#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i6z s SER 86 N 0.00 5.01 -0.60 1.61 0.01 -1.26 -5.06 113.70 113.41 1i6z s SER 86 Ca 0.00 -1.75 -0.26 0.00 1.31 0.00 0.00 55.95 55.25 1i6z s SER 86 Cb 0.00 -1.74 -0.03 0.00 0.21 0.00 0.00 66.02 64.46 1i6z s SER 86 CO 0.00 -0.40 1.95 -2.16 0.41 0.00 0.00 173.24 173.05 1i6z s PRO 87 N 1.14 2.53 0.52 12.44 0.04 -1.26 -4.69 135.00 145.73 1i6z s PRO 87 Ca 0.03 0.72 0.00 0.00 0.04 0.00 0.00 61.00 61.79 1i6z s PRO 87 Cb -0.21 -4.44 0.00 0.00 0.04 0.00 0.00 34.50 29.89 1i6z s PRO 87 CO -0.04 -2.85 0.00 0.39 0.04 0.00 0.00 177.00 174.55 1i6z n GLU 88 N 9.15 -3.82 -4.99 4.56 4.71 -1.26 -4.99 120.64 124.01 1i6z n GLU 88 Ca 0.23 2.94 -0.27 0.00 -0.01 0.00 0.00 57.16 60.05 1i6z n GLU 88 Cb 0.52 -3.59 -0.15 0.00 -1.01 0.00 0.00 31.44 27.21 1i6z n GLU 88 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 1i6z s PHE 89 N -4.87 1.84 -0.03 -0.32 0.40 -1.26 -5.02 117.98 108.71 1i6z s PHE 89 Ca 0.00 -0.35 0.13 0.00 -0.60 0.00 0.00 56.93 56.11 1i6z s PHE 89 Cb 0.00 -1.18 -0.20 0.00 0.51 0.00 0.00 43.02 42.16 1i6z s PHE 89 CO 0.00 -0.02 0.26 -1.33 0.70 0.00 0.00 175.22 174.82 1i6z n MET 90 N 2.53 0.59 -2.24 0.44 2.81 -1.26 -5.09 117.12 114.91 1i6z n MET 90 Ca -0.15 -0.11 -0.02 0.00 -1.81 0.00 0.00 57.70 55.61 1i6z n MET 90 Cb 0.53 -1.31 -0.02 0.00 -0.71 0.00 0.00 33.22 31.71 1i6z n MET 90 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 1i6z n LEU 91 N -2.01 -5.18 -4.67 4.03 -0.00 -1.26 -4.95 117.00 102.96 1i6z n LEU 91 Ca -0.04 1.26 -0.41 0.00 -0.00 0.00 0.00 56.01 56.81 1i6z n LEU 91 Cb 0.40 -2.49 -0.04 0.00 -0.00 0.00 0.00 43.42 41.29 1i6z n LEU 91 CO 0.27 -2.39 0.63 0.27 -0.00 0.00 0.00 177.39 176.17 1i6z s ILE 92 N -0.69 4.87 0.43 1.96 -4.36 -1.26 -5.04 121.20 117.10 1i6z s ILE 92 Ca -0.11 1.66 -0.14 0.00 -0.26 0.00 0.00 60.65 61.80 1i6z s ILE 92 Cb 0.01 -4.15 -0.08 0.00 1.25 0.00 0.00 42.46 39.49 1i6z s ILE 92 CO 0.51 0.02 0.85 -0.83 0.24 0.00 0.00 174.94 175.73 1i6z s GLY 93 N 1.16 2.09 0.14 6.27 0.00 -1.26 -5.09 107.32 110.63 1i6z s GLY 93 Ca 0.39 0.02 0.06 0.00 0.00 0.00 0.00 44.72 45.18 1i6z s GLY 93 CO 0.12 0.25 -0.13 1.85 0.00 0.00 0.00 173.10 175.19 1i6z s GLU 94 N -3.72 1.08 0.00 2.90 -6.30 -1.26 -5.09 118.70 106.31 1i6z s GLU 94 Ca 0.55 -1.35 0.00 0.00 -2.50 0.00 0.00 54.97 51.67 1i6z s GLU 94 Cb -0.10 -0.86 0.00 0.00 0.00 0.00 0.00 34.13 33.17 1i6z s GLU 94 CO 0.27 0.15 0.00 1.63 0.02 0.00 0.00 175.26 177.33 1i6z n LYS 95 N 0.18 0.00 -2.32 4.30 5.02 -1.26 -5.08 118.16 119.00 1i6z n LYS 95 Ca -0.13 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.78 1i6z n LYS 95 Cb 0.59 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.57 1i6z n LYS 95 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1i6z s SER 96 N -0.84 6.48 0.16 4.39 0.15 -1.26 -4.66 113.70 118.12 1i6z s SER 96 Ca 0.00 2.29 0.00 0.00 0.70 0.00 0.00 55.95 58.94 1i6z s SER 96 Cb 0.00 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 1i6z s SER 96 CO 0.00 -0.70 0.00 0.59 1.20 0.00 0.00 173.24 174.33 1i6z n ASN 97 N -0.06 -8.48 -3.46 5.45 3.02 -1.26 -5.01 115.26 105.46 1i6z n ASN 97 Ca 0.05 1.34 -0.24 0.00 -0.03 0.00 0.00 54.58 55.71 1i6z n ASN 97 Cb 0.47 -4.75 0.18 0.00 -0.61 0.00 0.00 39.78 35.06 1i6z n ASN 97 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1i6z n PRO 98 N 1.74 -1.55 0.01 3.52 -0.02 -1.26 -4.71 135.00 132.73 1i6z n PRO 98 Ca 0.00 -1.57 0.11 0.00 -2.02 0.00 0.00 63.50 60.02 1i6z n PRO 98 Cb 0.00 -1.16 0.54 0.00 -0.02 0.00 0.00 33.50 32.86 1i6z n PRO 98 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1i6z h GLU 99 N 0.00 0.29 -0.61 -0.52 4.81 -1.98 0.33 114.58 116.90 1i6z h GLU 99 Ca -0.34 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 58.80 1i6z h GLU 99 Cb 0.96 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.25 1i6z h GLU 99 CO 0.23 0.19 0.11 0.93 -0.73 0.00 0.00 179.01 179.74 1i6z h GLU 100 N 0.30 0.99 -0.35 1.92 5.08 -1.99 0.05 114.58 120.57 1i6z h GLU 100 Ca 0.19 -0.24 -0.15 0.00 -1.00 0.00 0.00 59.36 58.16 1i6z h GLU 100 Cb 0.39 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1i6z h GLU 100 CO -0.04 0.91 -0.38 0.93 -1.00 0.00 0.00 179.01 179.42 1i6z h GLU 101 N 0.93 0.84 -0.06 2.33 4.39 -0.78 -1.59 114.58 120.65 1i6z h GLU 101 Ca 0.19 -0.43 -0.01 0.00 0.34 0.00 0.00 59.36 59.45 1i6z h GLU 101 Cb 0.39 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1i6z h GLU 101 CO 0.01 1.07 0.01 0.28 -1.16 0.00 0.00 179.01 179.22 1i6z h VAL 102 N 0.69 1.20 -0.29 3.13 2.07 -0.44 0.29 116.25 122.90 1i6z h VAL 102 Ca 0.06 -0.60 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 1i6z h VAL 102 Cb 0.95 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.20 1i6z h VAL 102 CO 0.09 0.17 -0.02 -0.33 0.02 0.00 0.00 177.57 177.50 1i6z h GLU 103 N -0.13 0.44 -0.15 1.57 4.39 -1.01 -2.33 114.58 117.35 1i6z h GLU 103 Ca 0.02 -0.09 -0.18 0.00 0.34 0.00 0.00 59.36 59.45 1i6z h GLU 103 Cb 0.25 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1i6z h GLU 103 CO 0.00 0.48 -0.65 1.25 -1.16 0.00 0.00 179.01 178.93 1i6z h LEU 104 N 0.42 0.66 -0.87 1.33 5.85 -1.03 -2.94 115.31 118.74 1i6z h LEU 104 Ca 0.09 -0.40 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 1i6z h LEU 104 Cb 0.31 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1i6z h LEU 104 CO 0.01 1.14 0.52 0.50 -0.34 0.00 0.00 178.44 180.27 1i6z h LYS 105 N 0.42 1.18 -0.36 1.25 3.64 0.12 -0.65 116.57 122.17 1i6z h LYS 105 Ca -0.02 -0.11 -0.06 0.00 -1.27 0.00 0.00 60.65 59.20 1i6z h LYS 105 Cb 1.23 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.79 1i6z h LYS 105 CO 0.12 0.83 -0.00 0.87 -2.27 0.00 0.00 179.45 179.00 1i6z h LYS 106 N 1.20 0.64 -0.91 1.90 1.57 -1.52 -2.23 116.57 117.22 1i6z h LYS 106 Ca 0.31 -0.21 0.04 0.00 -1.87 0.00 0.00 60.65 58.92 1i6z h LYS 106 Cb -0.05 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.15 1i6z h LYS 106 CO -0.06 0.75 0.60 1.25 -0.57 0.00 0.00 179.45 181.42 1i6z h LEU 107 N 0.45 0.98 -0.15 2.94 7.12 -1.26 0.40 115.31 125.79 1i6z h LEU 107 Ca 0.10 -0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.11 1i6z h LEU 107 Cb 0.47 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 40.36 1i6z h LEU 107 CO 0.02 0.67 0.09 0.50 -0.13 0.00 0.00 178.44 179.58 1i6z h LYS 108 N 1.13 0.18 -0.42 1.25 3.64 -0.79 -2.34 116.57 119.22 1i6z h LYS 108 Ca 0.36 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.69 1i6z h LYS 108 Cb 0.03 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 1i6z h LYS 108 CO -0.11 0.12 0.09 -0.44 -2.27 0.00 0.00 179.45 176.84 1i6z h ASP 109 N 0.18 0.58 -0.92 4.20 5.19 -0.76 -2.79 116.42 122.09 1i6z h ASP 109 Ca 0.06 -0.09 -0.01 0.00 -0.62 0.00 0.00 57.03 56.37 1i6z h ASP 109 Cb -0.01 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.31 1i6z h ASP 109 CO -0.02 0.58 0.54 0.25 -3.12 0.00 0.00 179.24 177.47 1i6z h LEU 110 N 0.61 1.12 -0.41 1.55 6.46 -0.41 0.46 115.31 124.69 1i6z h LEU 110 Ca 0.14 -0.08 -0.11 0.00 -0.12 0.00 0.00 57.88 57.71 1i6z h LEU 110 Cb 0.25 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.88 1i6z h LEU 110 CO -0.00 0.87 -0.17 -0.08 -0.62 0.00 0.00 178.44 178.44 1i6z h GLU 111 N 1.28 0.84 -0.17 1.25 4.81 -1.22 -0.10 114.58 121.27 1i6z h GLU 111 Ca 0.33 -0.36 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1i6z h GLU 111 Cb -0.03 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1i6z h GLU 111 CO -0.06 0.99 -0.03 0.28 -0.73 0.00 0.00 179.01 179.46 1i6z h VAL 112 N 0.66 1.28 -0.73 0.32 2.07 -1.26 1.00 116.25 119.59 1i6z h VAL 112 Ca 0.10 -0.98 0.01 0.00 0.82 0.00 0.00 66.70 66.65 1i6z h VAL 112 Cb 0.72 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 32.05 1i6z h VAL 112 CO 0.05 0.29 0.48 0.77 0.02 0.00 0.00 177.57 179.19 1i6z h SER 113 N 0.03 0.82 -0.37 0.57 4.64 -0.07 0.39 113.55 119.55 1i6z h SER 113 Ca 0.04 -0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 61.23 1i6z h SER 113 Cb 0.46 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 1i6z h SER 113 CO 0.02 0.59 -0.20 0.00 -0.87 0.00 0.00 176.83 176.36 1i6z h ALA 114 N 1.55 0.53 -0.70 5.18 0.00 -0.63 -2.20 119.26 123.00 1i6z h ALA 114 Ca 0.27 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1i6z h ALA 114 Cb -0.09 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1i6z h ALA 114 CO -0.06 0.49 0.46 1.49 0.00 0.00 0.00 179.25 181.63 1i6z h GLU 115 N 0.60 0.90 -0.23 0.00 4.22 0.32 0.12 114.58 120.50 1i6z h GLU 115 Ca 0.08 -0.05 -0.04 0.00 0.08 0.00 0.00 59.36 59.42 1i6z h GLU 115 Cb 0.76 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1i6z h GLU 115 CO 0.06 0.59 -0.02 -0.22 -2.18 0.00 0.00 179.01 177.24 1i6z h LYS 116 N 0.93 0.41 -0.45 1.92 3.64 -0.05 0.40 116.57 123.36 1i6z h LYS 116 Ca 0.26 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1i6z h LYS 116 Cb -0.08 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1i6z h LYS 116 CO -0.06 0.62 0.26 0.82 -2.27 0.00 0.00 179.45 178.82 1i6z h ILE 117 N 0.17 1.15 -0.40 2.00 2.04 -0.81 -0.09 117.51 121.57 1i6z h ILE 117 Ca 0.06 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 1i6z h ILE 117 Cb 0.45 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1i6z h ILE 117 CO 0.02 0.16 0.07 0.00 0.00 0.00 0.00 178.15 178.40 1i6z h ALA 118 N 1.11 1.39 -0.48 1.87 0.00 -0.64 -2.53 119.26 119.98 1i6z h ALA 118 Ca 0.16 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1i6z h ALA 118 Cb 0.03 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1i6z h ALA 118 CO -0.03 0.44 -0.01 -0.97 0.00 0.00 0.00 179.25 178.68 1i6z h ASN 119 N 0.58 0.84 -0.83 0.00 -0.73 0.69 -2.81 115.58 113.31 1i6z h ASN 119 Ca 0.13 -0.31 0.03 0.00 1.87 0.00 0.00 56.30 58.02 1i6z h ASN 119 Cb 0.26 -0.23 -0.05 0.00 0.27 0.00 0.00 38.32 38.58 1i6z h ASN 119 CO 0.00 0.95 0.55 -0.74 -0.37 0.00 0.00 177.43 177.81 1i6z h HIS 120 N 0.70 1.00 -0.02 0.67 2.76 -0.64 -1.53 115.15 118.09 1i6z h HIS 120 Ca 0.13 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.33 1i6z h HIS 120 Cb 0.53 -0.33 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 1i6z h HIS 120 CO 0.04 0.59 -0.01 1.25 -1.30 0.00 0.00 177.93 178.49 1i6z h LEU 121 N 1.04 -0.04 -1.41 0.26 7.12 -1.22 0.43 115.31 121.48 1i6z h LEU 121 Ca 0.33 0.01 -0.02 0.00 0.13 0.00 0.00 57.88 58.33 1i6z h LEU 121 Cb 0.01 0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 40.14 1i6z h LEU 121 CO -0.09 -0.02 0.20 1.56 -0.13 0.00 0.00 178.44 179.96 1i6z h GLN 122 N -0.01 0.60 0.01 1.25 4.20 -1.26 0.71 115.11 120.59 1i6z h GLN 122 Ca 0.01 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 1i6z h GLN 122 Cb 0.03 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.70 1i6z h GLN 122 CO -0.03 0.47 -0.00 0.93 -0.67 0.00 0.00 178.83 179.53 1i6z h GLU 123 N 0.60 -0.01 -0.48 1.46 4.39 -0.69 -1.80 114.58 118.05 1i6z h GLU 123 Ca 0.15 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.83 1i6z h GLU 123 Cb 0.08 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 1i6z h GLU 123 CO -0.02 0.51 0.20 1.25 -1.16 0.00 0.00 179.01 179.79 1i6z h LEU 124 N -0.52 0.62 -1.11 1.33 5.85 0.16 -1.63 115.31 120.01 1i6z h LEU 124 Ca -0.00 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 1i6z h LEU 124 Cb 0.52 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 1i6z h LEU 124 CO 0.00 0.56 0.33 0.78 -0.34 0.00 0.00 178.44 179.77 1i6z h ASN 125 N 0.68 0.86 -0.44 1.25 -0.26 0.56 0.26 115.58 118.49 1i6z h ASN 125 Ca 0.17 -0.09 -0.00 0.00 -0.56 0.00 0.00 56.30 55.82 1i6z h ASN 125 Cb 0.13 -0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 37.15 1i6z h ASN 125 CO -0.02 0.72 0.26 0.50 -1.06 0.00 0.00 177.43 177.84 1i6z h LYS 126 N 0.95 0.60 -0.25 0.81 1.63 -0.40 0.56 116.57 120.47 1i6z h LYS 126 Ca 0.23 -0.06 -0.13 0.00 -0.85 0.00 0.00 60.65 59.85 1i6z h LYS 126 Cb 0.09 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.59 1i6z h LYS 126 CO -0.03 0.45 -0.38 1.49 -3.45 0.00 0.00 179.45 177.53 1i6z h GLU 127 N 0.59 0.57 -0.61 1.90 4.81 -1.23 -1.05 114.58 119.55 1i6z h GLU 127 Ca 0.16 -0.28 -0.07 0.00 -0.13 0.00 0.00 59.36 59.04 1i6z h GLU 127 Cb 0.00 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1i6z h GLU 127 CO -0.03 0.86 0.11 1.25 -0.73 0.00 0.00 179.01 180.47 1i6z h LEU 128 N 0.47 0.96 -0.77 1.64 7.12 0.16 -0.01 115.31 124.87 1i6z h LEU 128 Ca 0.04 -0.25 -0.12 0.00 0.13 0.00 0.00 57.88 57.68 1i6z h LEU 128 Cb 0.88 -0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 40.74 1i6z h LEU 128 CO 0.08 0.97 -0.43 -1.28 -0.13 0.00 0.00 178.44 177.64 1i6z h SER 129 N 0.91 0.43 -0.24 1.25 0.87 0.28 0.38 113.55 117.43 1i6z h SER 129 Ca 0.19 -0.19 -0.07 0.00 -1.23 0.00 0.00 61.79 60.48 1i6z h SER 129 Cb 0.41 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 1i6z h SER 129 CO 0.01 0.81 -0.13 1.23 -0.53 0.00 0.00 176.83 178.22 1i6z h GLY 130 N 1.16 0.55 1.48 5.77 0.00 -0.79 -2.50 103.07 108.74 1i6z h GLY 130 Ca 0.03 -0.51 -0.12 0.00 0.00 0.00 0.00 47.33 46.73 1i6z h GLY 130 CO 0.08 0.46 -0.32 0.16 0.00 0.00 0.00 176.54 176.91 1i6z h ILE 131 N 0.23 1.28 -0.80 2.60 3.07 -0.93 -2.78 117.51 120.18 1i6z h ILE 131 Ca 0.05 -1.44 0.16 0.00 1.55 0.00 0.00 64.86 65.18 1i6z h ILE 131 Cb 0.64 1.42 -0.06 0.00 -0.27 0.00 0.00 36.82 38.55 1i6z h ILE 131 CO 0.04 0.46 0.53 1.56 -1.05 0.00 0.00 178.15 179.69 1i6z h GLN 132 N 0.50 0.43 -0.69 0.16 1.08 0.04 0.03 115.11 116.66 1i6z h GLN 132 Ca 0.06 -0.03 0.20 0.00 -1.45 0.00 0.00 58.65 57.43 1i6z h GLN 132 Cb 0.80 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 28.11 1i6z h GLN 132 CO 0.07 0.29 0.55 1.96 -0.95 0.00 0.00 178.83 180.75 1i6z h GLN 133 N 0.45 0.00 0.00 1.46 4.20 -1.15 -3.46 115.11 116.60 1i6z h GLN 133 Ca 0.40 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.11 1i6z h GLN 133 Cb 0.90 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.68 1i6z h GLN 133 CO -0.14 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.43 1i6z n GLY 134 N -1.63 3.95 1.04 3.46 0.00 -0.00 -5.11 105.19 106.88 1i6z n GLY 134 Ca 0.14 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.93 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 -1.60 -3.34 -3.55 1.61 -0.00 -1.26 -4.80 117.46 104.51 1i6z n PHE 135 Ca 0.00 0.71 0.00 0.00 -0.00 0.00 0.00 57.45 58.16 1i6z n PHE 135 Cb 0.00 2.03 0.00 0.00 -0.00 0.00 0.00 39.48 41.51 1i6z n PHE 135 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 1i6z n LEU 136 N -3.09 0.00 0.00 -2.13 7.94 -1.26 -5.13 117.00 113.33 1i6z n LEU 136 Ca 0.00 0.00 -0.26 0.00 -1.11 0.00 0.00 56.01 54.64 1i6z n LEU 136 Cb 0.00 0.00 0.22 0.00 0.53 0.00 0.00 43.42 44.17 1i6z n LEU 136 CO 0.00 0.00 0.56 0.00 -1.11 0.00 0.00 177.39 176.84 1i6z n ALA 137 N -3.00 -2.88 0.17 1.96 0.00 -1.26 -4.69 120.51 110.81 1i6z n ALA 137 Ca 0.00 -1.46 0.04 0.00 0.00 0.00 0.00 53.44 52.03 1i6z n ALA 137 Cb 0.00 -0.10 0.46 0.00 0.00 0.00 0.00 19.45 19.81 1i6z n ALA 137 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1i6z h LYS 138 N 0.00 0.13 -0.31 0.00 5.09 -2.02 -1.29 116.57 118.18 1i6z h LYS 138 Ca -0.37 -0.02 0.03 0.00 0.09 0.00 0.00 60.65 60.38 1i6z h LYS 138 Cb 1.11 -0.02 -0.03 0.00 0.10 0.00 0.00 32.23 33.39 1i6z h LYS 138 CO 0.24 0.26 0.11 0.93 -2.09 0.00 0.00 179.45 178.90 1i6z h GLU 139 N 0.12 0.23 0.03 0.07 5.08 -1.99 0.19 114.58 118.33 1i6z h GLU 139 Ca 0.03 -0.01 -0.21 0.00 -1.00 0.00 0.00 59.36 58.16 1i6z h GLU 139 Cb 0.31 -0.05 0.02 0.00 0.50 0.00 0.00 28.75 29.52 1i6z h GLU 139 CO 0.02 0.15 -0.84 1.25 -1.00 0.00 0.00 179.01 178.59 1i6z h LEU 140 N 0.24 0.68 -0.20 1.33 5.85 -1.84 -2.55 115.31 118.81 1i6z h LEU 140 Ca 0.14 -0.79 0.04 0.00 0.84 0.00 0.00 57.88 58.11 1i6z h LEU 140 Cb 0.10 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 1i6z h LEU 140 CO -0.14 1.38 -0.05 1.56 -0.34 0.00 0.00 178.44 180.85 1i6z h GLN 141 N 0.05 -0.00 -0.40 1.25 7.50 -1.09 0.85 115.11 123.27 1i6z h GLN 141 Ca -0.11 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.00 1i6z h GLN 141 Cb 1.54 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 29.05 1i6z h GLN 141 CO 0.16 -0.00 0.11 0.00 -1.50 0.00 0.00 178.83 177.60 1i6z h ALA 142 N 1.19 1.45 -0.22 3.87 0.00 -0.71 0.25 119.26 125.10 1i6z h ALA 142 Ca 0.10 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1i6z h ALA 142 Cb 0.15 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1i6z h ALA 142 CO -0.21 0.41 -0.16 1.49 0.00 0.00 0.00 179.25 180.78 1i6z h GLU 143 N 0.58 0.49 -0.41 0.00 4.81 -0.74 -2.31 114.58 117.00 1i6z h GLU 143 Ca 0.14 -0.24 -0.14 0.00 -0.13 0.00 0.00 59.36 58.99 1i6z h GLU 143 Cb 0.19 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1i6z h GLU 143 CO -0.01 0.80 -0.31 0.00 -0.73 0.00 0.00 179.01 178.77 1i6z h ALA 144 N 0.68 0.59 -0.29 2.92 0.00 0.11 -2.22 119.26 121.05 1i6z h ALA 144 Ca 0.04 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1i6z h ALA 144 Cb 0.68 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1i6z h ALA 144 CO 0.04 0.64 0.19 -0.07 0.00 0.00 0.00 179.25 180.05 1i6z h LEU 145 N 0.76 0.33 -0.61 0.00 4.07 -0.52 0.76 115.31 120.10 1i6z h LEU 145 Ca 0.08 -0.01 0.01 0.00 0.08 0.00 0.00 57.88 58.04 1i6z h LEU 145 Cb 0.89 -0.08 -0.03 0.00 1.08 0.00 0.00 40.66 42.52 1i6z h LEU 145 CO 0.08 0.24 0.39 0.00 -1.08 0.00 0.00 178.44 178.07 1i6z h LYS 147 N 0.79 0.47 -0.29 0.00 1.63 -0.78 0.16 116.57 118.54 1i6z h LYS 147 Ca 0.23 -0.04 0.02 0.00 -0.85 0.00 0.00 60.65 60.01 1i6z h LYS 147 Cb -0.05 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.46 1i6z h LYS 147 CO -0.07 0.35 0.14 1.25 -3.45 0.00 0.00 179.45 177.67 1i6z h LEU 148 N 0.45 0.20 -0.88 5.20 7.12 0.13 0.17 115.31 127.69 1i6z h LEU 148 Ca 0.13 0.02 -0.05 0.00 0.13 0.00 0.00 57.88 58.10 1i6z h LEU 148 Cb -0.00 -0.02 -0.03 0.00 -0.53 0.00 0.00 40.66 40.08 1i6z h LEU 148 CO -0.02 0.15 0.26 -2.24 -0.13 0.00 0.00 178.44 176.45 1i6z h ASP 149 N 0.29 1.00 -0.87 1.25 3.04 -0.29 -1.54 116.42 119.30 1i6z h ASP 149 Ca 0.12 -0.16 -0.00 0.00 -3.24 0.00 0.00 57.03 53.75 1i6z h ASP 149 Cb 0.05 -0.26 -0.04 0.00 -1.04 0.00 0.00 39.33 38.04 1i6z h ASP 149 CO -0.09 0.91 0.53 0.03 -2.04 0.00 0.00 179.24 178.58 1i6z h ARG 150 N 1.05 1.18 -0.18 4.15 3.08 0.11 -0.25 114.38 123.52 1i6z h ARG 150 Ca 0.24 -0.10 -0.10 0.00 0.07 0.00 0.00 59.98 60.09 1i6z h ARG 150 Cb 0.24 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1i6z h ARG 150 CO -0.02 0.82 -0.31 -0.22 -1.07 0.00 0.00 179.97 179.18 1i6z h LYS 151 N 1.20 0.35 -0.69 0.04 3.11 -0.44 -0.98 116.57 119.17 1i6z h LYS 151 Ca 0.31 -0.14 0.01 0.00 -2.81 0.00 0.00 60.65 58.02 1i6z h LYS 151 Cb -0.06 -0.02 -0.03 0.00 -1.00 0.00 0.00 32.23 31.12 1i6z h LYS 151 CO -0.06 0.63 0.45 0.28 -2.81 0.00 0.00 179.45 177.94 1i6z h VAL 152 N 0.31 1.17 -0.79 2.00 2.07 -0.11 -0.82 116.25 120.07 1i6z h VAL 152 Ca 0.04 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1i6z h VAL 152 Cb 0.70 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 1i6z h VAL 152 CO 0.05 0.17 0.47 0.11 0.02 0.00 0.00 177.57 178.39 1i6z h LYS 153 N 0.92 1.07 -0.63 1.57 1.57 0.21 -1.05 116.57 120.24 1i6z h LYS 153 Ca 0.25 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1i6z h LYS 153 Cb -0.10 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 31.96 1i6z h LYS 153 CO -0.06 0.76 0.37 0.00 -0.57 0.00 0.00 179.45 179.96 1i6z h ALA 154 N 1.42 1.47 -0.50 3.86 0.00 -0.87 -0.43 119.26 124.21 1i6z h ALA 154 Ca 0.28 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 1i6z h ALA 154 Cb -0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1i6z h ALA 154 CO -0.05 0.46 -0.10 1.15 0.00 0.00 0.00 179.25 180.70 1i6z h THR 155 N 0.87 1.27 -0.83 0.00 2.02 -0.94 -2.79 112.91 112.52 1i6z h THR 155 Ca 0.23 -1.24 0.01 0.00 0.77 0.00 0.00 66.41 66.18 1i6z h THR 155 Cb -0.02 1.05 -0.04 0.00 -1.74 0.00 0.00 68.15 67.39 1i6z h THR 155 CO -0.04 0.43 0.55 0.40 0.37 0.00 0.00 175.52 177.23 1i6z h ILE 156 N 0.81 1.20 -0.76 3.11 2.04 -0.30 -1.94 117.51 121.67 1i6z h ILE 156 Ca 0.13 -0.38 0.08 0.00 1.00 0.00 0.00 64.86 65.69 1i6z h ILE 156 Cb 0.66 -0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.67 1i6z h ILE 156 CO 0.05 0.20 0.43 -0.08 0.00 0.00 0.00 178.15 178.75 1i6z h GLU 157 N 1.11 0.73 -0.11 2.37 4.22 -0.87 0.53 114.58 122.56 1i6z h GLU 157 Ca 0.31 -0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.70 1i6z h GLU 157 Cb -0.12 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 28.96 1i6z h GLU 157 CO -0.07 0.48 0.06 1.96 -2.18 0.00 0.00 179.01 179.26 1i6z h GLN 158 N 0.75 0.16 -0.73 1.92 4.20 -1.14 0.17 115.11 120.44 1i6z h GLN 158 Ca 0.36 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 59.08 1i6z h GLN 158 Cb 0.29 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.00 1i6z h GLN 158 CO -0.22 0.22 0.48 0.74 -0.67 0.00 0.00 178.83 179.37 1i6z h PHE 159 N 0.06 0.86 -0.23 2.96 0.04 -0.58 -0.75 116.94 119.31 1i6z h PHE 159 Ca 0.04 0.02 -0.12 0.00 2.80 0.00 0.00 57.97 60.71 1i6z h PHE 159 Cb 0.11 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 37.96 1i6z h PHE 159 CO -0.03 0.50 -0.38 0.52 -0.60 0.00 0.00 178.31 178.32 1i6z h MET 160 N 0.89 0.51 -0.62 1.51 2.86 0.64 -2.93 114.93 117.79 1i6z h MET 160 Ca 0.29 -0.25 -0.08 0.00 -2.06 0.00 0.00 59.70 57.61 1i6z h MET 160 Cb 0.05 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 1i6z h MET 160 CO -0.08 0.81 0.09 -0.22 1.06 0.00 0.00 176.91 178.57 1i6z h LYS 161 N 0.43 1.03 -0.18 1.72 3.64 0.73 0.42 116.57 124.36 1i6z h LYS 161 Ca 0.04 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 59.14 1i6z h LYS 161 Cb 0.85 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.54 1i6z h LYS 161 CO 0.07 0.97 0.12 0.82 -2.27 0.00 0.00 179.45 179.15 1i6z h ILE 162 N 0.94 1.06 -0.53 2.00 2.04 -1.18 0.12 117.51 121.96 1i6z h ILE 162 Ca 0.19 -0.12 -0.11 0.00 1.00 0.00 0.00 64.86 65.82 1i6z h ILE 162 Cb 0.44 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 1i6z h ILE 162 CO 0.01 0.05 -0.10 0.25 0.00 0.00 0.00 178.15 178.36 1i6z h LEU 163 N 0.24 0.99 -1.14 1.44 6.46 -1.41 -2.22 115.31 119.66 1i6z h LEU 163 Ca 0.07 -0.32 -0.04 0.00 -0.12 0.00 0.00 57.88 57.47 1i6z h LEU 163 Cb -0.01 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 39.62 1i6z h LEU 163 CO -0.01 1.10 0.19 -0.33 -0.62 0.00 0.00 178.44 178.76 1i6z h GLU 164 N 0.88 0.79 -0.16 1.25 4.39 -0.57 1.01 114.58 122.17 1i6z h GLU 164 Ca 0.14 -0.13 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 1i6z h GLU 164 Cb 0.66 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 29.17 1i6z h GLU 164 CO 0.05 0.67 -0.12 0.93 -1.16 0.00 0.00 179.01 179.38 1i6z h GLU 165 N 0.78 0.36 -0.41 2.33 5.08 -0.55 -2.43 114.58 119.74 1i6z h GLU 165 Ca 0.18 -0.17 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1i6z h GLU 165 Cb 0.20 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1i6z h GLU 165 CO -0.01 0.71 -0.17 0.82 -1.00 0.00 0.00 179.01 179.36 1i6z h ILE 166 N 0.01 1.26 -0.51 3.13 2.04 -1.15 -2.00 117.51 120.29 1i6z h ILE 166 Ca 0.03 -1.25 0.14 0.00 1.00 0.00 0.00 64.86 64.78 1i6z h ILE 166 Cb 0.62 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1i6z h ILE 166 CO 0.03 0.42 0.36 -0.78 0.00 0.00 0.00 178.15 178.19 1i6z h ASP 167 N 0.68 0.06 0.68 1.72 3.58 0.13 -0.37 116.42 122.90 1i6z h ASP 167 Ca 0.11 0.00 -0.20 0.00 0.42 0.00 0.00 57.03 57.36 1i6z h ASP 167 Cb 0.66 -0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.67 1i6z h ASP 167 CO 0.05 0.03 -1.45 0.74 -2.88 0.00 0.00 179.24 175.73 1i6z h THR 168 N 0.06 0.63 -2.98 2.25 2.02 -0.94 -3.47 112.91 110.48 1i6z h THR 168 Ca 0.24 -2.22 -0.58 0.00 0.77 0.00 0.00 66.41 64.62 1i6z h THR 168 Cb 0.89 2.17 0.10 0.00 -1.74 0.00 0.00 68.15 69.57 1i6z h THR 168 CO -0.02 0.36 0.51 0.80 0.37 0.00 0.00 175.52 177.54 1i6z n MET 169 N -2.95 2.01 -2.72 6.66 1.56 -0.15 -4.98 117.12 116.55 1i6z n MET 169 Ca -0.11 0.71 -0.28 0.00 -0.27 0.00 0.00 57.70 57.75 1i6z n MET 169 Cb 0.90 -2.30 -0.01 0.00 2.15 0.00 0.00 33.22 33.96 1i6z n MET 169 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 1i6z s VAL 170 N -0.70 4.90 -0.18 1.12 1.01 -1.26 -5.00 120.40 120.29 1i6z s VAL 170 Ca 0.61 0.24 -0.03 0.00 0.00 0.00 0.00 61.98 62.80 1i6z s VAL 170 Cb -0.61 -3.84 0.06 0.00 0.00 0.00 0.00 36.38 31.98 1i6z s VAL 170 CO 0.57 -0.77 0.04 -0.22 0.00 0.00 0.00 175.10 174.72 1i6z s LEU 171 N -4.54 1.07 0.00 3.92 2.96 -1.26 -5.00 118.68 115.83 1i6z s LEU 171 Ca 0.48 -0.74 0.26 0.00 -0.22 0.00 0.00 54.13 53.91 1i6z s LEU 171 Cb -0.10 -0.56 1.50 0.00 0.50 0.00 0.00 46.19 47.53 1i6z s LEU 171 CO 0.42 -0.30 1.93 -0.81 -1.32 0.00 0.00 176.35 176.27 1i6z n PRO 172 N 5.07 0.68 -2.70 0.98 -0.04 -1.26 -4.93 135.00 132.80 1i6z n PRO 172 Ca -0.09 0.02 -0.01 0.00 -0.04 0.00 0.00 63.50 63.38 1i6z n PRO 172 Cb 0.48 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 1i6z n PRO 172 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1i6z n GLU 173 N -1.10 -1.13 0.00 0.54 1.02 -1.26 -4.98 120.64 113.73 1i6z n GLU 173 Ca 0.17 1.34 0.00 0.00 -0.02 0.00 0.00 57.16 58.65 1i6z n GLU 173 Cb 0.13 -4.83 0.00 0.00 -0.02 0.00 0.00 31.44 26.72 1i6z n GLU 173 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1i6z n GLN 174 N -1.46 0.00 -2.84 3.49 -0.06 -1.26 -5.01 117.38 110.23 1i6z n GLN 174 Ca 0.01 0.00 -0.43 0.00 -2.00 0.00 0.00 57.00 54.58 1i6z n GLN 174 Cb 0.48 -0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.63 1i6z n GLN 174 CO 0.00 0.00 0.00 -0.59 -0.20 0.00 0.00 177.06 176.27 1i6z s PHE 175 N -1.99 2.94 0.07 3.69 -0.12 -1.26 -4.85 117.98 116.45 1i6z s PHE 175 Ca 0.00 -1.16 -0.18 0.00 -0.05 0.00 0.00 56.93 55.54 1i6z s PHE 175 Cb 0.00 -4.37 -0.11 0.00 -0.63 0.00 0.00 43.02 37.91 1i6z s PHE 175 CO 0.00 -1.60 1.40 0.87 -0.05 0.00 0.00 175.22 175.84 1i6z h LYS 176 N 9.13 0.47 -0.23 1.99 6.56 -1.98 -0.60 116.57 131.92 1i6z h LYS 176 Ca 0.10 -0.22 -0.04 0.00 -1.06 0.00 0.00 60.65 59.42 1i6z h LYS 176 Cb 1.03 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.68 1i6z h LYS 176 CO 1.18 0.78 -0.01 -0.44 -2.06 0.00 0.00 179.45 178.89 1i6z h ASP 177 N 0.16 0.41 -0.33 0.86 5.19 -1.98 0.26 116.42 120.99 1i6z h ASP 177 Ca 0.04 -0.33 -0.03 0.00 -0.62 0.00 0.00 57.03 56.09 1i6z h ASP 177 Cb 0.66 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 40.05 1i6z h ASP 177 CO 0.04 0.64 0.08 0.28 -3.12 0.00 0.00 179.24 177.16 1i6z h SER 178 N 0.17 0.50 -0.38 6.45 0.02 -1.88 -0.40 113.55 118.04 1i6z h SER 178 Ca 0.06 -0.23 -0.07 0.00 -0.84 0.00 0.00 61.79 60.72 1i6z h SER 178 Cb 0.44 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 1i6z h SER 178 CO 0.01 0.60 -0.03 0.08 -1.14 0.00 0.00 176.83 176.35 1i6z h ARG 179 N 0.38 0.69 -0.68 3.45 0.11 -1.08 -1.13 114.38 116.12 1i6z h ARG 179 Ca 0.10 -0.23 0.04 0.00 0.10 0.00 0.00 59.98 59.99 1i6z h ARG 179 Cb 0.29 -0.05 -0.04 0.00 1.11 0.00 0.00 29.97 31.28 1i6z h ARG 179 CO 0.00 0.81 0.45 -0.07 0.10 0.00 0.00 179.97 181.25 1i6z h LEU 180 N 0.50 0.68 -0.28 0.08 4.07 -0.38 0.47 115.31 120.46 1i6z h LEU 180 Ca 0.10 -0.01 -0.04 0.00 0.08 0.00 0.00 57.88 58.01 1i6z h LEU 180 Cb 0.51 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 1i6z h LEU 180 CO 0.03 0.47 0.00 0.11 -1.08 0.00 0.00 178.44 177.97 1i6z h LYS 181 N 0.79 0.49 -0.40 1.13 1.57 -0.62 -1.59 116.57 117.94 1i6z h LYS 181 Ca 0.27 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1i6z h LYS 181 Cb 0.09 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1i6z h LYS 181 CO -0.08 0.64 0.17 -0.09 -0.57 0.00 0.00 179.45 179.52 1i6z h ARG 182 N 0.28 0.60 -0.21 3.15 2.43 -0.26 -0.19 114.38 120.17 1i6z h ARG 182 Ca 0.08 -0.11 0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1i6z h ARG 182 Cb 0.42 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 1i6z h ARG 182 CO 0.01 0.56 0.13 0.87 -1.51 0.00 0.00 179.97 180.03 1i6z h LYS 183 N 0.51 0.25 -0.71 0.20 1.57 -0.89 -0.46 116.57 117.04 1i6z h LYS 183 Ca 0.14 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1i6z h LYS 183 Cb 0.18 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1i6z h LYS 183 CO -0.01 0.17 0.44 -0.97 -0.57 0.00 0.00 179.45 178.50 1i6z h ASN 184 N 0.26 0.84 -0.55 0.86 -0.73 -1.14 -0.67 115.58 114.45 1i6z h ASN 184 Ca 0.08 -0.04 -0.01 0.00 1.87 0.00 0.00 56.30 58.21 1i6z h ASN 184 Cb -0.01 -0.21 -0.03 0.00 0.27 0.00 0.00 38.32 38.34 1i6z h ASN 184 CO -0.04 0.64 0.33 0.25 -0.37 0.00 0.00 177.43 178.24 1i6z h LEU 185 N 0.98 0.68 -0.12 0.34 7.12 -0.14 -0.42 115.31 123.74 1i6z h LEU 185 Ca 0.26 -0.04 -0.01 0.00 0.13 0.00 0.00 57.88 58.22 1i6z h LEU 185 Cb -0.06 -0.17 -0.01 0.00 -0.53 0.00 0.00 40.66 39.90 1i6z h LEU 185 CO -0.05 0.53 0.04 0.58 -0.13 0.00 0.00 178.44 179.41 1i6z h VAL 186 N 0.78 1.18 -0.70 1.05 2.07 0.42 0.15 116.25 121.21 1i6z h VAL 186 Ca 0.20 -0.55 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 1i6z h VAL 186 Cb -0.01 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 1i6z h VAL 186 CO -0.04 0.16 0.23 0.11 0.02 0.00 0.00 177.57 178.05 1i6z h LYS 187 N 0.01 1.06 -0.61 1.57 6.56 -0.84 1.36 116.57 125.68 1i6z h LYS 187 Ca 0.04 -0.21 -0.02 0.00 -1.06 0.00 0.00 60.65 59.39 1i6z h LYS 187 Cb 0.22 -0.16 -0.03 0.00 -0.57 0.00 0.00 32.23 31.69 1i6z h LYS 187 CO -0.00 0.90 0.29 0.87 -2.06 0.00 0.00 179.45 179.45 1i6z h LYS 188 N 1.03 0.85 -0.47 3.15 1.57 -0.92 -0.93 116.57 120.86 1i6z h LYS 188 Ca 0.23 -0.11 -0.13 0.00 -1.87 0.00 0.00 60.65 58.77 1i6z h LYS 188 Cb 0.27 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1i6z h LYS 188 CO -0.01 0.66 -0.24 0.28 -0.57 0.00 0.00 179.45 179.57 1i6z h VAL 189 N 0.85 1.27 -0.64 0.50 2.07 0.16 -1.64 116.25 118.82 1i6z h VAL 189 Ca 0.21 -1.40 0.05 0.00 0.82 0.00 0.00 66.70 66.38 1i6z h VAL 189 Cb 0.09 1.16 -0.05 0.00 -1.52 0.00 0.00 31.29 30.96 1i6z h VAL 189 CO -0.03 0.48 0.36 1.56 0.02 0.00 0.00 177.57 179.96 1i6z h GLN 190 N 0.84 0.66 -0.04 1.57 1.08 0.30 0.99 115.11 120.51 1i6z h GLN 190 Ca 0.10 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.25 1i6z h GLN 190 Cb 0.81 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 28.10 1i6z h GLN 190 CO 0.07 0.43 -0.04 0.28 -0.95 0.00 0.00 178.83 178.62 1i6z h VAL 191 N 0.68 1.39 -0.47 -0.54 2.07 -1.22 0.14 116.25 118.30 1i6z h VAL 191 Ca 0.28 -1.24 -0.09 0.00 0.82 0.00 0.00 66.70 66.48 1i6z h VAL 191 Cb 0.15 2.15 -0.02 0.00 -1.52 0.00 0.00 31.29 32.05 1i6z h VAL 191 CO -0.17 0.33 -0.08 -0.26 0.02 0.00 0.00 177.57 177.42 1i6z h PHE 192 N -0.39 0.91 -0.12 1.57 0.04 -1.08 1.43 116.94 119.30 1i6z h PHE 192 Ca 0.00 -0.16 -0.08 0.00 2.80 0.00 0.00 57.97 60.54 1i6z h PHE 192 Cb 0.56 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 38.47 1i6z h PHE 192 CO 0.10 0.88 -0.23 1.25 -0.60 0.00 0.00 178.31 179.71 1i6z h LEU 193 N 0.76 0.41 -0.53 1.54 6.46 0.99 -2.43 115.31 122.51 1i6z h LEU 193 Ca 0.13 -0.55 -0.15 0.00 -0.12 0.00 0.00 57.88 57.20 1i6z h LEU 193 Cb 0.57 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 1i6z h LEU 193 CO 0.03 0.88 -0.40 0.00 -0.62 0.00 0.00 178.44 178.33 1i6z h ALA 194 N 0.54 0.71 -0.75 1.25 0.00 -0.60 -2.85 119.26 117.57 1i6z h ALA 194 Ca 0.01 -0.45 0.02 0.00 0.00 0.00 0.00 54.91 54.48 1i6z h ALA 194 Cb 0.81 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 1i6z h ALA 194 CO 0.05 0.66 0.50 1.49 0.00 0.00 0.00 179.25 181.95 1i6z h GLU 195 N 0.61 0.95 -0.60 0.00 4.81 0.20 0.14 114.58 120.69 1i6z h GLU 195 Ca 0.05 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1i6z h GLU 195 Cb 0.95 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 30.09 1i6z h GLU 195 CO 0.09 0.63 0.30 0.00 -0.73 0.00 0.00 179.01 179.29 1i6z h ASP 197 N 0.81 0.84 -0.62 0.00 3.58 -0.93 -1.35 116.42 118.75 1i6z h ASP 197 Ca 0.21 -0.25 -0.07 0.00 0.42 0.00 0.00 57.03 57.33 1i6z h ASP 197 Cb 0.10 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 1i6z h ASP 197 CO -0.03 0.96 0.10 0.74 -2.88 0.00 0.00 179.24 178.13 1i6z h THR 198 N 0.77 1.26 -0.14 2.25 2.02 -0.35 0.99 112.91 119.71 1i6z h THR 198 Ca 0.13 -1.01 -0.01 0.00 0.77 0.00 0.00 66.41 66.29 1i6z h THR 198 Cb 0.60 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 1i6z h THR 198 CO 0.04 0.38 0.06 0.58 0.37 0.00 0.00 175.52 176.94 1i6z h VAL 199 N 0.94 1.15 -0.63 3.16 2.07 -0.87 0.48 116.25 122.55 1i6z h VAL 199 Ca 0.19 -0.47 -0.09 0.00 0.82 0.00 0.00 66.70 67.16 1i6z h VAL 199 Cb 0.43 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 1i6z h VAL 199 CO 0.01 0.14 0.06 1.05 0.02 0.00 0.00 177.57 178.85 1i6z h GLU 200 N 0.07 1.06 -0.42 1.57 -0.00 -1.04 -1.48 114.58 114.34 1i6z h GLU 200 Ca 0.05 -0.30 -0.09 0.00 -0.00 0.00 0.00 59.36 59.02 1i6z h GLU 200 Cb 0.18 -0.11 -0.02 0.00 -0.00 0.00 0.00 28.75 28.79 1i6z h GLU 200 CO -0.00 1.00 -0.09 1.96 -0.00 0.00 0.00 179.01 181.88 1i6z h GLN 201 N 0.98 0.73 -0.14 1.06 4.20 0.13 0.63 115.11 122.71 1i6z h GLN 201 Ca 0.19 -0.23 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 1i6z h GLN 201 Cb 0.49 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.19 1i6z h GLN 201 CO 0.02 0.80 -0.03 -0.92 -0.67 0.00 0.00 178.83 178.03 1i6z h TYR 202 N 0.67 0.30 -0.47 2.96 5.03 0.25 1.15 116.97 126.86 1i6z h TYR 202 Ca 0.12 -0.06 -0.13 0.00 2.58 0.00 0.00 58.73 61.23 1i6z h TYR 202 Cb 0.55 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.74 1i6z h TYR 202 CO 0.03 0.55 -0.23 0.82 -1.32 0.00 0.00 178.16 178.01 1i6z h ILE 203 N -0.05 1.27 -0.08 1.81 2.04 -1.17 -0.29 117.51 121.04 1i6z h ILE 203 Ca 0.03 -1.40 -0.03 0.00 1.00 0.00 0.00 64.86 64.47 1i6z h ILE 203 Cb 0.46 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1i6z h ILE 203 CO 0.01 0.48 -0.06 0.00 0.00 0.00 0.00 178.15 178.59 1i6z h GLN 205 N -0.21 0.64 -0.20 0.00 -0.00 0.14 0.87 115.11 116.35 1i6z h GLN 205 Ca 0.02 -0.22 -0.05 0.00 -0.00 0.00 0.00 58.65 58.40 1i6z h GLN 205 Cb 0.54 -0.05 -0.01 0.00 -0.00 0.00 0.00 27.48 27.96 1i6z h GLN 205 CO 0.02 0.77 -0.08 1.05 -0.00 0.00 0.00 178.83 180.59 1i6z h GLU 206 N 0.58 0.41 -0.37 0.06 4.11 -1.07 0.04 114.58 118.32 1i6z h GLU 206 Ca 0.10 -0.17 -0.14 0.00 0.07 0.00 0.00 59.36 59.21 1i6z h GLU 206 Cb 0.60 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1i6z h GLU 206 CO 0.04 0.69 -0.32 1.15 0.07 0.00 0.00 179.01 180.63 1i6z h THR 207 N 0.11 1.28 -0.56 -1.06 2.02 -1.26 -2.74 112.91 110.69 1i6z h THR 207 Ca 0.05 -1.48 0.04 0.00 0.77 0.00 0.00 66.41 65.78 1i6z h THR 207 Cb 0.56 1.33 -0.04 0.00 -1.74 0.00 0.00 68.15 68.26 1i6z h THR 207 CO 0.03 0.49 0.31 -0.08 0.37 0.00 0.00 175.52 176.64 1i6z h GLU 208 N 0.70 0.58 -0.63 6.66 4.81 0.95 -1.47 114.58 126.18 1i6z h GLU 208 Ca 0.07 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1i6z h GLU 208 Cb 0.88 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 1i6z h GLU 208 CO 0.08 0.38 0.32 -0.09 -0.73 0.00 0.00 179.01 178.97 1i6z h ARG 209 N 0.60 0.88 -0.19 1.92 2.43 -0.85 -1.59 114.38 117.59 1i6z h ARG 209 Ca 0.24 -0.11 0.03 0.00 -0.81 0.00 0.00 59.98 59.33 1i6z h ARG 209 Cb 0.11 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1i6z h ARG 209 CO -0.14 0.67 0.13 1.25 -1.51 0.00 0.00 179.97 180.37 1i6z h LEU 210 N 0.89 0.12 -6.44 3.80 5.85 -0.98 -3.15 115.31 115.41 1i6z h LEU 210 Ca 0.22 -0.00 -0.63 0.00 0.84 0.00 0.00 57.88 58.31 1i6z h LEU 210 Cb 0.07 -0.03 -0.40 0.00 0.37 0.00 0.00 40.66 40.67 1i6z h LEU 210 CO -0.03 0.08 -0.40 0.00 -0.34 0.00 0.00 178.44 177.75 1i6z n GLN 211 N -4.50 2.69 0.02 1.25 3.00 -0.60 -4.88 117.38 114.35 1i6z n GLN 211 Ca 0.01 -4.63 -0.10 0.00 -0.01 0.00 0.00 57.00 52.26 1i6z n GLN 211 Cb 0.16 -2.30 -0.08 0.00 0.00 0.00 0.00 30.24 28.02 1i6z n GLN 211 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 1i6z h SER 212 N 4.55 -0.12 -3.28 1.08 0.87 -1.59 -3.47 113.55 111.60 1i6z h SER 212 Ca 0.19 -0.45 -0.31 0.00 -1.23 0.00 0.00 61.79 59.99 1i6z h SER 212 Cb 0.67 0.03 0.13 0.00 -0.44 0.00 0.00 62.40 62.79 1i6z h SER 212 CO 0.88 0.51 0.28 0.41 -0.53 0.00 0.00 176.83 178.38 1i6z n THR 213 N -4.84 0.00 -1.91 2.23 -1.04 -1.26 -4.90 114.28 102.55 1i6z n THR 213 Ca -0.07 -0.66 0.00 0.00 -2.04 0.00 0.00 64.05 61.27 1i6z n THR 213 Cb 0.28 -1.57 0.00 0.00 -1.82 0.00 0.00 70.33 67.21 1i6z n THR 213 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1i6z n ASN 214 N -3.73 -8.28 -2.78 8.00 5.15 -1.26 -5.09 115.26 107.26 1i6z n ASN 214 Ca 0.12 1.24 -0.15 0.00 -0.60 0.00 0.00 54.58 55.19 1i6z n ASN 214 Cb 0.42 -4.67 -0.06 0.00 -0.53 0.00 0.00 39.78 34.94 1i6z n ASN 214 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1i6z n LEU 215 N 1.72 0.00 -1.42 1.20 7.94 -1.26 -5.11 117.00 120.07 1i6z n LEU 215 Ca 0.00 -2.42 0.19 0.00 -1.11 0.00 0.00 56.01 52.67 1i6z n LEU 215 Cb 0.00 1.22 -0.06 0.00 0.53 0.00 0.00 43.42 45.11 1i6z n LEU 215 CO 0.00 -0.40 -0.35 0.00 -1.11 0.00 0.00 177.39 175.53 1i6z n ALA 216 N -1.28 -3.74 -1.45 1.96 0.00 -1.26 -4.99 120.51 109.74 1i6z n ALA 216 Ca -0.09 0.56 0.19 0.00 0.00 0.00 0.00 53.44 54.09 1i6z n ALA 216 Cb 0.46 -1.35 -0.07 0.00 0.00 0.00 0.00 19.45 18.49 1i6z n ALA 216 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1i6z n LEU 217 N -4.18 -0.87 0.01 0.00 4.77 -1.26 -4.93 117.00 110.52 1i6z n LEU 217 Ca -0.01 1.99 -0.00 0.00 -0.03 0.00 0.00 56.01 57.96 1i6z n LEU 217 Cb 0.67 -4.68 -0.00 0.00 -2.33 0.00 0.00 43.42 37.08 1i6z n LEU 217 CO 0.02 -3.09 -0.45 0.00 -1.33 0.00 0.00 177.39 172.54 1i6z n ALA 218 N -3.28 2.98 -0.52 -1.18 0.00 -1.26 -5.27 120.51 111.99 1i6z n ALA 218 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1i6z n ALA 218 Cb 0.68 0.46 0.00 0.00 0.00 0.00 0.00 19.45 20.59 1i6z n ALA 218 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89