0.03 -0.55 -0.40 -1.43 0.15 -1.22 0.14 113.70 110.36 1ibj s SER 262 Ca 0.00 0.91 0.05 0.00 0.70 0.00 0.00 55.95 57.61 1ibj s SER 262 Cb 0.00 0.87 0.20 0.00 -1.71 0.00 0.00 66.02 65.38 1ibj s SER 262 CO 0.00 -0.29 0.40 0.54 1.20 0.00 0.00 173.24 175.09 1ibj n ARG 263 N 1.85 0.36 -0.13 5.44 1.74 -1.26 -4.23 116.66 120.42 1ibj n ARG 263 Ca -0.13 -3.18 0.28 0.00 -0.77 0.00 0.00 57.85 54.04 1ibj n ARG 263 Cb 0.56 -1.52 0.64 0.00 -1.02 0.00 0.00 32.46 31.12 1ibj n ARG 263 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 1ibj h PRO 264 N 5.09 0.00 0.00 5.56 0.11 -1.92 -0.23 132.00 140.61 1ibj h PRO 264 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1ibj h PRO 264 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1ibj h PRO 264 CO 0.40 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.47 1ibj n LEU 265 N -3.62 0.00 -1.67 2.35 4.77 -1.26 -1.07 117.00 116.50 1ibj n LEU 265 Ca 0.18 0.49 0.08 0.00 -0.03 0.00 0.00 56.01 56.73 1ibj n LEU 265 Cb 1.14 -0.49 0.37 0.00 -2.33 0.00 0.00 43.42 42.11 1ibj n LEU 265 CO 0.29 -0.31 0.84 -0.62 -1.33 0.00 0.00 177.39 176.26 1ibj n GLU 266 N -1.49 4.25 -0.15 3.23 1.02 -0.10 -4.13 120.64 123.27 1ibj n GLU 266 Ca 0.03 -3.02 0.02 0.00 -0.02 0.00 0.00 57.16 54.17 1ibj n GLU 266 Cb 0.12 -2.07 0.03 0.00 -0.02 0.00 0.00 31.44 29.50 1ibj n GLU 266 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1ibj n LEU 267 N 0.74 0.87 0.00 -4.62 4.77 -0.23 -4.99 117.00 113.54 1ibj n LEU 267 Ca 0.26 -1.27 0.00 0.00 -0.03 0.00 0.00 56.01 54.97 1ibj n LEU 267 Cb 1.04 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 1ibj n LEU 267 CO 0.27 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1ibj n GLY 268 N -0.37 1.43 3.76 -0.72 0.00 -1.21 -3.71 105.19 104.37 1ibj n GLY 268 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1ibj n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ibj s ALA 269 N -2.31 2.45 -0.21 4.61 0.00 -0.96 -4.80 121.76 120.54 1ibj s ALA 269 Ca 0.00 0.69 0.12 0.00 0.00 0.00 0.00 51.96 52.77 1ibj s ALA 269 Cb 0.00 -3.36 -0.21 0.00 0.00 0.00 0.00 23.12 19.55 1ibj s ALA 269 CO 0.00 -1.30 -0.02 -0.25 0.00 0.00 0.00 175.76 174.19 1ibj n ASP 270 N -2.23 0.89 -3.80 0.00 9.92 0.78 -4.49 116.55 117.62 1ibj n ASP 270 Ca 0.11 -0.04 -0.16 0.00 -0.53 0.00 0.00 54.79 54.17 1ibj n ASP 270 Cb 0.51 0.53 -0.16 0.00 -0.64 0.00 0.00 41.12 41.37 1ibj n ASP 270 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1ibj s ILE 271 N -2.47 0.06 -0.07 0.53 1.01 -0.79 -1.28 121.20 118.19 1ibj s ILE 271 Ca -0.17 0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.63 1ibj s ILE 271 Cb 0.07 -0.17 -0.03 0.00 0.01 0.00 0.00 42.46 42.34 1ibj s ILE 271 CO 0.71 0.11 -0.08 -0.69 0.00 0.00 0.00 174.94 174.99 1ibj s VAL 272 N 0.97 3.62 0.04 2.92 1.01 0.88 -1.37 120.40 128.46 1ibj s VAL 272 Ca -0.09 -0.51 0.07 0.00 0.00 0.00 0.00 61.98 61.45 1ibj s VAL 272 Cb -0.12 -2.48 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 1ibj s VAL 272 CO -0.02 0.59 -0.20 -0.32 0.00 0.00 0.00 175.10 175.15 1ibj s MET 273 N -0.68 1.35 0.02 2.72 0.00 0.70 -0.61 119.30 122.81 1ibj s MET 273 Ca 0.10 -0.90 0.04 0.00 0.00 0.00 0.00 55.69 54.93 1ibj s MET 273 Cb -0.11 -1.44 -0.02 0.00 0.00 0.00 0.00 34.83 33.26 1ibj s MET 273 CO 0.02 0.37 -0.13 -1.01 0.00 0.00 0.00 175.02 174.27 1ibj s HIS 274 N -0.78 1.15 -0.65 4.11 3.76 -0.79 0.76 115.29 122.86 1ibj s HIS 274 Ca 0.07 -0.30 -0.20 0.00 -0.15 0.00 0.00 55.06 54.48 1ibj s HIS 274 Cb -0.09 -0.70 0.10 0.00 1.11 0.00 0.00 32.58 33.00 1ibj s HIS 274 CO 0.02 0.01 0.81 0.45 -0.85 0.00 0.00 174.74 175.17 1ibj s SER 275 N -0.81 6.24 0.00 1.40 0.15 -1.26 -1.31 113.70 118.11 1ibj s SER 275 Ca 0.02 -1.43 0.12 0.00 0.70 0.00 0.00 55.95 55.37 1ibj s SER 275 Cb -0.07 -2.33 0.66 0.00 -1.71 0.00 0.00 66.02 62.57 1ibj s SER 275 CO 0.01 -1.17 1.24 0.00 1.20 0.00 0.00 173.24 174.51 1ibj n ALA 276 N 6.59 1.82 0.26 5.45 0.00 0.18 -1.02 120.51 133.78 1ibj n ALA 276 Ca -0.04 -0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.46 1ibj n ALA 276 Cb 0.44 -1.20 0.68 0.00 0.00 0.00 0.00 19.45 19.38 1ibj n ALA 276 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1ibj h THR 277 N 0.00 0.44 0.00 0.00 2.02 -1.66 -1.46 112.91 112.25 1ibj h THR 277 Ca 0.00 -0.66 0.00 0.00 0.77 0.00 0.00 66.41 66.52 1ibj h THR 277 Cb 0.07 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1ibj h THR 277 CO 0.00 0.12 0.00 0.29 0.37 0.00 0.00 175.52 176.30 1ibj n LYS 278 N -3.45 0.00 0.07 6.66 4.76 -0.19 -4.54 118.16 121.47 1ibj n LYS 278 Ca -0.01 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.35 1ibj n LYS 278 Cb 0.29 0.00 0.04 0.00 -1.84 0.00 0.00 35.03 33.52 1ibj n LYS 278 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 1ibj h PHE 279 N 0.00 0.42 0.78 2.13 -1.00 -1.76 -1.91 116.94 115.59 1ibj h PHE 279 Ca 0.00 -0.19 -0.04 0.00 2.81 0.00 0.00 57.97 60.55 1ibj h PHE 279 Cb 0.00 -0.06 0.01 0.00 3.61 0.00 0.00 35.95 39.51 1ibj h PHE 279 CO 0.00 0.94 -0.37 0.82 -1.61 0.00 0.00 178.31 178.09 1ibj h ILE 280 N 0.20 0.00 -0.59 -0.55 2.04 -1.85 -3.06 117.51 113.71 1ibj h ILE 280 Ca -0.03 -0.01 -0.08 0.00 1.00 0.00 0.00 64.86 65.74 1ibj h ILE 280 Cb 1.32 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1ibj h ILE 280 CO 0.12 0.00 0.05 0.00 0.00 0.00 0.00 178.15 178.32 1ibj h ALA 281 N -1.51 0.78 0.00 1.87 0.00 -1.41 -3.00 119.26 116.00 1ibj h ALA 281 Ca -0.11 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1ibj h ALA 281 Cb 0.80 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1ibj h ALA 281 CO 0.18 0.58 0.00 0.41 0.00 0.00 0.00 179.25 180.41 1ibj n GLY 282 N -0.48 0.15 0.07 0.00 0.00 -0.72 -4.44 105.19 99.77 1ibj n GLY 282 Ca 0.03 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.08 1ibj n GLY 282 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ibj n HIS 283 N -2.10 0.00 -1.16 1.61 8.25 -1.26 -2.44 115.22 118.12 1ibj n HIS 283 Ca 0.00 -0.59 -0.05 0.00 -0.26 0.00 0.00 57.72 56.82 1ibj n HIS 283 Cb 0.19 -0.08 -0.02 0.00 1.12 0.00 0.00 29.99 31.20 1ibj n HIS 283 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1ibj n SER 284 N -0.75 -5.41 -0.42 0.41 7.64 -1.26 -4.87 113.62 108.95 1ibj n SER 284 Ca 0.06 0.13 0.04 0.00 1.01 0.00 0.00 58.87 60.12 1ibj n SER 284 Cb 0.47 -3.39 0.08 0.00 -1.01 0.00 0.00 64.21 60.35 1ibj n SER 284 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1ibj n ASP 285 N -0.85 2.19 -3.84 6.43 5.68 -1.26 -5.02 116.55 119.88 1ibj n ASP 285 Ca -0.05 -1.66 -0.12 0.00 -0.50 0.00 0.00 54.79 52.46 1ibj n ASP 285 Cb 0.47 -0.08 -0.13 0.00 -1.14 0.00 0.00 41.12 40.24 1ibj n ASP 285 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1ibj s VAL 286 N -0.86 0.01 -0.19 2.12 1.01 -1.26 -5.14 120.40 116.09 1ibj s VAL 286 Ca 0.14 -0.09 -0.08 0.00 0.00 0.00 0.00 61.98 61.95 1ibj s VAL 286 Cb 0.08 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 36.23 1ibj s VAL 286 CO 0.12 -0.05 0.08 -0.32 0.00 0.00 0.00 175.10 174.93 1ibj s MET 287 N -0.11 4.04 -0.17 2.72 1.75 -1.26 -4.33 119.30 121.94 1ibj s MET 287 Ca -0.02 -0.30 -0.29 0.00 -1.25 0.00 0.00 55.69 53.83 1ibj s MET 287 Cb -0.02 -3.28 0.11 0.00 2.84 0.00 0.00 34.83 34.49 1ibj s MET 287 CO 0.00 0.29 0.93 0.00 -0.65 0.00 0.00 175.02 175.59 1ibj s ALA 288 N 0.35 -1.90 0.14 4.11 0.00 -1.24 -4.59 121.76 118.63 1ibj s ALA 288 Ca 0.05 1.63 0.09 0.00 0.00 0.00 0.00 51.96 53.72 1ibj s ALA 288 Cb -0.12 -0.77 -0.04 0.00 0.00 0.00 0.00 23.12 22.19 1ibj s ALA 288 CO -0.01 -0.31 -0.20 0.20 0.00 0.00 0.00 175.76 175.45 1ibj s GLY 289 N -0.73 1.36 0.03 0.00 0.00 -0.35 0.47 107.32 108.09 1ibj s GLY 289 Ca -0.02 -1.41 0.03 0.00 0.00 0.00 0.00 44.72 43.32 1ibj s GLY 289 CO 0.01 -1.45 -0.10 0.14 0.00 0.00 0.00 173.10 171.71 1ibj s VAL 290 N -1.70 0.78 -0.15 1.40 1.01 -0.42 -0.36 120.40 120.96 1ibj s VAL 290 Ca 0.13 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.32 1ibj s VAL 290 Cb -0.07 -0.73 0.03 0.00 0.00 0.00 0.00 36.38 35.61 1ibj s VAL 290 CO 0.06 -0.04 -0.10 -0.76 0.00 0.00 0.00 175.10 174.25 1ibj s LEU 291 N -0.93 1.67 -0.24 3.92 1.43 0.53 -1.88 118.68 123.18 1ibj s LEU 291 Ca -0.01 -0.55 -0.04 0.00 -1.03 0.00 0.00 54.13 52.50 1ibj s LEU 291 Cb -0.07 -1.07 0.00 0.00 0.03 0.00 0.00 46.19 45.09 1ibj s LEU 291 CO 0.01 -0.11 -0.03 0.00 0.23 0.00 0.00 176.35 176.45 1ibj s ALA 292 N 1.55 2.83 -0.02 4.21 0.00 0.22 0.58 121.76 131.13 1ibj s ALA 292 Ca 0.03 -1.28 0.02 0.00 0.00 0.00 0.00 51.96 50.73 1ibj s ALA 292 Cb -0.14 -1.77 -0.03 0.00 0.00 0.00 0.00 23.12 21.18 1ibj s ALA 292 CO -0.09 -0.60 -0.06 0.08 0.00 0.00 0.00 175.76 175.10 1ibj s VAL 293 N 1.45 3.75 -0.22 0.00 1.01 -0.32 -0.08 120.40 125.98 1ibj s VAL 293 Ca 0.04 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.34 1ibj s VAL 293 Cb -0.15 -2.61 0.01 0.00 0.00 0.00 0.00 36.38 33.63 1ibj s VAL 293 CO -0.03 0.45 -0.09 -0.75 0.00 0.00 0.00 175.10 174.69 1ibj s LYS 294 N -1.27 3.11 0.00 2.72 2.47 -0.41 0.06 119.74 126.43 1ibj s LYS 294 Ca 0.16 -0.78 0.00 0.00 -1.56 0.00 0.00 55.97 53.79 1ibj s LYS 294 Cb -0.11 -2.89 0.00 0.00 -1.46 0.00 0.00 37.83 33.37 1ibj s LYS 294 CO 0.06 -0.26 0.00 0.41 0.16 0.00 0.00 175.35 175.72 1ibj n GLY 295 N 4.71 2.29 0.25 5.54 0.00 -1.26 -4.75 105.19 111.96 1ibj n GLY 295 Ca -0.18 -1.11 -0.00 0.00 0.00 0.00 0.00 46.02 44.72 1ibj n GLY 295 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ibj h GLU 296 N 0.00 0.52 0.16 1.61 4.39 -1.98 -0.38 114.58 118.90 1ibj h GLU 296 Ca 0.00 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1ibj h GLU 296 Cb 0.00 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.53 1ibj h GLU 296 CO 0.00 0.34 -0.09 0.87 -1.16 0.00 0.00 179.01 178.97 1ibj h LYS 297 N 0.53 -0.23 0.06 2.33 6.56 -1.99 -0.88 116.57 122.95 1ibj h LYS 297 Ca 0.31 0.02 0.02 0.00 -1.06 0.00 0.00 60.65 59.94 1ibj h LYS 297 Cb 0.31 0.05 -0.04 0.00 -0.57 0.00 0.00 32.23 31.98 1ibj h LYS 297 CO -0.25 -0.15 -0.29 1.25 -2.06 0.00 0.00 179.45 177.95 1ibj h LEU 298 N -0.24 -0.84 -0.34 2.94 5.85 -1.79 -1.10 115.31 119.80 1ibj h LEU 298 Ca -0.02 0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.87 1ibj h LEU 298 Cb 0.19 0.33 -0.08 0.00 0.37 0.00 0.00 40.66 41.47 1ibj h LEU 298 CO 0.03 -0.37 -0.41 0.00 -0.34 0.00 0.00 178.44 177.35 1ibj h ALA 299 N 0.27 -0.44 -1.02 1.25 0.00 -0.97 0.35 119.26 118.70 1ibj h ALA 299 Ca 0.05 0.05 0.27 0.00 0.00 0.00 0.00 54.91 55.27 1ibj h ALA 299 Cb 0.53 0.84 -0.07 0.00 0.00 0.00 0.00 17.79 19.09 1ibj h ALA 299 CO -0.20 -0.86 0.69 0.87 0.00 0.00 0.00 179.25 179.74 1ibj h LYS 300 N -0.36 0.26 0.00 0.00 1.79 -0.43 0.83 116.57 118.66 1ibj h LYS 300 Ca 0.13 -0.02 -0.18 0.00 -2.18 0.00 0.00 60.65 58.40 1ibj h LYS 300 Cb 0.59 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 31.15 1ibj h LYS 300 CO -0.52 0.17 -0.87 0.93 -1.08 0.00 0.00 179.45 178.08 1ibj h GLU 301 N 0.27 0.00 0.03 3.15 4.39 0.79 -1.66 114.58 121.55 1ibj h GLU 301 Ca 0.54 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 60.06 1ibj h GLU 301 Cb 1.61 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 30.28 1ibj h GLU 301 CO -0.18 0.87 -0.72 0.28 -1.16 0.00 0.00 179.01 178.10 1ibj h VAL 302 N 0.00 1.42 -0.64 3.13 2.07 0.31 -3.05 116.25 119.49 1ibj h VAL 302 Ca -0.01 -2.20 0.02 0.00 0.82 0.00 0.00 66.70 65.33 1ibj h VAL 302 Cb 1.61 2.69 -0.04 0.00 -1.52 0.00 0.00 31.29 34.04 1ibj h VAL 302 CO 0.11 0.64 0.41 0.22 0.02 0.00 0.00 177.57 178.97 1ibj h TYR 303 N -0.09 0.76 -0.83 1.57 3.20 0.02 0.71 116.97 122.31 1ibj h TYR 303 Ca -0.10 0.02 0.14 0.00 3.14 0.00 0.00 58.73 61.93 1ibj h TYR 303 Cb 1.44 -0.25 -0.06 0.00 1.54 0.00 0.00 36.73 39.40 1ibj h TYR 303 CO 0.15 0.45 0.55 0.35 -1.64 0.00 0.00 178.16 178.02 1ibj h PHE 304 N 0.81 0.69 0.14 -3.82 3.57 -1.30 -0.39 116.94 116.63 1ibj h PHE 304 Ca 0.25 0.02 -0.31 0.00 3.53 0.00 0.00 57.97 61.46 1ibj h PHE 304 Cb -0.03 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.50 1ibj h PHE 304 CO -0.04 0.26 -1.49 -0.07 -2.23 0.00 0.00 178.31 174.74 1ibj h LEU 305 N 0.59 0.45 -1.37 0.59 3.38 -1.12 -1.81 115.31 116.02 1ibj h LEU 305 Ca 0.41 -0.58 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1ibj h LEU 305 Cb 0.75 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1ibj h LEU 305 CO -0.17 1.48 -0.01 -0.61 0.09 0.00 0.00 178.44 179.22 1ibj h GLN 306 N 0.08 0.40 0.11 1.13 4.15 -0.16 -2.03 115.11 118.79 1ibj h GLN 306 Ca -0.23 -0.08 -0.21 0.00 0.77 0.00 0.00 58.65 58.90 1ibj h GLN 306 Cb 2.03 -0.06 0.02 0.00 0.21 0.00 0.00 27.48 29.68 1ibj h GLN 306 CO 0.18 0.44 -0.89 -0.97 -1.93 0.00 0.00 178.83 175.66 1ibj h ASN 307 N 0.39 0.59 0.66 -0.69 -1.24 -1.16 -2.08 115.58 112.05 1ibj h ASN 307 Ca 0.09 -0.88 -0.20 0.00 0.71 0.00 0.00 56.30 56.02 1ibj h ASN 307 Cb 0.28 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 39.13 1ibj h ASN 307 CO 0.01 1.41 -0.89 0.28 -1.29 0.00 0.00 177.43 176.96 1ibj h SER 308 N -0.15 0.19 -0.47 1.15 0.02 -1.21 -3.03 113.55 110.06 1ibj h SER 308 Ca -0.14 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 1ibj h SER 308 Cb 1.65 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 64.13 1ibj h SER 308 CO 0.17 0.98 0.00 1.21 -1.14 0.00 0.00 176.83 178.05 1ibj n GLU 309 N -3.62 2.30 -3.46 3.45 2.13 -0.77 -4.96 120.64 115.71 1ibj n GLU 309 Ca -0.03 -1.79 -0.21 0.00 0.66 0.00 0.00 57.16 55.80 1ibj n GLU 309 Cb 0.82 -1.45 0.00 0.00 0.27 0.00 0.00 31.44 31.08 1ibj n GLU 309 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ibj n GLY 310 N 1.17 -0.90 0.14 8.31 0.00 -1.15 -4.90 105.19 107.86 1ibj n GLY 310 Ca 0.16 0.52 0.02 0.00 0.00 0.00 0.00 46.02 46.72 1ibj n GLY 310 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ibj n SER 311 N -1.73 0.90 -4.77 1.61 7.64 -0.79 -5.04 113.62 111.44 1ibj n SER 311 Ca -0.24 -1.87 -0.39 0.00 1.01 0.00 0.00 58.87 57.38 1ibj n SER 311 Cb 0.54 -0.13 -0.00 0.00 -1.01 0.00 0.00 64.21 63.61 1ibj n SER 311 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1ibj s GLY 312 N -1.02 2.90 0.38 0.23 0.00 -1.25 -0.64 107.32 107.93 1ibj s GLY 312 Ca 0.06 1.18 -0.26 0.00 0.00 0.00 0.00 44.72 45.70 1ibj s GLY 312 CO 0.01 1.74 1.20 -0.10 0.00 0.00 0.00 173.10 175.95 1ibj n LEU 313 N -0.03 3.37 -4.78 0.66 7.94 -0.18 -4.29 117.00 119.69 1ibj n LEU 313 Ca 0.05 1.13 -0.33 0.00 -1.11 0.00 0.00 56.01 55.75 1ibj n LEU 313 Cb 0.44 -1.45 0.04 0.00 0.53 0.00 0.00 43.42 42.99 1ibj n LEU 313 CO 0.54 -0.83 0.73 0.00 -1.11 0.00 0.00 177.39 176.72 1ibj s ALA 314 N -1.17 2.52 0.27 1.96 0.00 -1.26 -4.80 121.76 119.29 1ibj s ALA 314 Ca 0.59 0.45 0.00 0.00 0.00 0.00 0.00 51.96 53.01 1ibj s ALA 314 Cb -0.56 -3.29 0.55 0.00 0.00 0.00 0.00 23.12 19.82 1ibj s ALA 314 CO 0.59 -1.23 1.81 -1.35 0.00 0.00 0.00 175.76 175.58 1ibj h PRO 315 N -0.07 0.84 -0.28 0.00 0.11 -1.92 0.63 132.00 131.32 1ibj h PRO 315 Ca -0.46 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1ibj h PRO 315 Cb 1.24 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1ibj h PRO 315 CO 0.55 0.56 0.09 0.35 -0.21 0.00 0.00 178.00 179.34 1ibj h PHE 316 N 0.86 0.44 -0.88 0.65 3.57 -1.93 0.31 116.94 119.96 1ibj h PHE 316 Ca 0.48 -0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.99 1ibj h PHE 316 Cb 0.55 -0.13 -0.06 0.00 2.79 0.00 0.00 35.95 39.11 1ibj h PHE 316 CO -0.03 0.46 0.56 -0.44 -2.23 0.00 0.00 178.31 176.63 1ibj h ASP 317 N 0.29 0.92 -0.75 0.41 3.45 -1.79 -0.20 116.42 118.74 1ibj h ASP 317 Ca 0.09 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.50 1ibj h ASP 317 Cb 0.22 -0.19 -0.03 0.00 -0.56 0.00 0.00 39.33 38.76 1ibj h ASP 317 CO -0.00 0.61 0.25 0.00 -1.57 0.00 0.00 179.24 178.53 1ibj h TRP 319 N 1.11 1.14 -0.12 0.00 7.01 -0.04 0.53 115.95 125.58 1ibj h TRP 319 Ca 0.24 -0.12 -0.09 0.00 2.11 0.00 0.00 58.89 61.03 1ibj h TRP 319 Cb 0.29 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 27.01 1ibj h TRP 319 CO 0.02 0.92 -0.35 -0.07 -2.79 0.00 0.00 178.44 176.18 1ibj h LEU 320 N 1.03 0.24 -0.30 0.65 3.38 -0.75 -0.67 115.31 118.90 1ibj h LEU 320 Ca 0.22 -0.09 -0.13 0.00 0.09 0.00 0.00 57.88 57.97 1ibj h LEU 320 Cb 0.33 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1ibj h LEU 320 CO -0.00 0.58 -0.32 0.00 0.09 0.00 0.00 178.44 178.78 1ibj h LEU 322 N 0.49 0.89 -0.11 0.00 3.38 -0.61 0.36 115.31 119.71 1ibj h LEU 322 Ca 0.04 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 1ibj h LEU 322 Cb 0.90 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1ibj h LEU 322 CO 0.08 0.62 -0.34 -0.09 0.09 0.00 0.00 178.44 178.80 1ibj h ARG 323 N 1.04 0.43 0.00 1.13 2.43 -0.92 -3.26 114.38 115.23 1ibj h ARG 323 Ca 0.32 -0.31 -0.13 0.00 -0.81 0.00 0.00 59.98 59.05 1ibj h ARG 323 Cb 0.00 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 1ibj h ARG 323 CO -0.09 0.93 -0.60 0.78 -1.51 0.00 0.00 179.97 179.48 1ibj h GLY 324 N 0.01 0.00 2.00 2.80 0.00 -0.79 -3.18 103.07 103.91 1ibj h GLY 324 Ca -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 1ibj h GLY 324 CO 0.07 0.00 -0.02 1.19 0.00 0.00 0.00 176.54 177.78 1ibj h ILE 325 N 0.00 0.08 -0.19 2.60 2.10 -0.14 -2.99 117.51 118.97 1ibj h ILE 325 Ca -0.01 -0.31 -0.03 0.00 1.08 0.00 0.00 64.86 65.60 1ibj h ILE 325 Cb 1.35 1.28 -0.01 0.00 -1.09 0.00 0.00 36.82 38.35 1ibj h ILE 325 CO 0.08 0.02 -0.01 0.11 -1.08 0.00 0.00 178.15 177.26 1ibj h LYS 326 N 0.00 0.28 -0.45 2.19 1.57 -1.61 -1.93 116.57 116.63 1ibj h LYS 326 Ca -0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1ibj h LYS 326 Cb 0.28 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1ibj h LYS 326 CO 0.00 0.32 0.00 0.25 -0.57 0.00 0.00 179.45 179.45 1ibj n THR 327 N -4.36 0.59 -0.07 -0.16 -2.24 -1.13 -4.61 114.28 102.30 1ibj n THR 327 Ca -0.00 -0.64 -0.07 0.00 -2.27 0.00 0.00 64.05 61.06 1ibj n THR 327 Cb 0.19 0.43 -0.01 0.00 -2.10 0.00 0.00 70.33 68.85 1ibj n THR 327 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1ibj h MET 328 N 3.09 -0.19 -0.26 -0.78 -1.53 -1.45 0.69 114.93 114.50 1ibj h MET 328 Ca 0.00 0.01 -0.01 0.00 -3.44 0.00 0.00 59.70 56.26 1ibj h MET 328 Cb 0.70 0.04 -0.01 0.00 -0.55 0.00 0.00 31.60 31.78 1ibj h MET 328 CO 0.00 -0.13 0.12 0.00 0.14 0.00 0.00 176.91 177.04 1ibj h ALA 329 N 0.92 0.34 -0.16 0.39 0.00 -1.81 -0.71 119.26 118.22 1ibj h ALA 329 Ca 0.15 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1ibj h ALA 329 Cb 0.44 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1ibj h ALA 329 CO -0.41 -0.09 -0.03 1.25 0.00 0.00 0.00 179.25 179.98 1ibj h LEU 330 N 0.28 -0.12 -0.19 0.00 5.85 -1.72 -0.92 115.31 118.50 1ibj h LEU 330 Ca 0.09 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.86 1ibj h LEU 330 Cb 0.13 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1ibj h LEU 330 CO -0.01 -0.04 0.11 0.03 -0.34 0.00 0.00 178.44 178.20 1ibj h ARG 331 N 0.02 0.23 -0.48 1.25 3.08 0.58 -2.61 114.38 116.45 1ibj h ARG 331 Ca 0.07 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1ibj h ARG 331 Cb 0.11 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 1ibj h ARG 331 CO -0.15 0.15 0.25 0.82 -1.07 0.00 0.00 179.97 179.97 1ibj h ILE 332 N 0.23 1.18 0.16 2.04 2.04 -1.03 0.16 117.51 122.28 1ibj h ILE 332 Ca 0.07 -0.48 0.01 0.00 1.00 0.00 0.00 64.86 65.47 1ibj h ILE 332 Cb -0.01 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 36.64 1ibj h ILE 332 CO -0.03 0.19 -0.48 -0.08 0.00 0.00 0.00 178.15 177.75 1ibj h GLU 333 N 0.63 -0.71 -0.25 2.37 4.81 -0.89 0.56 114.58 121.10 1ibj h GLU 333 Ca 0.17 0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.38 1ibj h GLU 333 Cb 0.08 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 1ibj h GLU 333 CO -0.02 -0.47 -0.12 -0.22 -0.73 0.00 0.00 179.01 177.45 1ibj h LYS 334 N -0.74 0.42 0.14 1.92 1.63 -1.45 -2.95 116.57 115.53 1ibj h LYS 334 Ca 0.00 -0.11 -0.01 0.00 -0.85 0.00 0.00 60.65 59.68 1ibj h LYS 334 Cb 0.74 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.32 1ibj h LYS 334 CO -0.25 0.54 -0.06 1.96 -3.45 0.00 0.00 179.45 178.19 1ibj h GLN 335 N 0.39 -0.17 -0.29 1.90 4.20 0.13 -2.28 115.11 118.98 1ibj h GLN 335 Ca 0.08 0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.87 1ibj h GLN 335 Cb 0.45 0.04 -0.07 0.00 0.30 0.00 0.00 27.48 28.19 1ibj h GLN 335 CO 0.03 0.15 -0.22 0.37 -0.67 0.00 0.00 178.83 178.49 1ibj h GLN 336 N -0.52 -0.19 -0.63 1.46 4.15 -0.05 0.05 115.11 119.38 1ibj h GLN 336 Ca -0.02 0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.51 1ibj h GLN 336 Cb 0.41 0.04 -0.04 0.00 0.21 0.00 0.00 27.48 28.10 1ibj h GLN 336 CO 0.03 -0.12 0.42 1.49 -1.93 0.00 0.00 178.83 178.72 1ibj h GLU 337 N -0.19 0.46 -0.14 1.69 4.57 -1.51 0.27 114.58 119.73 1ibj h GLU 337 Ca 0.16 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.27 1ibj h GLU 337 Cb 0.43 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.92 1ibj h GLU 337 CO -0.41 0.31 -0.08 -0.91 -1.18 0.00 0.00 179.01 176.74 1ibj h ASN 338 N 0.48 0.31 -0.28 1.04 2.35 -0.50 -2.21 115.58 116.77 1ibj h ASN 338 Ca 0.29 -0.43 0.00 0.00 -0.55 0.00 0.00 56.30 55.62 1ibj h ASN 338 Cb 0.50 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1ibj h ASN 338 CO -0.09 0.67 0.18 0.00 -1.65 0.00 0.00 177.43 176.54 1ibj h ALA 339 N 0.65 0.35 -0.27 -0.83 0.00 -0.20 -0.58 119.26 118.39 1ibj h ALA 339 Ca 0.03 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1ibj h ALA 339 Cb 0.56 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1ibj h ALA 339 CO 0.02 -0.17 -0.48 -0.09 0.00 0.00 0.00 179.25 178.53 1ibj h ARG 340 N 0.37 -0.38 -0.94 0.00 2.43 -0.84 0.20 114.38 115.21 1ibj h ARG 340 Ca 0.10 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.37 1ibj h ARG 340 Cb -0.03 0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 29.53 1ibj h ARG 340 CO -0.02 -0.26 0.59 0.87 -1.51 0.00 0.00 179.97 179.65 1ibj h LYS 341 N -0.40 1.01 0.00 0.20 1.57 -1.09 0.40 116.57 118.27 1ibj h LYS 341 Ca 0.05 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 1ibj h LYS 341 Cb 0.54 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1ibj h LYS 341 CO -0.46 0.67 -0.28 0.82 -0.57 0.00 0.00 179.45 179.63 1ibj h ILE 342 N 1.04 0.74 0.12 1.86 2.04 -0.43 -1.95 117.51 120.93 1ibj h ILE 342 Ca 0.42 -1.19 -0.27 0.00 1.00 0.00 0.00 64.86 64.82 1ibj h ILE 342 Cb 0.25 1.75 0.01 0.00 -0.74 0.00 0.00 36.82 38.09 1ibj h ILE 342 CO -0.20 0.27 -1.21 0.00 0.00 0.00 0.00 178.15 177.01 1ibj h ALA 343 N 1.72 0.11 0.17 1.87 0.00 0.24 -2.48 119.26 120.90 1ibj h ALA 343 Ca -0.00 -0.83 0.01 0.00 0.00 0.00 0.00 54.91 54.09 1ibj h ALA 343 Cb 0.73 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 1ibj h ALA 343 CO 0.04 0.88 -0.42 1.98 0.00 0.00 0.00 179.25 181.72 1ibj h MET 344 N 0.13 -0.67 -0.44 0.00 -1.53 -0.41 0.14 114.93 112.16 1ibj h MET 344 Ca -0.14 0.05 0.06 0.00 -3.44 0.00 0.00 59.70 56.23 1ibj h MET 344 Cb 1.91 0.15 -0.05 0.00 -0.55 0.00 0.00 31.60 33.06 1ibj h MET 344 CO 0.21 -0.45 0.12 -0.92 0.14 0.00 0.00 176.91 176.01 1ibj h TYR 345 N -0.69 0.20 -0.21 1.39 3.20 -1.41 -2.82 116.97 116.64 1ibj h TYR 345 Ca 0.01 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.76 1ibj h TYR 345 Cb 0.70 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.93 1ibj h TYR 345 CO -0.34 0.05 -0.47 -0.07 -1.64 0.00 0.00 178.16 175.69 1ibj h LEU 346 N 0.27 0.57 -0.76 2.82 3.38 -1.23 -3.14 115.31 117.22 1ibj h LEU 346 Ca 0.21 -0.28 0.06 0.00 0.09 0.00 0.00 57.88 57.97 1ibj h LEU 346 Cb 0.24 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 1ibj h LEU 346 CO -0.25 0.95 0.45 -1.28 0.09 0.00 0.00 178.44 178.41 1ibj h SER 347 N 0.42 0.68 -0.84 -0.43 0.87 -0.46 -1.55 113.55 112.25 1ibj h SER 347 Ca 0.03 0.03 -0.38 0.00 -1.23 0.00 0.00 61.79 60.23 1ibj h SER 347 Cb 0.98 -0.11 -0.23 0.00 -0.44 0.00 0.00 62.40 62.60 1ibj h SER 347 CO 0.09 0.43 0.49 -1.54 -0.53 0.00 0.00 176.83 175.77 1ibj n SER 348 N -4.71 4.02 -4.66 6.23 3.41 -1.17 -4.93 113.62 111.81 1ibj n SER 348 Ca 0.10 -3.36 -0.35 0.00 -0.26 0.00 0.00 58.87 55.01 1ibj n SER 348 Cb 0.18 -0.79 -0.09 0.00 -0.26 0.00 0.00 64.21 63.25 1ibj n SER 348 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1ibj s HIS 349 N -2.95 3.27 0.55 7.33 5.04 -0.58 -5.00 115.29 122.94 1ibj s HIS 349 Ca 0.52 0.13 0.31 0.00 -1.54 0.00 0.00 55.06 54.48 1ibj s HIS 349 Cb 0.43 -2.03 1.48 0.00 0.04 0.00 0.00 32.58 32.50 1ibj s HIS 349 CO 0.11 0.25 1.88 -1.35 -2.34 0.00 0.00 174.74 173.29 1ibj h PRO 350 N 6.34 0.00 -0.45 2.88 0.11 -1.91 -1.80 132.00 137.17 1ibj h PRO 350 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1ibj h PRO 350 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1ibj h PRO 350 CO 0.68 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 179.01 1ibj n ARG 351 N -4.17 2.50 -3.78 1.05 1.74 -1.26 -4.88 116.66 107.87 1ibj n ARG 351 Ca 0.17 -2.31 -0.37 0.00 -0.77 0.00 0.00 57.85 54.57 1ibj n ARG 351 Cb 0.94 -1.49 -0.13 0.00 -1.02 0.00 0.00 32.46 30.76 1ibj n ARG 351 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ibj s VAL 352 N -1.30 3.81 0.00 1.55 1.01 -0.68 -4.62 120.40 120.18 1ibj s VAL 352 Ca 0.39 -0.84 -0.23 0.00 0.00 0.00 0.00 61.98 61.29 1ibj s VAL 352 Cb 0.22 -3.02 -0.18 0.00 0.00 0.00 0.00 36.38 33.41 1ibj s VAL 352 CO 0.30 0.02 1.28 0.11 0.00 0.00 0.00 175.10 176.81 1ibj h LYS 353 N 8.21 0.18 -3.46 2.72 1.57 -1.46 -3.45 116.57 120.89 1ibj h LYS 353 Ca -0.29 -0.10 -0.17 0.00 -1.87 0.00 0.00 60.65 58.22 1ibj h LYS 353 Cb 1.11 0.01 -0.23 0.00 0.08 0.00 0.00 32.23 33.19 1ibj h LYS 353 CO 0.60 0.64 -0.52 0.21 -0.57 0.00 0.00 179.45 179.81 1ibj s LYS 354 N -4.18 0.33 -0.12 3.15 2.20 -1.19 -4.99 119.74 114.92 1ibj s LYS 354 Ca -0.15 -0.11 0.02 0.00 -0.36 0.00 0.00 55.97 55.37 1ibj s LYS 354 Cb 0.03 0.14 0.01 0.00 -1.51 0.00 0.00 37.83 36.51 1ibj s LYS 354 CO 0.72 -0.07 -0.17 0.08 -0.36 0.00 0.00 175.35 175.55 1ibj s VAL 355 N -0.67 1.64 -0.37 4.02 1.01 -1.26 -1.39 120.40 123.38 1ibj s VAL 355 Ca -0.08 -0.72 -0.13 0.00 0.00 0.00 0.00 61.98 61.05 1ibj s VAL 355 Cb -0.05 -1.49 0.01 0.00 0.00 0.00 0.00 36.38 34.85 1ibj s VAL 355 CO 0.01 0.47 0.25 -0.31 0.00 0.00 0.00 175.10 175.52 1ibj s TYR 356 N 1.03 3.23 -0.29 5.22 1.51 0.31 -4.98 117.35 123.38 1ibj s TYR 356 Ca -0.05 -0.54 -0.14 0.00 -1.01 0.00 0.00 57.07 55.34 1ibj s TYR 356 Cb -0.15 -2.51 0.11 0.00 -0.11 0.00 0.00 41.96 39.30 1ibj s TYR 356 CO -0.03 -0.52 0.72 -0.47 -1.11 0.00 0.00 175.55 174.14 1ibj s TYR 357 N 1.67 -1.10 -1.42 2.71 5.04 -1.26 -1.80 117.35 121.19 1ibj s TYR 357 Ca 0.05 2.06 0.16 0.00 -2.44 0.00 0.00 57.07 56.89 1ibj s TYR 357 Cb -0.18 0.66 0.78 0.00 0.35 0.00 0.00 41.96 43.56 1ibj s TYR 357 CO 0.09 -0.54 1.44 0.00 -1.34 0.00 0.00 175.55 175.20 1ibj n ALA 358 N 4.70 1.86 0.32 3.97 0.00 -1.26 -2.64 120.51 127.45 1ibj n ALA 358 Ca -0.16 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.32 1ibj n ALA 358 Cb 0.55 -1.25 0.09 0.00 0.00 0.00 0.00 19.45 18.84 1ibj n ALA 358 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ibj h GLY 359 N 2.57 0.00 -4.99 0.00 0.00 -1.96 -3.42 103.07 95.27 1ibj h GLY 359 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 1ibj h GLY 359 CO 0.00 0.00 0.84 1.08 0.00 0.00 0.00 176.54 178.46 1ibj s LEU 360 N -4.95 4.25 0.34 3.11 1.43 -1.08 -4.91 118.68 116.86 1ibj s LEU 360 Ca 0.03 1.86 0.14 0.00 -1.03 0.00 0.00 54.13 55.13 1ibj s LEU 360 Cb 0.11 -3.55 1.08 0.00 0.03 0.00 0.00 46.19 43.86 1ibj s LEU 360 CO 0.75 -0.71 1.66 1.55 0.23 0.00 0.00 176.35 179.82 1ibj h PRO 361 N 8.02 0.29 0.00 1.29 0.13 -1.89 0.32 132.00 140.16 1ibj h PRO 361 Ca -0.32 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1ibj h PRO 361 Cb 1.14 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1ibj h PRO 361 CO 0.93 0.19 0.00 -3.47 -0.23 0.00 0.00 178.00 175.42 1ibj n ASP 362 N -5.07 0.00 -4.66 1.44 -0.08 -1.26 -4.83 116.55 102.08 1ibj n ASP 362 Ca 0.31 -0.34 -0.42 0.00 -1.51 0.00 0.00 54.79 52.83 1ibj n ASP 362 Cb 0.98 -0.14 -0.03 0.00 2.34 0.00 0.00 41.12 44.27 1ibj n ASP 362 CO 0.00 0.00 0.00 -2.28 0.12 0.00 0.00 177.20 175.04 1ibj s HIS 363 N -2.28 3.39 -0.06 -0.67 2.46 0.11 -4.98 115.29 113.25 1ibj s HIS 363 Ca 0.26 1.39 -0.30 0.00 0.47 0.00 0.00 55.06 56.87 1ibj s HIS 363 Cb 0.14 -3.16 -0.09 0.00 -0.13 0.00 0.00 32.58 29.35 1ibj s HIS 363 CO 0.28 -0.36 2.04 -2.30 -2.47 0.00 0.00 174.74 171.92 1ibj n PRO 364 N 5.75 2.47 0.00 2.88 -0.02 -1.26 -1.39 135.00 143.44 1ibj n PRO 364 Ca 0.08 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 1ibj n PRO 364 Cb 0.47 -3.00 0.00 0.00 -0.02 0.00 0.00 33.50 30.96 1ibj n PRO 364 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ibj n GLY 365 N 4.92 2.26 0.29 -1.23 0.00 -1.26 -4.61 105.19 105.57 1ibj n GLY 365 Ca 0.24 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.18 1ibj n GLY 365 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ibj n HIS 366 N -0.10 -0.30 0.05 1.61 -0.00 -0.48 0.19 115.22 116.19 1ibj n HIS 366 Ca 0.00 0.86 -0.01 0.00 -0.00 0.00 0.00 57.72 58.57 1ibj n HIS 366 Cb 0.00 -0.55 0.27 0.00 -0.00 0.00 0.00 29.99 29.71 1ibj n HIS 366 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 1ibj h HIS 367 N 0.00 0.43 0.69 1.57 -0.00 -1.92 -0.71 115.15 115.22 1ibj h HIS 367 Ca 0.11 -0.08 -0.03 0.00 -0.00 0.00 0.00 60.37 60.37 1ibj h HIS 367 Cb 0.28 -0.11 0.01 0.00 -0.00 0.00 0.00 27.41 27.59 1ibj h HIS 367 CO -0.76 0.58 -0.33 1.25 -0.00 0.00 0.00 177.93 178.66 1ibj h LEU 368 N 0.36 -0.78 -0.28 0.26 5.85 -0.66 -2.64 115.31 117.42 1ibj h LEU 368 Ca 0.06 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.85 1ibj h LEU 368 Cb 0.56 0.20 -0.08 0.00 0.37 0.00 0.00 40.66 41.71 1ibj h LEU 368 CO 0.04 -0.41 -0.41 -0.74 -0.34 0.00 0.00 178.44 176.57 1ibj h HIS 369 N -1.21 -1.19 0.00 1.25 2.76 -0.47 0.32 115.15 116.61 1ibj h HIS 369 Ca -0.09 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 1ibj h HIS 369 Cb 0.72 0.56 0.00 0.00 1.55 0.00 0.00 27.41 30.25 1ibj h HIS 369 CO 0.00 -0.45 0.00 1.19 -1.30 0.00 0.00 177.93 177.37 1ibj n PHE 370 N -5.42 0.00 1.05 5.26 3.01 -0.28 -0.06 117.46 121.02 1ibj n PHE 370 Ca -0.02 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.56 1ibj n PHE 370 Cb 0.35 -0.06 0.18 0.00 -0.01 0.00 0.00 39.48 39.94 1ibj n PHE 370 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1ibj n SER 371 N -1.06 0.81 -0.11 4.37 3.41 0.11 -4.26 113.62 116.89 1ibj n SER 371 Ca 0.07 -0.62 0.00 0.00 -0.26 0.00 0.00 58.87 58.06 1ibj n SER 371 Cb 0.04 0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 1ibj n SER 371 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ibj n GLN 372 N -1.23 0.19 -3.71 4.33 10.64 0.92 -5.08 117.38 123.44 1ibj n GLN 372 Ca 0.07 -0.71 -0.14 0.00 -1.83 0.00 0.00 57.00 54.40 1ibj n GLN 372 Cb 0.35 -0.55 -0.09 0.00 -0.86 0.00 0.00 30.24 29.09 1ibj n GLN 372 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ibj s ALA 373 N -0.11 -1.15 -2.05 2.61 0.00 0.58 -4.70 121.76 116.94 1ibj s ALA 373 Ca 0.01 1.17 0.23 0.00 0.00 0.00 0.00 51.96 53.37 1ibj s ALA 373 Cb 0.00 -0.58 1.28 0.00 0.00 0.00 0.00 23.12 23.83 1ibj s ALA 373 CO 0.00 -0.24 1.84 1.63 0.00 0.00 0.00 175.76 178.99 1ibj n LYS 374 N 2.44 1.11 -3.61 0.00 5.02 0.37 -4.24 118.16 119.24 1ibj n LYS 374 Ca -0.15 -0.16 0.00 0.00 -2.02 0.00 0.00 58.31 55.98 1ibj n LYS 374 Cb 0.57 -1.37 -0.01 0.00 -0.02 0.00 0.00 35.03 34.20 1ibj n LYS 374 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1ibj s GLY 375 N -1.71 -0.38 -0.06 0.72 0.00 -1.25 -5.02 107.32 99.61 1ibj s GLY 375 Ca 0.34 0.93 0.14 0.00 0.00 0.00 0.00 44.72 46.14 1ibj s GLY 375 CO 0.27 0.23 1.39 0.00 0.00 0.00 0.00 173.10 174.99 1ibj n ALA 376 N -0.39 2.80 -0.98 3.20 0.00 -1.26 -4.97 120.51 118.91 1ibj n ALA 376 Ca -0.06 -1.09 0.00 0.00 0.00 0.00 0.00 53.44 52.29 1ibj n ALA 376 Cb 0.62 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.06 1ibj n ALA 376 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ibj n GLY 377 N 1.03 -0.07 0.12 0.00 0.00 -1.26 -4.57 105.19 100.44 1ibj n GLY 377 Ca 0.19 -0.92 0.05 0.00 0.00 0.00 0.00 46.02 45.33 1ibj n GLY 377 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ibj n SER 378 N -2.94 1.65 -4.45 1.61 3.41 -1.26 -4.50 113.62 107.15 1ibj n SER 378 Ca 0.00 -2.45 -0.32 0.00 -0.26 0.00 0.00 58.87 55.84 1ibj n SER 378 Cb 0.00 -0.25 -0.13 0.00 -0.26 0.00 0.00 64.21 63.57 1ibj n SER 378 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ibj s VAL 379 N -1.66 2.88 0.23 -3.33 1.01 -1.26 -1.85 120.40 116.41 1ibj s VAL 379 Ca 0.16 -0.84 -0.23 0.00 0.00 0.00 0.00 61.98 61.07 1ibj s VAL 379 Cb 0.14 -2.12 0.04 0.00 0.00 0.00 0.00 36.38 34.43 1ibj s VAL 379 CO 0.01 0.56 0.81 0.72 0.00 0.00 0.00 175.10 177.20 1ibj s PHE 380 N -0.74 -0.17 0.23 5.22 -0.12 -0.95 -4.89 117.98 116.56 1ibj s PHE 380 Ca 0.12 -0.23 -0.06 0.00 -0.05 0.00 0.00 56.93 56.71 1ibj s PHE 380 Cb -0.10 0.68 -0.02 0.00 -0.63 0.00 0.00 43.02 42.94 1ibj s PHE 380 CO 0.01 -1.08 0.30 -1.54 -0.05 0.00 0.00 175.22 172.86 1ibj s SER 381 N -2.92 0.07 0.08 1.98 1.04 -0.75 -1.07 113.70 112.12 1ibj s SER 381 Ca 0.11 -1.18 -0.12 0.00 0.48 0.00 0.00 55.95 55.24 1ibj s SER 381 Cb -0.04 0.48 0.01 0.00 0.10 0.00 0.00 66.02 66.57 1ibj s SER 381 CO 0.05 -0.99 0.26 0.72 0.98 0.00 0.00 173.24 174.26 1ibj s PHE 382 N -4.07 0.00 0.12 5.02 -0.12 -0.32 0.11 117.98 118.73 1ibj s PHE 382 Ca 0.31 -0.30 0.08 0.00 -0.05 0.00 0.00 56.93 56.97 1ibj s PHE 382 Cb 0.03 0.05 -0.04 0.00 -0.63 0.00 0.00 43.02 42.43 1ibj s PHE 382 CO 0.11 -0.55 -0.12 0.42 -0.05 0.00 0.00 175.22 175.04 1ibj s ILE 383 N -3.32 3.21 0.00 -4.49 1.01 -0.48 -0.85 121.20 116.28 1ibj s ILE 383 Ca 0.01 -1.41 0.00 0.00 0.00 0.00 0.00 60.65 59.24 1ibj s ILE 383 Cb 0.02 -2.51 0.00 0.00 0.01 0.00 0.00 42.46 39.98 1ibj s ILE 383 CO -0.08 0.06 0.22 0.35 0.00 0.00 0.00 174.94 175.49 1ibj n THR 384 N 0.57 0.00 -0.80 2.92 -2.24 -1.26 -1.30 114.28 112.17 1ibj n THR 384 Ca -0.13 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1ibj n THR 384 Cb 0.53 1.35 0.00 0.00 -2.10 0.00 0.00 70.33 70.11 1ibj n THR 384 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ibj n GLY 385 N 0.11 0.43 2.73 3.38 0.00 -1.26 -4.64 105.19 105.94 1ibj n GLY 385 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1ibj n GLY 385 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ibj s SER 386 N -2.37 3.81 0.44 1.61 0.15 -1.26 -4.96 113.70 111.11 1ibj s SER 386 Ca 0.00 -2.28 0.25 0.00 0.70 0.00 0.00 55.95 54.62 1ibj s SER 386 Cb 0.00 -0.99 1.26 0.00 -1.71 0.00 0.00 66.02 64.57 1ibj s SER 386 CO 0.00 -0.32 1.76 0.58 1.20 0.00 0.00 173.24 176.46 1ibj h VAL 387 N 5.70 0.45 -0.26 4.45 2.07 -1.89 0.18 116.25 126.96 1ibj h VAL 387 Ca -0.05 -0.09 -0.15 0.00 0.82 0.00 0.00 66.70 67.23 1ibj h VAL 387 Cb 0.96 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1ibj h VAL 387 CO 0.47 0.05 -0.46 0.00 0.02 0.00 0.00 177.57 177.65 1ibj h ALA 388 N 1.56 0.71 -0.00 1.67 0.00 -1.97 -2.35 119.26 118.88 1ibj h ALA 388 Ca 0.61 -0.47 -0.19 0.00 0.00 0.00 0.00 54.91 54.86 1ibj h ALA 388 Cb 1.82 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 1ibj h ALA 388 CO -0.23 0.67 -0.84 1.25 0.00 0.00 0.00 179.25 180.10 1ibj h LEU 389 N 0.53 0.18 -0.00 0.00 5.85 -1.14 -2.67 115.31 118.05 1ibj h LEU 389 Ca 0.03 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 1ibj h LEU 389 Cb 1.00 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.98 1ibj h LEU 389 CO 0.09 0.94 -0.00 0.28 -0.34 0.00 0.00 178.44 179.41 1ibj h SER 390 N 0.08 0.00 -0.68 1.25 0.02 -1.12 0.28 113.55 113.39 1ibj h SER 390 Ca -0.03 -0.33 0.08 0.00 -0.84 0.00 0.00 61.79 60.67 1ibj h SER 390 Cb 1.46 -0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.93 1ibj h SER 390 CO 0.12 0.34 0.34 0.11 -1.14 0.00 0.00 176.83 176.60 1ibj h LYS 391 N -0.33 0.57 -0.82 3.45 1.57 -1.48 -0.61 116.57 118.93 1ibj h LYS 391 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1ibj h LYS 391 Cb 0.34 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.48 1ibj h LYS 391 CO 0.00 0.38 0.51 1.25 -0.57 0.00 0.00 179.45 181.02 1ibj h HIS 392 N 0.59 1.06 -0.27 -1.35 2.76 -1.18 0.15 115.15 116.92 1ibj h HIS 392 Ca 0.33 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.48 1ibj h HIS 392 Cb 0.32 -0.35 -0.01 0.00 1.55 0.00 0.00 27.41 28.92 1ibj h HIS 392 CO -0.11 0.70 0.07 -0.07 -1.30 0.00 0.00 177.93 177.22 1ibj h LEU 393 N 1.12 0.40 -0.74 0.26 3.38 -0.27 -1.13 115.31 118.34 1ibj h LEU 393 Ca 0.30 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 58.08 1ibj h LEU 393 Cb -0.07 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.52 1ibj h LEU 393 CO -0.06 0.53 0.45 0.58 0.09 0.00 0.00 178.44 180.03 1ibj h VAL 394 N 0.26 1.05 0.00 1.22 2.07 -0.41 -2.03 116.25 118.42 1ibj h VAL 394 Ca 0.08 -0.29 -0.09 0.00 0.82 0.00 0.00 66.70 67.22 1ibj h VAL 394 Cb 0.28 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 1ibj h VAL 394 CO 0.00 0.16 -1.10 -0.33 0.02 0.00 0.00 177.57 176.32 1ibj h GLU 395 N 0.85 0.00 0.00 1.57 5.08 -0.68 -3.38 114.58 118.01 1ibj h GLU 395 Ca 0.31 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.45 1ibj h GLU 395 Cb 0.10 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 1ibj h GLU 395 CO -0.14 0.19 -1.51 1.15 -1.00 0.00 0.00 179.01 177.70 1ibj h THR 396 N 0.00 0.71 -2.23 1.13 2.02 -1.11 -3.47 112.91 109.97 1ibj h THR 396 Ca -0.08 -2.38 -0.59 0.00 0.77 0.00 0.00 66.41 64.13 1ibj h THR 396 Cb 1.32 2.25 0.05 0.00 -1.74 0.00 0.00 68.15 70.03 1ibj h THR 396 CO 0.03 0.41 0.80 0.35 0.37 0.00 0.00 175.52 177.47 1ibj n THR 397 N -2.99 0.04 0.13 3.16 -2.24 -0.77 -4.86 114.28 106.75 1ibj n THR 397 Ca -0.12 -0.01 0.06 0.00 -2.27 0.00 0.00 64.05 61.71 1ibj n THR 397 Cb 0.94 -1.52 0.03 0.00 -2.10 0.00 0.00 70.33 67.68 1ibj n THR 397 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1ibj h LYS 398 N 6.07 0.00 -0.02 -0.78 1.57 -1.90 -3.37 116.57 118.14 1ibj h LYS 398 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1ibj h LYS 398 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 1ibj h LYS 398 CO 0.89 0.26 -0.29 0.66 -0.57 0.00 0.00 179.45 180.39 1ibj n TYR 399 N -3.03 0.00 -4.71 -1.35 0.53 -1.26 -4.93 117.16 102.40 1ibj n TYR 399 Ca -0.00 0.00 -0.33 0.00 -1.02 0.00 0.00 57.90 56.54 1ibj n TYR 399 Cb 0.68 0.00 -0.12 0.00 -1.03 0.00 0.00 39.34 38.87 1ibj n TYR 399 CO 0.00 0.00 0.00 -0.06 -1.02 0.00 0.00 176.86 175.78 1ibj s PHE 400 N -2.15 2.86 0.07 -0.72 0.40 -1.26 -4.47 117.98 112.71 1ibj s PHE 400 Ca 0.20 -0.06 -0.07 0.00 -0.60 0.00 0.00 56.93 56.40 1ibj s PHE 400 Cb 0.17 -1.69 -0.05 0.00 0.51 0.00 0.00 43.02 41.96 1ibj s PHE 400 CO 0.44 0.26 0.33 -1.12 0.70 0.00 0.00 175.22 175.84 1ibj s SER 401 N -0.73 6.53 -0.57 1.36 0.01 -0.22 -4.80 113.70 115.28 1ibj s SER 401 Ca 0.11 0.62 -0.25 0.00 1.31 0.00 0.00 55.95 57.74 1ibj s SER 401 Cb -0.11 -2.11 0.04 0.00 0.21 0.00 0.00 66.02 64.05 1ibj s SER 401 CO 0.01 0.17 1.02 -0.63 0.41 0.00 0.00 173.24 174.23 1ibj s ILE 402 N -1.44 4.26 0.19 1.44 1.01 -1.26 -0.93 121.20 124.48 1ibj s ILE 402 Ca 0.33 0.41 -0.22 0.00 0.00 0.00 0.00 60.65 61.17 1ibj s ILE 402 Cb -0.13 -4.62 0.05 0.00 0.01 0.00 0.00 42.46 37.78 1ibj s ILE 402 CO 0.20 -1.23 0.63 0.00 0.00 0.00 0.00 174.94 174.53 1ibj s ALA 403 N 4.30 -1.47 0.64 9.38 0.00 -1.17 -4.98 121.76 128.47 1ibj s ALA 403 Ca 0.33 0.25 -0.10 0.00 0.00 0.00 0.00 51.96 52.44 1ibj s ALA 403 Cb -0.11 0.88 -0.01 0.00 0.00 0.00 0.00 23.12 23.87 1ibj s ALA 403 CO 0.20 -0.84 1.01 0.14 0.00 0.00 0.00 175.76 176.27 1ibj s VAL 404 N -3.80 4.05 0.03 0.00 -7.23 -1.26 -4.62 120.40 107.57 1ibj s VAL 404 Ca 0.04 0.50 0.00 0.00 -1.81 0.00 0.00 61.98 60.71 1ibj s VAL 404 Cb -0.02 -3.64 0.00 0.00 0.56 0.00 0.00 36.38 33.28 1ibj s VAL 404 CO -0.07 -0.79 0.00 -1.54 -0.31 0.00 0.00 175.10 172.38 1ibj n SER 405 N -2.78 -3.57 -2.03 4.85 3.41 -1.26 -5.07 113.62 107.16 1ibj n SER 405 Ca 0.06 0.13 -0.06 0.00 -0.26 0.00 0.00 58.87 58.74 1ibj n SER 405 Cb 0.56 -0.38 0.01 0.00 -0.26 0.00 0.00 64.21 64.14 1ibj n SER 405 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1ibj n PHE 406 N -1.38 -1.62 -1.00 7.33 1.16 -1.26 -4.88 117.46 115.81 1ibj n PHE 406 Ca 0.00 -1.11 0.00 0.00 -1.87 0.00 0.00 57.45 54.47 1ibj n PHE 406 Cb 0.06 0.48 0.00 0.00 -1.61 0.00 0.00 39.48 38.41 1ibj n PHE 406 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1ibj n GLY 407 N -0.31 0.55 3.96 4.97 0.00 -1.26 -4.45 105.19 108.65 1ibj n GLY 407 Ca -0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 1ibj n GLY 407 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ibj s SER 408 N -2.12 6.28 0.45 1.61 1.04 -1.26 -3.91 113.70 115.78 1ibj s SER 408 Ca 0.00 0.18 0.31 0.00 0.48 0.00 0.00 55.95 56.92 1ibj s SER 408 Cb 0.00 -1.87 1.56 0.00 0.10 0.00 0.00 66.02 65.81 1ibj s SER 408 CO 0.00 -0.18 1.93 -0.37 0.98 0.00 0.00 173.24 175.60 1ibj h VAL 409 N 1.00 0.00 -2.84 5.02 -1.51 -1.84 -3.40 116.25 112.68 1ibj h VAL 409 Ca -0.51 -0.11 -0.64 0.00 -1.23 0.00 0.00 66.70 64.22 1ibj h VAL 409 Cb 1.23 0.86 -0.06 0.00 -2.13 0.00 0.00 31.29 31.19 1ibj h VAL 409 CO 0.60 0.00 -0.34 -0.75 -1.23 0.00 0.00 177.57 175.86 1ibj s LYS 410 N -3.71 3.69 0.12 5.19 2.47 -1.26 -1.55 119.74 124.68 1ibj s LYS 410 Ca -0.02 0.14 -0.30 0.00 -1.56 0.00 0.00 55.97 54.24 1ibj s LYS 410 Cb 0.09 -3.20 -0.06 0.00 -1.46 0.00 0.00 37.83 33.20 1ibj s LYS 410 CO 0.34 0.73 1.02 -1.12 0.16 0.00 0.00 175.35 176.48 1ibj s SER 411 N -1.09 7.39 0.25 1.43 0.01 -1.26 -4.44 113.70 115.99 1ibj s SER 411 Ca 0.20 1.89 0.12 0.00 1.31 0.00 0.00 55.95 59.47 1ibj s SER 411 Cb -0.14 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.45 1ibj s SER 411 CO 0.09 -0.16 -0.21 -0.76 0.41 0.00 0.00 173.24 172.61 1ibj s LEU 412 N 0.06 2.54 -0.03 2.44 1.43 -0.39 -1.06 118.68 123.67 1ibj s LEU 412 Ca 0.49 -0.98 -0.09 0.00 -1.03 0.00 0.00 54.13 52.52 1ibj s LEU 412 Cb -0.25 -1.12 0.01 0.00 0.03 0.00 0.00 46.19 44.86 1ibj s LEU 412 CO 0.31 0.06 0.20 -0.51 0.23 0.00 0.00 176.35 176.65 1ibj s ILE 413 N -2.25 0.05 0.20 -0.59 2.07 -0.10 -0.88 121.20 119.69 1ibj s ILE 413 Ca 0.27 -0.40 -0.22 0.00 -1.41 0.00 0.00 60.65 58.90 1ibj s ILE 413 Cb -0.06 -0.42 0.07 0.00 0.13 0.00 0.00 42.46 42.18 1ibj s ILE 413 CO 0.13 -0.22 1.01 -0.94 -1.91 0.00 0.00 174.94 173.01 1ibj s SER 414 N -0.83 -0.01 -0.31 4.50 1.04 -0.31 -3.04 113.70 114.75 1ibj s SER 414 Ca -0.09 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 55.64 1ibj s SER 414 Cb -0.05 0.53 0.10 0.00 0.10 0.00 0.00 66.02 66.70 1ibj s SER 414 CO 0.02 -1.06 0.08 -0.04 0.98 0.00 0.00 173.24 173.22 1ibj s MET 415 N -2.26 0.94 0.41 4.02 -1.94 -1.26 -0.35 119.30 118.86 1ibj s MET 415 Ca 0.21 -1.26 0.16 0.00 -1.71 0.00 0.00 55.69 53.09 1ibj s MET 415 Cb -0.03 -2.32 1.05 0.00 2.01 0.00 0.00 34.83 35.55 1ibj s MET 415 CO 0.06 -0.96 1.86 -1.35 -0.01 0.00 0.00 175.02 174.62 1ibj h PRO 416 N 7.96 0.42 0.07 2.03 0.11 -1.95 -0.04 132.00 140.60 1ibj h PRO 416 Ca -0.11 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.97 1ibj h PRO 416 Cb 1.02 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1ibj h PRO 416 CO 0.48 0.28 -0.03 0.00 -0.21 0.00 0.00 178.00 178.52 1ibj n PHE 418 N -3.06 0.00 0.02 0.00 -0.00 -1.23 -3.71 117.46 109.49 1ibj n PHE 418 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.44 1ibj n PHE 418 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.51 1ibj n PHE 418 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1ibj n MET 419 N -0.85 0.00 0.00 3.97 0.00 -0.04 -4.05 117.12 116.16 1ibj n MET 419 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.82 1ibj n MET 419 Cb 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 33.22 33.22 1ibj n MET 419 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1ibj n SER 420 N -2.69 0.67 0.00 3.17 2.88 -1.03 0.30 113.62 116.93 1ibj n SER 420 Ca 0.00 -0.72 0.00 0.00 -1.33 0.00 0.00 58.87 56.82 1ibj n SER 420 Cb 0.00 -0.18 0.00 0.00 -0.75 0.00 0.00 64.21 63.28 1ibj n SER 420 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 1ibj n HIS 421 N 0.53 0.00 -0.33 0.66 -0.00 -1.19 -4.91 115.22 109.98 1ibj n HIS 421 Ca 0.00 0.00 -0.09 0.00 0.46 0.00 0.00 57.72 58.09 1ibj n HIS 421 Cb 0.13 0.00 -0.08 0.00 -0.12 0.00 0.00 29.99 29.92 1ibj n HIS 421 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1ibj n ALA 422 N 0.00 -0.50 -0.50 1.57 0.00 0.15 -1.53 120.51 119.69 1ibj n ALA 422 Ca 0.00 0.67 -0.10 0.00 0.00 0.00 0.00 53.44 54.01 1ibj n ALA 422 Cb 0.00 -0.08 -0.06 0.00 0.00 0.00 0.00 19.45 19.32 1ibj n ALA 422 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ibj n SER 423 N -4.89 2.94 -4.23 0.00 2.88 -1.26 -4.78 113.62 104.27 1ibj n SER 423 Ca 0.02 -2.05 -0.33 0.00 -1.33 0.00 0.00 58.87 55.17 1ibj n SER 423 Cb 0.20 -0.76 -0.16 0.00 -0.75 0.00 0.00 64.21 62.74 1ibj n SER 423 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1ibj s ILE 424 N 2.64 2.42 0.00 2.46 1.01 -0.58 -5.07 121.20 124.08 1ibj s ILE 424 Ca 0.31 -0.86 0.00 0.00 0.00 0.00 0.00 60.65 60.10 1ibj s ILE 424 Cb 0.12 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.60 1ibj s ILE 424 CO -0.01 0.53 0.00 -2.65 0.00 0.00 0.00 174.94 172.81 1ibj n PRO 425 N 3.97 2.68 -0.06 2.79 -0.02 -1.26 -4.64 135.00 138.46 1ibj n PRO 425 Ca -0.19 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.07 1ibj n PRO 425 Cb 0.52 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.87 1ibj n PRO 425 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ibj n ALA 426 N -3.00 0.97 0.18 3.55 0.00 -1.26 -3.60 120.51 117.35 1ibj n ALA 426 Ca 0.00 -0.69 0.11 0.00 0.00 0.00 0.00 53.44 52.86 1ibj n ALA 426 Cb 0.00 -0.47 -0.16 0.00 0.00 0.00 0.00 19.45 18.82 1ibj n ALA 426 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1ibj n GLU 427 N -3.82 0.54 0.13 0.00 -0.00 -1.26 -3.37 120.64 112.86 1ibj n GLU 427 Ca -0.37 -0.16 0.13 0.00 -0.00 0.00 0.00 57.16 56.76 1ibj n GLU 427 Cb 0.91 -1.52 0.32 0.00 -0.00 0.00 0.00 31.44 31.16 1ibj n GLU 427 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.13 176.74 1ibj h VAL 428 N 0.00 0.00 0.00 3.84 -1.51 -1.93 0.22 116.25 116.87 1ibj h VAL 428 Ca 0.00 -0.61 -0.34 0.00 -1.23 0.00 0.00 66.70 64.52 1ibj h VAL 428 Cb 0.91 1.57 -0.06 0.00 -2.13 0.00 0.00 31.29 31.58 1ibj h VAL 428 CO 0.00 0.00 -2.12 0.54 -1.23 0.00 0.00 177.57 174.76 1ibj n ARG 429 N -2.46 0.67 0.00 5.19 5.12 -1.24 -4.00 116.66 119.94 1ibj n ARG 429 Ca 0.05 0.12 0.13 0.00 -1.93 0.00 0.00 57.85 56.21 1ibj n ARG 429 Cb 0.46 -1.63 0.28 0.00 -1.16 0.00 0.00 32.46 30.41 1ibj n ARG 429 CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 1ibj n GLU 430 N -2.88 1.27 0.00 5.56 0.00 -1.20 -3.78 120.64 119.61 1ibj n GLU 430 Ca -0.27 -0.88 0.00 0.00 0.00 0.00 0.00 57.16 56.01 1ibj n GLU 430 Cb 1.11 -1.48 0.00 0.00 0.00 0.00 0.00 31.44 31.07 1ibj n GLU 430 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ibj n ALA 431 N -0.10 2.35 -3.71 -1.84 0.00 0.76 -4.44 120.51 113.53 1ibj n ALA 431 Ca 0.13 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.40 1ibj n ALA 431 Cb 0.41 -1.00 -0.17 0.00 0.00 0.00 0.00 19.45 18.69 1ibj n ALA 431 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ibj s ARG 432 N -1.87 -0.03 -0.78 0.00 0.52 -1.25 -5.04 118.95 110.50 1ibj s ARG 432 Ca 0.00 0.35 -0.19 0.00 -0.52 0.00 0.00 55.73 55.37 1ibj s ARG 432 Cb 0.00 -0.36 -0.18 0.00 0.52 0.00 0.00 34.95 34.93 1ibj s ARG 432 CO 0.00 -0.26 2.00 0.41 0.02 0.00 0.00 175.30 177.47 1ibj n GLY 433 N 4.87 -0.30 3.20 -3.53 0.00 -1.26 -4.65 105.19 103.52 1ibj n GLY 433 Ca -0.13 0.12 0.04 0.00 0.00 0.00 0.00 46.02 46.05 1ibj n GLY 433 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ibj s LEU 434 N 10.85 -0.20 0.32 0.99 2.96 -1.26 -4.84 118.68 127.49 1ibj s LEU 434 Ca 0.77 0.21 -0.27 0.00 -0.22 0.00 0.00 54.13 54.62 1ibj s LEU 434 Cb -0.18 1.20 -0.09 0.00 0.50 0.00 0.00 46.19 47.62 1ibj s LEU 434 CO 0.18 -0.04 1.04 0.42 -1.32 0.00 0.00 176.35 176.63 1ibj s THR 435 N 2.48 3.72 -1.78 3.68 -4.23 -1.26 -4.61 115.64 113.65 1ibj s THR 435 Ca -0.03 1.57 0.00 0.00 -1.18 0.00 0.00 61.69 62.05 1ibj s THR 435 Cb -0.05 -3.93 0.00 0.00 1.34 0.00 0.00 72.50 69.86 1ibj s THR 435 CO -0.13 0.25 0.48 -1.84 -0.54 0.00 0.00 174.62 172.84 1ibj n GLU 436 N 0.78 0.00 -0.14 3.99 0.28 -1.26 -1.33 120.64 122.96 1ibj n GLU 436 Ca 0.01 0.02 0.06 0.00 -0.16 0.00 0.00 57.16 57.09 1ibj n GLU 436 Cb 0.47 -1.50 0.13 0.00 1.43 0.00 0.00 31.44 31.97 1ibj n GLU 436 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1ibj n ASP 437 N -0.98 2.73 -4.70 -1.84 5.75 -1.26 -4.15 116.55 112.10 1ibj n ASP 437 Ca 0.00 -1.86 -0.42 0.00 -0.01 0.00 0.00 54.79 52.50 1ibj n ASP 437 Cb 0.00 -0.18 -0.03 0.00 -1.03 0.00 0.00 41.12 39.88 1ibj n ASP 437 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1ibj s LEU 438 N -1.01 4.37 -0.16 -2.12 2.96 -0.44 -4.39 118.68 117.90 1ibj s LEU 438 Ca 0.22 2.58 -0.03 0.00 -0.22 0.00 0.00 54.13 56.69 1ibj s LEU 438 Cb 0.12 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 43.22 1ibj s LEU 438 CO 0.17 -0.89 -0.06 -0.69 -1.32 0.00 0.00 176.35 173.55 1ibj s VAL 439 N 2.19 3.56 -0.11 1.68 1.01 -0.03 -3.94 120.40 124.76 1ibj s VAL 439 Ca 0.74 -0.47 -0.03 0.00 0.00 0.00 0.00 61.98 62.23 1ibj s VAL 439 Cb -0.42 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 1ibj s VAL 439 CO 0.33 0.49 -0.01 -0.60 0.00 0.00 0.00 175.10 175.30 1ibj s ARG 440 N 0.59 3.26 -0.00 2.72 3.52 0.52 -1.18 118.95 128.38 1ibj s ARG 440 Ca -0.04 -0.45 0.08 0.00 -0.13 0.00 0.00 55.73 55.19 1ibj s ARG 440 Cb -0.15 -2.85 -0.02 0.00 -1.56 0.00 0.00 34.95 30.37 1ibj s ARG 440 CO 0.03 0.52 -0.25 0.42 -0.81 0.00 0.00 175.30 175.21 1ibj s ILE 441 N -0.38 1.97 -0.26 4.11 1.01 -0.23 -1.16 121.20 126.26 1ibj s ILE 441 Ca 0.07 -1.13 0.03 0.00 0.00 0.00 0.00 60.65 59.61 1ibj s ILE 441 Cb -0.12 -1.65 0.06 0.00 0.01 0.00 0.00 42.46 40.75 1ibj s ILE 441 CO 0.02 0.50 -0.11 -0.55 0.00 0.00 0.00 174.94 174.80 1ibj s SER 442 N -0.75 4.43 0.38 3.58 0.15 -0.06 -2.23 113.70 119.20 1ibj s SER 442 Ca 0.10 -1.35 -0.26 0.00 0.70 0.00 0.00 55.95 55.14 1ibj s SER 442 Cb -0.10 -1.56 -0.09 0.00 -1.71 0.00 0.00 66.02 62.57 1ibj s SER 442 CO -0.00 -0.19 1.15 0.00 1.20 0.00 0.00 173.24 175.40 1ibj s ALA 443 N 1.12 3.19 0.00 5.45 0.00 -0.77 -1.26 121.76 129.49 1ibj s ALA 443 Ca -0.08 0.93 0.00 0.00 0.00 0.00 0.00 51.96 52.81 1ibj s ALA 443 Cb -0.20 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1ibj s ALA 443 CO -0.05 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.68 1ibj n GLY 444 N 0.66 5.98 1.93 0.00 0.00 -1.26 -4.79 105.19 107.71 1ibj n GLY 444 Ca 0.04 -2.07 -0.08 0.00 0.00 0.00 0.00 46.02 43.91 1ibj n GLY 444 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ibj n ILE 445 N -0.05 2.93 -1.70 -0.61 -5.35 -0.60 -4.50 119.36 109.49 1ibj n ILE 445 Ca 0.00 -1.77 -0.24 0.00 -0.27 0.00 0.00 62.75 60.46 1ibj n ILE 445 Cb 0.00 -0.37 0.17 0.00 -1.74 0.00 0.00 39.64 37.71 1ibj n ILE 445 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1ibj n GLU 446 N -0.38 -1.22 -2.37 6.28 4.71 -1.26 -4.98 120.64 121.42 1ibj n GLU 446 Ca 0.42 -1.69 -0.43 0.00 -0.01 0.00 0.00 57.16 55.46 1ibj n GLU 446 Cb 1.39 -1.16 -0.02 0.00 -1.01 0.00 0.00 31.44 30.64 1ibj n GLU 446 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1ibj s ASP 447 N -4.95 6.92 0.58 1.62 -1.08 -1.26 -4.88 116.67 113.62 1ibj s ASP 447 Ca 0.62 1.79 0.39 0.00 -0.52 0.00 0.00 52.55 54.83 1ibj s ASP 447 Cb -0.02 -2.54 2.05 0.00 -1.46 0.00 0.00 42.92 40.95 1ibj s ASP 447 CO 0.44 -0.75 2.19 1.62 0.52 0.00 0.00 175.17 179.19 1ibj h VAL 448 N 5.41 0.00 0.00 1.11 3.04 -1.96 0.61 116.25 124.46 1ibj h VAL 448 Ca -0.29 -0.07 -0.14 0.00 -1.01 0.00 0.00 66.70 65.18 1ibj h VAL 448 Cb 1.12 0.98 -0.02 0.00 -2.01 0.00 0.00 31.29 31.36 1ibj h VAL 448 CO 0.95 0.00 -0.65 0.44 -1.01 0.00 0.00 177.57 177.30 1ibj h ASP 449 N 0.00 0.00 -0.19 3.17 3.32 -1.99 -0.63 116.42 120.10 1ibj h ASP 449 Ca 0.00 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.88 1ibj h ASP 449 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1ibj h ASP 449 CO 0.00 0.65 -0.54 0.44 -1.72 0.00 0.00 179.24 178.07 1ibj h ASP 450 N 0.00 0.81 -0.05 6.45 3.32 -1.28 -2.04 116.42 123.63 1ibj h ASP 450 Ca -0.01 -0.58 -0.03 0.00 0.02 0.00 0.00 57.03 56.43 1ibj h ASP 450 Cb 1.32 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1ibj h ASP 450 CO 0.09 1.25 -0.10 -0.07 -1.72 0.00 0.00 179.24 178.69 1ibj h LEU 451 N 0.42 0.17 -0.75 1.55 3.38 -1.37 -1.65 115.31 117.06 1ibj h LEU 451 Ca -0.01 -0.57 -0.04 0.00 0.09 0.00 0.00 57.88 57.35 1ibj h LEU 451 Cb 1.16 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 1ibj h LEU 451 CO 0.12 0.70 0.32 0.40 0.09 0.00 0.00 178.44 180.07 1ibj h ILE 452 N -0.36 1.25 -0.23 1.22 2.04 -1.22 -2.19 117.51 118.03 1ibj h ILE 452 Ca 0.00 -0.75 -0.07 0.00 1.00 0.00 0.00 64.86 65.04 1ibj h ILE 452 Cb 0.68 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1ibj h ILE 452 CO 0.02 0.31 -0.15 -1.28 0.00 0.00 0.00 178.15 177.05 1ibj h SER 453 N 1.07 0.37 -0.67 1.72 0.87 -1.42 -1.65 113.55 113.84 1ibj h SER 453 Ca 0.25 -0.09 -0.05 0.00 -1.23 0.00 0.00 61.79 60.67 1ibj h SER 453 Cb 0.18 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.01 1ibj h SER 453 CO -0.03 0.55 0.21 -0.78 -0.53 0.00 0.00 176.83 176.25 1ibj h ASP 454 N 0.35 0.98 -0.29 6.23 3.58 -0.80 -2.42 116.42 124.05 1ibj h ASP 454 Ca 0.07 -0.21 -0.17 0.00 0.42 0.00 0.00 57.03 57.14 1ibj h ASP 454 Cb 0.48 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.28 1ibj h ASP 454 CO 0.03 0.93 -0.47 -0.07 -2.88 0.00 0.00 179.24 176.78 1ibj h LEU 455 N 0.97 0.91 0.15 2.28 3.38 -1.09 -3.05 115.31 118.87 1ibj h LEU 455 Ca 0.21 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1ibj h LEU 455 Cb 0.30 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1ibj h LEU 455 CO -0.01 1.26 -0.14 -0.78 0.09 0.00 0.00 178.44 178.86 1ibj h ASP 456 N 0.60 -0.37 -0.75 -0.43 3.58 -1.18 -1.68 116.42 116.19 1ibj h ASP 456 Ca 0.02 0.03 0.10 0.00 0.42 0.00 0.00 57.03 57.61 1ibj h ASP 456 Cb 1.08 0.13 -0.08 0.00 1.72 0.00 0.00 39.33 42.18 1ibj h ASP 456 CO 0.11 -0.21 0.38 0.40 -2.88 0.00 0.00 179.24 177.03 1ibj h ILE 457 N -0.31 0.83 0.00 2.25 2.04 -1.51 -1.03 117.51 119.78 1ibj h ILE 457 Ca 0.00 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 1ibj h ILE 457 Cb 0.29 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.52 1ibj h ILE 457 CO -0.03 0.11 -0.10 0.00 0.00 0.00 0.00 178.15 178.13 1ibj h ALA 458 N 1.46 1.57 0.01 1.87 0.00 -1.26 -0.68 119.26 122.23 1ibj h ALA 458 Ca 0.37 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 54.99 1ibj h ALA 458 Cb 0.41 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1ibj h ALA 458 CO -0.28 0.13 -0.93 0.74 0.00 0.00 0.00 179.25 178.91 1ibj h PHE 459 N 0.00 0.07 0.00 0.00 -1.00 -0.34 -3.25 116.94 112.42 1ibj h PHE 459 Ca -0.00 -0.04 -0.14 0.00 2.81 0.00 0.00 57.97 60.60 1ibj h PHE 459 Cb 0.22 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 39.75 1ibj h PHE 459 CO 0.00 0.94 -0.79 0.87 -1.61 0.00 0.00 178.31 177.72 1ibj h LYS 460 N 0.02 0.00 -0.00 1.51 1.57 -0.47 -3.32 116.57 115.88 1ibj h LYS 460 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1ibj h LYS 460 Cb 1.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.93 1ibj h LYS 460 CO 0.13 0.53 -0.38 0.25 -0.57 0.00 0.00 179.45 179.41 1ibj n THR 461 N -3.17 0.00 -1.87 -0.16 -2.24 -0.38 -4.91 114.28 101.55 1ibj n THR 461 Ca -0.01 -0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.27 1ibj n THR 461 Cb 0.79 0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 69.36 1ibj n THR 461 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1ibj s PHE 462 N -2.72 1.66 0.26 4.78 5.36 -1.23 -4.97 117.98 121.12 1ibj s PHE 462 Ca 0.18 0.15 -0.30 0.00 -0.96 0.00 0.00 56.93 56.01 1ibj s PHE 462 Cb 0.18 -4.04 -0.10 0.00 -0.34 0.00 0.00 43.02 38.73 1ibj s PHE 462 CO 0.60 -4.16 1.40 -2.14 -1.46 0.00 0.00 175.22 169.46 1ibj s PRO 463 N 4.74 4.30 0.00 10.12 0.02 -1.26 -5.09 135.00 147.82 1ibj s PRO 463 Ca 0.82 2.25 0.11 0.00 0.02 0.00 0.00 61.00 64.20 1ibj s PRO 463 Cb -0.34 -3.11 0.08 0.00 0.02 0.00 0.00 34.50 31.15 1ibj s PRO 463 CO 0.34 -0.36 0.83 1.28 -0.33 0.00 0.00 177.00 178.77