#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i6z n SER 86 N 0.00 -1.32 -4.76 1.61 7.64 -1.26 -5.15 113.62 110.39 1i6z n SER 86 Ca 0.00 0.50 -0.33 0.00 1.01 0.00 0.00 58.87 60.05 1i6z n SER 86 Cb 0.00 1.49 0.07 0.00 -1.01 0.00 0.00 64.21 64.75 1i6z n SER 86 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1i6z s PRO 87 N -1.73 2.54 -0.09 1.43 0.04 -1.26 -5.05 135.00 130.88 1i6z s PRO 87 Ca 0.00 1.44 0.02 0.00 0.04 0.00 0.00 61.00 62.50 1i6z s PRO 87 Cb 0.00 -1.91 0.01 0.00 0.04 0.00 0.00 34.50 32.64 1i6z s PRO 87 CO 0.00 -1.46 -0.15 -1.21 0.04 0.00 0.00 177.00 174.22 1i6z s GLU 88 N -4.18 2.14 0.57 4.56 0.41 -1.26 -5.06 118.70 115.89 1i6z s GLU 88 Ca 0.68 -0.55 0.00 0.00 -0.41 0.00 0.00 54.97 54.69 1i6z s GLU 88 Cb -0.22 -1.76 0.00 0.00 -1.78 0.00 0.00 34.13 30.38 1i6z s GLU 88 CO 0.44 0.01 0.00 1.19 -0.49 0.00 0.00 175.26 176.42 1i6z n PHE 89 N 3.94 -3.95 -4.27 1.61 3.01 -1.26 -4.90 117.46 111.63 1i6z n PHE 89 Ca -0.20 2.16 -0.34 0.00 1.01 0.00 0.00 57.45 60.07 1i6z n PHE 89 Cb 0.52 -3.42 -0.13 0.00 -0.01 0.00 0.00 39.48 36.43 1i6z n PHE 89 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 1i6z s MET 90 N -4.99 3.47 -0.24 -1.08 -1.94 -1.26 -5.08 119.30 108.18 1i6z s MET 90 Ca 0.00 -0.60 -0.04 0.00 -1.71 0.00 0.00 55.69 53.34 1i6z s MET 90 Cb 0.00 -2.89 0.09 0.00 2.01 0.00 0.00 34.83 34.03 1i6z s MET 90 CO 0.00 0.04 0.14 -0.51 -0.01 0.00 0.00 175.02 174.68 1i6z s LEU 91 N 0.86 0.33 -0.35 -0.03 1.43 -1.26 -5.09 118.68 114.58 1i6z s LEU 91 Ca -0.01 -0.89 0.01 0.00 -1.03 0.00 0.00 54.13 52.20 1i6z s LEU 91 Cb -0.15 -0.16 0.11 0.00 0.03 0.00 0.00 46.19 46.02 1i6z s LEU 91 CO 0.01 -0.39 0.12 0.27 0.23 0.00 0.00 176.35 176.59 1i6z s ILE 92 N 2.16 1.31 0.00 -0.59 -4.36 -1.26 -5.07 121.20 113.39 1i6z s ILE 92 Ca 0.06 -1.86 0.00 0.00 -0.26 0.00 0.00 60.65 58.59 1i6z s ILE 92 Cb -0.16 -1.97 0.00 0.00 1.25 0.00 0.00 42.46 41.58 1i6z s ILE 92 CO -0.24 -0.70 0.00 0.61 0.24 0.00 0.00 174.94 174.84 1i6z n GLY 93 N 4.44 0.48 3.22 6.27 0.00 -1.26 -5.08 105.19 113.25 1i6z n GLY 93 Ca 0.01 -1.89 -0.11 0.00 0.00 0.00 0.00 46.02 44.03 1i6z n GLY 93 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1i6z s GLU 94 N -1.91 0.73 0.18 1.61 -1.05 -1.26 -5.18 118.70 111.82 1i6z s GLU 94 Ca 0.00 -0.49 -0.05 0.00 -0.15 0.00 0.00 54.97 54.28 1i6z s GLU 94 Cb 0.00 0.31 0.02 0.00 -0.44 0.00 0.00 34.13 34.02 1i6z s GLU 94 CO 0.00 -0.22 0.33 0.36 0.95 0.00 0.00 175.26 176.68 1i6z n LYS 95 N 0.78 0.48 -1.03 -4.83 2.85 -1.26 -5.15 118.16 110.00 1i6z n LYS 95 Ca -0.19 -1.13 0.14 0.00 -1.05 0.00 0.00 58.31 56.07 1i6z n LYS 95 Cb 0.58 1.30 -0.03 0.00 -0.65 0.00 0.00 35.03 36.23 1i6z n LYS 95 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1i6z n SER 96 N -1.44 -6.51 -3.82 -5.58 7.64 -1.26 -4.73 113.62 97.93 1i6z n SER 96 Ca -0.03 1.10 -0.30 0.00 1.01 0.00 0.00 58.87 60.66 1i6z n SER 96 Cb 0.28 -3.10 -0.13 0.00 -1.01 0.00 0.00 64.21 60.24 1i6z n SER 96 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1i6z s ASN 97 N -5.84 3.94 0.00 6.43 -0.87 -1.26 -5.03 114.94 112.31 1i6z s ASN 97 Ca 0.00 -2.78 0.00 0.00 -1.57 0.00 0.00 52.86 48.51 1i6z s ASN 97 Cb 0.00 -1.30 0.00 0.00 -0.02 0.00 0.00 41.25 39.93 1i6z s ASN 97 CO 0.00 -0.25 0.18 -0.81 -2.57 0.00 0.00 177.10 173.65 1i6z n PRO 98 N 3.38 0.00 0.02 -0.60 -0.04 -1.26 -2.85 135.00 133.65 1i6z n PRO 98 Ca 0.07 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.62 1i6z n PRO 98 Cb 0.33 -0.61 0.53 0.00 -0.04 0.00 0.00 33.50 33.71 1i6z n PRO 98 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1i6z h GLU 99 N 0.00 0.32 -0.82 0.54 4.39 -1.99 -1.28 114.58 115.75 1i6z h GLU 99 Ca 0.00 -0.02 0.06 0.00 0.34 0.00 0.00 59.36 59.75 1i6z h GLU 99 Cb 0.00 -0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 28.52 1i6z h GLU 99 CO 0.00 0.21 0.49 0.93 -1.16 0.00 0.00 179.01 179.49 1i6z h GLU 100 N 0.33 0.87 -0.36 2.33 5.08 -1.98 -0.32 114.58 120.53 1i6z h GLU 100 Ca 0.18 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.35 1i6z h GLU 100 Cb 0.30 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1i6z h GLU 100 CO -0.04 0.57 -0.34 0.93 -1.00 0.00 0.00 179.01 179.13 1i6z h GLU 101 N 0.89 0.83 -0.06 2.33 5.08 -1.09 -1.84 114.58 120.72 1i6z h GLU 101 Ca 0.36 -0.41 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1i6z h GLU 101 Cb 0.19 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 1i6z h GLU 101 CO -0.18 1.04 0.03 0.28 -1.00 0.00 0.00 179.01 179.18 1i6z h VAL 102 N 0.69 1.10 -0.17 3.13 2.07 -0.74 0.78 116.25 123.11 1i6z h VAL 102 Ca 0.07 -0.28 -0.09 0.00 0.82 0.00 0.00 66.70 67.22 1i6z h VAL 102 Cb 0.90 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 1i6z h VAL 102 CO 0.08 0.08 -0.28 -0.33 0.02 0.00 0.00 177.57 177.14 1i6z h GLU 103 N -0.01 0.33 -0.14 1.57 4.39 -1.13 -2.68 114.58 116.91 1i6z h GLU 103 Ca 0.02 -0.12 -0.19 0.00 0.34 0.00 0.00 59.36 59.41 1i6z h GLU 103 Cb 0.10 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1i6z h GLU 103 CO -0.00 0.59 -0.67 1.25 -1.16 0.00 0.00 179.01 179.01 1i6z h LEU 104 N 0.29 0.66 -0.81 1.33 5.85 -0.99 -2.98 115.31 118.66 1i6z h LEU 104 Ca 0.04 -0.40 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 1i6z h LEU 104 Cb 0.66 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 1i6z h LEU 104 CO 0.05 1.15 0.48 0.11 -0.34 0.00 0.00 178.44 179.89 1i6z h LYS 105 N 0.41 1.10 -0.29 1.25 1.57 0.92 0.32 116.57 121.85 1i6z h LYS 105 Ca -0.02 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.61 1i6z h LYS 105 Cb 1.25 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 1i6z h LYS 105 CO 0.13 0.78 0.01 0.87 -0.57 0.00 0.00 179.45 180.67 1i6z h LYS 106 N 1.11 0.51 -0.83 3.15 1.57 -1.53 -2.52 116.57 118.03 1i6z h LYS 106 Ca 0.29 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1i6z h LYS 106 Cb -0.03 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 1i6z h LYS 106 CO -0.05 0.65 0.54 1.25 -0.57 0.00 0.00 179.45 181.27 1i6z h LEU 107 N 0.30 0.96 -0.24 2.94 7.12 -1.32 -2.42 115.31 122.64 1i6z h LEU 107 Ca 0.08 -0.03 0.02 0.00 0.13 0.00 0.00 57.88 58.09 1i6z h LEU 107 Cb 0.41 -0.24 -0.03 0.00 -0.53 0.00 0.00 40.66 40.28 1i6z h LEU 107 CO 0.01 0.70 0.08 0.50 -0.13 0.00 0.00 178.44 179.60 1i6z h LYS 108 N 1.13 0.19 -0.77 1.25 3.64 -0.63 -0.96 116.57 120.42 1i6z h LYS 108 Ca 0.30 -0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.78 1i6z h LYS 108 Cb -0.12 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.60 1i6z h LYS 108 CO -0.06 0.12 0.50 0.22 -2.27 0.00 0.00 179.45 177.96 1i6z h ASP 109 N 0.19 0.57 -0.51 4.20 1.82 -1.02 0.13 116.42 121.81 1i6z h ASP 109 Ca 0.11 0.02 -0.10 0.00 -0.39 0.00 0.00 57.03 56.67 1i6z h ASP 109 Cb 0.07 -0.10 -0.02 0.00 0.68 0.00 0.00 39.33 39.96 1i6z h ASP 109 CO -0.11 0.33 -0.04 0.25 -1.61 0.00 0.00 179.24 178.06 1i6z h LEU 110 N 0.63 0.95 -1.02 2.28 6.46 -0.91 -2.35 115.31 121.35 1i6z h LEU 110 Ca 0.36 -0.28 -0.04 0.00 -0.12 0.00 0.00 57.88 57.80 1i6z h LEU 110 Cb 0.55 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 40.19 1i6z h LEU 110 CO -0.13 1.03 0.24 -0.08 -0.62 0.00 0.00 178.44 178.87 1i6z h GLU 111 N 0.88 0.94 -0.20 1.25 4.81 0.02 -0.50 114.58 121.78 1i6z h GLU 111 Ca 0.15 -0.16 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1i6z h GLU 111 Cb 0.58 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1i6z h GLU 111 CO 0.03 0.78 0.02 0.28 -0.73 0.00 0.00 179.01 179.39 1i6z h VAL 112 N 0.92 1.24 -0.70 0.32 2.07 -1.11 1.44 116.25 120.42 1i6z h VAL 112 Ca 0.21 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 66.94 1i6z h VAL 112 Cb 0.21 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 1i6z h VAL 112 CO -0.02 0.25 0.47 0.28 0.02 0.00 0.00 177.57 178.57 1i6z h SER 113 N 0.12 0.81 -0.41 0.57 0.02 -1.24 0.15 113.55 113.57 1i6z h SER 113 Ca 0.06 -0.02 -0.14 0.00 -0.84 0.00 0.00 61.79 60.85 1i6z h SER 113 Cb 0.35 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1i6z h SER 113 CO 0.01 0.58 -0.28 0.00 -1.14 0.00 0.00 176.83 176.00 1i6z h ALA 114 N 1.56 0.68 -0.69 3.77 0.00 -0.51 -2.85 119.26 121.22 1i6z h ALA 114 Ca 0.26 -0.41 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1i6z h ALA 114 Cb -0.11 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 1i6z h ALA 114 CO -0.06 0.67 0.46 1.49 0.00 0.00 0.00 179.25 181.81 1i6z h GLU 115 N 0.79 0.89 -0.19 0.00 4.22 0.46 0.23 114.58 120.97 1i6z h GLU 115 Ca 0.09 -0.05 -0.05 0.00 0.08 0.00 0.00 59.36 59.43 1i6z h GLU 115 Cb 0.86 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 1i6z h GLU 115 CO 0.08 0.59 -0.06 -0.22 -2.18 0.00 0.00 179.01 177.21 1i6z h LYS 116 N 0.91 0.37 -0.58 1.92 3.64 -0.74 0.78 116.57 122.88 1i6z h LYS 116 Ca 0.26 -0.15 -0.07 0.00 -1.27 0.00 0.00 60.65 59.42 1i6z h LYS 116 Cb -0.07 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 1i6z h LYS 116 CO -0.06 0.65 0.11 -0.84 -2.27 0.00 0.00 179.45 177.03 1i6z h ILE 117 N 0.08 1.25 -0.15 2.00 3.07 -1.25 -1.04 117.51 121.48 1i6z h ILE 117 Ca 0.05 -0.96 -0.09 0.00 1.55 0.00 0.00 64.86 65.40 1i6z h ILE 117 Cb 0.52 0.76 -0.01 0.00 -0.27 0.00 0.00 36.82 37.82 1i6z h ILE 117 CO 0.02 0.35 -0.33 0.00 -1.05 0.00 0.00 178.15 177.15 1i6z h ALA 118 N 1.01 1.17 -0.29 0.16 0.00 -0.44 -2.61 119.26 118.26 1i6z h ALA 118 Ca 0.18 -0.36 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1i6z h ALA 118 Cb 0.40 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1i6z h ALA 118 CO 0.01 0.54 -0.23 -0.91 0.00 0.00 0.00 179.25 178.67 1i6z h ASN 119 N 0.26 0.70 -0.67 0.00 4.21 0.11 -2.59 115.58 117.59 1i6z h ASN 119 Ca 0.03 -0.45 -0.03 0.00 1.21 0.00 0.00 56.30 57.07 1i6z h ASN 119 Cb 0.71 -0.20 -0.03 0.00 -1.12 0.00 0.00 38.32 37.68 1i6z h ASN 119 CO 0.05 1.00 0.33 -0.74 -1.29 0.00 0.00 177.43 176.78 1i6z h HIS 120 N 0.41 0.98 0.02 1.19 2.76 -1.09 -1.30 115.15 118.12 1i6z h HIS 120 Ca 0.05 -0.04 -0.00 0.00 -2.20 0.00 0.00 60.37 58.18 1i6z h HIS 120 Cb 0.78 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 29.43 1i6z h HIS 120 CO 0.07 0.72 -0.01 1.25 -1.30 0.00 0.00 177.93 178.66 1i6z h LEU 121 N 0.98 -0.02 -1.42 0.26 6.46 -1.39 0.22 115.31 120.40 1i6z h LEU 121 Ca 0.24 -0.23 -0.02 0.00 -0.12 0.00 0.00 57.88 57.75 1i6z h LEU 121 Cb 0.11 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.02 1i6z h LEU 121 CO -0.03 0.22 0.19 1.56 -0.62 0.00 0.00 178.44 179.75 1i6z h GLN 122 N -0.26 0.58 -0.15 1.25 1.08 -1.30 0.15 115.11 116.45 1i6z h GLN 122 Ca -0.00 -0.07 -0.07 0.00 -1.45 0.00 0.00 58.65 57.06 1i6z h GLN 122 Cb 0.25 -0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.56 1i6z h GLN 122 CO 0.00 0.46 -0.19 1.49 -0.95 0.00 0.00 178.83 179.64 1i6z h GLU 123 N 0.58 0.40 -0.55 1.46 4.22 -1.05 -1.36 114.58 118.28 1i6z h GLU 123 Ca 0.15 -0.23 0.01 0.00 0.08 0.00 0.00 59.36 59.37 1i6z h GLU 123 Cb 0.08 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1i6z h GLU 123 CO -0.02 0.80 0.37 1.25 -2.18 0.00 0.00 179.01 179.23 1i6z h LEU 124 N 0.02 0.63 -0.19 1.64 5.85 0.01 0.57 115.31 123.83 1i6z h LEU 124 Ca 0.02 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1i6z h LEU 124 Cb 0.75 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1i6z h LEU 124 CO 0.05 0.45 -0.03 0.78 -0.34 0.00 0.00 178.44 179.35 1i6z h ASN 125 N 0.74 0.36 -0.20 1.25 -0.26 -0.48 0.22 115.58 117.21 1i6z h ASN 125 Ca 0.20 -0.35 -0.08 0.00 -0.56 0.00 0.00 56.30 55.51 1i6z h ASN 125 Cb -0.08 -0.10 -0.00 0.00 -1.06 0.00 0.00 38.32 37.08 1i6z h ASN 125 CO -0.04 0.63 -0.18 0.11 -1.06 0.00 0.00 177.43 176.89 1i6z h LYS 126 N 0.09 0.47 -0.37 0.81 1.57 -0.61 -1.71 116.57 116.83 1i6z h LYS 126 Ca 0.05 -0.24 -0.12 0.00 -1.87 0.00 0.00 60.65 58.47 1i6z h LYS 126 Cb 0.46 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 1i6z h LYS 126 CO 0.02 0.81 -0.23 1.49 -0.57 0.00 0.00 179.45 180.96 1i6z h GLU 127 N 0.15 0.81 -0.22 3.15 4.81 0.11 0.30 114.58 123.69 1i6z h GLU 127 Ca 0.03 -0.38 -0.06 0.00 -0.13 0.00 0.00 59.36 58.83 1i6z h GLU 127 Cb 0.71 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 1i6z h GLU 127 CO 0.05 1.01 -0.09 1.25 -0.73 0.00 0.00 179.01 180.49 1i6z h LEU 128 N 0.60 0.46 -0.68 1.64 5.85 -0.61 -1.07 115.31 121.50 1i6z h LEU 128 Ca 0.08 -0.40 -0.14 0.00 0.84 0.00 0.00 57.88 58.26 1i6z h LEU 128 Cb 0.80 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 1i6z h LEU 128 CO 0.06 0.75 -0.51 0.28 -0.34 0.00 0.00 178.44 178.69 1i6z h SER 129 N 0.16 0.43 -0.48 1.25 0.02 -1.33 1.37 113.55 114.97 1i6z h SER 129 Ca 0.05 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.77 1i6z h SER 129 Cb 0.57 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 1i6z h SER 129 CO 0.03 0.87 0.24 1.23 -1.14 0.00 0.00 176.83 178.06 1i6z h GLY 130 N 1.22 0.73 1.48 -3.77 0.00 -0.30 -1.15 103.07 101.27 1i6z h GLY 130 Ca 0.01 -0.35 -0.13 0.00 0.00 0.00 0.00 47.33 46.87 1i6z h GLY 130 CO 0.09 0.33 -0.37 -2.22 0.00 0.00 0.00 176.54 174.37 1i6z h ILE 131 N 0.63 1.29 -4.98 2.60 2.04 -0.96 -3.46 117.51 114.67 1i6z h ILE 131 Ca 0.17 -1.51 -0.38 0.00 1.00 0.00 0.00 64.86 64.13 1i6z h ILE 131 Cb 0.09 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1i6z h ILE 131 CO -0.02 0.48 -0.57 0.00 0.00 0.00 0.00 178.15 178.04 1i6z n GLN 132 N -4.05 -3.96 -0.16 2.37 6.02 0.47 -4.77 117.38 113.29 1i6z n GLN 132 Ca -0.01 0.66 0.13 0.00 -0.01 0.00 0.00 57.00 57.76 1i6z n GLN 132 Cb 0.50 -5.43 0.24 0.00 1.02 0.00 0.00 30.24 26.57 1i6z n GLN 132 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1i6z n GLN 133 N -3.81 -0.03 -1.53 -1.09 0.00 -1.19 -4.20 117.38 105.52 1i6z n GLN 133 Ca -0.06 0.69 -0.41 0.00 -0.00 0.00 0.00 57.00 57.21 1i6z n GLN 133 Cb 0.58 -1.19 -0.05 0.00 0.00 0.00 0.00 30.24 29.58 1i6z n GLN 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1i6z n GLY 134 N -1.16 0.34 1.96 1.69 0.00 -1.26 -4.58 105.19 102.18 1i6z n GLY 134 Ca 0.16 0.81 -0.01 0.00 0.00 0.00 0.00 46.02 46.98 1i6z n GLY 134 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1i6z n PHE 135 N 13.05 -0.88 -4.22 1.61 -0.00 -1.26 -5.14 117.46 120.62 1i6z n PHE 135 Ca 0.40 -0.74 -0.10 0.00 -0.00 0.00 0.00 57.45 57.02 1i6z n PHE 135 Cb 0.39 0.97 -0.02 0.00 -0.00 0.00 0.00 39.48 40.82 1i6z n PHE 135 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 1i6z n LEU 136 N -0.66 0.00 -4.56 -2.13 4.77 -1.26 -5.07 117.00 108.09 1i6z n LEU 136 Ca -0.08 -1.07 -0.29 0.00 -0.03 0.00 0.00 56.01 54.54 1i6z n LEU 136 Cb 0.66 0.22 0.23 0.00 -2.33 0.00 0.00 43.42 42.20 1i6z n LEU 136 CO -0.07 -0.16 0.57 0.00 -1.33 0.00 0.00 177.39 176.40 1i6z s ALA 137 N -2.33 0.21 0.48 -1.18 0.00 -1.26 -4.38 121.76 113.31 1i6z s ALA 137 Ca 0.03 -0.47 0.17 0.00 0.00 0.00 0.00 51.96 51.69 1i6z s ALA 137 Cb 0.00 -3.09 1.18 0.00 0.00 0.00 0.00 23.12 21.22 1i6z s ALA 137 CO 0.02 -3.51 2.03 1.57 0.00 0.00 0.00 175.76 175.87 1i6z h LYS 138 N -2.44 0.20 -0.10 0.00 5.09 -2.01 0.85 116.57 118.15 1i6z h LYS 138 Ca -0.54 -0.01 -0.02 0.00 0.09 0.00 0.00 60.65 60.16 1i6z h LYS 138 Cb 1.33 -0.04 -0.00 0.00 0.10 0.00 0.00 32.23 33.61 1i6z h LYS 138 CO 0.48 0.13 -0.03 0.93 -2.09 0.00 0.00 179.45 178.87 1i6z h GLU 139 N 0.20 0.20 0.21 0.07 5.08 -1.99 -1.67 114.58 116.69 1i6z h GLU 139 Ca 0.19 -0.08 -0.33 0.00 -1.00 0.00 0.00 59.36 58.15 1i6z h GLU 139 Cb 0.50 -0.01 0.04 0.00 0.50 0.00 0.00 28.75 29.78 1i6z h GLU 139 CO -0.03 0.52 -1.41 -0.07 -1.00 0.00 0.00 179.01 177.03 1i6z h LEU 140 N -0.13 0.86 -0.03 1.33 -0.00 -1.72 -2.47 115.31 113.16 1i6z h LEU 140 Ca 0.03 -0.88 0.01 0.00 -0.00 0.00 0.00 57.88 57.04 1i6z h LEU 140 Cb 0.45 -0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 40.82 1i6z h LEU 140 CO 0.01 1.68 -0.03 1.56 -0.00 0.00 0.00 178.44 181.66 1i6z h GLN 141 N 0.19 -0.03 -0.37 1.13 1.08 0.62 0.96 115.11 118.69 1i6z h GLN 141 Ca -0.23 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 56.92 1i6z h GLN 141 Cb 2.09 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 29.51 1i6z h GLN 141 CO 0.27 -0.02 0.03 0.00 -0.95 0.00 0.00 178.83 178.15 1i6z h ALA 142 N 1.00 1.36 0.00 3.87 0.00 -1.42 0.39 119.26 124.46 1i6z h ALA 142 Ca 0.02 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1i6z h ALA 142 Cb 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1i6z h ALA 142 CO -0.06 0.45 -0.00 0.93 0.00 0.00 0.00 179.25 180.57 1i6z h GLU 143 N 0.55 -0.00 -0.12 0.00 4.39 -0.80 -0.27 114.58 118.33 1i6z h GLU 143 Ca 0.12 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.78 1i6z h GLU 143 Cb 0.31 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1i6z h GLU 143 CO 0.01 0.29 -0.10 0.00 -1.16 0.00 0.00 179.01 178.05 1i6z h ALA 144 N 0.71 0.18 -0.26 3.43 0.00 0.12 -0.90 119.26 122.54 1i6z h ALA 144 Ca -0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1i6z h ALA 144 Cb 0.29 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1i6z h ALA 144 CO 0.00 0.01 0.16 -0.07 0.00 0.00 0.00 179.25 179.35 1i6z h LEU 145 N -0.10 0.30 -0.88 0.00 4.07 -0.29 0.52 115.31 118.93 1i6z h LEU 145 Ca 0.02 -0.04 -0.08 0.00 0.08 0.00 0.00 57.88 57.87 1i6z h LEU 145 Cb 0.60 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.24 1i6z h LEU 145 CO 0.03 0.25 -0.02 0.00 -1.08 0.00 0.00 178.44 177.62 1i6z h LYS 147 N 0.75 0.39 -0.17 0.00 3.11 -0.70 -1.06 116.57 118.88 1i6z h LYS 147 Ca 0.14 -0.18 -0.03 0.00 -2.81 0.00 0.00 60.65 57.77 1i6z h LYS 147 Cb 0.48 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.70 1i6z h LYS 147 CO 0.02 0.72 0.01 1.25 -2.81 0.00 0.00 179.45 178.64 1i6z h LEU 148 N 0.32 0.29 -0.39 5.20 7.12 0.65 -1.96 115.31 126.54 1i6z h LEU 148 Ca 0.03 -0.30 -0.02 0.00 0.13 0.00 0.00 57.88 57.72 1i6z h LEU 148 Cb 0.83 -0.08 -0.02 0.00 -0.53 0.00 0.00 40.66 40.87 1i6z h LEU 148 CO 0.07 0.51 0.16 -0.78 -0.13 0.00 0.00 178.44 178.27 1i6z h ASP 149 N 0.05 0.53 -0.59 1.25 3.58 -1.03 -1.81 116.42 118.40 1i6z h ASP 149 Ca 0.05 -0.17 -0.01 0.00 0.42 0.00 0.00 57.03 57.32 1i6z h ASP 149 Cb 0.36 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.24 1i6z h ASP 149 CO 0.01 0.55 0.33 0.08 -2.88 0.00 0.00 179.24 177.33 1i6z h ARG 150 N 0.48 0.84 -0.15 0.28 -0.00 -1.15 -0.89 114.38 113.80 1i6z h ARG 150 Ca 0.13 -0.09 -0.11 0.00 -0.00 0.00 0.00 59.98 59.91 1i6z h ARG 150 Cb 0.19 -0.17 -0.01 0.00 -0.00 0.00 0.00 29.97 29.97 1i6z h ARG 150 CO -0.01 0.63 -0.41 -0.22 -0.00 0.00 0.00 179.97 179.96 1i6z h LYS 151 N 0.85 0.33 -0.63 0.08 3.11 -1.10 -1.52 116.57 117.70 1i6z h LYS 151 Ca 0.22 -0.16 -0.01 0.00 -2.81 0.00 0.00 60.65 57.89 1i6z h LYS 151 Cb 0.03 -0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.23 1i6z h LYS 151 CO -0.04 0.69 0.35 0.28 -2.81 0.00 0.00 179.45 177.92 1i6z h VAL 152 N 0.28 1.19 -0.69 2.00 2.07 -0.34 -1.20 116.25 119.56 1i6z h VAL 152 Ca 0.03 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 1i6z h VAL 152 Cb 0.84 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 1i6z h VAL 152 CO 0.07 0.20 0.37 0.11 0.02 0.00 0.00 177.57 178.34 1i6z h LYS 153 N 0.87 0.95 -0.87 1.57 1.57 -0.19 -1.61 116.57 118.86 1i6z h LYS 153 Ca 0.22 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1i6z h LYS 153 Cb 0.01 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.09 1i6z h LYS 153 CO -0.04 0.70 0.53 0.00 -0.57 0.00 0.00 179.45 180.08 1i6z h ALA 154 N 1.45 1.11 -0.59 3.86 0.00 -0.92 -0.35 119.26 123.82 1i6z h ALA 154 Ca 0.24 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 1i6z h ALA 154 Cb 0.03 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1i6z h ALA 154 CO -0.04 0.56 -0.01 1.15 0.00 0.00 0.00 179.25 180.91 1i6z h THR 155 N 1.19 1.26 -0.81 0.00 2.02 -1.14 -2.49 112.91 112.95 1i6z h THR 155 Ca 0.31 -1.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.33 1i6z h THR 155 Cb -0.06 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 1i6z h THR 155 CO -0.06 0.42 0.47 0.40 0.37 0.00 0.00 175.52 177.12 1i6z h ILE 156 N 0.94 1.23 -0.46 3.11 2.04 -0.58 -1.63 117.51 122.16 1i6z h ILE 156 Ca 0.17 -0.53 -0.08 0.00 1.00 0.00 0.00 64.86 65.43 1i6z h ILE 156 Cb 0.56 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 1i6z h ILE 156 CO 0.03 0.25 -0.02 1.05 0.00 0.00 0.00 178.15 179.45 1i6z h GLU 157 N 1.11 0.77 -0.10 2.37 4.11 -0.83 1.15 114.58 123.16 1i6z h GLU 157 Ca 0.29 -0.22 -0.03 0.00 0.07 0.00 0.00 59.36 59.47 1i6z h GLU 157 Cb -0.02 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.14 1i6z h GLU 157 CO -0.05 0.80 -0.05 1.96 0.07 0.00 0.00 179.01 181.74 1i6z h GLN 158 N 0.72 0.21 -0.25 1.06 4.20 -1.08 0.15 115.11 120.12 1i6z h GLN 158 Ca 0.14 -0.09 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 1i6z h GLN 158 Cb 0.47 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1i6z h GLN 158 CO 0.02 0.56 -0.15 0.74 -0.67 0.00 0.00 178.83 179.34 1i6z h PHE 159 N -0.15 0.64 -0.75 2.96 0.04 -1.18 -2.70 116.94 115.80 1i6z h PHE 159 Ca 0.02 -0.17 -0.03 0.00 2.80 0.00 0.00 57.97 60.59 1i6z h PHE 159 Cb 0.50 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.47 1i6z h PHE 159 CO 0.07 0.82 0.33 0.52 -0.60 0.00 0.00 178.31 179.45 1i6z h MET 160 N 0.27 1.09 -0.86 1.51 2.86 0.14 -1.18 114.93 118.75 1i6z h MET 160 Ca 0.05 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 1i6z h MET 160 Cb 0.67 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 32.10 1i6z h MET 160 CO 0.04 0.86 0.54 0.87 1.06 0.00 0.00 176.91 180.28 1i6z h LYS 161 N 1.07 1.16 -0.35 1.72 1.79 -0.61 -0.29 116.57 121.05 1i6z h LYS 161 Ca 0.25 -0.09 -0.14 0.00 -2.18 0.00 0.00 60.65 58.50 1i6z h LYS 161 Cb 0.15 -0.25 -0.01 0.00 -1.58 0.00 0.00 32.23 30.54 1i6z h LYS 161 CO -0.03 0.80 -0.33 0.82 -1.08 0.00 0.00 179.45 179.63 1i6z h ILE 162 N 1.18 1.28 -0.19 1.86 2.04 -1.11 -2.69 117.51 119.88 1i6z h ILE 162 Ca 0.31 -1.48 -0.00 0.00 1.00 0.00 0.00 64.86 64.68 1i6z h ILE 162 Cb -0.08 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 1i6z h ILE 162 CO -0.06 0.49 0.10 0.25 0.00 0.00 0.00 178.15 178.93 1i6z h LEU 163 N 0.66 0.24 -1.36 1.44 6.46 -0.61 -0.94 115.31 121.20 1i6z h LEU 163 Ca 0.07 -0.08 0.05 0.00 -0.12 0.00 0.00 57.88 57.80 1i6z h LEU 163 Cb 0.87 -0.06 -0.04 0.00 -0.73 0.00 0.00 40.66 40.70 1i6z h LEU 163 CO 0.08 0.25 0.48 -0.33 -0.62 0.00 0.00 178.44 178.30 1i6z h GLU 164 N 0.20 0.77 -0.16 1.25 5.08 -1.00 1.17 114.58 121.89 1i6z h GLU 164 Ca 0.07 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 1i6z h GLU 164 Cb 0.07 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.14 1i6z h GLU 164 CO -0.01 0.51 -0.12 0.93 -1.00 0.00 0.00 179.01 179.32 1i6z h GLU 165 N 0.80 0.36 -0.46 2.33 5.08 -1.12 -2.45 114.58 119.13 1i6z h GLU 165 Ca 0.31 -0.18 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 1i6z h GLU 165 Cb 0.19 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1i6z h GLU 165 CO -0.10 0.71 -0.05 0.82 -1.00 0.00 0.00 179.01 179.39 1i6z h ILE 166 N 0.02 1.25 -0.91 3.13 2.04 -0.51 -2.33 117.51 120.20 1i6z h ILE 166 Ca 0.03 -1.08 0.12 0.00 1.00 0.00 0.00 64.86 64.93 1i6z h ILE 166 Cb 0.63 0.95 -0.07 0.00 -0.74 0.00 0.00 36.82 37.59 1i6z h ILE 166 CO 0.03 0.37 0.58 -0.78 0.00 0.00 0.00 178.15 178.36 1i6z h ASP 167 N 0.73 0.76 -0.66 1.72 1.82 0.16 -1.33 116.42 119.61 1i6z h ASP 167 Ca 0.13 0.03 -0.42 0.00 -0.39 0.00 0.00 57.03 56.39 1i6z h ASP 167 Cb 0.51 -0.12 -0.25 0.00 0.68 0.00 0.00 39.33 40.15 1i6z h ASP 167 CO 0.03 0.41 0.03 0.35 -1.61 0.00 0.00 179.24 178.45 1i6z n THR 168 N -4.56 2.87 -3.18 2.25 -2.24 -0.94 -5.02 114.28 103.45 1i6z n THR 168 Ca 0.17 -3.08 -0.30 0.00 -2.27 0.00 0.00 64.05 58.56 1i6z n THR 168 Cb 0.38 -0.73 -0.04 0.00 -2.10 0.00 0.00 70.33 67.85 1i6z n THR 168 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1i6z s MET 169 N -3.48 3.73 -0.07 -0.78 1.75 -0.50 -5.01 119.30 114.94 1i6z s MET 169 Ca 0.52 0.24 -0.26 0.00 -1.25 0.00 0.00 55.69 54.94 1i6z s MET 169 Cb 0.44 -2.55 -0.03 0.00 2.84 0.00 0.00 34.83 35.53 1i6z s MET 169 CO 0.02 0.15 0.83 0.08 -0.65 0.00 0.00 175.02 175.44 1i6z s VAL 170 N -2.12 4.94 -0.30 10.11 1.01 -1.26 -5.03 120.40 127.75 1i6z s VAL 170 Ca 0.47 1.70 -0.12 0.00 0.00 0.00 0.00 61.98 64.03 1i6z s VAL 170 Cb -0.11 -4.16 0.14 0.00 0.00 0.00 0.00 36.38 32.26 1i6z s VAL 170 CO 0.28 0.16 0.78 -0.22 0.00 0.00 0.00 175.10 176.10 1i6z s LEU 171 N 1.22 -0.92 0.76 3.92 0.20 -1.26 -5.17 118.68 117.43 1i6z s LEU 171 Ca 0.43 1.27 -0.11 0.00 0.69 0.00 0.00 54.13 56.41 1i6z s LEU 171 Cb -0.18 2.06 0.05 0.00 -0.43 0.00 0.00 46.19 47.68 1i6z s LEU 171 CO 0.20 -0.18 1.08 -2.16 -0.29 0.00 0.00 176.35 175.00 1i6z s PRO 172 N 2.69 2.35 -0.53 0.98 0.04 -1.26 -4.99 135.00 134.27 1i6z s PRO 172 Ca -0.05 0.96 -0.21 0.00 0.04 0.00 0.00 61.00 61.74 1i6z s PRO 172 Cb -0.10 -1.92 0.05 0.00 0.04 0.00 0.00 34.50 32.58 1i6z s PRO 172 CO -0.18 -1.52 0.76 -2.00 0.04 0.00 0.00 177.00 174.10 1i6z s GLU 173 N -5.00 3.20 0.05 4.56 -6.30 -1.26 -4.45 118.70 109.49 1i6z s GLU 173 Ca 0.60 -0.67 0.00 0.00 -2.50 0.00 0.00 54.97 52.40 1i6z s GLU 173 Cb -0.16 -4.09 0.00 0.00 0.00 0.00 0.00 34.13 29.88 1i6z s GLU 173 CO 0.55 -1.35 0.00 0.94 0.02 0.00 0.00 175.26 175.42 1i6z n GLN 174 N 6.71 0.00 -1.64 4.30 7.27 -1.26 -5.10 117.38 127.66 1i6z n GLN 174 Ca -0.03 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.61 1i6z n GLN 174 Cb 0.46 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 33.08 1i6z n GLN 174 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1i6z s PHE 175 N -2.00 1.21 -0.01 3.69 0.08 -1.26 -4.86 117.98 114.82 1i6z s PHE 175 Ca 0.00 0.66 -0.26 0.00 0.12 0.00 0.00 56.93 57.46 1i6z s PHE 175 Cb 0.00 -3.91 -0.20 0.00 -0.57 0.00 0.00 43.02 38.34 1i6z s PHE 175 CO 0.00 -3.80 1.30 0.87 -0.10 0.00 0.00 175.22 173.48 1i6z h LYS 176 N 15.40 -0.00 -0.31 0.44 1.57 -1.98 -1.71 116.57 129.97 1i6z h LYS 176 Ca -0.38 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.34 1i6z h LYS 176 Cb 1.24 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 1i6z h LYS 176 CO 0.99 0.45 -0.04 0.22 -0.57 0.00 0.00 179.45 180.50 1i6z h ASP 177 N -0.46 0.57 -0.62 0.86 1.82 -1.99 -1.70 116.42 114.90 1i6z h ASP 177 Ca -0.00 -0.34 0.01 0.00 -0.39 0.00 0.00 57.03 56.31 1i6z h ASP 177 Cb 0.46 -0.16 -0.03 0.00 0.68 0.00 0.00 39.33 40.28 1i6z h ASP 177 CO 0.00 0.78 0.41 -1.28 -1.61 0.00 0.00 179.24 177.54 1i6z h SER 178 N 0.36 0.70 -0.09 2.28 0.87 -1.89 -0.77 113.55 114.99 1i6z h SER 178 Ca 0.08 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 1i6z h SER 178 Cb 0.51 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.30 1i6z h SER 178 CO 0.02 0.50 -0.02 -0.09 -0.53 0.00 0.00 176.83 176.71 1i6z h ARG 179 N 0.83 0.18 -0.71 2.24 9.65 -1.25 -2.41 114.38 122.90 1i6z h ARG 179 Ca 0.23 -0.07 0.03 0.00 -1.10 0.00 0.00 59.98 59.07 1i6z h ARG 179 Cb -0.07 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.46 1i6z h ARG 179 CO -0.06 0.49 0.47 1.25 2.80 0.00 0.00 179.97 184.92 1i6z h LEU 180 N -0.15 0.76 -0.16 3.80 7.12 -1.17 -1.70 115.31 123.81 1i6z h LEU 180 Ca 0.02 -0.01 -0.04 0.00 0.13 0.00 0.00 57.88 57.99 1i6z h LEU 180 Cb 0.42 -0.18 -0.00 0.00 -0.53 0.00 0.00 40.66 40.37 1i6z h LEU 180 CO 0.01 0.53 -0.04 0.07 -0.13 0.00 0.00 178.44 178.87 1i6z h LYS 181 N 0.88 0.32 -0.48 1.25 5.09 -1.07 -2.13 116.57 120.43 1i6z h LYS 181 Ca 0.28 -0.12 -0.00 0.00 0.09 0.00 0.00 60.65 60.89 1i6z h LYS 181 Cb 0.02 -0.02 -0.02 0.00 0.10 0.00 0.00 32.23 32.31 1i6z h LYS 181 CO -0.08 0.60 0.29 -0.09 -2.09 0.00 0.00 179.45 178.08 1i6z h ARG 182 N 0.02 0.64 -0.14 0.07 2.43 -1.08 0.13 114.38 116.45 1i6z h ARG 182 Ca 0.04 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1i6z h ARG 182 Cb 0.48 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1i6z h ARG 182 CO 0.02 0.47 0.06 0.87 -1.51 0.00 0.00 179.97 179.87 1i6z h LYS 183 N 0.64 0.21 -0.23 0.20 1.79 -1.33 -0.39 116.57 117.45 1i6z h LYS 183 Ca 0.17 -0.04 -0.04 0.00 -2.18 0.00 0.00 60.65 58.56 1i6z h LYS 183 Cb -0.01 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.59 1i6z h LYS 183 CO -0.03 0.29 -0.04 -0.97 -1.08 0.00 0.00 179.45 177.62 1i6z h ASN 184 N 0.08 0.32 -0.33 0.86 -1.24 -1.24 -1.25 115.58 112.78 1i6z h ASN 184 Ca 0.05 -0.05 -0.09 0.00 0.71 0.00 0.00 56.30 56.91 1i6z h ASN 184 Cb 0.16 -0.08 -0.02 0.00 0.73 0.00 0.00 38.32 39.11 1i6z h ASN 184 CO -0.00 0.41 -0.12 -0.07 -1.29 0.00 0.00 177.43 176.36 1i6z h LEU 185 N 0.34 0.75 0.03 0.34 -0.00 -0.30 0.41 115.31 116.89 1i6z h LEU 185 Ca 0.07 -0.23 -0.00 0.00 -0.00 0.00 0.00 57.88 57.73 1i6z h LEU 185 Cb 0.29 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 40.75 1i6z h LEU 185 CO 0.01 0.89 -0.01 0.58 -0.00 0.00 0.00 178.44 179.91 1i6z h VAL 186 N 0.69 1.22 -0.38 1.22 2.07 -0.18 -2.34 116.25 118.55 1i6z h VAL 186 Ca 0.12 -0.80 -0.06 0.00 0.82 0.00 0.00 66.70 66.78 1i6z h VAL 186 Cb 0.59 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.11 1i6z h VAL 186 CO 0.04 0.20 -0.00 0.11 0.02 0.00 0.00 177.57 177.94 1i6z h LYS 187 N -0.39 0.60 -0.82 1.57 6.56 -1.08 0.68 116.57 123.68 1i6z h LYS 187 Ca -0.00 -0.14 0.01 0.00 -1.06 0.00 0.00 60.65 59.46 1i6z h LYS 187 Cb 0.37 -0.08 -0.04 0.00 -0.57 0.00 0.00 32.23 31.90 1i6z h LYS 187 CO 0.01 0.63 0.54 1.57 -2.06 0.00 0.00 179.45 180.13 1i6z h LYS 188 N 0.57 1.06 -0.43 3.15 2.10 -0.11 0.23 116.57 123.13 1i6z h LYS 188 Ca 0.12 -0.06 -0.15 0.00 -2.00 0.00 0.00 60.65 58.56 1i6z h LYS 188 Cb 0.37 -0.24 -0.01 0.00 -0.90 0.00 0.00 32.23 31.45 1i6z h LYS 188 CO 0.01 0.70 -0.30 0.28 -2.00 0.00 0.00 179.45 178.14 1i6z h VAL 189 N 1.09 1.27 -0.14 0.07 2.07 -0.68 -2.21 116.25 117.72 1i6z h VAL 189 Ca 0.31 -1.47 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 1i6z h VAL 189 Cb -0.09 1.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1i6z h VAL 189 CO -0.07 0.50 -0.03 1.56 0.02 0.00 0.00 177.57 179.55 1i6z h GLN 190 N 0.81 0.26 -0.02 1.57 1.08 0.51 -2.87 115.11 116.45 1i6z h GLN 190 Ca 0.09 -0.10 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 1i6z h GLN 190 Cb 0.89 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 28.31 1i6z h GLN 190 CO 0.08 0.55 -0.03 0.28 -0.95 0.00 0.00 178.83 178.76 1i6z h VAL 191 N -0.04 1.42 -0.56 -0.54 2.07 -0.65 -1.46 116.25 116.48 1i6z h VAL 191 Ca 0.03 -1.27 -0.03 0.00 0.82 0.00 0.00 66.70 66.25 1i6z h VAL 191 Cb 0.45 2.23 -0.02 0.00 -1.52 0.00 0.00 31.29 32.43 1i6z h VAL 191 CO 0.01 0.34 0.22 -0.26 0.02 0.00 0.00 177.57 177.89 1i6z h PHE 192 N -0.46 0.87 -0.07 1.57 0.04 -1.52 1.18 116.94 118.54 1i6z h PHE 192 Ca 0.00 -0.07 -0.08 0.00 2.80 0.00 0.00 57.97 60.62 1i6z h PHE 192 Cb 0.56 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.46 1i6z h PHE 192 CO 0.11 0.71 -0.28 -0.07 -0.60 0.00 0.00 178.31 178.18 1i6z h LEU 193 N 0.77 0.37 -0.32 1.54 -0.00 -1.61 -2.62 115.31 113.44 1i6z h LEU 193 Ca 0.19 -0.63 -0.11 0.00 -0.00 0.00 0.00 57.88 57.33 1i6z h LEU 193 Cb 0.22 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 40.76 1i6z h LEU 193 CO -0.01 0.94 -0.23 0.00 -0.00 0.00 0.00 178.44 179.14 1i6z h ALA 194 N 0.45 0.46 -0.68 1.53 0.00 -1.23 -2.56 119.26 117.23 1i6z h ALA 194 Ca -0.01 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.53 1i6z h ALA 194 Cb 0.91 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1i6z h ALA 194 CO 0.06 0.43 0.45 1.49 0.00 0.00 0.00 179.25 181.68 1i6z h GLU 195 N 0.48 0.88 -0.64 0.00 4.57 0.14 0.13 114.58 120.14 1i6z h GLU 195 Ca 0.06 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 58.15 1i6z h GLU 195 Cb 0.78 -0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 29.14 1i6z h GLU 195 CO 0.06 0.58 0.22 0.00 -1.18 0.00 0.00 179.01 178.69 1i6z h ASP 197 N 0.93 0.83 -0.18 0.00 3.58 -0.60 -1.06 116.42 119.92 1i6z h ASP 197 Ca 0.21 -0.23 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 1i6z h ASP 197 Cb 0.23 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.05 1i6z h ASP 197 CO -0.01 0.92 0.09 0.74 -2.88 0.00 0.00 179.24 178.10 1i6z h THR 198 N 0.78 1.12 -0.66 2.25 2.02 -0.76 1.41 112.91 119.08 1i6z h THR 198 Ca 0.14 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1i6z h THR 198 Cb 0.53 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 1i6z h THR 198 CO 0.03 0.12 0.42 0.58 0.37 0.00 0.00 175.52 177.04 1i6z h VAL 199 N 0.17 1.18 -0.49 3.16 2.07 -1.29 -1.13 116.25 119.92 1i6z h VAL 199 Ca 0.06 -0.36 -0.06 0.00 0.82 0.00 0.00 66.70 67.17 1i6z h VAL 199 Cb 0.10 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 1i6z h VAL 199 CO -0.01 0.18 0.08 -0.33 0.02 0.00 0.00 177.57 177.51 1i6z h GLU 200 N 0.90 0.81 -0.85 1.57 3.07 -0.77 -1.45 114.58 117.86 1i6z h GLU 200 Ca 0.24 -0.22 0.13 0.00 -0.50 0.00 0.00 59.36 59.01 1i6z h GLU 200 Cb -0.07 -0.09 -0.06 0.00 -0.84 0.00 0.00 28.75 27.68 1i6z h GLU 200 CO -0.05 0.81 0.55 1.96 -1.40 0.00 0.00 179.01 180.88 1i6z h GLN 201 N 0.68 0.66 -0.15 2.33 4.20 0.26 0.95 115.11 124.04 1i6z h GLN 201 Ca 0.15 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 1i6z h GLN 201 Cb 0.39 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 1i6z h GLN 201 CO 0.01 0.43 -0.04 -0.92 -0.67 0.00 0.00 178.83 177.64 1i6z h TYR 202 N 0.67 0.33 -0.95 2.96 3.20 -0.68 0.71 116.97 123.21 1i6z h TYR 202 Ca 0.42 -0.07 0.04 0.00 3.14 0.00 0.00 58.73 62.25 1i6z h TYR 202 Cb 0.65 -0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.79 1i6z h TYR 202 CO -0.00 0.58 0.62 0.82 -1.64 0.00 0.00 178.16 178.53 1i6z h ILE 203 N -0.01 1.16 -0.08 1.81 2.04 0.13 0.31 117.51 122.86 1i6z h ILE 203 Ca 0.04 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 1i6z h ILE 203 Cb 0.47 -0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.41 1i6z h ILE 203 CO 0.02 0.22 -0.06 0.00 0.00 0.00 0.00 178.15 178.33 1i6z h GLN 205 N -0.22 0.69 -0.34 0.00 3.07 0.87 0.28 115.11 119.46 1i6z h GLN 205 Ca 0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 58.65 58.60 1i6z h GLN 205 Cb 0.54 -0.10 -0.02 0.00 0.08 0.00 0.00 27.48 27.98 1i6z h GLN 205 CO 0.02 0.66 0.17 0.93 0.09 0.00 0.00 178.83 180.70 1i6z h GLU 206 N 0.66 0.48 -0.50 0.06 4.39 -0.42 0.47 114.58 119.72 1i6z h GLU 206 Ca 0.15 -0.06 -0.10 0.00 0.34 0.00 0.00 59.36 59.68 1i6z h GLU 206 Cb 0.31 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 1i6z h GLU 206 CO 0.00 0.42 -0.08 1.15 -1.16 0.00 0.00 179.01 179.34 1i6z h THR 207 N 0.42 1.26 -0.51 1.13 2.02 -1.26 -1.77 112.91 114.20 1i6z h THR 207 Ca 0.12 -1.19 0.01 0.00 0.77 0.00 0.00 66.41 66.12 1i6z h THR 207 Cb 0.09 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 1i6z h THR 207 CO -0.02 0.42 0.34 -0.08 0.37 0.00 0.00 175.52 176.54 1i6z h GLU 208 N 0.81 0.66 -0.51 6.66 4.81 0.43 -1.95 114.58 125.49 1i6z h GLU 208 Ca 0.14 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 1i6z h GLU 208 Cb 0.60 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.81 1i6z h GLU 208 CO 0.04 0.44 0.08 -0.09 -0.73 0.00 0.00 179.01 178.74 1i6z h ARG 209 N 0.68 0.81 -0.49 1.92 2.43 0.16 -2.33 114.38 117.56 1i6z h ARG 209 Ca 0.19 -0.19 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1i6z h ARG 209 Cb -0.07 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.35 1i6z h ARG 209 CO -0.05 0.76 0.32 1.25 -1.51 0.00 0.00 179.97 180.75 1i6z h LEU 210 N 0.77 0.51 -8.43 3.80 5.85 -0.59 -3.37 115.31 113.84 1i6z h LEU 210 Ca 0.16 -0.01 -0.55 0.00 0.84 0.00 0.00 57.88 58.32 1i6z h LEU 210 Cb 0.36 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.18 1i6z h LEU 210 CO 0.01 0.36 1.01 -1.10 -0.34 0.00 0.00 178.44 178.37 1i6z s GLN 211 N -5.53 3.29 -0.10 1.25 1.11 -0.87 -4.88 119.66 113.94 1i6z s GLN 211 Ca -0.09 -0.10 -0.06 0.00 0.01 0.00 0.00 55.36 55.12 1i6z s GLN 211 Cb 0.18 -4.13 -0.05 0.00 -1.01 0.00 0.00 33.01 28.00 1i6z s GLN 211 CO 0.74 -1.98 0.20 1.03 0.01 0.00 0.00 175.29 175.29 1i6z h SER 212 N 9.85 -0.05 -4.00 5.90 0.87 -1.82 -3.46 113.55 120.83 1i6z h SER 212 Ca -0.27 -0.15 -0.53 0.00 -1.23 0.00 0.00 61.79 59.62 1i6z h SER 212 Cb 1.05 0.01 0.09 0.00 -0.44 0.00 0.00 62.40 63.12 1i6z h SER 212 CO 1.24 0.51 0.56 -0.89 -0.53 0.00 0.00 176.83 177.73 1i6z s THR 213 N -1.89 2.60 0.36 2.23 2.01 -1.26 -5.03 115.64 114.66 1i6z s THR 213 Ca -0.04 0.48 0.04 0.00 0.31 0.00 0.00 61.69 62.48 1i6z s THR 213 Cb -0.00 -3.25 -0.01 0.00 0.01 0.00 0.00 72.50 69.24 1i6z s THR 213 CO 0.13 0.02 0.52 0.54 -0.69 0.00 0.00 174.62 175.14 1i6z s ASN 214 N -1.04 5.98 -0.02 3.53 4.22 -1.26 -5.03 114.94 121.31 1i6z s ASN 214 Ca 0.65 -0.00 0.01 0.00 -2.14 0.00 0.00 52.86 51.37 1i6z s ASN 214 Cb -0.35 -1.41 0.03 0.00 1.28 0.00 0.00 41.25 40.80 1i6z s ASN 214 CO 0.43 -0.47 0.92 0.00 -2.04 0.00 0.00 177.10 175.95 1i6z n LEU 215 N -1.75 -0.91 -4.89 3.54 -0.00 -1.26 -5.14 117.00 106.58 1i6z n LEU 215 Ca -0.01 -1.86 -0.20 0.00 -0.00 0.00 0.00 56.01 53.94 1i6z n LEU 215 Cb 0.58 0.02 -0.03 0.00 -0.00 0.00 0.00 43.42 43.99 1i6z n LEU 215 CO 0.44 1.40 -0.02 0.00 -0.00 0.00 0.00 177.39 179.22 1i6z s ALA 216 N 0.01 4.03 0.18 1.47 0.00 -1.26 -5.04 121.76 121.15 1i6z s ALA 216 Ca 0.01 -1.69 0.00 0.00 0.00 0.00 0.00 51.96 50.28 1i6z s ALA 216 Cb 0.03 -1.25 0.00 0.00 0.00 0.00 0.00 23.12 21.90 1i6z s ALA 216 CO -0.01 -0.09 0.00 -0.11 0.00 0.00 0.00 175.76 175.55 1i6z n LEU 217 N -1.51 -0.67 -4.55 0.00 0.00 -1.26 -5.04 117.00 103.98 1i6z n LEU 217 Ca 0.01 0.32 -0.42 0.00 0.00 0.00 0.00 56.01 55.92 1i6z n LEU 217 Cb 0.60 0.77 -0.03 0.00 0.00 0.00 0.00 43.42 44.76 1i6z n LEU 217 CO 0.42 -0.50 1.10 0.00 0.00 0.00 0.00 177.39 178.41 1i6z s ALA 218 N -2.00 2.85 0.00 1.96 0.00 -1.26 -5.36 121.76 117.95 1i6z s ALA 218 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 50.70 1i6z s ALA 218 Cb 0.00 -4.16 0.00 0.00 0.00 0.00 0.00 23.12 18.96 1i6z s ALA 218 CO 0.00 -3.06 0.00 -1.91 0.00 0.00 0.00 175.76 170.79