#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cnl n GLY 30 N 0.00 -1.95 3.72 5.00 0.00 -1.26 -4.96 105.19 105.75 2cnl n GLY 30 Ca 0.00 -1.58 -0.43 0.00 0.00 0.00 0.00 46.02 44.02 2cnl n GLY 30 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2cnl n ILE 31 N -3.16 0.73 -4.76 -0.61 5.41 -1.26 -5.00 119.36 110.71 2cnl n ILE 31 Ca 0.07 -0.18 -0.33 0.00 1.00 0.00 0.00 62.75 63.31 2cnl n ILE 31 Cb 0.25 -1.87 -0.16 0.00 -0.71 0.00 0.00 39.64 37.16 2cnl n ILE 31 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2cnl s SER 32 N 0.63 3.50 -0.24 4.38 0.15 -1.26 -5.04 113.70 115.83 2cnl s SER 32 Ca 0.68 -0.49 -0.04 0.00 0.70 0.00 0.00 55.95 56.81 2cnl s SER 32 Cb -0.53 -1.52 -0.18 0.00 -1.71 0.00 0.00 66.02 62.08 2cnl s SER 32 CO 0.45 0.12 -0.14 0.18 1.20 0.00 0.00 173.24 175.04 2cnl n LEU 33 N 3.83 2.67 -2.80 3.45 4.77 -1.26 -5.04 117.00 122.62 2cnl n LEU 33 Ca -0.19 0.04 -0.13 0.00 -0.03 0.00 0.00 56.01 55.69 2cnl n LEU 33 Cb 0.52 -0.93 0.07 0.00 -2.33 0.00 0.00 43.42 40.75 2cnl n LEU 33 CO 0.29 0.82 0.10 -0.67 -1.33 0.00 0.00 177.39 176.60 2cnl n ASP 34 N -3.55 -2.49 -0.17 -1.43 2.03 -1.26 -4.94 116.55 104.74 2cnl n ASP 34 Ca -0.45 -0.45 0.11 0.00 0.52 0.00 0.00 54.79 54.52 2cnl n ASP 34 Cb 0.96 -3.92 0.00 0.00 -0.72 0.00 0.00 41.12 37.45 2cnl n ASP 34 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2cnl n ASN 35 N -2.47 1.25 -4.13 1.67 3.02 -1.26 -4.94 115.26 108.39 2cnl n ASN 35 Ca -0.18 -1.05 -0.19 0.00 -0.03 0.00 0.00 54.58 53.12 2cnl n ASN 35 Cb 0.61 0.68 -0.13 0.00 -0.61 0.00 0.00 39.78 40.33 2cnl n ASN 35 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2cnl s SER 36 N -2.80 1.57 0.44 6.41 1.04 -1.26 -5.12 113.70 113.97 2cnl s SER 36 Ca 0.13 -0.46 -0.25 0.00 0.48 0.00 0.00 55.95 55.85 2cnl s SER 36 Cb 0.17 -0.09 -0.09 0.00 0.10 0.00 0.00 66.02 66.11 2cnl s SER 36 CO 0.73 0.01 1.40 -1.22 0.98 0.00 0.00 173.24 175.15 2cnl n TYR 37 N 1.88 2.59 -2.20 5.02 4.01 -1.26 -4.90 117.16 122.31 2cnl n TYR 37 Ca -0.18 0.45 -0.43 0.00 -0.16 0.00 0.00 57.90 57.58 2cnl n TYR 37 Cb 0.55 -2.45 -0.02 0.00 -0.31 0.00 0.00 39.34 37.11 2cnl n TYR 37 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2cnl s LYS 38 N -2.37 3.53 -0.19 -0.72 2.20 -1.26 -4.84 119.74 116.09 2cnl s LYS 38 Ca 0.61 1.21 0.16 0.00 -0.36 0.00 0.00 55.97 57.58 2cnl s LYS 38 Cb -0.46 -4.08 0.47 0.00 -1.51 0.00 0.00 37.83 32.24 2cnl s LYS 38 CO 0.58 -1.62 1.36 -1.33 -0.36 0.00 0.00 175.35 173.98 2cnl n MET 39 N 8.13 2.34 -0.84 4.03 2.81 -1.26 -4.63 117.12 127.70 2cnl n MET 39 Ca 0.19 -2.84 -0.05 0.00 -1.81 0.00 0.00 57.70 53.18 2cnl n MET 39 Cb 0.47 -1.76 0.22 0.00 -0.71 0.00 0.00 33.22 31.45 2cnl n MET 39 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2cnl n ASP 40 N -0.84 3.33 -4.67 7.83 3.85 -1.26 -4.91 116.55 119.88 2cnl n ASP 40 Ca 0.22 -3.51 -0.29 0.00 -0.71 0.00 0.00 54.79 50.50 2cnl n ASP 40 Cb 0.85 -0.67 0.17 0.00 -1.35 0.00 0.00 41.12 40.12 2cnl n ASP 40 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 2cnl s TYR 41 N -3.14 2.10 0.36 2.11 1.51 -1.26 -4.90 117.35 114.14 2cnl s TYR 41 Ca 0.48 1.14 0.11 0.00 -1.01 0.00 0.00 57.07 57.78 2cnl s TYR 41 Cb 0.41 -3.21 0.88 0.00 -0.11 0.00 0.00 41.96 39.94 2cnl s TYR 41 CO 0.06 -2.79 1.83 -1.35 -1.11 0.00 0.00 175.55 172.19 2cnl h PRO 42 N -1.83 0.60 -6.29 -1.71 0.11 -1.94 -3.41 132.00 117.54 2cnl h PRO 42 Ca -0.53 -0.04 -0.61 0.00 0.11 0.00 0.00 66.00 64.94 2cnl h PRO 42 Cb 1.31 -0.14 -0.25 0.00 0.11 0.00 0.00 31.00 32.03 2cnl h PRO 42 CO 0.55 0.40 -0.85 -1.21 -0.21 0.00 0.00 178.00 176.68 2cnl s GLU 43 N -5.65 1.44 0.21 1.05 2.02 -0.45 -5.02 118.70 112.29 2cnl s GLU 43 Ca -0.10 -1.04 0.00 0.00 0.02 0.00 0.00 54.97 53.86 2cnl s GLU 43 Cb 0.23 -1.61 0.17 0.00 0.10 0.00 0.00 34.13 33.02 2cnl s GLU 43 CO 0.79 0.41 1.52 0.52 0.02 0.00 0.00 175.26 178.52 2cnl h MET 44 N 4.67 0.39 0.00 1.61 2.86 -1.81 0.74 114.93 123.39 2cnl h MET 44 Ca -0.44 -0.27 0.00 0.00 -2.06 0.00 0.00 59.70 56.93 2cnl h MET 44 Cb 1.16 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.86 2cnl h MET 44 CO 0.43 0.87 0.00 0.41 1.06 0.00 0.00 176.91 179.68 2cnl n GLY 45 N 0.30 0.83 3.87 8.32 0.00 -1.26 -0.88 105.19 116.37 2cnl n GLY 45 Ca -0.03 -2.18 -0.31 0.00 0.00 0.00 0.00 46.02 43.49 2cnl n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cnl s LEU 46 N 0.00 4.01 -0.33 0.99 1.43 -1.25 -0.97 118.68 122.56 2cnl s LEU 46 Ca 0.00 1.08 -0.00 0.00 -1.03 0.00 0.00 54.13 54.18 2cnl s LEU 46 Cb 0.00 -3.90 0.11 0.00 0.03 0.00 0.00 46.19 42.42 2cnl s LEU 46 CO 0.00 -0.24 0.12 0.00 0.23 0.00 0.00 176.35 176.46 2cnl s ILE 48 N 1.42 5.05 -0.25 0.00 1.01 0.20 -1.26 121.20 127.37 2cnl s ILE 48 Ca 0.11 1.04 -0.04 0.00 0.00 0.00 0.00 60.65 61.76 2cnl s ILE 48 Cb -0.18 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.40 2cnl s ILE 48 CO -0.21 0.11 -0.00 -0.63 0.00 0.00 0.00 174.94 174.21 2cnl s ILE 49 N 2.03 3.50 -0.38 2.92 -1.09 0.20 -0.06 121.20 128.31 2cnl s ILE 49 Ca 0.25 -0.64 -0.11 0.00 -2.23 0.00 0.00 60.65 57.92 2cnl s ILE 49 Cb -0.16 -2.70 0.03 0.00 -1.58 0.00 0.00 42.46 38.06 2cnl s ILE 49 CO 0.09 0.27 0.22 -0.63 -1.23 0.00 0.00 174.94 173.67 2cnl s ILE 50 N 1.46 4.62 -0.48 2.92 1.01 -0.13 -0.91 121.20 129.70 2cnl s ILE 50 Ca 0.04 -0.88 -0.07 0.00 0.00 0.00 0.00 60.65 59.73 2cnl s ILE 50 Cb -0.16 -3.60 0.12 0.00 0.01 0.00 0.00 42.46 38.84 2cnl s ILE 50 CO -0.01 -0.27 0.34 0.21 0.00 0.00 0.00 174.94 175.21 2cnl s ASN 51 N 1.60 5.61 -0.44 3.58 2.47 0.70 -1.33 114.94 127.12 2cnl s ASN 51 Ca 0.02 -2.04 -0.14 0.00 0.42 0.00 0.00 52.86 51.11 2cnl s ASN 51 Cb -0.19 -1.97 0.06 0.00 -1.45 0.00 0.00 41.25 37.70 2cnl s ASN 51 CO 0.07 -0.63 0.34 0.20 -3.72 0.00 0.00 177.10 173.36 2cnl s ASN 52 N 2.32 6.06 -0.22 -4.21 0.01 -0.63 -0.79 114.94 117.47 2cnl s ASN 52 Ca 0.08 -1.21 -0.06 0.00 -0.71 0.00 0.00 52.86 50.96 2cnl s ASN 52 Cb -0.24 -2.15 -0.12 0.00 0.41 0.00 0.00 41.25 39.15 2cnl s ASN 52 CO -0.02 -0.57 -0.25 1.17 -1.51 0.00 0.00 177.10 175.93 2cnl n LYS 53 N 5.15 0.50 -4.27 -0.60 4.81 -1.26 -4.55 118.16 117.95 2cnl n LYS 53 Ca -0.12 0.17 -0.34 0.00 -0.87 0.00 0.00 58.31 57.15 2cnl n LYS 53 Cb 0.45 -1.36 -0.11 0.00 0.02 0.00 0.00 35.03 34.02 2cnl n LYS 53 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 2cnl s ASN 54 N -6.60 5.07 0.11 3.14 0.01 -1.26 -0.95 114.94 114.46 2cnl s ASN 54 Ca -0.30 -0.06 0.08 0.00 -0.71 0.00 0.00 52.86 51.87 2cnl s ASN 54 Cb 0.10 -1.84 -0.04 0.00 0.41 0.00 0.00 41.25 39.88 2cnl s ASN 54 CO 0.44 0.17 -0.15 -0.36 -1.51 0.00 0.00 177.10 175.69 2cnl s PHE 55 N 0.37 2.62 0.28 2.20 0.40 -1.26 -4.80 117.98 117.78 2cnl s PHE 55 Ca -0.02 -0.22 -0.30 0.00 -0.60 0.00 0.00 56.93 55.79 2cnl s PHE 55 Cb -0.14 -1.39 -0.13 0.00 0.51 0.00 0.00 43.02 41.88 2cnl s PHE 55 CO 0.02 0.40 1.46 0.72 0.70 0.00 0.00 175.22 178.52 2cnl n HIS 56 N 0.79 2.45 -0.31 0.36 8.25 -0.22 -4.86 115.22 121.67 2cnl n HIS 56 Ca -0.15 0.39 0.15 0.00 -0.26 0.00 0.00 57.72 57.85 2cnl n HIS 56 Cb 0.52 -2.50 0.39 0.00 1.12 0.00 0.00 29.99 29.53 2cnl n HIS 56 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2cnl h LYS 57 N 4.14 0.62 -0.09 -0.41 3.64 -1.91 -0.91 116.57 121.64 2cnl h LYS 57 Ca -0.46 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 58.91 2cnl h LYS 57 Cb 1.26 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2cnl h LYS 57 CO 0.75 0.41 0.12 0.66 -2.27 0.00 0.00 179.45 179.11 2cnl h SER 58 N 0.63 0.00 1.72 4.20 4.64 -1.95 -1.39 113.55 121.42 2cnl h SER 58 Ca 0.53 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.84 2cnl h SER 58 Cb 0.99 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2cnl h SER 58 CO -0.29 0.00 -0.28 0.71 -0.87 0.00 0.00 176.83 176.11 2cnl h THR 59 N 0.00 0.03 -0.13 2.95 1.35 -1.48 -3.47 112.91 112.15 2cnl h THR 59 Ca 0.04 -1.05 -0.06 0.00 -0.55 0.00 0.00 66.41 64.80 2cnl h THR 59 Cb 0.28 1.89 -0.02 0.00 -1.73 0.00 0.00 68.15 68.56 2cnl h THR 59 CO -0.00 0.02 -0.05 0.61 -0.25 0.00 0.00 175.52 175.85 2cnl n GLY 60 N 1.13 0.57 3.80 5.82 0.00 -0.52 -5.00 105.19 110.98 2cnl n GLY 60 Ca 0.03 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 2cnl n GLY 60 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2cnl s MET 61 N -1.44 4.21 0.60 1.61 -1.94 -1.26 -5.07 119.30 116.01 2cnl s MET 61 Ca 0.00 0.71 -0.13 0.00 -1.71 0.00 0.00 55.69 54.56 2cnl s MET 61 Cb 0.00 -3.26 -0.04 0.00 2.01 0.00 0.00 34.83 33.54 2cnl s MET 61 CO 0.00 0.58 1.03 0.95 -0.01 0.00 0.00 175.02 177.57 2cnl s THR 62 N -0.90 4.47 0.47 2.05 -4.23 -1.26 -4.59 115.64 111.66 2cnl s THR 62 Ca 0.29 0.93 -0.22 0.00 -1.18 0.00 0.00 61.69 61.51 2cnl s THR 62 Cb -0.19 -3.71 -0.08 0.00 1.34 0.00 0.00 72.50 69.86 2cnl s THR 62 CO 0.18 -0.92 1.11 -0.94 -0.54 0.00 0.00 174.62 173.51 2cnl s SER 63 N -3.70 6.21 -1.08 3.99 1.04 -1.26 -4.71 113.70 114.18 2cnl s SER 63 Ca 0.57 2.15 -0.05 0.00 0.48 0.00 0.00 55.95 59.09 2cnl s SER 63 Cb -0.12 -2.59 0.30 0.00 0.10 0.00 0.00 66.02 63.71 2cnl s SER 63 CO 0.47 -0.88 1.32 0.54 0.98 0.00 0.00 173.24 175.67 2cnl n ARG 64 N -0.71 4.07 -1.68 4.02 1.74 -0.12 -5.03 116.66 118.95 2cnl n ARG 64 Ca 0.08 -4.53 -0.44 0.00 -0.77 0.00 0.00 57.85 52.19 2cnl n ARG 64 Cb 0.50 -2.52 -0.03 0.00 -1.02 0.00 0.00 32.46 29.40 2cnl n ARG 64 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2cnl n SER 65 N 1.80 2.97 0.00 0.55 3.41 -1.26 -1.94 113.62 119.15 2cnl n SER 65 Ca 0.25 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 60.00 2cnl n SER 65 Cb 0.35 -1.45 0.00 0.00 -0.26 0.00 0.00 64.21 62.85 2cnl n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cnl n GLY 66 N 2.33 1.16 0.22 5.00 0.00 -1.26 -4.93 105.19 107.71 2cnl n GLY 66 Ca 0.12 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.20 2cnl n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cnl h THR 67 N 0.00 0.99 -0.32 2.61 1.03 -1.80 -2.32 112.91 113.10 2cnl h THR 67 Ca 0.00 -0.92 -0.06 0.00 -0.01 0.00 0.00 66.41 65.42 2cnl h THR 67 Cb 0.00 1.52 -0.02 0.00 -1.07 0.00 0.00 68.15 68.58 2cnl h THR 67 CO 0.00 0.25 -0.05 0.44 -0.01 0.00 0.00 175.52 176.15 2cnl h ASP 68 N 0.00 0.49 -0.67 0.00 3.32 -1.92 0.39 116.42 118.04 2cnl h ASP 68 Ca -0.00 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 2cnl h ASP 68 Cb 0.50 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 2cnl h ASP 68 CO 0.03 0.60 0.31 0.58 -1.72 0.00 0.00 179.24 179.04 2cnl h VAL 69 N 0.49 1.23 -0.22 -1.35 2.07 -1.84 -0.41 116.25 116.21 2cnl h VAL 69 Ca 0.10 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 2cnl h VAL 69 Cb 0.39 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2cnl h VAL 69 CO 0.02 0.27 0.08 0.44 0.02 0.00 0.00 177.57 178.40 2cnl h ASP 70 N 0.93 0.32 -0.72 0.57 3.32 -1.24 -1.41 116.42 118.20 2cnl h ASP 70 Ca 0.23 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.11 2cnl h ASP 70 Cb 0.14 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.57 2cnl h ASP 70 CO -0.03 0.42 0.47 0.00 -1.72 0.00 0.00 179.24 178.38 2cnl h ALA 71 N 0.91 0.91 -0.45 3.45 0.00 -0.61 -0.45 119.26 123.03 2cnl h ALA 71 Ca 0.07 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 2cnl h ALA 71 Cb 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2cnl h ALA 71 CO -0.00 0.30 -0.18 0.00 0.00 0.00 0.00 179.25 179.37 2cnl h ALA 72 N 1.27 0.63 -0.61 0.00 0.00 -1.00 -1.59 119.26 117.96 2cnl h ALA 72 Ca 0.27 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2cnl h ALA 72 Cb -0.08 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2cnl h ALA 72 CO -0.07 0.58 0.26 -0.97 0.00 0.00 0.00 179.25 179.05 2cnl h ASN 73 N 0.75 0.83 -0.41 0.00 -0.73 -0.96 -1.80 115.58 113.26 2cnl h ASN 73 Ca 0.10 -0.16 -0.04 0.00 1.87 0.00 0.00 56.30 58.08 2cnl h ASN 73 Cb 0.75 -0.21 -0.02 0.00 0.27 0.00 0.00 38.32 39.11 2cnl h ASN 73 CO 0.06 0.76 0.11 -0.07 -0.37 0.00 0.00 177.43 177.91 2cnl h LEU 74 N 0.84 0.62 -0.44 0.34 3.38 -0.98 -0.63 115.31 118.45 2cnl h LEU 74 Ca 0.20 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.98 2cnl h LEU 74 Cb 0.18 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 2cnl h LEU 74 CO -0.02 0.68 0.21 -0.09 0.09 0.00 0.00 178.44 179.32 2cnl h ARG 75 N 0.52 0.42 -0.30 1.13 2.43 -1.01 -0.34 114.38 117.24 2cnl h ARG 75 Ca 0.13 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.21 2cnl h ARG 75 Cb 0.30 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2cnl h ARG 75 CO 0.00 0.28 -0.07 1.49 -1.51 0.00 0.00 179.97 180.15 2cnl h GLU 76 N 0.43 0.58 -0.14 0.20 4.57 -1.21 -0.87 114.58 118.14 2cnl h GLU 76 Ca 0.19 -0.22 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2cnl h GLU 76 Cb 0.10 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 2cnl h GLU 76 CO -0.14 0.77 0.08 1.15 -1.18 0.00 0.00 179.01 179.70 2cnl h THR 77 N 0.34 1.06 0.00 0.32 2.02 -0.86 -2.02 112.91 113.78 2cnl h THR 77 Ca 0.08 -0.15 -0.04 0.00 0.77 0.00 0.00 66.41 67.06 2cnl h THR 77 Cb 0.56 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.88 2cnl h THR 77 CO 0.03 0.06 -0.19 -0.26 0.37 0.00 0.00 175.52 175.53 2cnl h PHE 78 N 0.16 0.00 -0.47 3.16 0.04 -1.10 -2.91 116.94 115.83 2cnl h PHE 78 Ca 0.05 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.78 2cnl h PHE 78 Cb 0.02 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.15 2cnl h PHE 78 CO -0.06 0.19 0.15 -0.09 -0.60 0.00 0.00 178.31 177.91 2cnl h ARG 79 N 0.00 0.72 0.00 1.51 2.43 -0.85 -1.01 114.38 117.18 2cnl h ARG 79 Ca -0.00 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2cnl h ARG 79 Cb 0.94 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 2cnl h ARG 79 CO 0.02 0.69 0.00 -0.91 -1.51 0.00 0.00 179.97 178.26 2cnl h ASN 80 N 0.62 0.00 -0.19 -3.80 2.35 -1.18 -0.96 115.58 112.43 2cnl h ASN 80 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2cnl h ASN 80 Cb 0.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.63 2cnl h ASN 80 CO -0.01 0.00 0.00 0.18 -1.65 0.00 0.00 177.43 175.95 2cnl n LEU 81 N -2.85 1.98 -0.65 1.61 4.77 -0.88 -4.93 117.00 116.06 2cnl n LEU 81 Ca 0.01 -0.82 -0.06 0.00 -0.03 0.00 0.00 56.01 55.11 2cnl n LEU 81 Cb 0.25 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.22 2cnl n LEU 81 CO 0.24 0.41 -0.07 0.29 -1.33 0.00 0.00 177.39 176.93 2cnl n LYS 82 N 0.53 -0.47 -3.13 3.23 4.76 -0.36 -4.94 118.16 117.78 2cnl n LYS 82 Ca 0.17 0.36 -0.30 0.00 -2.87 0.00 0.00 58.31 55.66 2cnl n LYS 82 Cb 0.38 -4.18 -0.04 0.00 -1.84 0.00 0.00 35.03 29.36 2cnl n LYS 82 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2cnl s TYR 83 N -2.29 3.45 -0.73 2.13 1.51 -0.44 -4.16 117.35 116.84 2cnl s TYR 83 Ca 0.00 0.91 -0.22 0.00 -1.01 0.00 0.00 57.07 56.75 2cnl s TYR 83 Cb 0.00 -2.32 0.08 0.00 -0.11 0.00 0.00 41.96 39.61 2cnl s TYR 83 CO 0.00 0.07 1.04 -2.00 -1.11 0.00 0.00 175.55 173.54 2cnl s GLU 84 N -3.48 3.22 -0.03 -0.62 2.12 -0.14 -4.54 118.70 115.23 2cnl s GLU 84 Ca 0.49 -0.96 -0.25 0.00 0.36 0.00 0.00 54.97 54.61 2cnl s GLU 84 Cb -0.11 -4.40 -0.04 0.00 0.26 0.00 0.00 34.13 29.85 2cnl s GLU 84 CO 0.28 -1.85 0.77 0.08 -0.54 0.00 0.00 175.26 173.99 2cnl s VAL 85 N 4.00 4.94 -0.10 3.70 1.01 -1.26 -1.13 120.40 131.55 2cnl s VAL 85 Ca 0.26 1.61 0.01 0.00 0.00 0.00 0.00 61.98 63.85 2cnl s VAL 85 Cb -0.13 -4.11 0.02 0.00 0.00 0.00 0.00 36.38 32.15 2cnl s VAL 85 CO 0.06 0.26 -0.10 -0.13 0.00 0.00 0.00 175.10 175.19 2cnl s ARG 86 N 0.63 1.71 0.03 2.72 0.52 -0.39 -4.95 118.95 119.22 2cnl s ARG 86 Ca 0.41 -0.36 0.03 0.00 -0.52 0.00 0.00 55.73 55.28 2cnl s ARG 86 Cb -0.19 -1.60 -0.04 0.00 0.52 0.00 0.00 34.95 33.65 2cnl s ARG 86 CO 0.21 -0.15 0.00 1.21 0.02 0.00 0.00 175.30 176.59 2cnl s ASN 87 N 1.28 5.08 -0.02 0.23 2.47 -1.26 -0.63 114.94 122.09 2cnl s ASN 87 Ca -0.03 -0.06 0.01 0.00 0.42 0.00 0.00 52.86 53.20 2cnl s ASN 87 Cb -0.14 -1.29 0.01 0.00 -1.45 0.00 0.00 41.25 38.39 2cnl s ASN 87 CO -0.04 0.25 -0.01 -0.54 -3.72 0.00 0.00 177.10 173.03 2cnl s LYS 88 N -1.80 0.27 0.03 0.43 -0.14 -0.08 -4.95 119.74 113.49 2cnl s LYS 88 Ca 0.22 -0.00 0.06 0.00 -1.36 0.00 0.00 55.97 54.88 2cnl s LYS 88 Cb -0.12 -0.36 -0.03 0.00 -1.68 0.00 0.00 37.83 35.64 2cnl s LYS 88 CO 0.13 -0.05 -0.14 -0.80 -0.76 0.00 0.00 175.35 173.73 2cnl s ASN 89 N 0.53 4.09 -0.94 2.83 0.01 -1.26 -0.21 114.94 119.99 2cnl s ASN 89 Ca -0.05 -0.32 -0.10 0.00 -0.71 0.00 0.00 52.86 51.68 2cnl s ASN 89 Cb -0.08 -0.78 0.01 0.00 0.41 0.00 0.00 41.25 40.81 2cnl s ASN 89 CO -0.01 0.27 0.65 0.47 -1.51 0.00 0.00 177.10 176.97 2cnl n ASP 90 N 1.58 -5.07 -4.84 -1.22 10.43 0.03 -4.95 116.55 112.49 2cnl n ASP 90 Ca -0.16 -0.95 -0.38 0.00 2.57 0.00 0.00 54.79 55.88 2cnl n ASP 90 Cb 0.52 -2.25 -0.06 0.00 1.84 0.00 0.00 41.12 41.17 2cnl n ASP 90 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2cnl s LEU 91 N -5.57 4.43 0.90 0.64 1.43 -1.26 -4.86 118.68 114.38 2cnl s LEU 91 Ca 0.16 0.77 -0.12 0.00 -1.03 0.00 0.00 54.13 53.91 2cnl s LEU 91 Cb -0.08 -2.40 0.13 0.00 0.03 0.00 0.00 46.19 43.88 2cnl s LEU 91 CO 0.89 0.34 1.12 0.42 0.23 0.00 0.00 176.35 179.35 2cnl s THR 92 N -0.96 2.30 0.34 5.49 -4.23 -1.26 -0.92 115.64 116.40 2cnl s THR 92 Ca 0.20 0.10 0.02 0.00 -1.18 0.00 0.00 61.69 60.83 2cnl s THR 92 Cb -0.15 -2.78 0.27 0.00 1.34 0.00 0.00 72.50 71.18 2cnl s THR 92 CO 0.10 -0.13 1.98 0.08 -0.54 0.00 0.00 174.62 176.11 2cnl h ARG 93 N -1.48 0.87 -0.42 3.99 0.11 -1.85 -1.07 114.38 114.53 2cnl h ARG 93 Ca -0.50 -0.05 -0.06 0.00 0.10 0.00 0.00 59.98 59.47 2cnl h ARG 93 Cb 1.31 -0.20 -0.02 0.00 1.11 0.00 0.00 29.97 32.18 2cnl h ARG 93 CO 0.60 0.58 0.03 0.93 0.10 0.00 0.00 179.97 182.21 2cnl h GLU 94 N 0.90 0.72 -0.17 0.08 3.07 -1.95 -2.55 114.58 114.67 2cnl h GLU 94 Ca 0.28 -0.21 -0.07 0.00 -0.50 0.00 0.00 59.36 58.85 2cnl h GLU 94 Cb 0.01 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 27.83 2cnl h GLU 94 CO -0.07 0.78 -0.22 0.93 -1.40 0.00 0.00 179.01 179.02 2cnl h GLU 95 N 0.56 0.31 -0.12 2.33 5.08 -1.74 -0.86 114.58 120.13 2cnl h GLU 95 Ca 0.12 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2cnl h GLU 95 Cb 0.43 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 2cnl h GLU 95 CO 0.01 0.52 0.02 0.82 -1.00 0.00 0.00 179.01 179.39 2cnl h ILE 96 N 0.28 1.22 -0.60 3.13 2.04 -1.05 0.12 117.51 122.65 2cnl h ILE 96 Ca 0.05 -0.71 -0.03 0.00 1.00 0.00 0.00 64.86 65.17 2cnl h ILE 96 Cb 0.56 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.06 2cnl h ILE 96 CO 0.04 0.21 0.25 0.58 0.00 0.00 0.00 178.15 179.23 2cnl h VAL 97 N -0.02 1.23 -0.55 1.67 2.07 -1.26 -1.54 116.25 117.84 2cnl h VAL 97 Ca 0.04 -0.69 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 2cnl h VAL 97 Cb 0.30 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 2cnl h VAL 97 CO 0.00 0.27 0.21 -0.08 0.02 0.00 0.00 177.57 178.00 2cnl h GLU 98 N 0.83 0.83 -0.02 1.57 4.81 -1.05 -0.69 114.58 120.86 2cnl h GLU 98 Ca 0.20 -0.16 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2cnl h GLU 98 Cb 0.18 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 2cnl h GLU 98 CO -0.02 0.73 0.01 1.25 -0.73 0.00 0.00 179.01 180.25 2cnl h LEU 99 N 0.76 0.03 -0.62 1.64 5.85 -0.74 -0.92 115.31 121.30 2cnl h LEU 99 Ca 0.18 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 2cnl h LEU 99 Cb 0.21 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 2cnl h LEU 99 CO -0.01 0.08 0.37 0.24 -0.34 0.00 0.00 178.44 178.78 2cnl h MET 100 N -0.03 0.84 0.01 1.25 2.86 -1.16 -0.40 114.93 118.31 2cnl h MET 100 Ca 0.01 -0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 2cnl h MET 100 Cb 0.06 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.54 2cnl h MET 100 CO -0.00 0.60 -0.00 -0.09 1.06 0.00 0.00 176.91 178.48 2cnl h ARG 101 N 0.84 -0.01 -0.38 1.72 2.43 -0.99 -0.55 114.38 117.44 2cnl h ARG 101 Ca 0.22 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.41 2cnl h ARG 101 Cb -0.02 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 2cnl h ARG 101 CO -0.04 0.05 0.21 -0.44 -1.51 0.00 0.00 179.97 178.23 2cnl h ASP 102 N -0.07 0.32 -0.65 -3.80 3.45 -0.93 -1.85 116.42 112.90 2cnl h ASP 102 Ca -0.00 0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.45 2cnl h ASP 102 Cb 0.06 -0.06 -0.03 0.00 -0.56 0.00 0.00 39.33 38.75 2cnl h ASP 102 CO 0.00 0.23 0.33 0.58 -1.57 0.00 0.00 179.24 178.82 2cnl h VAL 103 N 0.42 1.22 0.00 -1.35 2.07 -0.95 -1.95 116.25 115.71 2cnl h VAL 103 Ca 0.15 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 2cnl h VAL 103 Cb 0.03 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 2cnl h VAL 103 CO -0.09 0.24 -0.04 0.77 0.02 0.00 0.00 177.57 178.47 2cnl h SER 104 N 0.89 0.00 0.09 0.57 4.64 -0.73 -2.27 113.55 116.73 2cnl h SER 104 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2cnl h SER 104 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2cnl h SER 104 CO -0.03 0.04 -0.08 0.29 -0.87 0.00 0.00 176.83 176.18 2cnl n LYS 105 N -3.24 1.30 -1.63 4.77 5.02 -0.73 -4.80 118.16 118.86 2cnl n LYS 105 Ca -0.01 -0.70 -0.30 0.00 -2.02 0.00 0.00 58.31 55.28 2cnl n LYS 105 Cb 0.23 -1.49 0.08 0.00 -0.02 0.00 0.00 35.03 33.84 2cnl n LYS 105 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2cnl s GLU 106 N -2.18 2.23 -0.53 1.97 2.02 -0.86 -4.99 118.70 116.37 2cnl s GLU 106 Ca 0.34 0.58 -0.21 0.00 0.02 0.00 0.00 54.97 55.70 2cnl s GLU 106 Cb 0.21 -1.94 0.05 0.00 0.10 0.00 0.00 34.13 32.55 2cnl s GLU 106 CO 0.40 -1.50 0.75 0.34 0.02 0.00 0.00 175.26 175.27 2cnl s ASP 107 N -4.02 6.26 -0.10 -0.19 -1.08 -1.26 -4.89 116.67 111.39 2cnl s ASP 107 Ca 0.60 -0.74 0.12 0.00 -0.52 0.00 0.00 52.55 52.01 2cnl s ASP 107 Cb -0.14 -2.35 0.53 0.00 -1.46 0.00 0.00 42.92 39.51 2cnl s ASP 107 CO 0.54 -1.04 1.38 1.41 0.52 0.00 0.00 175.17 177.98 2cnl n HIS 108 N 6.70 1.17 -0.30 -5.34 8.25 -1.26 -4.59 115.22 119.84 2cnl n HIS 108 Ca -0.04 -0.45 0.11 0.00 -0.26 0.00 0.00 57.72 57.09 2cnl n HIS 108 Cb 0.46 -0.24 0.28 0.00 1.12 0.00 0.00 29.99 31.62 2cnl n HIS 108 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2cnl h SER 109 N 2.92 0.40 -0.45 0.41 0.02 -1.90 -0.60 113.55 114.35 2cnl h SER 109 Ca 0.00 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 2cnl h SER 109 Cb 1.21 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.84 2cnl h SER 109 CO 0.21 0.07 0.00 0.29 -1.14 0.00 0.00 176.83 176.26 2cnl n LYS 110 N -4.99 2.19 -4.38 3.45 5.02 -1.26 -4.89 118.16 113.31 2cnl n LYS 110 Ca 0.21 -1.68 -0.34 0.00 -2.02 0.00 0.00 58.31 54.47 2cnl n LYS 110 Cb 0.59 -1.41 -0.10 0.00 -0.02 0.00 0.00 35.03 34.08 2cnl n LYS 110 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2cnl s ARG 111 N -1.45 3.19 0.22 1.97 0.52 -0.23 -1.35 118.95 121.82 2cnl s ARG 111 Ca 0.31 -0.44 0.09 0.00 -0.52 0.00 0.00 55.73 55.17 2cnl s ARG 111 Cb 0.17 -2.83 0.17 0.00 0.52 0.00 0.00 34.95 32.98 2cnl s ARG 111 CO 0.20 0.56 1.51 0.77 0.02 0.00 0.00 175.30 178.36 2cnl h SER 112 N 5.63 0.01 -2.29 0.23 0.02 -0.69 -3.47 113.55 112.99 2cnl h SER 112 Ca -0.45 -0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.45 2cnl h SER 112 Cb 1.19 -0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 2cnl h SER 112 CO 0.57 0.74 0.11 -1.54 -1.14 0.00 0.00 176.83 175.57 2cnl n SER 113 N -3.66 -1.19 -3.81 3.07 3.41 -0.06 -4.31 113.62 107.07 2cnl n SER 113 Ca -0.01 -1.94 -0.13 0.00 -0.26 0.00 0.00 58.87 56.54 2cnl n SER 113 Cb 0.72 2.01 -0.14 0.00 -0.26 0.00 0.00 64.21 66.54 2cnl n SER 113 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2cnl s PHE 114 N -4.88 -0.06 -0.03 7.33 5.36 -0.76 -3.93 117.98 121.01 2cnl s PHE 114 Ca 0.11 0.20 0.03 0.00 -0.96 0.00 0.00 56.93 56.30 2cnl s PHE 114 Cb -0.02 -0.06 0.01 0.00 -0.34 0.00 0.00 43.02 42.61 2cnl s PHE 114 CO 0.08 -0.07 -0.10 0.08 -1.46 0.00 0.00 175.22 173.75 2cnl s VAL 115 N 0.47 0.87 -0.06 3.12 1.01 -0.21 -0.50 120.40 125.09 2cnl s VAL 115 Ca -0.04 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.56 2cnl s VAL 115 Cb -0.05 -0.78 0.02 0.00 0.00 0.00 0.00 36.38 35.57 2cnl s VAL 115 CO -0.02 0.27 -0.04 0.00 0.00 0.00 0.00 175.10 175.31 2cnl s VAL 117 N 1.23 2.96 -0.22 0.00 1.01 0.91 -0.51 120.40 125.78 2cnl s VAL 117 Ca -0.06 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 2cnl s VAL 117 Cb -0.14 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 2cnl s VAL 117 CO -0.02 0.50 -0.05 -0.76 0.00 0.00 0.00 175.10 174.77 2cnl s LEU 118 N 0.74 2.86 -0.28 3.92 1.43 0.52 -0.95 118.68 126.91 2cnl s LEU 118 Ca -0.05 -0.40 0.03 0.00 -1.03 0.00 0.00 54.13 52.68 2cnl s LEU 118 Cb -0.15 -1.73 0.07 0.00 0.03 0.00 0.00 46.19 44.41 2cnl s LEU 118 CO 0.01 -0.01 -0.06 -0.76 0.23 0.00 0.00 176.35 175.76 2cnl s LEU 119 N 1.44 3.75 0.00 1.79 1.43 -0.44 -0.88 118.68 125.76 2cnl s LEU 119 Ca 0.05 -1.60 -0.12 0.00 -1.03 0.00 0.00 54.13 51.43 2cnl s LEU 119 Cb -0.14 -1.55 0.04 0.00 0.03 0.00 0.00 46.19 44.57 2cnl s LEU 119 CO -0.03 -0.25 0.57 -0.24 0.23 0.00 0.00 176.35 176.63 2cnl n SER 120 N 4.40 -0.64 -4.84 2.29 2.88 -0.94 -1.60 113.62 115.17 2cnl n SER 120 Ca -0.09 -1.21 -0.31 0.00 -1.33 0.00 0.00 58.87 55.93 2cnl n SER 120 Cb 0.42 1.01 0.03 0.00 -0.75 0.00 0.00 64.21 64.93 2cnl n SER 120 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2cnl s HIS 121 N -3.05 3.35 0.16 0.66 3.76 -1.26 -4.11 115.29 114.81 2cnl s HIS 121 Ca 0.13 1.36 -0.23 0.00 -0.15 0.00 0.00 55.06 56.16 2cnl s HIS 121 Cb -0.01 -2.81 0.08 0.00 1.11 0.00 0.00 32.58 30.95 2cnl s HIS 121 CO 0.01 -0.99 1.05 0.20 -0.85 0.00 0.00 174.74 174.16 2cnl s GLY 122 N -3.98 0.02 0.29 -2.22 0.00 -1.26 -1.26 107.32 98.90 2cnl s GLY 122 Ca 0.57 -0.19 -0.02 0.00 0.00 0.00 0.00 44.72 45.07 2cnl s GLY 122 CO 0.55 2.08 0.36 -0.54 0.00 0.00 0.00 173.10 175.54 2cnl s GLU 123 N -2.36 1.64 -0.06 2.90 2.02 -0.91 -4.05 118.70 117.88 2cnl s GLU 123 Ca 0.20 -1.67 -0.34 0.00 0.02 0.00 0.00 54.97 53.18 2cnl s GLU 123 Cb -0.02 0.39 -0.12 0.00 0.10 0.00 0.00 34.13 34.48 2cnl s GLU 123 CO 0.04 -0.64 1.84 -1.91 0.02 0.00 0.00 175.26 174.61 2cnl n GLU 124 N -0.47 2.15 -0.98 1.61 4.07 -1.17 -0.74 120.64 125.12 2cnl n GLU 124 Ca 0.02 0.79 0.00 0.00 -0.06 0.00 0.00 57.16 57.91 2cnl n GLU 124 Cb 0.63 -2.62 0.00 0.00 -0.06 0.00 0.00 31.44 29.39 2cnl n GLU 124 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2cnl n GLY 125 N 4.26 0.37 3.11 8.31 0.00 -1.26 -5.00 105.19 114.98 2cnl n GLY 125 Ca 0.22 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.05 2cnl n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cnl s ILE 126 N -1.82 0.98 -0.03 -0.61 -1.09 0.08 -1.24 121.20 117.47 2cnl s ILE 126 Ca 0.00 -0.85 0.04 0.00 -2.23 0.00 0.00 60.65 57.61 2cnl s ILE 126 Cb 0.00 -0.88 -0.01 0.00 -1.58 0.00 0.00 42.46 39.99 2cnl s ILE 126 CO 0.00 0.04 -0.15 -0.51 -1.23 0.00 0.00 174.94 173.09 2cnl s ILE 127 N -0.72 1.21 -0.08 2.92 2.07 -0.64 -2.41 121.20 123.55 2cnl s ILE 127 Ca 0.01 -0.62 -0.16 0.00 -1.41 0.00 0.00 60.65 58.48 2cnl s ILE 127 Cb -0.07 -1.03 -0.05 0.00 0.13 0.00 0.00 42.46 41.44 2cnl s ILE 127 CO 0.01 0.35 0.40 -0.36 -1.91 0.00 0.00 174.94 173.43 2cnl s PHE 128 N -0.09 3.59 0.79 3.50 0.08 -0.39 -0.62 117.98 124.85 2cnl s PHE 128 Ca 0.00 0.86 -0.07 0.00 0.12 0.00 0.00 56.93 57.84 2cnl s PHE 128 Cb -0.09 -2.39 0.13 0.00 -0.57 0.00 0.00 43.02 40.11 2cnl s PHE 128 CO 0.01 0.38 1.11 0.20 -0.10 0.00 0.00 175.22 176.82 2cnl s GLY 129 N -0.12 1.75 0.37 4.36 0.00 0.33 -4.62 107.32 109.38 2cnl s GLY 129 Ca 0.23 -1.33 0.27 0.00 0.00 0.00 0.00 44.72 43.89 2cnl s GLY 129 CO 0.10 -0.74 1.82 -0.91 0.00 0.00 0.00 173.10 173.37 2cnl h THR 130 N -0.91 0.00 0.00 0.90 1.35 -1.29 -3.08 112.91 109.88 2cnl h THR 130 Ca -0.41 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 2cnl h THR 130 Cb 1.27 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 2cnl h THR 130 CO 0.45 0.00 -0.03 -0.46 -0.25 0.00 0.00 175.52 175.23 2cnl n ASN 131 N -2.51 1.66 0.00 5.36 6.94 -1.26 -1.06 115.26 124.39 2cnl n ASN 131 Ca 0.01 -2.08 0.00 0.00 -0.02 0.00 0.00 54.58 52.49 2cnl n ASN 131 Cb 0.20 -0.10 0.00 0.00 -2.36 0.00 0.00 39.78 37.52 2cnl n ASN 131 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2cnl n GLY 132 N -0.59 1.59 3.82 4.83 0.00 -1.16 -4.91 105.19 108.77 2cnl n GLY 132 Ca 0.03 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 2cnl n GLY 132 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cnl s PRO 133 N -1.94 3.33 -0.05 1.61 0.04 -1.26 0.12 135.00 136.85 2cnl s PRO 133 Ca 0.00 1.02 -0.01 0.00 0.04 0.00 0.00 61.00 62.06 2cnl s PRO 133 Cb 0.00 -2.04 0.03 0.00 0.04 0.00 0.00 34.50 32.53 2cnl s PRO 133 CO 0.00 -0.79 0.01 0.08 0.04 0.00 0.00 177.00 176.34 2cnl s VAL 134 N -2.77 0.22 0.14 -0.36 1.01 0.21 -4.77 120.40 114.09 2cnl s VAL 134 Ca 0.60 0.14 -0.31 0.00 0.00 0.00 0.00 61.98 62.40 2cnl s VAL 134 Cb -0.14 -0.36 -0.09 0.00 0.00 0.00 0.00 36.38 35.79 2cnl s VAL 134 CO 0.44 0.20 1.47 -1.81 0.00 0.00 0.00 175.10 175.39 2cnl s ASP 135 N 1.52 6.72 0.47 3.32 -0.00 -1.26 -1.62 116.67 125.82 2cnl s ASP 135 Ca -0.02 2.45 0.13 0.00 -0.00 0.00 0.00 52.55 55.11 2cnl s ASP 135 Cb -0.13 -2.59 1.10 0.00 -0.00 0.00 0.00 42.92 41.30 2cnl s ASP 135 CO -0.03 -0.73 2.08 -0.07 -0.00 0.00 0.00 175.17 176.42 2cnl h LEU 136 N 6.79 0.23 -1.23 1.23 3.38 -1.52 -1.49 115.31 122.70 2cnl h LEU 136 Ca -0.42 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.52 2cnl h LEU 136 Cb 1.21 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 2cnl h LEU 136 CO 0.89 0.16 0.23 0.50 0.09 0.00 0.00 178.44 180.30 2cnl h LYS 137 N 0.26 0.76 -0.63 1.13 1.63 -1.90 -0.91 116.57 116.92 2cnl h LYS 137 Ca 0.12 -0.11 -0.07 0.00 -0.85 0.00 0.00 60.65 59.75 2cnl h LYS 137 Cb 0.14 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 31.61 2cnl h LYS 137 CO -0.02 0.62 0.14 -0.22 -3.45 0.00 0.00 179.45 176.51 2cnl h LYS 138 N 0.76 1.01 0.01 1.90 3.64 -1.65 -0.09 116.57 122.15 2cnl h LYS 138 Ca 0.18 -0.25 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2cnl h LYS 138 Cb 0.13 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2cnl h LYS 138 CO -0.02 0.93 -0.00 0.82 -2.27 0.00 0.00 179.45 178.90 2cnl h ILE 139 N 0.93 1.23 0.00 2.00 2.04 -1.32 -3.24 117.51 119.15 2cnl h ILE 139 Ca 0.19 -0.71 -0.07 0.00 1.00 0.00 0.00 64.86 65.27 2cnl h ILE 139 Cb 0.38 1.71 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 2cnl h ILE 139 CO 0.01 0.18 -0.35 0.71 0.00 0.00 0.00 178.15 178.69 2cnl h THR 140 N -0.31 0.88 -0.20 -0.27 1.35 -1.11 -3.15 112.91 110.10 2cnl h THR 140 Ca -0.00 -1.42 0.01 0.00 -0.55 0.00 0.00 66.41 64.45 2cnl h THR 140 Cb 0.31 1.86 -0.01 0.00 -1.73 0.00 0.00 68.15 68.58 2cnl h THR 140 CO 0.00 0.35 0.13 0.78 -0.25 0.00 0.00 175.52 176.53 2cnl h ASN 141 N 0.00 0.21 -0.07 5.36 2.35 -1.03 -1.25 115.58 121.16 2cnl h ASN 141 Ca -0.00 -0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.76 2cnl h ASN 141 Cb 0.83 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 39.15 2cnl h ASN 141 CO 0.05 0.15 0.06 -0.26 -1.65 0.00 0.00 177.43 175.78 2cnl h PHE 142 N 0.25 0.00 -0.60 1.19 0.04 -1.65 -1.95 116.94 114.22 2cnl h PHE 142 Ca 0.08 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.85 2cnl h PHE 142 Cb 0.01 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.16 2cnl h PHE 142 CO -0.00 0.00 0.00 1.19 -0.60 0.00 0.00 178.31 178.90 2cnl n PHE 143 N -4.05 0.79 -1.53 -0.55 3.72 -0.48 -4.01 117.46 111.35 2cnl n PHE 143 Ca -0.01 -0.39 -0.38 0.00 -0.05 0.00 0.00 57.45 56.62 2cnl n PHE 143 Cb 0.16 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.75 2cnl n PHE 143 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2cnl n ARG 144 N 1.59 0.66 -0.06 -1.08 1.74 -0.73 -4.56 116.66 114.22 2cnl n ARG 144 Ca 0.23 0.26 0.23 0.00 -0.77 0.00 0.00 57.85 57.80 2cnl n ARG 144 Cb 0.62 -1.93 0.71 0.00 -1.02 0.00 0.00 32.46 30.84 2cnl n ARG 144 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2cnl h GLY 145 N 0.30 0.00 0.58 -0.13 0.00 -1.91 -0.21 103.07 101.70 2cnl h GLY 145 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2cnl h GLY 145 CO 0.48 0.00 -0.77 2.09 0.00 0.00 0.00 176.54 178.34 2cnl n ASP 146 N -4.24 0.69 -0.01 0.19 5.75 -1.26 -4.34 116.55 113.33 2cnl n ASP 146 Ca 0.13 -0.49 0.08 0.00 -0.01 0.00 0.00 54.79 54.50 2cnl n ASP 146 Cb 0.75 0.61 -0.13 0.00 -1.03 0.00 0.00 41.12 41.32 2cnl n ASP 146 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2cnl n ARG 147 N -1.59 0.54 -3.64 0.11 1.74 -0.20 -4.69 116.66 108.93 2cnl n ARG 147 Ca 0.04 -0.15 -0.28 0.00 -0.77 0.00 0.00 57.85 56.69 2cnl n ARG 147 Cb 0.35 -1.40 -0.11 0.00 -1.02 0.00 0.00 32.46 30.28 2cnl n ARG 147 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2cnl h ARG 149 N 5.78 0.00 0.00 0.00 2.47 -1.83 -1.72 114.38 119.08 2cnl h ARG 149 Ca 0.17 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.89 2cnl h ARG 149 Cb 0.86 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.18 2cnl h ARG 149 CO 0.52 0.04 0.00 -1.13 0.56 0.00 0.00 179.97 179.96 2cnl n SER 150 N -4.35 0.00 -0.11 7.04 3.41 -1.26 -2.44 113.62 115.92 2cnl n SER 150 Ca -0.03 -0.52 0.02 0.00 -0.26 0.00 0.00 58.87 58.08 2cnl n SER 150 Cb 0.12 -0.11 0.01 0.00 -0.26 0.00 0.00 64.21 63.97 2cnl n SER 150 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2cnl n LEU 151 N -1.11 1.07 -4.70 1.04 4.77 -0.67 -4.13 117.00 113.27 2cnl n LEU 151 Ca 0.16 -0.91 -0.43 0.00 -0.03 0.00 0.00 56.01 54.80 2cnl n LEU 151 Cb 0.13 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 2cnl n LEU 151 CO 0.16 0.24 1.27 0.41 -1.33 0.00 0.00 177.39 178.14 2cnl n THR 152 N -0.04 0.25 -0.85 -5.08 -1.04 -1.02 -0.92 114.28 105.58 2cnl n THR 152 Ca 0.02 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 2cnl n THR 152 Cb 0.08 -1.81 0.00 0.00 -1.82 0.00 0.00 70.33 66.78 2cnl n THR 152 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2cnl n GLY 153 N 3.36 1.11 3.60 3.41 0.00 -1.26 -5.02 105.19 110.39 2cnl n GLY 153 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 2cnl n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cnl s LYS 154 N -0.07 2.43 0.15 1.61 1.02 -0.10 -4.96 119.74 119.82 2cnl s LYS 154 Ca 0.00 -0.83 -0.31 0.00 0.02 0.00 0.00 55.97 54.85 2cnl s LYS 154 Cb 0.00 -2.45 -0.09 0.00 -0.52 0.00 0.00 37.83 34.77 2cnl s LYS 154 CO 0.00 0.56 1.48 -1.25 -0.92 0.00 0.00 175.35 175.23 2cnl s PRO 155 N -1.80 4.26 -0.29 -1.68 0.04 -1.26 -4.92 135.00 129.36 2cnl s PRO 155 Ca 0.20 2.23 0.00 0.00 0.04 0.00 0.00 61.00 63.47 2cnl s PRO 155 Cb -0.11 -3.19 0.06 0.00 0.04 0.00 0.00 34.50 31.29 2cnl s PRO 155 CO 0.11 -0.52 -0.02 0.15 0.04 0.00 0.00 177.00 176.76 2cnl s LYS 156 N 1.06 2.29 -0.20 4.56 1.02 -1.26 -1.82 119.74 125.38 2cnl s LYS 156 Ca 0.67 -1.36 -0.07 0.00 0.02 0.00 0.00 55.97 55.23 2cnl s LYS 156 Cb -0.41 -3.11 -0.04 0.00 -0.52 0.00 0.00 37.83 33.76 2cnl s LYS 156 CO 0.31 -0.65 0.06 -0.51 -0.92 0.00 0.00 175.35 173.64 2cnl s LEU 157 N 1.18 3.63 -0.22 3.17 1.43 0.34 -5.01 118.68 123.20 2cnl s LEU 157 Ca -0.05 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 2cnl s LEU 157 Cb -0.20 -1.93 0.03 0.00 0.03 0.00 0.00 46.19 44.12 2cnl s LEU 157 CO -0.03 0.10 -0.13 -0.36 0.23 0.00 0.00 176.35 176.16 2cnl s PHE 158 N 0.82 3.00 -0.29 0.29 0.40 -1.26 -0.70 117.98 120.24 2cnl s PHE 158 Ca 0.03 -1.75 -0.10 0.00 -0.60 0.00 0.00 56.93 54.51 2cnl s PHE 158 Cb -0.14 -1.97 -0.03 0.00 0.51 0.00 0.00 43.02 41.39 2cnl s PHE 158 CO 0.02 -0.79 0.15 0.42 0.70 0.00 0.00 175.22 175.73 2cnl s ILE 159 N 1.26 4.86 -0.24 0.64 -1.09 0.33 -4.99 121.20 121.97 2cnl s ILE 159 Ca 0.00 -0.11 0.02 0.00 -2.23 0.00 0.00 60.65 58.34 2cnl s ILE 159 Cb -0.16 -3.36 0.05 0.00 -1.58 0.00 0.00 42.46 37.41 2cnl s ILE 159 CO -0.08 0.20 -0.12 -0.63 -1.23 0.00 0.00 174.94 173.08 2cnl s ILE 160 N 1.68 2.08 -0.51 2.92 1.01 -1.26 -0.36 121.20 126.75 2cnl s ILE 160 Ca 0.06 -1.45 -0.11 0.00 0.00 0.00 0.00 60.65 59.16 2cnl s ILE 160 Cb -0.16 -2.14 0.13 0.00 0.01 0.00 0.00 42.46 40.30 2cnl s ILE 160 CO 0.08 0.08 0.41 -1.58 0.00 0.00 0.00 174.94 173.93 2cnl s GLN 161 N 1.17 2.67 -0.19 2.79 2.00 -0.06 -5.00 119.66 123.04 2cnl s GLN 161 Ca -0.06 -1.82 -0.33 0.00 -2.00 0.00 0.00 55.36 51.15 2cnl s GLN 161 Cb -0.18 -4.04 0.14 0.00 0.80 0.00 0.00 33.01 29.73 2cnl s GLN 161 CO -0.07 -1.23 1.19 0.00 -0.50 0.00 0.00 175.29 174.67 2cnl s ALA 162 N 1.30 -2.05 0.69 1.58 0.00 -1.26 -2.21 121.76 119.82 2cnl s ALA 162 Ca 0.06 1.61 -0.15 0.00 0.00 0.00 0.00 51.96 53.48 2cnl s ALA 162 Cb -0.26 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.49 2cnl s ALA 162 CO -0.00 -0.50 1.16 0.00 0.00 0.00 0.00 175.76 176.42 2cnl n ARG 164 N -2.52 1.16 -2.79 0.00 1.74 -1.26 -2.15 116.66 110.84 2cnl n ARG 164 Ca 0.12 -1.88 0.00 0.00 -0.77 0.00 0.00 57.85 55.32 2cnl n ARG 164 Cb 0.51 -1.11 0.00 0.00 -1.02 0.00 0.00 32.46 30.84 2cnl n ARG 164 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cnl n GLY 165 N -0.84 -0.34 0.09 -0.13 0.00 -1.26 -3.07 105.19 99.63 2cnl n GLY 165 Ca 0.08 -1.39 0.08 0.00 0.00 0.00 0.00 46.02 44.80 2cnl n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cnl n THR 166 N 9.00 1.76 -2.98 2.61 -2.24 -1.26 -4.97 114.28 116.20 2cnl n THR 166 Ca 0.00 -2.05 -0.33 0.00 -2.27 0.00 0.00 64.05 59.40 2cnl n THR 166 Cb 0.00 -0.12 -0.07 0.00 -2.10 0.00 0.00 70.33 68.05 2cnl n THR 166 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2cnl s GLU 167 N -2.57 4.15 -0.04 -0.78 2.02 -1.26 -5.07 118.70 115.15 2cnl s GLU 167 Ca 0.27 0.92 0.07 0.00 0.02 0.00 0.00 54.97 56.25 2cnl s GLU 167 Cb 0.24 -2.36 -0.01 0.00 0.10 0.00 0.00 34.13 32.09 2cnl s GLU 167 CO 0.03 0.09 -0.25 -0.51 0.02 0.00 0.00 175.26 174.64 2cnl s LEU 168 N -2.97 2.06 -0.40 1.80 1.43 -1.26 -5.10 118.68 114.25 2cnl s LEU 168 Ca 0.57 -0.49 -0.18 0.00 -1.03 0.00 0.00 54.13 53.00 2cnl s LEU 168 Cb -0.10 -1.36 0.01 0.00 0.03 0.00 0.00 46.19 44.77 2cnl s LEU 168 CO 0.16 0.28 0.48 -0.62 0.23 0.00 0.00 176.35 176.88 2cnl s ASP 169 N -0.35 6.25 0.31 2.29 -1.08 -1.26 -4.93 116.67 117.90 2cnl s ASP 169 Ca 0.02 -0.40 0.26 0.00 -0.52 0.00 0.00 52.55 51.91 2cnl s ASP 169 Cb -0.12 -2.25 1.02 0.00 -1.46 0.00 0.00 42.92 40.11 2cnl s ASP 169 CO 0.02 -0.56 1.77 0.00 0.52 0.00 0.00 175.17 176.91 2cnl n GLY 171 N 0.17 -1.87 3.12 0.00 0.00 -1.26 -4.98 105.19 100.38 2cnl n GLY 171 Ca 0.02 -1.35 -0.12 0.00 0.00 0.00 0.00 46.02 44.58 2cnl n GLY 171 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2cnl s ILE 172 N -2.00 -0.03 0.15 -0.61 -1.16 -1.26 -5.13 121.20 111.16 2cnl s ILE 172 Ca 0.00 0.11 -0.31 0.00 -0.51 0.00 0.00 60.65 59.93 2cnl s ILE 172 Cb 0.00 -0.43 -0.11 0.00 0.61 0.00 0.00 42.46 42.53 2cnl s ILE 172 CO 0.00 0.04 1.77 -0.70 -2.81 0.00 0.00 174.94 173.25 2cnl s GLU 173 N 1.07 4.14 0.27 3.50 2.56 -1.26 -4.97 118.70 124.01 2cnl s GLU 173 Ca -0.08 2.57 -0.14 0.00 0.00 0.00 0.00 54.97 57.33 2cnl s GLU 173 Cb -0.08 -3.41 -0.08 0.00 2.00 0.00 0.00 34.13 32.55 2cnl s GLU 173 CO -0.08 -0.80 0.67 0.95 -0.56 0.00 0.00 175.26 175.45 2cnl s THR 174 N 2.18 4.74 0.00 -1.70 -4.23 -1.26 -5.35 115.64 110.02 2cnl s THR 174 Ca 0.78 0.87 0.00 0.00 -1.18 0.00 0.00 61.69 62.16 2cnl s THR 174 Cb -0.47 -3.66 0.00 0.00 1.34 0.00 0.00 72.50 69.72 2cnl s THR 174 CO 0.35 -0.07 0.00 0.47 -0.54 0.00 0.00 174.62 174.83