#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dtd s LEU 43 N 0.00 4.48 -0.16 2.46 2.96 -1.26 -4.83 118.68 122.33 3dtd s LEU 43 Ca 0.00 2.11 -0.29 0.00 -0.22 0.00 0.00 54.13 55.73 3dtd s LEU 43 Cb 0.00 -3.60 -0.00 0.00 0.50 0.00 0.00 46.19 43.08 3dtd s LEU 43 CO 0.00 -0.25 1.04 -0.89 -1.32 0.00 0.00 176.35 174.93 3dtd s THR 44 N -0.21 4.69 0.04 3.68 2.01 -1.26 -4.66 115.64 119.93 3dtd s THR 44 Ca 0.50 2.00 -0.08 0.00 0.31 0.00 0.00 61.69 64.42 3dtd s THR 44 Cb -0.30 -4.29 -0.05 0.00 0.01 0.00 0.00 72.50 67.87 3dtd s THR 44 CO 0.35 -0.09 0.32 -1.61 -0.69 0.00 0.00 174.62 172.91 3dtd s GLU 45 N 2.62 3.65 -0.11 4.92 2.02 -0.41 -4.93 118.70 126.46 3dtd s GLU 45 Ca 0.47 0.02 0.03 0.00 0.02 0.00 0.00 54.97 55.50 3dtd s GLU 45 Cb -0.17 -3.04 0.01 0.00 0.10 0.00 0.00 34.13 31.02 3dtd s GLU 45 CO 0.13 0.61 -0.20 0.99 0.02 0.00 0.00 175.26 176.81 3dtd s THR 46 N -1.35 1.81 -0.34 3.63 2.01 -1.26 -0.74 115.64 119.40 3dtd s THR 46 Ca 0.30 -0.84 0.01 0.00 0.31 0.00 0.00 61.69 61.46 3dtd s THR 46 Cb -0.13 -1.60 0.11 0.00 0.01 0.00 0.00 72.50 70.88 3dtd s THR 46 CO 0.17 0.50 0.12 -0.31 -0.69 0.00 0.00 174.62 174.41 3dtd s TYR 47 N 0.73 2.13 0.00 4.92 2.02 0.43 -5.01 117.35 122.58 3dtd s TYR 47 Ca -0.11 -2.11 0.00 0.00 -0.37 0.00 0.00 57.07 54.48 3dtd s TYR 47 Cb -0.16 -1.97 0.00 0.00 -0.40 0.00 0.00 41.96 39.43 3dtd s TYR 47 CO 0.02 -0.87 0.00 0.41 -1.57 0.00 0.00 175.55 173.54 3dtd n GLY 48 N 4.46 2.45 0.46 0.71 0.00 -1.26 -1.17 105.19 110.84 3dtd n GLY 48 Ca 0.01 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.29 3dtd n GLY 48 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dtd n LEU 49 N 0.00 1.82 -4.90 0.99 4.77 0.20 -4.96 117.00 114.92 3dtd n LEU 49 Ca 0.00 -0.65 -0.33 0.00 -0.03 0.00 0.00 56.01 55.00 3dtd n LEU 49 Cb 0.00 -0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.01 3dtd n LEU 49 CO 0.00 0.34 -0.16 0.26 -1.33 0.00 0.00 177.39 176.50 3dtd s TRP 50 N -2.45 3.55 0.16 -1.77 0.52 -0.32 -4.83 118.94 113.79 3dtd s TRP 50 Ca 0.21 0.36 0.09 0.00 0.02 0.00 0.00 56.10 56.78 3dtd s TRP 50 Cb 0.18 -1.83 -0.04 0.00 -1.15 0.00 0.00 33.47 30.64 3dtd s TRP 50 CO 0.54 0.65 -0.16 -1.12 0.02 0.00 0.00 176.95 176.89 3dtd s SER 51 N -1.95 3.96 -0.08 2.95 0.01 -0.28 -0.43 113.70 117.88 3dtd s SER 51 Ca 0.27 -0.62 0.02 0.00 1.31 0.00 0.00 55.95 56.93 3dtd s SER 51 Cb -0.13 -0.57 0.02 0.00 0.21 0.00 0.00 66.02 65.56 3dtd s SER 51 CO 0.19 0.14 -0.11 -0.63 0.41 0.00 0.00 173.24 173.24 3dtd s ILE 52 N -1.48 1.09 0.04 1.44 1.01 0.08 -0.84 121.20 122.54 3dtd s ILE 52 Ca 0.21 -0.42 0.06 0.00 0.00 0.00 0.00 60.65 60.51 3dtd s ILE 52 Cb -0.09 -1.02 -0.02 0.00 0.01 0.00 0.00 42.46 41.33 3dtd s ILE 52 CO 0.12 0.35 -0.18 0.20 0.00 0.00 0.00 174.94 175.43 3dtd s ASN 53 N 0.94 2.20 -0.03 3.58 -0.87 -0.95 -1.29 114.94 118.52 3dtd s ASN 53 Ca -0.09 -0.50 0.06 0.00 -1.57 0.00 0.00 52.86 50.76 3dtd s ASN 53 Cb -0.15 -0.17 -0.02 0.00 -0.02 0.00 0.00 41.25 40.89 3dtd s ASN 53 CO 0.00 0.12 -0.22 0.00 -2.57 0.00 0.00 177.10 174.43 3dtd n GLY 55 N 2.43 1.79 3.04 0.00 0.00 0.08 -4.72 105.19 107.81 3dtd n GLY 55 Ca -0.16 -1.90 -0.11 0.00 0.00 0.00 0.00 46.02 43.84 3dtd n GLY 55 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3dtd s ILE 56 N 2.52 0.05 0.03 -0.61 2.07 -1.26 -3.68 121.20 120.31 3dtd s ILE 56 Ca 0.00 -0.43 0.00 0.00 -1.41 0.00 0.00 60.65 58.81 3dtd s ILE 56 Cb 0.00 -0.30 0.00 0.00 0.13 0.00 0.00 42.46 42.29 3dtd s ILE 56 CO 0.00 -0.24 0.00 0.00 -1.91 0.00 0.00 174.94 172.79 3dtd n GLN 57 N 2.14 0.00 -3.74 3.50 1.13 -1.26 -4.71 117.38 114.44 3dtd n GLN 57 Ca -0.19 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.50 3dtd n GLN 57 Cb 0.57 -0.30 -0.12 0.00 0.11 0.00 0.00 30.24 30.49 3dtd n GLN 57 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 3dtd s LYS 61 N -2.00 2.85 -0.33 -1.09 -2.85 -1.26 -5.32 119.74 109.74 3dtd s LYS 61 Ca 0.00 -1.03 -0.21 0.00 -1.00 0.00 0.00 55.97 53.74 3dtd s LYS 61 Cb 0.00 -3.45 -0.00 0.00 -2.06 0.00 0.00 37.83 32.32 3dtd s LYS 61 CO 0.00 -0.57 0.64 0.54 0.10 0.00 0.00 175.35 176.06 3dtd s VAL 62 N 1.46 4.90 -0.11 1.79 0.11 -1.24 -4.86 120.40 122.46 3dtd s VAL 62 Ca 0.01 0.74 -0.01 0.00 -2.93 0.00 0.00 61.98 59.79 3dtd s VAL 62 Cb -0.18 -4.05 -0.03 0.00 -1.53 0.00 0.00 36.38 30.59 3dtd s VAL 62 CO 0.03 -0.23 -0.07 0.00 -3.33 0.00 0.00 175.10 171.50 3dtd s PHE 64 N -0.22 1.84 -0.16 0.00 -0.12 -0.28 -4.56 117.98 114.48 3dtd s PHE 64 Ca 0.03 -0.47 -0.01 0.00 -0.05 0.00 0.00 56.93 56.43 3dtd s PHE 64 Cb -0.13 -0.90 -0.01 0.00 -0.63 0.00 0.00 43.02 41.35 3dtd s PHE 64 CO 0.03 0.35 -0.13 1.41 -0.05 0.00 0.00 175.22 176.83 3dtd s MET 65 N -2.91 3.31 0.06 1.99 1.75 0.96 -2.24 119.30 122.21 3dtd s MET 65 Ca 0.17 -0.70 -0.08 0.00 -1.25 0.00 0.00 55.69 53.83 3dtd s MET 65 Cb -0.05 -2.69 -0.00 0.00 2.84 0.00 0.00 34.83 34.92 3dtd s MET 65 CO 0.07 0.06 0.16 -3.38 -0.65 0.00 0.00 175.02 171.28 3dtd s HIS 66 N 0.75 0.15 -0.22 4.11 -3.43 -0.02 0.14 115.29 116.76 3dtd s HIS 66 Ca -0.05 -0.49 -0.14 0.00 -0.80 0.00 0.00 55.06 53.58 3dtd s HIS 66 Cb -0.15 -0.09 0.07 0.00 -1.43 0.00 0.00 32.58 30.98 3dtd s HIS 66 CO 0.01 -0.46 0.55 0.50 -2.00 0.00 0.00 174.74 173.35 3dtd s ARG 67 N -3.14 0.57 0.00 -0.38 6.06 -0.55 -1.13 118.95 120.38 3dtd s ARG 67 Ca -0.01 0.98 0.03 0.00 -2.50 0.00 0.00 55.73 54.24 3dtd s ARG 67 Cb 0.02 0.09 -0.03 0.00 0.06 0.00 0.00 34.95 35.09 3dtd s ARG 67 CO -0.07 -0.14 -0.08 -0.65 -2.50 0.00 0.00 175.30 171.85 3dtd s GLN 68 N 1.36 2.52 -0.09 5.12 -0.21 -1.26 -0.85 119.66 126.25 3dtd s GLN 68 Ca -0.08 -0.73 0.02 0.00 0.02 0.00 0.00 55.36 54.58 3dtd s GLN 68 Cb -0.06 -2.47 -0.02 0.00 1.00 0.00 0.00 33.01 31.45 3dtd s GLN 68 CO -0.14 0.60 -0.13 -1.21 -2.12 0.00 0.00 175.29 172.29 3dtd s GLU 69 N -1.35 2.90 0.27 2.91 0.41 0.81 -5.00 118.70 119.64 3dtd s GLU 69 Ca 0.16 -0.68 0.11 0.00 -0.41 0.00 0.00 54.97 54.15 3dtd s GLU 69 Cb -0.11 -2.50 -0.05 0.00 -1.78 0.00 0.00 34.13 29.69 3dtd s GLU 69 CO 0.07 0.45 -0.15 0.14 -0.49 0.00 0.00 175.26 175.27 3dtd s VAL 70 N -0.27 2.72 0.02 2.63 -7.23 -1.26 -1.29 120.40 115.72 3dtd s VAL 70 Ca 0.02 -2.24 -0.00 0.00 -1.81 0.00 0.00 61.98 57.95 3dtd s VAL 70 Cb -0.13 -2.42 0.00 0.00 0.56 0.00 0.00 36.38 34.39 3dtd s VAL 70 CO 0.03 -0.36 0.03 -0.46 -0.31 0.00 0.00 175.10 174.02 3dtd n ASN 71 N -0.59 0.03 0.29 4.85 0.23 -1.02 -4.91 115.26 114.14 3dtd n ASN 71 Ca -0.06 -1.03 0.18 0.00 -0.53 0.00 0.00 54.58 53.14 3dtd n ASN 71 Cb 0.59 -0.02 0.79 0.00 -2.08 0.00 0.00 39.78 39.07 3dtd n ASN 71 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 3dtd h ASP 72 N -0.02 0.00 -0.24 0.53 3.04 -2.02 -2.02 116.42 115.70 3dtd h ASP 72 Ca -0.01 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.78 3dtd h ASP 72 Cb 0.03 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.32 3dtd h ASP 72 CO 0.01 0.03 0.00 0.00 -2.04 0.00 0.00 179.24 177.24 3dtd n GLN 73 N -3.16 1.77 -1.87 4.15 1.13 -1.26 -4.95 117.38 113.19 3dtd n GLN 73 Ca -0.00 -1.18 -0.16 0.00 -1.94 0.00 0.00 57.00 53.72 3dtd n GLN 73 Cb 0.26 -1.35 -0.04 0.00 0.11 0.00 0.00 30.24 29.21 3dtd n GLN 73 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 3dtd n ASN 74 N 0.42 -4.88 -4.86 1.08 5.15 -0.76 -5.02 115.26 106.39 3dtd n ASN 74 Ca 0.15 0.20 -0.37 0.00 -0.60 0.00 0.00 54.58 53.96 3dtd n ASN 74 Cb 0.32 -3.89 -0.06 0.00 -0.53 0.00 0.00 39.78 35.62 3dtd n ASN 74 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3dtd s ARG 75 N -4.06 3.59 0.01 1.20 1.70 -1.26 -4.84 118.95 115.29 3dtd s ARG 75 Ca 0.00 -0.07 -0.30 0.00 -0.47 0.00 0.00 55.73 54.89 3dtd s ARG 75 Cb 0.00 -3.22 -0.07 0.00 -0.57 0.00 0.00 34.95 31.09 3dtd s ARG 75 CO 0.00 0.71 1.55 0.08 -1.08 0.00 0.00 175.30 176.56 3dtd s VAL 76 N -0.86 3.43 -0.20 4.99 1.01 -1.26 -2.43 120.40 125.08 3dtd s VAL 76 Ca 0.15 0.78 -0.01 0.00 0.00 0.00 0.00 61.98 62.90 3dtd s VAL 76 Cb -0.12 -3.50 -0.12 0.00 0.00 0.00 0.00 36.38 32.63 3dtd s VAL 76 CO 0.05 -0.02 -0.19 0.52 0.00 0.00 0.00 175.10 175.45 3dtd n VAL 77 N 4.87 1.13 -3.97 2.92 0.31 -0.41 -4.98 118.33 118.20 3dtd n VAL 77 Ca 0.15 -0.40 -0.14 0.00 -0.01 0.00 0.00 64.34 63.94 3dtd n VAL 77 Cb 0.42 -1.32 -0.14 0.00 -0.91 0.00 0.00 33.84 31.89 3dtd n VAL 77 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3dtd s VAL 78 N -2.39 0.15 0.07 2.52 0.11 -1.19 -3.59 120.40 116.08 3dtd s VAL 78 Ca -0.27 -0.06 0.03 0.00 -2.93 0.00 0.00 61.98 58.75 3dtd s VAL 78 Cb 0.08 -0.15 -0.03 0.00 -1.53 0.00 0.00 36.38 34.75 3dtd s VAL 78 CO 0.43 0.05 -0.10 0.00 -3.33 0.00 0.00 175.10 172.16 3dtd s ALA 79 N 0.08 0.89 -0.03 1.54 0.00 -0.80 -0.14 121.76 123.30 3dtd s ALA 79 Ca -0.00 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 50.96 3dtd s ALA 79 Cb -0.02 0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.15 3dtd s ALA 79 CO -0.00 -0.02 0.01 1.41 0.00 0.00 0.00 175.76 177.16 3dtd s MET 80 N -2.23 0.24 -0.03 0.00 1.75 -0.03 -0.02 119.30 118.98 3dtd s MET 80 Ca -0.01 0.10 0.03 0.00 -1.25 0.00 0.00 55.69 54.56 3dtd s MET 80 Cb -0.06 -0.44 -0.00 0.00 2.84 0.00 0.00 34.83 37.17 3dtd s MET 80 CO 0.00 -0.14 -0.13 0.45 -0.65 0.00 0.00 175.02 174.55 3dtd s SER 81 N 1.03 1.71 -0.02 1.11 0.15 -0.28 -1.48 113.70 115.92 3dtd s SER 81 Ca -0.10 -0.27 -0.01 0.00 0.70 0.00 0.00 55.95 56.27 3dtd s SER 81 Cb -0.13 -0.45 0.01 0.00 -1.71 0.00 0.00 66.02 63.74 3dtd s SER 81 CO -0.02 0.12 0.04 -0.69 1.20 0.00 0.00 173.24 173.89 3dtd s VAL 82 N 0.08 -0.01 0.21 4.45 1.01 0.12 -0.96 120.40 125.30 3dtd s VAL 82 Ca -0.03 0.05 0.11 0.00 0.00 0.00 0.00 61.98 62.11 3dtd s VAL 82 Cb -0.10 -0.08 -0.05 0.00 0.00 0.00 0.00 36.38 36.16 3dtd s VAL 82 CO 0.01 0.02 -0.22 0.68 0.00 0.00 0.00 175.10 175.59 3dtd s VAL 83 N 0.28 2.30 -0.22 2.92 -7.23 0.44 -0.03 120.40 118.86 3dtd s VAL 83 Ca -0.02 -2.11 -0.09 0.00 -1.81 0.00 0.00 61.98 57.94 3dtd s VAL 83 Cb -0.03 -2.13 -0.05 0.00 0.56 0.00 0.00 36.38 34.73 3dtd s VAL 83 CO -0.01 -0.23 0.12 -0.22 -0.31 0.00 0.00 175.10 174.46 3dtd s LEU 84 N -2.89 4.02 0.49 1.32 0.20 -1.26 -2.07 118.68 118.47 3dtd s LEU 84 Ca 0.22 0.11 0.01 0.00 0.69 0.00 0.00 54.13 55.16 3dtd s LEU 84 Cb -0.07 -2.06 0.01 0.00 -0.43 0.00 0.00 46.19 43.65 3dtd s LEU 84 CO 0.11 0.11 0.71 0.20 -0.29 0.00 0.00 176.35 177.18 3dtd s ASN 85 N 0.78 5.63 0.51 3.68 0.01 -0.57 -4.99 114.94 119.98 3dtd s ASN 85 Ca 0.06 0.17 0.25 0.00 -0.71 0.00 0.00 52.86 52.64 3dtd s ASN 85 Cb -0.13 -1.28 1.36 0.00 0.41 0.00 0.00 41.25 41.61 3dtd s ASN 85 CO 0.02 -0.86 2.04 0.00 -1.51 0.00 0.00 177.10 176.79 3dtd h ALA 86 N 0.28 1.31 -0.43 0.60 0.00 -1.99 -1.92 119.26 117.11 3dtd h ALA 86 Ca -0.45 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3dtd h ALA 86 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3dtd h ALA 86 CO 0.55 0.17 0.00 -0.40 0.00 0.00 0.00 179.25 179.58 3dtd n ASP 87 N -3.71 4.39 -0.20 0.00 5.75 -1.26 -4.92 116.55 116.59 3dtd n ASP 87 Ca -0.02 -2.64 -0.03 0.00 -0.01 0.00 0.00 54.79 52.09 3dtd n ASP 87 Cb 0.25 -0.62 -0.01 0.00 -1.03 0.00 0.00 41.12 39.71 3dtd n ASP 87 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dtd n GLY 88 N 0.51 0.57 3.81 6.12 0.00 -0.72 -5.02 105.19 110.46 3dtd n GLY 88 Ca 0.20 -0.37 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 3dtd n GLY 88 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dtd s VAL 89 N -1.95 5.41 -0.32 1.61 0.11 -1.26 -4.87 120.40 119.13 3dtd s VAL 89 Ca 0.00 0.31 -0.14 0.00 -2.93 0.00 0.00 61.98 59.22 3dtd s VAL 89 Cb 0.00 -3.48 -0.03 0.00 -1.53 0.00 0.00 36.38 31.34 3dtd s VAL 89 CO 0.00 0.53 0.30 -0.69 -3.33 0.00 0.00 175.10 171.90 3dtd s VAL 90 N -0.39 5.23 0.15 2.04 1.01 -1.21 -1.52 120.40 125.71 3dtd s VAL 90 Ca 0.14 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.22 3dtd s VAL 90 Cb -0.12 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 3dtd s VAL 90 CO 0.03 0.04 0.01 -0.94 0.00 0.00 0.00 175.10 174.25 3dtd s SER 91 N 1.72 0.92 0.00 3.32 1.04 -0.88 -0.23 113.70 119.58 3dtd s SER 91 Ca 0.10 -1.17 0.00 0.00 0.48 0.00 0.00 55.95 55.36 3dtd s SER 91 Cb -0.16 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.13 3dtd s SER 91 CO 0.11 -0.61 0.00 0.61 0.98 0.00 0.00 173.24 174.32 3dtd n GLY 92 N -0.18 -0.72 2.97 7.32 0.00 -0.46 -0.42 105.19 113.70 3dtd n GLY 92 Ca -0.07 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.46 3dtd n GLY 92 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dtd s ASN 93 N -4.00 0.66 -0.16 1.61 0.01 -0.14 -1.64 114.94 111.28 3dtd s ASN 93 Ca 0.00 -0.13 -0.04 0.00 -0.71 0.00 0.00 52.86 51.98 3dtd s ASN 93 Cb 0.00 -0.06 -0.03 0.00 0.41 0.00 0.00 41.25 41.57 3dtd s ASN 93 CO 0.00 0.05 -0.04 -0.22 -1.51 0.00 0.00 177.10 175.38 3dtd s LEU 94 N -0.23 3.22 -0.30 0.60 2.96 0.72 -1.13 118.68 124.52 3dtd s LEU 94 Ca 0.01 -0.15 -0.11 0.00 -0.22 0.00 0.00 54.13 53.66 3dtd s LEU 94 Cb -0.03 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 3dtd s LEU 94 CO -0.00 0.15 0.19 -0.89 -1.32 0.00 0.00 176.35 174.48 3dtd s THR 95 N 0.47 5.14 0.36 3.68 2.01 0.97 0.23 115.64 128.50 3dtd s THR 95 Ca -0.03 -0.01 0.08 0.00 0.31 0.00 0.00 61.69 62.03 3dtd s THR 95 Cb -0.14 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 3dtd s THR 95 CO 0.03 0.18 0.21 0.68 -0.69 0.00 0.00 174.62 175.02 3dtd s VAL 96 N 1.72 2.91 1.04 3.82 -7.23 0.39 -1.91 120.40 121.14 3dtd s VAL 96 Ca 0.06 -1.60 -0.12 0.00 -1.81 0.00 0.00 61.98 58.52 3dtd s VAL 96 Cb -0.16 -3.01 0.21 0.00 0.56 0.00 0.00 36.38 33.98 3dtd s VAL 96 CO 0.10 -0.12 1.07 -2.84 -0.31 0.00 0.00 175.10 173.00 3dtd s PRO 97 N -3.92 0.07 0.81 4.82 0.02 -1.24 -1.05 135.00 134.50 3dtd s PRO 97 Ca 0.40 0.90 -0.11 0.00 0.02 0.00 0.00 61.00 62.22 3dtd s PRO 97 Cb -0.02 -1.66 0.08 0.00 0.02 0.00 0.00 34.50 32.91 3dtd s PRO 97 CO 0.24 -3.08 1.09 -0.06 -0.33 0.00 0.00 177.00 174.86 3dtd s PHE 98 N -2.67 2.55 0.00 6.54 0.08 -1.26 -4.25 117.98 118.97 3dtd s PHE 98 Ca 0.67 1.44 0.00 0.00 0.12 0.00 0.00 56.93 59.15 3dtd s PHE 98 Cb -0.22 -3.07 0.00 0.00 -0.57 0.00 0.00 43.02 39.16 3dtd s PHE 98 CO 0.61 -1.94 0.00 0.41 -0.10 0.00 0.00 175.22 174.20 3dtd n GLY 99 N -1.28 0.66 3.78 4.36 0.00 -1.26 -5.04 105.19 106.42 3dtd n GLY 99 Ca 0.08 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 3dtd n GLY 99 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dtd s ILE 100 N -2.00 4.91 -0.28 -0.61 -1.09 -1.26 -1.06 121.20 119.80 3dtd s ILE 100 Ca 0.00 1.15 -0.29 0.00 -2.23 0.00 0.00 60.65 59.28 3dtd s ILE 100 Cb 0.00 -3.88 -0.03 0.00 -1.58 0.00 0.00 42.46 36.98 3dtd s ILE 100 CO 0.00 0.47 1.81 -0.22 -1.23 0.00 0.00 174.94 175.77 3dtd s LEU 101 N -0.48 3.61 0.36 2.97 2.96 0.16 -4.56 118.68 123.71 3dtd s LEU 101 Ca 0.29 1.49 0.18 0.00 -0.22 0.00 0.00 54.13 55.87 3dtd s LEU 101 Cb -0.18 -3.53 0.60 0.00 0.50 0.00 0.00 46.19 43.58 3dtd s LEU 101 CO 0.16 -1.61 1.70 0.58 -1.32 0.00 0.00 176.35 175.86 3dtd h VAL 102 N 6.66 0.90 0.00 1.68 2.07 -1.95 -3.05 116.25 122.56 3dtd h VAL 102 Ca -0.35 -1.63 0.00 0.00 0.82 0.00 0.00 66.70 65.54 3dtd h VAL 102 Cb 1.18 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.94 3dtd h VAL 102 CO 1.01 0.39 -0.08 0.77 0.02 0.00 0.00 177.57 179.69 3dtd h SER 103 N 0.00 0.00 -2.83 0.57 4.64 -1.96 -3.42 113.55 110.55 3dtd h SER 103 Ca -0.00 -0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.68 3dtd h SER 103 Cb 0.96 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.00 3dtd h SER 103 CO 0.05 0.00 -0.46 -0.54 -0.87 0.00 0.00 176.83 175.01 3dtd s LYS 104 N -3.20 3.48 0.77 4.77 1.02 -1.16 -5.09 119.74 120.33 3dtd s LYS 104 Ca 0.07 -0.25 -0.11 0.00 0.02 0.00 0.00 55.97 55.70 3dtd s LYS 104 Cb 0.07 -3.09 0.05 0.00 -0.52 0.00 0.00 37.83 34.34 3dtd s LYS 104 CO 0.66 0.67 1.09 -2.14 -0.92 0.00 0.00 175.35 174.71 3dtd s PRO 105 N -1.87 2.30 -0.25 -1.68 0.02 -1.26 -4.81 135.00 127.44 3dtd s PRO 105 Ca 0.27 0.77 -0.08 0.00 0.02 0.00 0.00 61.00 61.98 3dtd s PRO 105 Cb -0.13 -1.93 -0.04 0.00 0.02 0.00 0.00 34.50 32.43 3dtd s PRO 105 CO 0.18 -1.50 0.10 0.08 -0.33 0.00 0.00 177.00 175.53 3dtd s VAL 106 N -3.10 4.62 -0.21 3.83 1.01 0.25 -4.49 120.40 122.31 3dtd s VAL 106 Ca 0.60 -0.07 -0.11 0.00 0.00 0.00 0.00 61.98 62.40 3dtd s VAL 106 Cb -0.15 -3.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.02 3dtd s VAL 106 CO 0.55 0.33 0.16 -0.60 0.00 0.00 0.00 175.10 175.54 3dtd s ARG 107 N 1.54 4.17 -0.16 2.72 3.52 0.55 -1.32 118.95 129.97 3dtd s ARG 107 Ca 0.06 -0.19 -0.01 0.00 -0.13 0.00 0.00 55.73 55.47 3dtd s ARG 107 Cb -0.15 -3.45 -0.01 0.00 -1.56 0.00 0.00 34.95 29.78 3dtd s ARG 107 CO 0.05 0.22 -0.13 -0.51 -0.81 0.00 0.00 175.30 174.13 3dtd s LEU 108 N 0.58 2.62 -0.02 -0.88 1.02 0.11 -0.94 118.68 121.16 3dtd s LEU 108 Ca 0.09 -0.41 0.00 0.00 0.02 0.00 0.00 54.13 53.83 3dtd s LEU 108 Cb -0.12 -1.61 0.03 0.00 0.02 0.00 0.00 46.19 44.51 3dtd s LEU 108 CO 0.01 0.09 0.01 -1.58 0.02 0.00 0.00 176.35 174.90 3dtd s GLN 109 N 0.78 0.15 -0.49 1.70 0.74 -0.44 -0.69 119.66 121.42 3dtd s GLN 109 Ca -0.05 0.11 -0.28 0.00 0.05 0.00 0.00 55.36 55.19 3dtd s GLN 109 Cb -0.15 -0.36 0.03 0.00 1.10 0.00 0.00 33.01 33.62 3dtd s GLN 109 CO 0.01 -0.14 1.10 0.08 -0.55 0.00 0.00 175.29 175.79 3dtd s VAL 110 N 0.97 4.24 0.00 1.34 1.01 -1.13 0.36 120.40 127.19 3dtd s VAL 110 Ca -0.09 1.07 0.00 0.00 0.00 0.00 0.00 61.98 62.96 3dtd s VAL 110 Cb -0.13 -4.59 0.00 0.00 0.00 0.00 0.00 36.38 31.67 3dtd s VAL 110 CO -0.02 -1.02 0.00 0.47 0.00 0.00 0.00 175.10 174.53 3dtd n ASP 111 N 7.77 0.00 -0.09 3.32 8.00 -0.72 -2.18 116.55 132.66 3dtd n ASP 111 Ca 0.10 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.66 3dtd n ASP 111 Cb 0.49 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.68 3dtd n ASP 111 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3dtd n GLU 112 N 8.64 1.54 -0.09 -1.24 1.02 -1.26 -4.82 120.64 124.44 3dtd n GLU 112 Ca 0.00 -2.08 0.00 0.00 -0.02 0.00 0.00 57.16 55.06 3dtd n GLU 112 Cb 0.00 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 3dtd n GLU 112 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dtd n GLY 113 N -1.01 -0.52 0.11 0.62 0.00 -0.93 -5.00 105.19 98.46 3dtd n GLY 113 Ca 0.10 -1.72 0.13 0.00 0.00 0.00 0.00 46.02 44.52 3dtd n GLY 113 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dtd n LYS 114 N -0.56 0.40 -2.35 1.61 5.02 -1.26 -4.74 118.16 116.28 3dtd n LYS 114 Ca 0.00 -0.23 -0.35 0.00 -2.02 0.00 0.00 58.31 55.71 3dtd n LYS 114 Cb 0.00 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.48 3dtd n LYS 114 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dtd s ALA 115 N -2.76 2.29 -0.16 7.82 0.00 -1.26 -4.95 121.76 122.75 3dtd s ALA 115 Ca 0.18 -1.92 0.01 0.00 0.00 0.00 0.00 51.96 50.24 3dtd s ALA 115 Cb 0.18 -4.53 0.01 0.00 0.00 0.00 0.00 23.12 18.79 3dtd s ALA 115 CO 0.61 -4.09 -0.20 0.08 0.00 0.00 0.00 175.76 172.16 3dtd s VAL 116 N 7.07 2.18 -0.09 0.00 1.01 -1.26 -2.85 120.40 126.47 3dtd s VAL 116 Ca 0.56 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.63 3dtd s VAL 116 Cb -0.03 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.43 3dtd s VAL 116 CO -0.05 0.54 -0.12 -0.63 0.00 0.00 0.00 175.10 174.83 3dtd s ILE 117 N 1.00 3.20 -0.19 2.22 1.01 0.13 -4.98 121.20 123.58 3dtd s ILE 117 Ca -0.02 -0.64 -0.00 0.00 0.00 0.00 0.00 60.65 59.98 3dtd s ILE 117 Cb -0.15 -2.31 0.01 0.00 0.01 0.00 0.00 42.46 40.03 3dtd s ILE 117 CO -0.06 0.56 -0.15 -0.70 0.00 0.00 0.00 174.94 174.59 3dtd s GLU 118 N -0.23 3.09 0.21 2.79 2.12 -1.26 0.04 118.70 125.45 3dtd s GLU 118 Ca 0.01 -0.78 0.05 0.00 0.36 0.00 0.00 54.97 54.61 3dtd s GLU 118 Cb -0.13 -2.70 -0.02 0.00 0.26 0.00 0.00 34.13 31.54 3dtd s GLU 118 CO 0.03 -0.21 0.17 -2.37 -0.54 0.00 0.00 175.26 172.33 3dtd n THR 119 N 4.67 0.00 -4.24 -1.70 5.66 -0.44 -4.97 114.28 113.26 3dtd n THR 119 Ca -0.20 -1.48 -0.14 0.00 -3.05 0.00 0.00 64.05 59.18 3dtd n THR 119 Cb 0.50 0.73 -0.10 0.00 -1.55 0.00 0.00 70.33 69.91 3dtd n THR 119 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 3dtd s GLY 120 N -2.43 1.55 0.11 1.09 0.00 -1.26 0.87 107.32 107.25 3dtd s GLY 120 Ca 0.24 -1.76 -0.31 0.00 0.00 0.00 0.00 44.72 42.89 3dtd s GLY 120 CO 0.17 -1.46 1.36 -0.42 0.00 0.00 0.00 173.10 172.74 3dtd s ILE 121 N -4.02 3.41 -0.12 0.90 1.01 -1.26 -4.11 121.20 117.01 3dtd s ILE 121 Ca 0.39 1.02 -0.14 0.00 0.00 0.00 0.00 60.65 61.91 3dtd s ILE 121 Cb 0.07 -3.65 -0.26 0.00 0.01 0.00 0.00 42.46 38.63 3dtd s ILE 121 CO 0.13 0.08 0.47 -0.09 0.00 0.00 0.00 174.94 175.53 3dtd h ARG 122 N 6.73 0.22 -2.50 2.79 2.43 -1.38 -3.49 114.38 119.18 3dtd h ARG 122 Ca -0.42 -0.38 0.13 0.00 -0.81 0.00 0.00 59.98 58.50 3dtd h ARG 122 Cb 1.21 0.14 -0.09 0.00 -0.42 0.00 0.00 29.97 30.81 3dtd h ARG 122 CO 0.85 1.18 0.42 -0.08 -1.51 0.00 0.00 179.97 180.84 3dtd s THR 123 N -2.49 0.00 0.05 0.20 -1.32 -1.24 -5.04 115.64 105.81 3dtd s THR 123 Ca -0.21 -0.58 0.08 0.00 -1.21 0.00 0.00 61.69 59.76 3dtd s THR 123 Cb 0.05 -1.78 -0.03 0.00 -1.51 0.00 0.00 72.50 69.24 3dtd s THR 123 CO 0.75 0.00 -0.22 0.00 -2.21 0.00 0.00 174.62 172.94 3dtd s VAL 125 N -0.85 1.14 0.52 0.00 -7.23 0.35 -4.97 120.40 109.36 3dtd s VAL 125 Ca 0.08 -2.00 0.31 0.00 -1.81 0.00 0.00 61.98 58.56 3dtd s VAL 125 Cb -0.09 -2.60 0.49 0.00 0.56 0.00 0.00 36.38 34.74 3dtd s VAL 125 CO 0.02 0.00 1.86 -0.65 -0.31 0.00 0.00 175.10 176.02 3dtd h PRO 126 N 1.85 0.06 0.00 4.82 0.11 -2.04 -0.79 132.00 136.01 3dtd h PRO 126 Ca -0.40 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3dtd h PRO 126 Cb 1.26 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3dtd h PRO 126 CO 0.69 0.04 0.00 0.00 -0.21 0.00 0.00 178.00 178.52 3dtd h ALA 127 N 1.53 1.00 0.00 -0.75 0.00 -1.99 -3.49 119.26 115.55 3dtd h ALA 127 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.39 3dtd h ALA 127 Cb 1.79 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.58 3dtd h ALA 127 CO -0.04 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.62 3dtd n GLY 128 N 0.45 0.86 3.76 0.00 0.00 -0.30 -4.92 105.19 105.03 3dtd n GLY 128 Ca 0.03 -1.98 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 3dtd n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dtd s ILE 130 N 0.11 5.26 -0.31 0.00 -1.09 0.15 -0.46 121.20 124.85 3dtd s ILE 130 Ca 0.18 0.47 -0.02 0.00 -2.23 0.00 0.00 60.65 59.05 3dtd s ILE 130 Cb -0.13 -3.63 0.06 0.00 -1.58 0.00 0.00 42.46 37.17 3dtd s ILE 130 CO 0.05 0.27 0.02 -0.69 -1.23 0.00 0.00 174.94 173.36 3dtd s VAL 131 N 1.39 2.99 0.28 2.92 1.01 0.13 -0.83 120.40 128.30 3dtd s VAL 131 Ca 0.14 -1.47 -0.29 0.00 0.00 0.00 0.00 61.98 60.35 3dtd s VAL 131 Cb -0.15 -2.76 -0.10 0.00 0.00 0.00 0.00 36.38 33.37 3dtd s VAL 131 CO 0.07 -0.17 1.21 -2.84 0.00 0.00 0.00 175.10 173.37 3dtd s PRO 132 N 1.23 4.49 -0.02 2.72 0.02 -1.26 -0.20 135.00 141.98 3dtd s PRO 132 Ca -0.04 2.00 0.02 0.00 0.02 0.00 0.00 61.00 63.00 3dtd s PRO 132 Cb -0.20 -3.15 0.00 0.00 0.02 0.00 0.00 34.50 31.17 3dtd s PRO 132 CO -0.02 -0.02 -0.07 0.96 -0.33 0.00 0.00 177.00 177.52 3dtd s ILE 133 N -0.92 0.64 -0.09 2.83 -4.36 -0.65 -4.75 121.20 113.89 3dtd s ILE 133 Ca 0.48 -0.29 0.01 0.00 -0.26 0.00 0.00 60.65 60.59 3dtd s ILE 133 Cb -0.36 -0.58 0.02 0.00 1.25 0.00 0.00 42.46 42.80 3dtd s ILE 133 CO 0.45 0.20 -0.10 -0.69 0.24 0.00 0.00 174.94 175.05 3dtd s VAL 134 N 0.17 1.08 -0.20 8.37 1.01 -1.26 -1.35 120.40 128.22 3dtd s VAL 134 Ca -0.02 -0.38 -0.05 0.00 0.00 0.00 0.00 61.98 61.53 3dtd s VAL 134 Cb -0.07 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.24 3dtd s VAL 134 CO 0.00 0.36 -0.00 -0.36 0.00 0.00 0.00 175.10 175.10 3dtd s PHE 135 N 1.24 3.04 0.90 5.22 2.99 0.68 -5.01 117.98 127.03 3dtd s PHE 135 Ca -0.04 -0.44 -0.14 0.00 0.00 0.00 0.00 56.93 56.32 3dtd s PHE 135 Cb -0.14 -2.07 0.14 0.00 0.00 0.00 0.00 43.02 40.95 3dtd s PHE 135 CO -0.03 -0.21 1.22 0.16 -0.00 0.00 0.00 175.22 176.35 3dtd s ASP 136 N 0.92 3.67 0.31 1.36 1.47 -1.26 -3.33 116.67 119.82 3dtd s ASP 136 Ca 0.01 0.63 0.04 0.00 1.18 0.00 0.00 52.55 54.41 3dtd s ASP 136 Cb -0.14 -0.97 0.66 0.00 -0.34 0.00 0.00 42.92 42.13 3dtd s ASP 136 CO 0.02 -2.42 1.84 0.11 0.68 0.00 0.00 175.17 175.40 3dtd h LYS 137 N -1.41 0.85 -0.06 2.11 1.79 -1.99 -0.41 116.57 117.44 3dtd h LYS 137 Ca -0.46 -0.05 -0.19 0.00 -2.18 0.00 0.00 60.65 57.77 3dtd h LYS 137 Cb 1.30 -0.19 -0.00 0.00 -1.58 0.00 0.00 32.23 31.75 3dtd h LYS 137 CO 0.54 0.56 -0.77 -0.91 -1.08 0.00 0.00 179.45 177.79 3dtd h ASN 138 N 0.87 0.46 -0.20 0.86 -0.26 -1.99 -2.33 115.58 112.99 3dtd h ASN 138 Ca 0.49 -0.32 -0.21 0.00 -0.56 0.00 0.00 56.30 55.71 3dtd h ASN 138 Cb 0.62 -0.14 0.01 0.00 -1.06 0.00 0.00 38.32 37.74 3dtd h ASN 138 CO -0.26 1.07 -0.68 0.22 -1.06 0.00 0.00 177.43 176.72 3dtd h TYR 139 N 0.25 1.07 -0.54 1.19 5.03 -1.75 -2.57 116.97 119.65 3dtd h TYR 139 Ca -0.04 -0.43 0.07 0.00 2.58 0.00 0.00 58.73 60.90 3dtd h TYR 139 Cb 1.36 -0.18 -0.06 0.00 1.55 0.00 0.00 36.73 39.40 3dtd h TYR 139 CO 0.04 1.26 0.24 0.28 -1.32 0.00 0.00 178.16 178.66 3dtd h VAL 140 N 0.59 0.87 -0.61 1.81 2.07 -1.11 -0.36 116.25 119.52 3dtd h VAL 140 Ca -0.02 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 3dtd h VAL 140 Cb 1.30 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 3dtd h VAL 140 CO 0.14 0.08 0.33 0.00 0.02 0.00 0.00 177.57 178.15 3dtd h ALA 141 N 1.33 1.45 -0.32 1.67 0.00 -1.38 -1.69 119.26 120.32 3dtd h ALA 141 Ca 0.26 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 3dtd h ALA 141 Cb 0.24 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3dtd h ALA 141 CO -0.22 0.46 -0.40 0.00 0.00 0.00 0.00 179.25 179.09 3dtd h ALA 142 N 1.53 0.69 -0.76 0.00 0.00 -1.00 -2.95 119.26 116.77 3dtd h ALA 142 Ca 0.22 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 3dtd h ALA 142 Cb 0.02 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 3dtd h ALA 142 CO -0.04 0.67 0.38 -0.07 0.00 0.00 0.00 179.25 180.19 3dtd h LEU 143 N 0.64 0.97 -1.00 0.00 4.07 -0.60 -0.28 115.31 119.11 3dtd h LEU 143 Ca 0.05 -0.10 -0.08 0.00 0.08 0.00 0.00 57.88 57.83 3dtd h LEU 143 Cb 0.95 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 42.43 3dtd h LEU 143 CO 0.09 0.80 -0.13 0.03 -1.08 0.00 0.00 178.44 178.16 3dtd h ARG 144 N 1.07 0.58 0.00 1.13 3.08 -1.28 -3.15 114.38 115.81 3dtd h ARG 144 Ca 0.26 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.14 3dtd h ARG 144 Cb 0.08 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.07 3dtd h ARG 144 CO -0.04 0.69 -0.74 0.00 -1.07 0.00 0.00 179.97 178.82 3dtd n ALA 145 N -2.48 3.84 -2.03 0.04 0.00 -1.07 -4.66 120.51 114.15 3dtd n ALA 145 Ca 0.01 -0.43 -0.25 0.00 0.00 0.00 0.00 53.44 52.77 3dtd n ALA 145 Cb 0.34 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 18.84 3dtd n ALA 145 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3dtd s GLY 146 N -3.14 1.67 -0.18 0.00 0.00 -0.14 -5.05 107.32 100.48 3dtd s GLY 146 Ca 0.09 -0.92 -0.02 0.00 0.00 0.00 0.00 44.72 43.87 3dtd s GLY 146 CO 0.77 -0.60 -0.18 0.28 0.00 0.00 0.00 173.10 173.37 3dtd n LYS 147 N -2.61 0.42 -4.57 2.90 5.02 -1.26 -4.69 118.16 113.37 3dtd n LYS 147 Ca 0.06 0.12 -0.22 0.00 -2.02 0.00 0.00 58.31 56.25 3dtd n LYS 147 Cb 0.59 -1.29 -0.14 0.00 -0.02 0.00 0.00 35.03 34.16 3dtd n LYS 147 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3dtd s HIS 148 N -2.34 1.30 -0.49 2.13 3.76 -1.26 -0.74 115.29 117.64 3dtd s HIS 148 Ca -0.24 -0.28 -0.13 0.00 -0.15 0.00 0.00 55.06 54.25 3dtd s HIS 148 Cb 0.07 -0.81 0.11 0.00 1.11 0.00 0.00 32.58 33.06 3dtd s HIS 148 CO 0.38 0.00 0.41 -1.17 -0.85 0.00 0.00 174.74 173.51 3dtd s LEU 149 N -0.63 5.83 0.18 0.89 2.96 0.57 -1.75 118.68 126.72 3dtd s LEU 149 Ca 0.04 -1.69 -0.30 0.00 -0.22 0.00 0.00 54.13 51.97 3dtd s LEU 149 Cb -0.06 -2.13 -0.08 0.00 0.50 0.00 0.00 46.19 44.42 3dtd s LEU 149 CO 0.00 -0.74 0.99 -0.54 -1.32 0.00 0.00 176.35 174.74 3dtd s LYS 150 N 1.53 4.74 -0.05 1.98 1.02 0.16 -0.95 119.74 128.17 3dtd s LYS 150 Ca 0.04 1.54 0.02 0.00 0.02 0.00 0.00 55.97 57.59 3dtd s LYS 150 Cb -0.27 -3.31 -0.03 0.00 -0.52 0.00 0.00 37.83 33.70 3dtd s LYS 150 CO 0.03 0.31 -0.10 -0.51 -0.92 0.00 0.00 175.35 174.15 3dtd s LEU 151 N -0.61 2.97 -0.06 3.17 2.01 -0.26 -1.32 118.68 124.58 3dtd s LEU 151 Ca 0.45 -0.11 0.00 0.00 0.01 0.00 0.00 54.13 54.48 3dtd s LEU 151 Cb -0.26 -1.63 0.02 0.00 0.01 0.00 0.00 46.19 44.33 3dtd s LEU 151 CO 0.32 0.35 -0.04 0.00 1.01 0.00 0.00 176.35 177.99 3dtd s ALA 152 N -0.79 0.79 0.30 4.21 0.00 -0.12 -4.31 121.76 121.84 3dtd s ALA 152 Ca 0.12 -0.15 -0.04 0.00 0.00 0.00 0.00 51.96 51.89 3dtd s ALA 152 Cb -0.11 -0.57 -0.00 0.00 0.00 0.00 0.00 23.12 22.44 3dtd s ALA 152 CO 0.01 -0.16 0.43 0.00 0.00 0.00 0.00 175.76 176.04 3dtd s MET 153 N 1.25 1.74 -0.11 0.00 0.23 -0.61 -0.33 119.30 121.48 3dtd s MET 153 Ca -0.06 -1.64 0.01 0.00 -1.03 0.00 0.00 55.69 52.97 3dtd s MET 153 Cb -0.14 0.43 -0.02 0.00 -1.53 0.00 0.00 34.83 33.57 3dtd s MET 153 CO -0.02 -0.71 -0.12 0.99 -2.03 0.00 0.00 175.02 173.13 3dtd s THR 154 N -3.41 3.18 0.02 3.16 2.01 -1.26 -0.26 115.64 119.08 3dtd s THR 154 Ca 0.30 -0.64 -0.27 0.00 0.31 0.00 0.00 61.69 61.39 3dtd s THR 154 Cb 0.01 -2.32 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 3dtd s THR 154 CO 0.17 0.54 0.86 -0.63 -0.69 0.00 0.00 174.62 174.88 3dtd s ILE 155 N -0.02 4.80 -1.19 1.82 1.01 0.23 0.37 121.20 128.22 3dtd s ILE 155 Ca -0.03 1.83 -0.20 0.00 0.00 0.00 0.00 60.65 62.25 3dtd s ILE 155 Cb -0.14 -4.21 0.04 0.00 0.01 0.00 0.00 42.46 38.16 3dtd s ILE 155 CO 0.04 0.26 1.70 0.00 0.00 0.00 0.00 174.94 176.94 3dtd s ALA 156 N 0.51 2.87 0.11 9.38 0.00 -0.23 -3.86 121.76 130.55 3dtd s ALA 156 Ca 0.45 -2.57 -0.11 0.00 0.00 0.00 0.00 51.96 49.73 3dtd s ALA 156 Cb -0.21 -4.62 0.01 0.00 0.00 0.00 0.00 23.12 18.30 3dtd s ALA 156 CO 0.25 -3.72 0.25 0.00 0.00 0.00 0.00 175.76 172.54 3dtd s ALA 157 N 5.64 -0.38 0.01 0.00 0.00 -1.26 -4.92 121.76 120.84 3dtd s ALA 157 Ca 0.55 -0.50 -0.34 0.00 0.00 0.00 0.00 51.96 51.66 3dtd s ALA 157 Cb 0.02 0.57 -0.13 0.00 0.00 0.00 0.00 23.12 23.58 3dtd s ALA 157 CO 0.04 -0.56 1.75 -2.30 0.00 0.00 0.00 175.76 174.69 3dtd n PRO 158 N -0.12 2.13 0.00 0.00 -0.02 -1.26 -0.80 135.00 134.93 3dtd n PRO 158 Ca -0.14 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 3dtd n PRO 158 Cb 0.63 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 3dtd n PRO 158 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dtd n GLY 159 N 3.98 3.46 3.47 -1.23 0.00 -1.26 -4.68 105.19 108.93 3dtd n GLY 159 Ca 0.20 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.05 3dtd n GLY 159 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dtd n GLU 160 N -1.94 -1.39 -2.51 1.61 1.02 0.02 -4.98 120.64 112.47 3dtd n GLU 160 Ca 0.00 0.95 -0.34 0.00 -0.02 0.00 0.00 57.16 57.75 3dtd n GLU 160 Cb 0.00 -4.25 -0.03 0.00 -0.02 0.00 0.00 31.44 27.14 3dtd n GLU 160 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 3dtd s PRO 161 N -4.50 3.77 0.48 3.49 0.02 -1.25 -4.68 135.00 132.32 3dtd s PRO 161 Ca 0.16 1.39 -0.20 0.00 0.02 0.00 0.00 61.00 62.38 3dtd s PRO 161 Cb -0.05 -2.10 -0.09 0.00 0.02 0.00 0.00 34.50 32.28 3dtd s PRO 161 CO 0.83 -0.47 1.00 -1.25 -0.33 0.00 0.00 177.00 176.78 3dtd s PRO 162 N -3.21 3.95 -0.29 5.54 0.04 -1.26 -0.60 135.00 139.17 3dtd s PRO 162 Ca 0.68 1.19 0.01 0.00 0.04 0.00 0.00 61.00 62.92 3dtd s PRO 162 Cb -0.17 -2.13 0.06 0.00 0.04 0.00 0.00 34.50 32.30 3dtd s PRO 162 CO 0.21 -0.28 -0.05 -1.17 0.04 0.00 0.00 177.00 175.75 3dtd s LEU 163 N -3.54 3.80 0.00 -3.56 2.96 0.65 -4.82 118.68 114.18 3dtd s LEU 163 Ca 0.64 -1.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.08 3dtd s LEU 163 Cb -0.12 -1.62 0.00 0.00 0.50 0.00 0.00 46.19 44.94 3dtd s LEU 163 CO 0.20 -0.25 0.28 0.59 -1.32 0.00 0.00 176.35 175.86 3dtd n ASN 164 N 4.48 0.56 -0.67 3.68 3.02 -1.26 -1.57 115.26 123.50 3dtd n ASN 164 Ca -0.11 -0.80 0.11 0.00 -0.03 0.00 0.00 54.58 53.75 3dtd n ASN 164 Cb 0.42 0.33 0.33 0.00 -0.61 0.00 0.00 39.78 40.25 3dtd n ASN 164 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 3dtd n ASP 165 N -0.33 2.01 -4.87 6.41 3.85 -1.26 -4.68 116.55 117.68 3dtd n ASP 165 Ca 0.00 -1.77 -0.33 0.00 -0.71 0.00 0.00 54.79 51.97 3dtd n ASP 165 Cb 0.02 -0.13 -0.05 0.00 -1.35 0.00 0.00 41.12 39.60 3dtd n ASP 165 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 3dtd s LEU 166 N -1.54 4.27 0.20 -2.12 1.02 -1.26 -5.02 118.68 114.23 3dtd s LEU 166 Ca 0.33 0.89 -0.18 0.00 0.02 0.00 0.00 54.13 55.19 3dtd s LEU 166 Cb 0.18 -3.35 0.03 0.00 0.02 0.00 0.00 46.19 43.07 3dtd s LEU 166 CO 0.27 0.05 0.53 0.72 0.02 0.00 0.00 176.35 177.94 3dtd s PHE 167 N -1.60 -0.11 -0.14 0.29 -0.12 -1.26 -1.10 117.98 113.94 3dtd s PHE 167 Ca 0.40 -0.23 0.01 0.00 -0.05 0.00 0.00 56.93 57.06 3dtd s PHE 167 Cb -0.13 0.41 -0.00 0.00 -0.63 0.00 0.00 43.02 42.66 3dtd s PHE 167 CO 0.20 -0.94 -0.17 0.08 -0.05 0.00 0.00 175.22 174.35 3dtd s VAL 168 N -3.88 2.63 0.12 -2.49 1.01 -0.12 -4.93 120.40 112.74 3dtd s VAL 168 Ca 0.10 -0.80 -0.30 0.00 0.00 0.00 0.00 61.98 60.98 3dtd s VAL 168 Cb -0.01 -2.09 -0.06 0.00 0.00 0.00 0.00 36.38 34.22 3dtd s VAL 168 CO -0.02 0.53 1.09 -1.10 0.00 0.00 0.00 175.10 175.60 3dtd s GLN 169 N 0.61 4.56 0.00 2.72 -0.21 -1.26 -0.31 119.66 125.76 3dtd s GLN 169 Ca -0.09 1.66 0.19 0.00 0.02 0.00 0.00 55.36 57.13 3dtd s GLN 169 Cb -0.16 -3.33 0.45 0.00 1.00 0.00 0.00 33.01 30.97 3dtd s GLN 169 CO 0.03 -0.01 1.37 1.28 -2.12 0.00 0.00 175.29 175.84 3dtd n LEU 170 N 3.02 3.39 -4.62 2.90 4.77 0.08 -4.93 117.00 121.60 3dtd n LEU 170 Ca 0.05 -1.78 -0.43 0.00 -0.03 0.00 0.00 56.01 53.82 3dtd n LEU 170 Cb 0.47 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 3dtd n LEU 170 CO 0.54 0.80 1.68 0.21 -1.33 0.00 0.00 177.39 179.29 3dtd s ASN 171 N -1.13 5.86 0.00 -1.43 3.84 -1.26 -1.80 114.94 119.02 3dtd s ASN 171 Ca 0.36 1.95 0.00 0.00 0.21 0.00 0.00 52.86 55.38 3dtd s ASN 171 Cb 0.20 -2.52 0.00 0.00 -0.55 0.00 0.00 41.25 38.38 3dtd s ASN 171 CO 0.27 -1.63 0.00 0.61 -2.79 0.00 0.00 177.10 173.56 3dtd n GLY 172 N 5.29 0.45 0.07 1.21 0.00 -1.26 -0.63 105.19 110.32 3dtd n GLY 172 Ca 0.25 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.17 3dtd n GLY 172 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3dtd h PHE 173 N 0.00 0.02 -0.23 1.61 3.57 -1.59 -1.21 116.94 119.11 3dtd h PHE 173 Ca 0.00 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 3dtd h PHE 173 Cb 0.00 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 3dtd h PHE 173 CO 0.00 0.00 0.14 1.03 -2.23 0.00 0.00 178.31 177.25 3dtd h SER 174 N 0.05 0.28 -0.25 0.41 0.87 -1.83 0.48 113.55 113.57 3dtd h SER 174 Ca 0.05 -0.05 -0.08 0.00 -1.23 0.00 0.00 61.79 60.47 3dtd h SER 174 Cb 0.04 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 3dtd h SER 174 CO -0.07 0.25 -0.11 0.78 -0.53 0.00 0.00 176.83 177.16 3dtd h ASN 175 N 0.28 0.63 -0.10 6.23 2.35 -1.92 -0.73 115.58 122.32 3dtd h ASN 175 Ca 0.08 -0.17 -0.16 0.00 -0.55 0.00 0.00 56.30 55.50 3dtd h ASN 175 Cb 0.02 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 3dtd h ASN 175 CO -0.02 0.77 -0.50 0.00 -1.65 0.00 0.00 177.43 176.04 3dtd h ALA 176 N 1.29 0.67 -0.41 -0.83 0.00 -1.02 -2.47 119.26 116.50 3dtd h ALA 176 Ca 0.11 -0.49 -0.12 0.00 0.00 0.00 0.00 54.91 54.41 3dtd h ALA 176 Cb 0.53 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3dtd h ALA 176 CO 0.03 0.68 -0.22 1.25 0.00 0.00 0.00 179.25 180.99 3dtd h LEU 177 N 0.52 0.82 -1.05 0.00 5.85 -0.70 -1.93 115.31 118.82 3dtd h LEU 177 Ca 0.02 -0.29 0.03 0.00 0.84 0.00 0.00 57.88 58.48 3dtd h LEU 177 Cb 1.05 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.80 3dtd h LEU 177 CO 0.10 1.01 0.64 0.78 -0.34 0.00 0.00 178.44 180.63 3dtd h ASN 178 N 0.70 1.08 -0.34 1.25 2.35 -1.09 -0.95 115.58 118.58 3dtd h ASN 178 Ca 0.10 -0.02 -0.11 0.00 -0.55 0.00 0.00 56.30 55.73 3dtd h ASN 178 Cb 0.73 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.84 3dtd h ASN 178 CO 0.06 0.75 -0.17 -0.09 -1.65 0.00 0.00 177.43 176.32 3dtd h ARG 179 N 1.25 0.80 -0.79 0.81 9.65 -1.27 -1.44 114.38 123.39 3dtd h ARG 179 Ca 0.38 -0.30 -0.05 0.00 -1.10 0.00 0.00 59.98 58.91 3dtd h ARG 179 Cb -0.03 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.46 3dtd h ARG 179 CO -0.11 0.92 0.31 -0.07 2.80 0.00 0.00 179.97 183.82 3dtd h LEU 180 N 0.71 1.10 -0.41 3.80 4.07 -0.81 0.15 115.31 123.93 3dtd h LEU 180 Ca 0.11 -0.17 -0.03 0.00 0.08 0.00 0.00 57.88 57.87 3dtd h LEU 180 Cb 0.68 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 42.12 3dtd h LEU 180 CO 0.05 0.97 0.15 0.40 -1.08 0.00 0.00 178.44 178.93 3dtd h ILE 181 N 1.16 1.20 -0.28 1.22 2.04 -1.04 -2.55 117.51 119.27 3dtd h ILE 181 Ca 0.26 -0.65 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 3dtd h ILE 181 Cb 0.22 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 3dtd h ILE 181 CO -0.02 0.23 -0.04 0.00 0.00 0.00 0.00 178.15 178.32 3dtd h ALA 182 N 1.00 1.41 0.00 1.87 0.00 -0.99 -2.74 119.26 119.79 3dtd h ALA 182 Ca 0.13 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3dtd h ALA 182 Cb 0.22 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3dtd h ALA 182 CO -0.01 0.41 -0.25 -0.07 0.00 0.00 0.00 179.25 179.33 3dtd h LEU 183 N 0.42 0.00 -0.49 0.00 3.38 -0.85 -2.98 115.31 114.79 3dtd h LEU 183 Ca 0.09 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 3dtd h LEU 183 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3dtd h LEU 183 CO 0.01 0.25 -0.42 1.56 0.09 0.00 0.00 178.44 179.93 3dtd h GLN 184 N 0.00 0.77 0.00 1.13 4.20 -1.15 -3.17 115.11 116.89 3dtd h GLN 184 Ca -0.00 -0.42 -0.12 0.00 0.06 0.00 0.00 58.65 58.17 3dtd h GLN 184 Cb 0.99 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.78 3dtd h GLN 184 CO 0.03 1.05 -0.57 0.87 -0.67 0.00 0.00 178.83 179.54 3dtd h LYS 185 N 0.63 0.00 0.00 1.46 1.57 -1.49 -3.52 116.57 115.21 3dtd h LYS 185 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3dtd h LYS 185 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 3dtd h LYS 185 CO 0.09 0.57 0.00 0.39 -0.57 0.00 0.00 179.45 179.93