#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c2m n GLY 30 N 0.00 -2.68 3.72 5.00 0.00 -1.26 -4.93 105.19 105.04 2c2m n GLY 30 Ca 0.00 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.13 2c2m n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c2m s ILE 31 N -2.21 2.25 -0.18 -0.61 1.09 -1.26 -5.00 121.20 115.29 2c2m s ILE 31 Ca 0.44 0.18 -0.02 0.00 -1.10 0.00 0.00 60.65 60.14 2c2m s ILE 31 Cb -0.04 -3.12 -0.01 0.00 -1.06 0.00 0.00 42.46 38.23 2c2m s ILE 31 CO 0.34 0.01 -0.08 -0.55 -0.10 0.00 0.00 174.94 174.56 2c2m s SER 32 N 1.13 4.23 -0.21 3.58 0.15 -1.26 -5.03 113.70 116.28 2c2m s SER 32 Ca 0.72 -0.34 -0.03 0.00 0.70 0.00 0.00 55.95 57.00 2c2m s SER 32 Cb -0.47 -1.69 -0.20 0.00 -1.71 0.00 0.00 66.02 61.95 2c2m s SER 32 CO 0.32 0.07 -0.03 0.18 1.20 0.00 0.00 173.24 174.99 2c2m n LEU 33 N 4.16 2.74 -3.02 3.45 4.77 -1.26 -5.04 117.00 122.80 2c2m n LEU 33 Ca -0.18 0.04 -0.15 0.00 -0.03 0.00 0.00 56.01 55.69 2c2m n LEU 33 Cb 0.52 -0.97 0.07 0.00 -2.33 0.00 0.00 43.42 40.71 2c2m n LEU 33 CO 0.30 0.85 0.11 -0.67 -1.33 0.00 0.00 177.39 176.65 2c2m n ASP 34 N -3.47 -2.57 -0.24 -1.43 2.03 -1.26 -4.94 116.55 104.67 2c2m n ASP 34 Ca -0.42 -0.50 0.11 0.00 0.52 0.00 0.00 54.79 54.50 2c2m n ASP 34 Cb 0.99 -4.31 0.03 0.00 -0.72 0.00 0.00 41.12 37.11 2c2m n ASP 34 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2c2m n ASN 35 N -2.68 1.39 -4.09 1.67 3.02 -1.26 -4.94 115.26 108.37 2c2m n ASN 35 Ca -0.20 -1.13 -0.16 0.00 -0.03 0.00 0.00 54.58 53.06 2c2m n ASN 35 Cb 0.63 0.59 -0.12 0.00 -0.61 0.00 0.00 39.78 40.26 2c2m n ASN 35 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2c2m s SER 36 N -2.71 1.19 0.46 6.41 1.04 -1.26 -5.13 113.70 113.69 2c2m s SER 36 Ca 0.15 -0.51 -0.25 0.00 0.48 0.00 0.00 55.95 55.83 2c2m s SER 36 Cb 0.17 -0.02 -0.08 0.00 0.10 0.00 0.00 66.02 66.19 2c2m s SER 36 CO 0.68 -0.10 1.38 -1.22 0.98 0.00 0.00 173.24 174.95 2c2m n TYR 37 N 1.64 2.47 -2.20 5.02 4.01 -1.26 -4.90 117.16 121.94 2c2m n TYR 37 Ca -0.21 0.45 -0.43 0.00 -0.16 0.00 0.00 57.90 57.56 2c2m n TYR 37 Cb 0.55 -2.42 -0.02 0.00 -0.31 0.00 0.00 39.34 37.13 2c2m n TYR 37 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2c2m s LYS 38 N -2.46 3.50 -0.17 -0.72 2.20 -1.26 -4.84 119.74 116.00 2c2m s LYS 38 Ca 0.63 1.17 0.17 0.00 -0.36 0.00 0.00 55.97 57.58 2c2m s LYS 38 Cb -0.46 -4.09 0.46 0.00 -1.51 0.00 0.00 37.83 32.23 2c2m s LYS 38 CO 0.56 -1.66 1.34 -1.33 -0.36 0.00 0.00 175.35 173.91 2c2m n MET 39 N 8.19 2.44 -0.94 4.03 2.81 -1.26 -4.61 117.12 127.77 2c2m n MET 39 Ca 0.19 -2.78 -0.10 0.00 -1.81 0.00 0.00 57.70 53.21 2c2m n MET 39 Cb 0.47 -1.75 0.21 0.00 -0.71 0.00 0.00 33.22 31.45 2c2m n MET 39 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2c2m n ASP 40 N -0.79 3.29 -4.72 7.83 3.85 -1.26 -4.90 116.55 119.85 2c2m n ASP 40 Ca 0.20 -3.59 -0.30 0.00 -0.71 0.00 0.00 54.79 50.39 2c2m n ASP 40 Cb 0.82 -0.71 0.14 0.00 -1.35 0.00 0.00 41.12 40.03 2c2m n ASP 40 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 2c2m s TYR 41 N -3.20 2.33 0.37 2.11 1.51 -1.26 -4.90 117.35 114.31 2c2m s TYR 41 Ca 0.50 1.20 0.12 0.00 -1.01 0.00 0.00 57.07 57.88 2c2m s TYR 41 Cb 0.43 -3.18 0.93 0.00 -0.11 0.00 0.00 41.96 40.03 2c2m s TYR 41 CO 0.06 -2.42 1.81 -1.35 -1.11 0.00 0.00 175.55 172.54 2c2m h PRO 42 N -1.56 0.56 -6.19 -1.71 0.11 -1.93 -3.41 132.00 117.86 2c2m h PRO 42 Ca -0.50 -0.03 -0.62 0.00 0.11 0.00 0.00 66.00 64.96 2c2m h PRO 42 Cb 1.29 -0.13 -0.28 0.00 0.11 0.00 0.00 31.00 32.00 2c2m h PRO 42 CO 0.56 0.37 -0.86 -1.21 -0.21 0.00 0.00 178.00 176.65 2c2m s GLU 43 N -5.62 1.62 0.25 1.05 2.02 -0.26 -5.02 118.70 112.74 2c2m s GLU 43 Ca -0.10 -0.88 0.01 0.00 0.02 0.00 0.00 54.97 54.02 2c2m s GLU 43 Cb 0.24 -1.66 0.31 0.00 0.10 0.00 0.00 34.13 33.12 2c2m s GLU 43 CO 0.79 0.44 1.65 0.52 0.02 0.00 0.00 175.26 178.68 2c2m h MET 44 N 5.21 0.48 0.00 1.61 2.86 -1.80 0.33 114.93 123.62 2c2m h MET 44 Ca -0.42 -0.22 0.00 0.00 -2.06 0.00 0.00 59.70 57.00 2c2m h MET 44 Cb 1.15 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.80 2c2m h MET 44 CO 0.46 0.77 0.00 0.41 1.06 0.00 0.00 176.91 179.61 2c2m n GLY 45 N -0.16 0.75 3.87 8.32 0.00 -1.26 -0.99 105.19 115.71 2c2m n GLY 45 Ca -0.01 -2.20 -0.31 0.00 0.00 0.00 0.00 46.02 43.49 2c2m n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c2m s LEU 46 N 0.00 4.03 -0.36 0.99 1.43 -1.25 -0.53 118.68 122.99 2c2m s LEU 46 Ca 0.00 1.11 0.00 0.00 -1.03 0.00 0.00 54.13 54.21 2c2m s LEU 46 Cb 0.00 -3.92 0.12 0.00 0.03 0.00 0.00 46.19 42.41 2c2m s LEU 46 CO 0.00 -0.22 0.16 0.00 0.23 0.00 0.00 176.35 176.52 2c2m s ILE 48 N 1.17 4.96 -0.25 0.00 1.01 0.18 -1.43 121.20 126.84 2c2m s ILE 48 Ca 0.13 1.05 -0.07 0.00 0.00 0.00 0.00 60.65 61.76 2c2m s ILE 48 Cb -0.20 -3.96 -0.02 0.00 0.01 0.00 0.00 42.46 38.28 2c2m s ILE 48 CO -0.14 -0.04 0.07 -0.63 0.00 0.00 0.00 174.94 174.20 2c2m s ILE 49 N 2.56 4.22 -0.41 2.92 -1.09 -0.06 -0.30 121.20 129.05 2c2m s ILE 49 Ca 0.26 -0.25 -0.10 0.00 -2.23 0.00 0.00 60.65 58.33 2c2m s ILE 49 Cb -0.15 -3.00 0.07 0.00 -1.58 0.00 0.00 42.46 37.80 2c2m s ILE 49 CO 0.10 0.31 0.25 -0.63 -1.23 0.00 0.00 174.94 173.74 2c2m s ILE 50 N 1.60 4.36 -0.50 2.92 1.01 -0.01 -0.86 121.20 129.70 2c2m s ILE 50 Ca 0.06 -1.26 -0.11 0.00 0.00 0.00 0.00 60.65 59.33 2c2m s ILE 50 Cb -0.15 -3.61 0.13 0.00 0.01 0.00 0.00 42.46 38.83 2c2m s ILE 50 CO 0.03 -0.45 0.41 0.21 0.00 0.00 0.00 174.94 175.14 2c2m s ASN 51 N 2.02 5.88 -0.41 3.58 2.47 0.70 -1.23 114.94 127.95 2c2m s ASN 51 Ca 0.03 -1.90 -0.14 0.00 0.42 0.00 0.00 52.86 51.27 2c2m s ASN 51 Cb -0.22 -2.08 0.03 0.00 -1.45 0.00 0.00 41.25 37.53 2c2m s ASN 51 CO 0.03 -0.74 0.30 0.20 -3.72 0.00 0.00 177.10 173.17 2c2m s ASN 52 N 2.95 6.01 -0.17 -4.21 0.01 -0.57 -0.89 114.94 118.07 2c2m s ASN 52 Ca 0.05 -1.04 -0.02 0.00 -0.71 0.00 0.00 52.86 51.14 2c2m s ASN 52 Cb -0.27 -2.12 -0.10 0.00 0.41 0.00 0.00 41.25 39.17 2c2m s ASN 52 CO 0.00 -0.48 -0.18 1.17 -1.51 0.00 0.00 177.10 176.11 2c2m n LYS 53 N 5.12 0.40 -4.30 -0.60 4.81 -1.26 -4.55 118.16 117.78 2c2m n LYS 53 Ca -0.11 0.12 -0.34 0.00 -0.87 0.00 0.00 58.31 57.11 2c2m n LYS 53 Cb 0.46 -1.26 -0.12 0.00 0.02 0.00 0.00 35.03 34.13 2c2m n LYS 53 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 2c2m s ASN 54 N -5.96 5.00 0.14 3.14 0.01 -1.26 -1.04 114.94 114.97 2c2m s ASN 54 Ca -0.23 -0.08 0.08 0.00 -0.71 0.00 0.00 52.86 51.92 2c2m s ASN 54 Cb 0.07 -1.83 -0.04 0.00 0.41 0.00 0.00 41.25 39.86 2c2m s ASN 54 CO 0.36 0.17 -0.13 -0.36 -1.51 0.00 0.00 177.10 175.63 2c2m s PHE 55 N 0.37 2.62 0.25 2.20 0.40 -1.26 -4.82 117.98 117.74 2c2m s PHE 55 Ca -0.02 -0.22 -0.31 0.00 -0.60 0.00 0.00 56.93 55.78 2c2m s PHE 55 Cb -0.14 -1.34 -0.12 0.00 0.51 0.00 0.00 43.02 41.94 2c2m s PHE 55 CO 0.02 0.45 1.66 -1.01 0.70 0.00 0.00 175.22 177.04 2c2m s HIS 56 N -1.38 2.83 0.36 0.36 3.76 -0.45 -4.86 115.29 115.91 2c2m s HIS 56 Ca 0.21 0.56 0.13 0.00 -0.15 0.00 0.00 55.06 55.81 2c2m s HIS 56 Cb -0.10 -4.10 0.94 0.00 1.11 0.00 0.00 32.58 30.43 2c2m s HIS 56 CO 0.13 -3.95 1.79 -0.22 -0.85 0.00 0.00 174.74 171.64 2c2m h LYS 57 N 5.86 0.54 -0.05 1.40 3.64 -1.89 0.49 116.57 126.55 2c2m h LYS 57 Ca -0.45 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 58.91 2c2m h LYS 57 Cb 1.21 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.91 2c2m h LYS 57 CO 0.88 0.36 0.13 0.66 -2.27 0.00 0.00 179.45 179.21 2c2m h SER 58 N 0.55 0.00 1.29 4.20 4.64 -1.95 -0.30 113.55 121.98 2c2m h SER 58 Ca 0.56 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.80 2c2m h SER 58 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 2c2m h SER 58 CO -0.31 0.00 -0.74 0.71 -0.87 0.00 0.00 176.83 175.62 2c2m h THR 59 N 0.00 0.42 0.00 2.95 1.35 -1.22 -3.47 112.91 112.94 2c2m h THR 59 Ca 0.03 -1.67 0.00 0.00 -0.55 0.00 0.00 66.41 64.21 2c2m h THR 59 Cb 0.29 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 2c2m h THR 59 CO -0.00 0.24 0.00 0.61 -0.25 0.00 0.00 175.52 176.12 2c2m n GLY 60 N 1.24 0.72 3.83 5.82 0.00 -0.13 -5.02 105.19 111.65 2c2m n GLY 60 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2c2m n GLY 60 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2c2m s MET 61 N -0.02 4.16 0.43 1.61 -1.94 -1.26 -5.07 119.30 117.20 2c2m s MET 61 Ca 0.00 0.93 0.03 0.00 -1.71 0.00 0.00 55.69 54.94 2c2m s MET 61 Cb 0.00 -2.38 0.00 0.00 2.01 0.00 0.00 34.83 34.47 2c2m s MET 61 CO 0.00 0.10 0.62 0.95 -0.01 0.00 0.00 175.02 176.68 2c2m s THR 62 N -2.01 3.64 0.61 2.05 -4.23 -1.26 -4.70 115.64 109.75 2c2m s THR 62 Ca 0.57 -0.74 -0.15 0.00 -1.18 0.00 0.00 61.69 60.18 2c2m s THR 62 Cb -0.11 -3.31 -0.02 0.00 1.34 0.00 0.00 72.50 70.40 2c2m s THR 62 CO 0.16 -0.17 1.07 -0.94 -0.54 0.00 0.00 174.62 174.20 2c2m s SER 63 N -4.26 5.59 -1.05 3.99 1.04 -1.26 -4.67 113.70 113.07 2c2m s SER 63 Ca 0.50 1.86 -0.07 0.00 0.48 0.00 0.00 55.95 58.72 2c2m s SER 63 Cb -0.10 -2.54 0.26 0.00 0.10 0.00 0.00 66.02 63.75 2c2m s SER 63 CO 0.35 -1.30 1.04 0.54 0.98 0.00 0.00 173.24 174.85 2c2m n ARG 64 N -2.17 3.32 -1.67 4.02 1.74 -0.21 -5.03 116.66 116.67 2c2m n ARG 64 Ca 0.09 -4.47 -0.45 0.00 -0.77 0.00 0.00 57.85 52.25 2c2m n ARG 64 Cb 0.53 -2.51 -0.03 0.00 -1.02 0.00 0.00 32.46 29.43 2c2m n ARG 64 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2c2m n SER 65 N 2.48 2.71 0.00 0.55 2.88 -1.26 -2.09 113.62 118.89 2c2m n SER 65 Ca 0.24 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.92 2c2m n SER 65 Cb 0.38 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.42 2c2m n SER 65 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2c2m n GLY 66 N 2.07 1.28 0.20 0.46 0.00 -1.26 -4.93 105.19 103.01 2c2m n GLY 66 Ca 0.11 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.17 2c2m n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c2m h THR 67 N 0.00 1.16 0.00 2.61 1.03 -1.83 -2.42 112.91 113.47 2c2m h THR 67 Ca 0.00 -1.14 -0.04 0.00 -0.01 0.00 0.00 66.41 65.23 2c2m h THR 67 Cb 0.00 1.62 -0.01 0.00 -1.07 0.00 0.00 68.15 68.70 2c2m h THR 67 CO 0.00 0.32 -0.18 0.44 -0.01 0.00 0.00 175.52 176.09 2c2m h ASP 68 N 0.00 0.00 -0.51 0.00 3.32 -1.92 -0.30 116.42 117.01 2c2m h ASP 68 Ca -0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 2c2m h ASP 68 Cb 0.60 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 2c2m h ASP 68 CO 0.04 0.18 -0.16 0.58 -1.72 0.00 0.00 179.24 178.16 2c2m h VAL 69 N 0.00 1.27 -0.07 -1.35 2.07 -1.85 -1.50 116.25 114.81 2c2m h VAL 69 Ca -0.00 -1.32 -0.01 0.00 0.82 0.00 0.00 66.70 66.19 2c2m h VAL 69 Cb 0.32 1.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2c2m h VAL 69 CO 0.02 0.46 0.02 0.44 0.02 0.00 0.00 177.57 178.54 2c2m h ASP 70 N 0.87 0.11 -0.61 0.57 3.32 -1.23 -1.05 116.42 118.40 2c2m h ASP 70 Ca 0.12 -0.22 0.06 0.00 0.02 0.00 0.00 57.03 57.01 2c2m h ASP 70 Cb 0.74 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.21 2c2m h ASP 70 CO 0.06 0.30 0.32 0.00 -1.72 0.00 0.00 179.24 178.19 2c2m h ALA 71 N 0.82 0.80 -0.40 3.45 0.00 -1.00 0.09 119.26 123.02 2c2m h ALA 71 Ca 0.02 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2c2m h ALA 71 Cb 0.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2c2m h ALA 71 CO -0.00 -0.03 -0.27 0.00 0.00 0.00 0.00 179.25 178.95 2c2m h ALA 72 N 1.33 0.77 -0.60 0.00 0.00 -1.21 -1.75 119.26 117.80 2c2m h ALA 72 Ca 0.28 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 2c2m h ALA 72 Cb 0.20 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2c2m h ALA 72 CO -0.19 0.65 0.18 -0.97 0.00 0.00 0.00 179.25 178.93 2c2m h ASN 73 N 0.71 0.87 -0.29 0.00 -0.73 -0.62 -2.34 115.58 113.19 2c2m h ASN 73 Ca 0.09 -0.21 -0.03 0.00 1.87 0.00 0.00 56.30 58.02 2c2m h ASN 73 Cb 0.81 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 39.16 2c2m h ASN 73 CO 0.07 0.85 0.08 -0.07 -0.37 0.00 0.00 177.43 177.99 2c2m h LEU 74 N 0.85 0.43 -0.41 0.34 3.38 -0.86 -1.06 115.31 117.98 2c2m h LEU 74 Ca 0.19 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 57.99 2c2m h LEU 74 Cb 0.29 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 2c2m h LEU 74 CO -0.01 0.54 0.16 -0.09 0.09 0.00 0.00 178.44 179.13 2c2m h ARG 75 N 0.30 0.32 -0.41 1.13 2.43 -1.18 -0.13 114.38 116.83 2c2m h ARG 75 Ca 0.09 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.16 2c2m h ARG 75 Cb 0.27 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 2c2m h ARG 75 CO -0.00 0.21 -0.04 1.49 -1.51 0.00 0.00 179.97 180.12 2c2m h GLU 76 N 0.33 0.76 0.20 0.20 4.57 -1.35 -0.97 114.58 118.33 2c2m h GLU 76 Ca 0.19 -0.27 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 2c2m h GLU 76 Cb 0.15 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 2c2m h GLU 76 CO -0.17 0.86 -0.10 1.15 -1.18 0.00 0.00 179.01 179.57 2c2m h THR 77 N 0.59 0.83 0.00 0.32 2.02 -0.80 -2.39 112.91 113.47 2c2m h THR 77 Ca 0.11 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.19 2c2m h THR 77 Cb 0.55 0.89 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2c2m h THR 77 CO 0.03 0.02 0.00 -0.26 0.37 0.00 0.00 175.52 175.68 2c2m h PHE 78 N -0.32 0.00 -0.34 3.16 0.04 -1.07 -2.87 116.94 115.54 2c2m h PHE 78 Ca -0.03 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.67 2c2m h PHE 78 Cb 0.24 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 2c2m h PHE 78 CO -0.05 0.00 -0.07 -0.09 -0.60 0.00 0.00 178.31 177.50 2c2m h ARG 79 N 0.00 0.65 0.00 1.51 2.43 -0.90 -0.94 114.38 117.13 2c2m h ARG 79 Ca 0.00 -0.25 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 2c2m h ARG 79 Cb 0.66 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 2c2m h ARG 79 CO 0.00 0.82 0.00 0.09 -1.51 0.00 0.00 179.97 179.37 2c2m n ASN 80 N -4.43 0.00 -1.03 -3.80 3.02 -0.92 -1.31 115.26 106.79 2c2m n ASN 80 Ca -0.02 0.48 0.12 0.00 -0.03 0.00 0.00 54.58 55.12 2c2m n ASN 80 Cb 0.33 -0.49 0.24 0.00 -0.61 0.00 0.00 39.78 39.24 2c2m n ASN 80 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2c2m n LEU 81 N -1.49 3.09 -0.72 3.41 4.77 -0.96 -4.95 117.00 120.15 2c2m n LEU 81 Ca 0.04 -1.30 -0.07 0.00 -0.03 0.00 0.00 56.01 54.66 2c2m n LEU 81 Cb 0.20 -0.20 -0.02 0.00 -2.33 0.00 0.00 43.42 41.08 2c2m n LEU 81 CO 0.16 0.65 -0.08 0.29 -1.33 0.00 0.00 177.39 177.08 2c2m n LYS 82 N 1.27 -0.55 -3.17 3.23 4.76 -0.43 -4.93 118.16 118.34 2c2m n LYS 82 Ca 0.18 0.54 -0.32 0.00 -2.87 0.00 0.00 58.31 55.84 2c2m n LYS 82 Cb 0.56 -4.40 -0.06 0.00 -1.84 0.00 0.00 35.03 29.29 2c2m n LYS 82 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2c2m s TYR 83 N -2.33 3.39 -0.74 2.13 1.51 -0.39 -4.17 117.35 116.76 2c2m s TYR 83 Ca 0.00 1.12 -0.24 0.00 -1.01 0.00 0.00 57.07 56.95 2c2m s TYR 83 Cb 0.00 -2.47 0.06 0.00 -0.11 0.00 0.00 41.96 39.45 2c2m s TYR 83 CO 0.00 0.11 1.12 -2.00 -1.11 0.00 0.00 175.55 173.67 2c2m s GLU 84 N -3.03 3.22 -0.09 -0.62 2.12 0.31 -4.56 118.70 116.04 2c2m s GLU 84 Ca 0.52 -0.75 -0.24 0.00 0.36 0.00 0.00 54.97 54.86 2c2m s GLU 84 Cb -0.10 -4.37 -0.03 0.00 0.26 0.00 0.00 34.13 29.88 2c2m s GLU 84 CO 0.19 -1.95 0.75 0.08 -0.54 0.00 0.00 175.26 173.79 2c2m s VAL 85 N 4.55 5.00 -0.13 3.70 1.01 -1.26 -0.93 120.40 132.34 2c2m s VAL 85 Ca 0.29 1.52 0.00 0.00 0.00 0.00 0.00 61.98 63.80 2c2m s VAL 85 Cb -0.12 -4.08 0.02 0.00 0.00 0.00 0.00 36.38 32.21 2c2m s VAL 85 CO 0.08 0.19 -0.13 -0.13 0.00 0.00 0.00 175.10 175.12 2c2m s ARG 86 N 1.15 2.05 0.04 2.72 0.52 -0.51 -4.95 118.95 119.97 2c2m s ARG 86 Ca 0.38 -0.47 0.01 0.00 -0.52 0.00 0.00 55.73 55.14 2c2m s ARG 86 Cb -0.18 -1.90 -0.04 0.00 0.52 0.00 0.00 34.95 33.35 2c2m s ARG 86 CO 0.17 -0.20 0.09 1.21 0.02 0.00 0.00 175.30 176.59 2c2m s ASN 87 N 1.42 5.66 -0.02 0.23 2.47 -1.26 -0.88 114.94 122.57 2c2m s ASN 87 Ca 0.02 0.09 0.00 0.00 0.42 0.00 0.00 52.86 53.39 2c2m s ASN 87 Cb -0.13 -1.59 0.02 0.00 -1.45 0.00 0.00 41.25 38.10 2c2m s ASN 87 CO -0.08 0.22 0.01 -0.54 -3.72 0.00 0.00 177.10 172.99 2c2m s LYS 88 N -2.09 0.12 0.02 0.43 -0.14 -0.04 -4.95 119.74 113.09 2c2m s LYS 88 Ca 0.27 0.07 0.05 0.00 -1.36 0.00 0.00 55.97 55.00 2c2m s LYS 88 Cb -0.12 -0.27 -0.03 0.00 -1.68 0.00 0.00 37.83 35.72 2c2m s LYS 88 CO 0.19 -0.09 -0.13 -0.80 -0.76 0.00 0.00 175.35 173.76 2c2m s ASN 89 N 0.67 4.18 -0.79 2.83 0.01 -1.26 -0.22 114.94 120.37 2c2m s ASN 89 Ca -0.06 -0.28 -0.03 0.00 -0.71 0.00 0.00 52.86 51.77 2c2m s ASN 89 Cb -0.09 -0.84 0.01 0.00 0.41 0.00 0.00 41.25 40.74 2c2m s ASN 89 CO -0.02 0.27 0.62 0.47 -1.51 0.00 0.00 177.10 176.93 2c2m n ASP 90 N 1.61 -5.17 -4.87 -1.22 10.43 -0.07 -4.96 116.55 112.30 2c2m n ASP 90 Ca -0.16 -0.82 -0.36 0.00 2.57 0.00 0.00 54.79 56.03 2c2m n ASP 90 Cb 0.52 -2.01 -0.06 0.00 1.84 0.00 0.00 41.12 41.42 2c2m n ASP 90 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2c2m s LEU 91 N -4.66 4.31 0.92 0.64 1.43 -1.26 -4.89 118.68 115.17 2c2m s LEU 91 Ca 0.03 0.41 -0.13 0.00 -1.03 0.00 0.00 54.13 53.42 2c2m s LEU 91 Cb -0.00 -2.17 0.14 0.00 0.03 0.00 0.00 46.19 44.19 2c2m s LEU 91 CO 0.88 0.37 1.15 0.42 0.23 0.00 0.00 176.35 179.41 2c2m s THR 92 N -1.08 1.98 0.35 5.49 -4.23 -1.26 -0.60 115.64 116.28 2c2m s THR 92 Ca 0.18 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.71 2c2m s THR 92 Cb -0.12 -2.77 0.24 0.00 1.34 0.00 0.00 72.50 71.19 2c2m s THR 92 CO 0.07 0.00 1.98 0.08 -0.54 0.00 0.00 174.62 176.21 2c2m h ARG 93 N -1.53 0.76 -0.35 3.99 0.11 -1.86 -1.44 114.38 114.07 2c2m h ARG 93 Ca -0.50 -0.07 -0.06 0.00 0.10 0.00 0.00 59.98 59.45 2c2m h ARG 93 Cb 1.32 -0.16 -0.01 0.00 1.11 0.00 0.00 29.97 32.23 2c2m h ARG 93 CO 0.59 0.56 -0.02 0.93 0.10 0.00 0.00 179.97 182.13 2c2m h GLU 94 N 0.77 0.63 -0.33 0.08 3.07 -1.95 -2.63 114.58 114.22 2c2m h GLU 94 Ca 0.20 -0.21 -0.08 0.00 -0.50 0.00 0.00 59.36 58.77 2c2m h GLU 94 Cb 0.01 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 27.85 2c2m h GLU 94 CO -0.03 0.76 -0.12 0.93 -1.40 0.00 0.00 179.01 179.15 2c2m h GLU 95 N 0.43 0.56 -0.09 2.33 5.08 -1.82 -0.50 114.58 120.57 2c2m h GLU 95 Ca 0.10 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2c2m h GLU 95 Cb 0.49 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 2c2m h GLU 95 CO 0.02 0.67 0.04 0.82 -1.00 0.00 0.00 179.01 179.56 2c2m h ILE 96 N 0.52 1.15 -0.64 3.13 2.04 -1.18 0.14 117.51 122.66 2c2m h ILE 96 Ca 0.09 -0.45 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 2c2m h ILE 96 Cb 0.51 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 2c2m h ILE 96 CO 0.03 0.13 0.31 0.58 0.00 0.00 0.00 178.15 179.20 2c2m h VAL 97 N -0.01 1.22 -0.42 1.67 2.07 -1.26 -1.48 116.25 118.04 2c2m h VAL 97 Ca 0.03 -0.63 -0.04 0.00 0.82 0.00 0.00 66.70 66.88 2c2m h VAL 97 Cb 0.18 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 2c2m h VAL 97 CO -0.00 0.26 0.12 -0.08 0.02 0.00 0.00 177.57 177.88 2c2m h GLU 98 N 0.89 0.66 -0.02 1.57 4.81 -0.93 -0.59 114.58 120.97 2c2m h GLU 98 Ca 0.22 -0.15 0.01 0.00 -0.13 0.00 0.00 59.36 59.31 2c2m h GLU 98 Cb 0.13 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2c2m h GLU 98 CO -0.03 0.66 -0.03 1.25 -0.73 0.00 0.00 179.01 180.13 2c2m h LEU 99 N 0.53 -0.10 -0.62 1.64 5.85 -0.51 0.24 115.31 122.35 2c2m h LEU 99 Ca 0.13 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 2c2m h LEU 99 Cb 0.29 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2c2m h LEU 99 CO -0.00 -0.05 0.27 0.24 -0.34 0.00 0.00 178.44 178.56 2c2m h MET 100 N -0.05 0.91 -0.06 1.25 2.86 -1.19 -0.61 114.93 118.05 2c2m h MET 100 Ca 0.02 -0.15 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 2c2m h MET 100 Cb 0.08 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.58 2c2m h MET 100 CO -0.05 0.76 0.04 -0.09 1.06 0.00 0.00 176.91 178.63 2c2m h ARG 101 N 0.86 0.08 -0.30 1.72 2.43 -0.89 -0.65 114.38 117.63 2c2m h ARG 101 Ca 0.21 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.41 2c2m h ARG 101 Cb 0.17 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 2c2m h ARG 101 CO -0.02 0.10 0.09 -0.44 -1.51 0.00 0.00 179.97 178.19 2c2m h ASP 102 N 0.04 0.10 -0.79 -3.80 3.45 -0.71 -2.13 116.42 112.58 2c2m h ASP 102 Ca 0.02 0.03 -0.03 0.00 0.43 0.00 0.00 57.03 57.49 2c2m h ASP 102 Cb 0.04 0.03 -0.04 0.00 -0.56 0.00 0.00 39.33 38.80 2c2m h ASP 102 CO -0.00 0.09 0.38 0.58 -1.57 0.00 0.00 179.24 178.72 2c2m h VAL 103 N 0.22 1.25 0.00 -1.35 2.07 -0.96 -2.04 116.25 115.44 2c2m h VAL 103 Ca 0.13 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 66.95 2c2m h VAL 103 Cb 0.11 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.10 2c2m h VAL 103 CO -0.14 0.30 -0.02 0.77 0.02 0.00 0.00 177.57 178.49 2c2m h SER 104 N 1.13 0.00 0.05 0.57 4.64 -0.72 -2.41 113.55 116.81 2c2m h SER 104 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2c2m h SER 104 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2c2m h SER 104 CO -0.03 0.02 -0.06 0.29 -0.87 0.00 0.00 176.83 176.18 2c2m n LYS 105 N -3.14 1.44 -1.65 4.77 5.02 -0.78 -4.80 118.16 119.03 2c2m n LYS 105 Ca 0.00 -0.81 -0.30 0.00 -2.02 0.00 0.00 58.31 55.17 2c2m n LYS 105 Cb 0.29 -1.48 0.06 0.00 -0.02 0.00 0.00 35.03 33.88 2c2m n LYS 105 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2c2m s GLU 106 N -2.12 2.66 -0.51 1.97 2.02 -0.91 -4.99 118.70 116.82 2c2m s GLU 106 Ca 0.35 0.72 -0.22 0.00 0.02 0.00 0.00 54.97 55.84 2c2m s GLU 106 Cb 0.21 -1.98 0.04 0.00 0.10 0.00 0.00 34.13 32.50 2c2m s GLU 106 CO 0.38 -1.23 0.78 0.34 0.02 0.00 0.00 175.26 175.55 2c2m s ASP 107 N -3.98 6.32 -0.11 -0.19 -1.08 -1.26 -4.89 116.67 111.48 2c2m s ASP 107 Ca 0.59 -0.47 0.13 0.00 -0.52 0.00 0.00 52.55 52.28 2c2m s ASP 107 Cb -0.13 -2.37 0.58 0.00 -1.46 0.00 0.00 42.92 39.53 2c2m s ASP 107 CO 0.54 -1.02 1.43 1.41 0.52 0.00 0.00 175.17 178.06 2c2m n HIS 108 N 6.80 1.28 -0.30 -5.34 8.25 -1.26 -4.61 115.22 120.04 2c2m n HIS 108 Ca -0.01 -0.49 0.11 0.00 -0.26 0.00 0.00 57.72 57.08 2c2m n HIS 108 Cb 0.47 -0.26 0.28 0.00 1.12 0.00 0.00 29.99 31.60 2c2m n HIS 108 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2c2m h SER 109 N 3.12 0.38 -0.48 0.41 0.02 -1.90 -0.78 113.55 114.31 2c2m h SER 109 Ca 0.00 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2c2m h SER 109 Cb 1.31 0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.95 2c2m h SER 109 CO 0.24 0.06 0.00 0.29 -1.14 0.00 0.00 176.83 176.28 2c2m n LYS 110 N -5.00 2.19 -4.43 3.45 4.76 -1.26 -4.90 118.16 112.97 2c2m n LYS 110 Ca 0.20 -1.75 -0.34 0.00 -2.87 0.00 0.00 58.31 53.55 2c2m n LYS 110 Cb 0.59 -1.41 -0.11 0.00 -1.84 0.00 0.00 35.03 32.26 2c2m n LYS 110 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2c2m s ARG 111 N -1.40 3.16 0.25 1.97 0.52 -0.30 -1.11 118.95 122.05 2c2m s ARG 111 Ca 0.32 -0.47 0.09 0.00 -0.52 0.00 0.00 55.73 55.15 2c2m s ARG 111 Cb 0.17 -2.79 0.28 0.00 0.52 0.00 0.00 34.95 33.13 2c2m s ARG 111 CO 0.21 0.54 1.57 0.77 0.02 0.00 0.00 175.30 178.42 2c2m h SER 112 N 5.69 0.07 -1.72 0.23 0.02 -0.22 -3.47 113.55 114.14 2c2m h SER 112 Ca -0.44 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.45 2c2m h SER 112 Cb 1.19 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2c2m h SER 112 CO 0.57 0.70 0.08 -1.54 -1.14 0.00 0.00 176.83 175.50 2c2m n SER 113 N -3.78 -0.74 -3.79 3.07 3.41 -0.17 -4.34 113.62 107.27 2c2m n SER 113 Ca -0.01 -1.54 -0.13 0.00 -0.26 0.00 0.00 58.87 56.92 2c2m n SER 113 Cb 0.64 1.25 -0.14 0.00 -0.26 0.00 0.00 64.21 65.70 2c2m n SER 113 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2c2m s PHE 114 N -6.53 -0.08 -0.02 7.33 5.36 -0.68 -3.93 117.98 119.43 2c2m s PHE 114 Ca 0.06 0.28 0.03 0.00 -0.96 0.00 0.00 56.93 56.34 2c2m s PHE 114 Cb -0.02 -0.07 -0.00 0.00 -0.34 0.00 0.00 43.02 42.59 2c2m s PHE 114 CO 0.04 -0.09 -0.12 0.08 -1.46 0.00 0.00 175.22 173.67 2c2m s VAL 115 N 0.67 1.01 -0.05 3.12 1.01 -0.06 -0.29 120.40 125.80 2c2m s VAL 115 Ca -0.05 -0.51 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 2c2m s VAL 115 Cb -0.07 -0.87 0.03 0.00 0.00 0.00 0.00 36.38 35.47 2c2m s VAL 115 CO -0.03 0.30 0.01 0.00 0.00 0.00 0.00 175.10 175.38 2c2m s VAL 117 N 1.70 3.53 -0.20 0.00 1.01 0.59 -0.89 120.40 126.15 2c2m s VAL 117 Ca 0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 61.98 61.48 2c2m s VAL 117 Cb -0.13 -2.55 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 2c2m s VAL 117 CO -0.03 0.48 -0.07 -0.76 0.00 0.00 0.00 175.10 174.71 2c2m s LEU 118 N 0.63 2.78 -0.27 3.92 1.43 0.50 -0.83 118.68 126.83 2c2m s LEU 118 Ca -0.04 -0.41 0.03 0.00 -1.03 0.00 0.00 54.13 52.68 2c2m s LEU 118 Cb -0.15 -1.69 0.07 0.00 0.03 0.00 0.00 46.19 44.45 2c2m s LEU 118 CO 0.03 0.01 -0.07 -0.76 0.23 0.00 0.00 176.35 175.79 2c2m s LEU 119 N 1.29 3.58 0.00 1.79 1.43 -0.37 -0.86 118.68 125.55 2c2m s LEU 119 Ca 0.03 -1.52 -0.16 0.00 -1.03 0.00 0.00 54.13 51.45 2c2m s LEU 119 Cb -0.14 -1.51 0.05 0.00 0.03 0.00 0.00 46.19 44.62 2c2m s LEU 119 CO -0.03 -0.24 0.74 -0.24 0.23 0.00 0.00 176.35 176.81 2c2m n SER 120 N 4.43 -0.86 -4.84 2.29 2.88 -1.02 -1.51 113.62 114.99 2c2m n SER 120 Ca -0.10 -1.30 -0.31 0.00 -1.33 0.00 0.00 58.87 55.82 2c2m n SER 120 Cb 0.42 1.37 0.03 0.00 -0.75 0.00 0.00 64.21 65.28 2c2m n SER 120 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2c2m s HIS 121 N -2.85 3.31 0.22 0.66 3.76 -1.26 -4.17 115.29 114.97 2c2m s HIS 121 Ca 0.17 1.38 -0.21 0.00 -0.15 0.00 0.00 55.06 56.25 2c2m s HIS 121 Cb -0.01 -2.82 0.07 0.00 1.11 0.00 0.00 32.58 30.92 2c2m s HIS 121 CO 0.01 -0.98 0.96 0.20 -0.85 0.00 0.00 174.74 174.08 2c2m s GLY 122 N -3.83 0.09 0.26 -2.22 0.00 -1.26 -1.66 107.32 98.70 2c2m s GLY 122 Ca 0.57 -0.33 -0.04 0.00 0.00 0.00 0.00 44.72 44.92 2c2m s GLY 122 CO 0.52 1.29 0.33 -0.54 0.00 0.00 0.00 173.10 174.70 2c2m s GLU 123 N -2.48 1.51 0.00 2.90 2.02 -0.86 -4.00 118.70 117.80 2c2m s GLU 123 Ca 0.18 -1.57 -0.35 0.00 0.02 0.00 0.00 54.97 53.25 2c2m s GLU 123 Cb -0.03 0.38 -0.14 0.00 0.10 0.00 0.00 34.13 34.44 2c2m s GLU 123 CO 0.06 -0.58 1.68 -1.91 0.02 0.00 0.00 175.26 174.53 2c2m n GLU 124 N -0.40 1.91 -1.12 1.61 4.07 -1.20 -0.75 120.64 124.76 2c2m n GLU 124 Ca 0.01 0.69 -0.04 0.00 -0.06 0.00 0.00 57.16 57.77 2c2m n GLU 124 Cb 0.63 -2.47 -0.02 0.00 -0.06 0.00 0.00 31.44 29.53 2c2m n GLU 124 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2c2m n GLY 125 N 3.77 0.55 3.04 8.31 0.00 -1.26 -4.98 105.19 114.62 2c2m n GLY 125 Ca 0.20 -0.11 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 2c2m n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c2m s ILE 126 N -1.69 0.63 -0.04 -0.61 1.01 0.07 -1.62 121.20 118.95 2c2m s ILE 126 Ca 0.00 -0.72 0.03 0.00 0.00 0.00 0.00 60.65 59.96 2c2m s ILE 126 Cb 0.00 -0.61 0.00 0.00 0.01 0.00 0.00 42.46 41.87 2c2m s ILE 126 CO 0.00 -0.09 -0.12 -0.51 0.00 0.00 0.00 174.94 174.22 2c2m s ILE 127 N -0.76 1.04 -0.14 2.92 1.10 -0.40 -2.46 121.20 122.50 2c2m s ILE 127 Ca -0.02 -0.48 -0.19 0.00 -0.51 0.00 0.00 60.65 59.44 2c2m s ILE 127 Cb -0.06 -0.92 -0.04 0.00 0.15 0.00 0.00 42.46 41.59 2c2m s ILE 127 CO 0.00 0.32 0.54 -0.36 -2.11 0.00 0.00 174.94 173.33 2c2m s PHE 128 N 0.28 3.47 0.85 3.50 0.08 -0.66 0.10 117.98 125.60 2c2m s PHE 128 Ca -0.06 0.92 -0.12 0.00 0.12 0.00 0.00 56.93 57.80 2c2m s PHE 128 Cb -0.11 -2.65 0.19 0.00 -0.57 0.00 0.00 43.02 39.88 2c2m s PHE 128 CO 0.02 0.06 1.15 0.41 -0.10 0.00 0.00 175.22 176.76 2c2m n GLY 129 N 3.44 -0.94 0.14 4.36 0.00 0.34 -4.61 105.19 107.93 2c2m n GLY 129 Ca -0.05 -1.79 0.12 0.00 0.00 0.00 0.00 46.02 44.31 2c2m n GLY 129 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2c2m h THR 130 N -1.43 0.00 0.00 2.61 1.35 -1.11 -3.18 112.91 111.15 2c2m h THR 130 Ca -0.38 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.21 2c2m h THR 130 Cb 1.11 1.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.57 2c2m h THR 130 CO 0.29 0.00 -0.07 -0.46 -0.25 0.00 0.00 175.52 175.04 2c2m n ASN 131 N -2.30 1.40 0.00 5.36 6.94 -1.26 -1.34 115.26 124.06 2c2m n ASN 131 Ca 0.02 -2.07 0.00 0.00 -0.02 0.00 0.00 54.58 52.51 2c2m n ASN 131 Cb 0.25 -0.14 0.00 0.00 -2.36 0.00 0.00 39.78 37.53 2c2m n ASN 131 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2c2m n GLY 132 N -0.57 1.83 3.83 4.83 0.00 -1.20 -4.90 105.19 109.00 2c2m n GLY 132 Ca 0.04 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.53 2c2m n GLY 132 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2c2m s PRO 133 N -1.98 3.50 -0.05 1.61 0.04 -1.26 0.13 135.00 136.99 2c2m s PRO 133 Ca 0.00 0.97 -0.00 0.00 0.04 0.00 0.00 61.00 62.01 2c2m s PRO 133 Cb 0.00 -2.07 0.03 0.00 0.04 0.00 0.00 34.50 32.50 2c2m s PRO 133 CO 0.00 -0.64 -0.02 0.08 0.04 0.00 0.00 177.00 176.46 2c2m s VAL 134 N -2.80 0.40 0.07 -0.36 1.01 0.11 -4.77 120.40 114.08 2c2m s VAL 134 Ca 0.59 0.02 -0.31 0.00 0.00 0.00 0.00 61.98 62.28 2c2m s VAL 134 Cb -0.12 -0.50 -0.08 0.00 0.00 0.00 0.00 36.38 35.68 2c2m s VAL 134 CO 0.43 0.22 1.52 -1.81 0.00 0.00 0.00 175.10 175.46 2c2m s ASP 135 N 1.36 6.72 0.37 3.32 -0.00 -1.26 -1.27 116.67 125.91 2c2m s ASP 135 Ca -0.04 2.36 0.09 0.00 -0.00 0.00 0.00 52.55 54.96 2c2m s ASP 135 Cb -0.13 -2.57 0.83 0.00 -0.00 0.00 0.00 42.92 41.04 2c2m s ASP 135 CO -0.02 -0.78 1.92 -0.07 -0.00 0.00 0.00 175.17 176.21 2c2m h LEU 136 N 7.90 0.61 -1.07 1.23 3.38 -1.65 -0.66 115.31 125.06 2c2m h LEU 136 Ca -0.41 0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.62 2c2m h LEU 136 Cb 1.20 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.79 2c2m h LEU 136 CO 0.91 0.35 0.63 0.50 0.09 0.00 0.00 178.44 180.91 2c2m h LYS 137 N 0.67 1.15 -0.48 1.13 1.63 -1.90 -0.96 116.57 117.82 2c2m h LYS 137 Ca 0.38 -0.07 -0.05 0.00 -0.85 0.00 0.00 60.65 60.05 2c2m h LYS 137 Cb 0.55 -0.26 -0.02 0.00 -0.60 0.00 0.00 32.23 31.90 2c2m h LYS 137 CO -0.15 0.76 0.07 -0.22 -3.45 0.00 0.00 179.45 176.47 2c2m h LYS 138 N 1.18 0.74 -0.10 1.90 3.64 -1.50 -0.45 116.57 121.99 2c2m h LYS 138 Ca 0.39 -0.16 -0.05 0.00 -1.27 0.00 0.00 60.65 59.56 2c2m h LYS 138 Cb 0.06 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2c2m h LYS 138 CO -0.13 0.70 -0.12 0.82 -2.27 0.00 0.00 179.45 178.46 2c2m h ILE 139 N 0.71 1.37 0.00 2.00 2.04 -1.18 -3.30 117.51 119.15 2c2m h ILE 139 Ca 0.15 -1.30 -0.09 0.00 1.00 0.00 0.00 64.86 64.62 2c2m h ILE 139 Cb 0.33 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 2c2m h ILE 139 CO 0.01 0.37 -0.44 0.71 0.00 0.00 0.00 178.15 178.79 2c2m h THR 140 N -0.16 1.01 -0.18 -0.27 1.35 -1.07 -3.22 112.91 110.38 2c2m h THR 140 Ca 0.01 -1.72 0.01 0.00 -0.55 0.00 0.00 66.41 64.17 2c2m h THR 140 Cb 0.65 2.02 -0.01 0.00 -1.73 0.00 0.00 68.15 69.08 2c2m h THR 140 CO 0.03 0.43 0.12 0.78 -0.25 0.00 0.00 175.52 176.63 2c2m h ASN 141 N 0.00 0.17 -0.06 5.36 2.35 -1.15 -0.74 115.58 121.50 2c2m h ASN 141 Ca -0.00 -0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.76 2c2m h ASN 141 Cb 0.98 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 39.31 2c2m h ASN 141 CO 0.06 0.12 0.06 -0.26 -1.65 0.00 0.00 177.43 175.76 2c2m h PHE 142 N 0.20 0.00 -0.66 1.19 0.04 -1.69 -1.59 116.94 114.42 2c2m h PHE 142 Ca 0.07 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.84 2c2m h PHE 142 Cb 0.03 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.18 2c2m h PHE 142 CO -0.00 0.00 0.00 1.19 -0.60 0.00 0.00 178.31 178.90 2c2m n PHE 143 N -3.91 0.99 -1.59 -0.55 3.72 -0.29 -3.99 117.46 111.85 2c2m n PHE 143 Ca -0.01 -0.52 -0.37 0.00 -0.05 0.00 0.00 57.45 56.49 2c2m n PHE 143 Cb 0.16 -0.05 0.06 0.00 -0.94 0.00 0.00 39.48 38.71 2c2m n PHE 143 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2c2m n ARG 144 N 1.38 0.80 -0.21 -1.08 1.74 -0.60 -4.62 116.66 114.07 2c2m n ARG 144 Ca 0.23 0.32 0.30 0.00 -0.77 0.00 0.00 57.85 57.92 2c2m n ARG 144 Cb 0.64 -2.13 0.72 0.00 -1.02 0.00 0.00 32.46 30.68 2c2m n ARG 144 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2c2m h GLY 145 N 0.35 0.04 0.51 -0.13 0.00 -1.91 -0.09 103.07 101.84 2c2m h GLY 145 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2c2m h GLY 145 CO 0.50 -0.00 -0.91 2.09 0.00 0.00 0.00 176.54 178.22 2c2m n ASP 146 N -4.26 0.68 -0.01 0.19 5.75 -1.26 -4.37 116.55 113.26 2c2m n ASP 146 Ca 0.20 -0.44 0.10 0.00 -0.01 0.00 0.00 54.79 54.64 2c2m n ASP 146 Cb 1.01 0.75 -0.16 0.00 -1.03 0.00 0.00 41.12 41.69 2c2m n ASP 146 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2c2m n ARG 147 N -1.71 0.61 -3.60 0.11 1.74 -0.11 -4.68 116.66 109.02 2c2m n ARG 147 Ca 0.03 -0.18 -0.28 0.00 -0.77 0.00 0.00 57.85 56.65 2c2m n ARG 147 Cb 0.38 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 30.22 2c2m n ARG 147 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2c2m h ARG 149 N 6.02 0.00 0.00 0.00 2.47 -1.83 -2.05 114.38 118.98 2c2m h ARG 149 Ca 0.14 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 2c2m h ARG 149 Cb 0.88 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.20 2c2m h ARG 149 CO 0.47 0.05 0.00 -1.13 0.56 0.00 0.00 179.97 179.91 2c2m n SER 150 N -4.45 0.00 -0.07 7.04 3.41 -1.26 -2.30 113.62 115.99 2c2m n SER 150 Ca -0.03 -0.56 0.01 0.00 -0.26 0.00 0.00 58.87 58.03 2c2m n SER 150 Cb 0.13 -0.08 0.01 0.00 -0.26 0.00 0.00 64.21 64.01 2c2m n SER 150 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2c2m n LEU 151 N -1.08 0.99 -4.69 1.04 4.77 -0.78 -4.15 117.00 113.10 2c2m n LEU 151 Ca 0.16 -0.92 -0.44 0.00 -0.03 0.00 0.00 56.01 54.78 2c2m n LEU 151 Cb 0.11 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.16 2c2m n LEU 151 CO 0.15 0.23 1.31 0.41 -1.33 0.00 0.00 177.39 178.15 2c2m n THR 152 N -0.08 0.07 -0.80 -5.08 -1.04 -0.97 -0.69 114.28 105.69 2c2m n THR 152 Ca 0.01 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2c2m n THR 152 Cb 0.05 -1.79 0.00 0.00 -1.82 0.00 0.00 70.33 66.77 2c2m n THR 152 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2c2m n GLY 153 N 3.76 1.06 3.63 3.41 0.00 -1.26 -5.03 105.19 110.76 2c2m n GLY 153 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2c2m n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c2m s LYS 154 N -0.13 2.36 0.10 1.61 1.02 0.13 -4.96 119.74 119.87 2c2m s LYS 154 Ca 0.00 -0.90 -0.31 0.00 0.02 0.00 0.00 55.97 54.78 2c2m s LYS 154 Cb 0.00 -2.43 -0.08 0.00 -0.52 0.00 0.00 37.83 34.80 2c2m s LYS 154 CO 0.00 0.53 1.45 -1.25 -0.92 0.00 0.00 175.35 175.16 2c2m s PRO 155 N -2.15 4.29 -0.31 -1.68 0.04 -1.26 -4.92 135.00 129.00 2c2m s PRO 155 Ca 0.23 2.13 0.00 0.00 0.04 0.00 0.00 61.00 63.40 2c2m s PRO 155 Cb -0.11 -3.31 0.07 0.00 0.04 0.00 0.00 34.50 31.19 2c2m s PRO 155 CO 0.15 -0.51 0.01 0.15 0.04 0.00 0.00 177.00 176.84 2c2m s LYS 156 N 1.44 2.14 -0.21 4.56 1.02 -1.26 -1.68 119.74 125.74 2c2m s LYS 156 Ca 0.66 -1.49 -0.08 0.00 0.02 0.00 0.00 55.97 55.08 2c2m s LYS 156 Cb -0.37 -3.17 -0.04 0.00 -0.52 0.00 0.00 37.83 33.72 2c2m s LYS 156 CO 0.30 -0.74 0.09 -0.51 -0.92 0.00 0.00 175.35 173.57 2c2m s LEU 157 N 1.13 3.79 -0.23 3.17 1.43 0.61 -5.01 118.68 123.57 2c2m s LEU 157 Ca -0.01 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.11 2c2m s LEU 157 Cb -0.20 -1.99 0.03 0.00 0.03 0.00 0.00 46.19 44.06 2c2m s LEU 157 CO -0.04 0.10 -0.12 -0.36 0.23 0.00 0.00 176.35 176.16 2c2m s PHE 158 N 0.85 3.01 -0.29 0.29 0.40 -1.26 -0.76 117.98 120.21 2c2m s PHE 158 Ca 0.05 -1.72 -0.10 0.00 -0.60 0.00 0.00 56.93 54.55 2c2m s PHE 158 Cb -0.13 -1.99 -0.02 0.00 0.51 0.00 0.00 43.02 41.39 2c2m s PHE 158 CO 0.02 -0.78 0.15 0.42 0.70 0.00 0.00 175.22 175.74 2c2m s ILE 159 N 1.27 4.78 -0.25 0.64 -1.09 -0.07 -5.00 121.20 121.48 2c2m s ILE 159 Ca 0.00 -0.21 0.01 0.00 -2.23 0.00 0.00 60.65 58.22 2c2m s ILE 159 Cb -0.16 -3.36 0.05 0.00 -1.58 0.00 0.00 42.46 37.41 2c2m s ILE 159 CO -0.07 0.16 -0.10 -0.63 -1.23 0.00 0.00 174.94 173.06 2c2m s ILE 160 N 1.66 2.37 -0.51 2.92 1.09 -1.26 -0.37 121.20 127.09 2c2m s ILE 160 Ca 0.06 -1.40 -0.14 0.00 -1.10 0.00 0.00 60.65 58.07 2c2m s ILE 160 Cb -0.16 -2.30 0.12 0.00 -1.06 0.00 0.00 42.46 39.06 2c2m s ILE 160 CO 0.07 0.09 0.44 -1.58 -0.10 0.00 0.00 174.94 173.86 2c2m s GLN 161 N 1.19 2.82 -0.19 2.79 2.00 -0.04 -4.99 119.66 123.23 2c2m s GLN 161 Ca -0.05 -1.71 -0.33 0.00 -2.00 0.00 0.00 55.36 51.27 2c2m s GLN 161 Cb -0.18 -4.17 0.14 0.00 0.80 0.00 0.00 33.01 29.60 2c2m s GLN 161 CO -0.06 -1.27 1.19 0.00 -0.50 0.00 0.00 175.29 174.65 2c2m s ALA 162 N 1.52 -2.05 0.70 1.58 0.00 -1.26 -2.42 121.76 119.84 2c2m s ALA 162 Ca 0.04 1.62 -0.14 0.00 0.00 0.00 0.00 51.96 53.47 2c2m s ALA 162 Cb -0.28 -0.42 0.02 0.00 0.00 0.00 0.00 23.12 22.44 2c2m s ALA 162 CO 0.02 -0.50 1.14 0.00 0.00 0.00 0.00 175.76 176.42 2c2m n ARG 164 N -2.69 0.73 -3.04 0.00 1.74 -1.26 -2.03 116.66 110.11 2c2m n ARG 164 Ca 0.11 -1.90 0.00 0.00 -0.77 0.00 0.00 57.85 55.29 2c2m n ARG 164 Cb 0.51 -1.07 0.00 0.00 -1.02 0.00 0.00 32.46 30.89 2c2m n ARG 164 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2c2m n GLY 165 N -0.82 -0.52 0.12 -0.13 0.00 -1.26 -3.22 105.19 99.36 2c2m n GLY 165 Ca 0.09 -1.35 0.09 0.00 0.00 0.00 0.00 46.02 44.85 2c2m n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c2m n THR 166 N 9.00 1.78 -2.97 2.61 -2.24 -1.26 -4.96 114.28 116.24 2c2m n THR 166 Ca 0.00 -2.16 -0.33 0.00 -2.27 0.00 0.00 64.05 59.29 2c2m n THR 166 Cb 0.00 -0.19 -0.07 0.00 -2.10 0.00 0.00 70.33 67.97 2c2m n THR 166 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2c2m s GLU 167 N -2.71 4.12 -0.03 -0.78 2.02 -1.26 -5.07 118.70 115.00 2c2m s GLU 167 Ca 0.30 0.90 0.07 0.00 0.02 0.00 0.00 54.97 56.27 2c2m s GLU 167 Cb 0.27 -2.31 -0.02 0.00 0.10 0.00 0.00 34.13 32.17 2c2m s GLU 167 CO 0.02 0.06 -0.23 -0.51 0.02 0.00 0.00 175.26 174.62 2c2m s LEU 168 N -3.07 2.04 -0.39 1.80 1.43 -1.26 -5.10 118.68 114.12 2c2m s LEU 168 Ca 0.58 -0.43 -0.16 0.00 -1.03 0.00 0.00 54.13 53.08 2c2m s LEU 168 Cb -0.10 -1.22 0.01 0.00 0.03 0.00 0.00 46.19 44.91 2c2m s LEU 168 CO 0.15 0.27 0.39 -0.62 0.23 0.00 0.00 176.35 176.78 2c2m s ASP 169 N -0.45 6.18 0.20 2.29 -1.08 -1.26 -4.92 116.67 117.62 2c2m s ASP 169 Ca 0.06 -0.55 0.23 0.00 -0.52 0.00 0.00 52.55 51.77 2c2m s ASP 169 Cb -0.10 -2.21 0.91 0.00 -1.46 0.00 0.00 42.92 40.06 2c2m s ASP 169 CO 0.00 -0.48 1.71 0.00 0.52 0.00 0.00 175.17 176.92 2c2m n GLY 171 N 0.38 -2.13 2.99 0.00 0.00 -1.26 -4.98 105.19 100.19 2c2m n GLY 171 Ca 0.03 -1.23 -0.12 0.00 0.00 0.00 0.00 46.02 44.70 2c2m n GLY 171 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2c2m s ILE 172 N -2.45 0.01 0.19 -0.61 2.07 -1.26 -5.13 121.20 114.01 2c2m s ILE 172 Ca 0.00 -0.04 -0.32 0.00 -1.41 0.00 0.00 60.65 58.88 2c2m s ILE 172 Cb 0.00 -0.17 -0.11 0.00 0.13 0.00 0.00 42.46 42.31 2c2m s ILE 172 CO 0.00 -0.02 1.64 -0.70 -1.91 0.00 0.00 174.94 173.95 2c2m s GLU 173 N -0.03 4.17 0.14 3.50 2.56 -1.26 -5.02 118.70 122.76 2c2m s GLU 173 Ca -0.01 2.49 0.02 0.00 0.00 0.00 0.00 54.97 57.47 2c2m s GLU 173 Cb -0.01 -3.11 0.02 0.00 2.00 0.00 0.00 34.13 33.03 2c2m s GLU 173 CO 0.00 -0.68 0.19 0.25 -0.56 0.00 0.00 175.26 174.47 2c2m n THR 174 N 3.87 0.00 0.00 -1.70 -2.24 -1.26 -5.35 114.28 107.60 2c2m n THR 174 Ca 0.14 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2c2m n THR 174 Cb 0.37 -0.91 0.00 0.00 -2.10 0.00 0.00 70.33 67.69 2c2m n THR 174 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60