#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ofh s THR 2 N 0.00 -0.33 -0.13 12.58 2.01 -1.26 -1.81 115.64 126.71 1ofh s THR 2 Ca 0.00 0.26 0.01 0.00 0.31 0.00 0.00 61.69 62.27 1ofh s THR 2 Cb 0.00 -0.41 0.02 0.00 0.01 0.00 0.00 72.50 72.12 1ofh s THR 2 CO 0.00 0.08 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.23 1ofh s ILE 3 N 2.34 1.58 0.05 1.82 -1.09 -0.71 -2.20 121.20 122.99 1ofh s ILE 3 Ca 0.03 -0.67 0.06 0.00 -2.23 0.00 0.00 60.65 57.84 1ofh s ILE 3 Cb -0.13 -1.46 -0.02 0.00 -1.58 0.00 0.00 42.46 39.27 1ofh s ILE 3 CO -0.08 0.46 -0.17 0.54 -1.23 0.00 0.00 174.94 174.47 1ofh s VAL 4 N 1.17 1.33 -0.05 2.92 0.11 -0.55 -0.60 120.40 124.73 1ofh s VAL 4 Ca -0.02 -1.12 0.02 0.00 -2.93 0.00 0.00 61.98 57.94 1ofh s VAL 4 Cb -0.14 -1.19 0.01 0.00 -1.53 0.00 0.00 36.38 33.53 1ofh s VAL 4 CO -0.05 0.05 -0.10 -0.55 -3.33 0.00 0.00 175.10 171.12 1ofh s SER 5 N -1.23 1.42 -0.06 3.54 0.15 0.20 -1.79 113.70 115.92 1ofh s SER 5 Ca 0.04 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.46 1ofh s SER 5 Cb -0.08 -0.58 0.02 0.00 -1.71 0.00 0.00 66.02 63.67 1ofh s SER 5 CO 0.02 0.03 -0.04 -0.69 1.20 0.00 0.00 173.24 173.75 1ofh s VAL 6 N 0.56 0.59 -0.25 4.45 1.01 -0.51 -1.00 120.40 125.25 1ofh s VAL 6 Ca -0.10 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.74 1ofh s VAL 6 Cb -0.13 -0.64 0.01 0.00 0.00 0.00 0.00 36.38 35.61 1ofh s VAL 6 CO 0.02 0.26 -0.00 -0.60 0.00 0.00 0.00 175.10 174.78 1ofh s ARG 7 N 1.31 3.13 -0.25 2.72 3.52 -0.60 -1.45 118.95 127.34 1ofh s ARG 7 Ca -0.05 -0.80 -0.02 0.00 -0.13 0.00 0.00 55.73 54.73 1ofh s ARG 7 Cb -0.14 -3.13 0.13 0.00 -1.56 0.00 0.00 34.95 30.25 1ofh s ARG 7 CO -0.02 -0.34 0.35 0.50 -0.81 0.00 0.00 175.30 174.98 1ofh s ARG 8 N 1.44 0.33 -0.00 5.12 3.52 0.37 -4.76 118.95 124.97 1ofh s ARG 8 Ca 0.03 0.35 -0.00 0.00 -0.13 0.00 0.00 55.73 55.98 1ofh s ARG 8 Cb -0.16 -0.59 -0.00 0.00 -1.56 0.00 0.00 34.95 32.64 1ofh s ARG 8 CO -0.01 -0.74 0.00 0.09 -0.81 0.00 0.00 175.30 173.83 1ofh n ASN 9 N 5.35 -2.01 0.00 -2.12 3.02 -1.26 -3.76 115.26 114.48 1ofh n ASN 9 Ca -0.03 -0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.52 1ofh n ASN 9 Cb 0.50 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 1ofh n ASN 9 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ofh n GLY 10 N -1.44 0.00 3.44 7.41 0.00 -1.26 -4.90 105.19 108.44 1ofh n GLY 10 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1ofh n GLY 10 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ofh s GLN 11 N -1.34 3.62 -0.22 1.61 -1.52 -1.25 -4.72 119.66 115.84 1ofh s GLN 11 Ca 0.00 -0.51 -0.01 0.00 -1.95 0.00 0.00 55.36 52.89 1ofh s GLN 11 Cb 0.00 -3.17 0.02 0.00 -0.22 0.00 0.00 33.01 29.64 1ofh s GLN 11 CO 0.00 -0.08 -0.11 0.54 -0.25 0.00 0.00 175.29 175.39 1ofh s VAL 12 N 1.26 2.65 0.08 1.09 0.11 -1.17 -0.48 120.40 123.95 1ofh s VAL 12 Ca 0.04 -0.91 0.08 0.00 -2.93 0.00 0.00 61.98 58.27 1ofh s VAL 12 Cb -0.15 -2.24 -0.04 0.00 -1.53 0.00 0.00 36.38 32.42 1ofh s VAL 12 CO 0.02 0.36 -0.19 -0.69 -3.33 0.00 0.00 175.10 171.27 1ofh s VAL 13 N 1.33 2.74 -0.11 2.04 1.01 -0.53 -2.89 120.40 123.99 1ofh s VAL 13 Ca 0.03 -1.39 -0.04 0.00 0.00 0.00 0.00 61.98 60.58 1ofh s VAL 13 Cb -0.15 -2.20 0.06 0.00 0.00 0.00 0.00 36.38 34.09 1ofh s VAL 13 CO -0.07 0.21 0.16 -0.69 0.00 0.00 0.00 175.10 174.71 1ofh s VAL 14 N -1.03 -0.25 0.17 2.92 1.01 -0.82 -1.42 120.40 120.98 1ofh s VAL 14 Ca 0.16 0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.41 1ofh s VAL 14 Cb -0.10 -0.39 -0.05 0.00 0.00 0.00 0.00 36.38 35.84 1ofh s VAL 14 CO 0.07 0.04 -0.12 -0.83 0.00 0.00 0.00 175.10 174.26 1ofh s GLY 15 N 2.28 1.22 0.09 4.51 0.00 -0.74 -0.32 107.32 114.36 1ofh s GLY 15 Ca 0.04 -1.56 -0.21 0.00 0.00 0.00 0.00 44.72 42.98 1ofh s GLY 15 CO -0.07 -1.66 0.52 -0.32 0.00 0.00 0.00 173.10 171.57 1ofh s GLY 16 N -3.23 -0.45 0.53 0.20 0.00 -1.22 -1.48 107.32 101.66 1ofh s GLY 16 Ca 0.19 0.45 -0.09 0.00 0.00 0.00 0.00 44.72 45.27 1ofh s GLY 16 CO 0.03 0.15 0.52 2.09 0.00 0.00 0.00 173.10 175.89 1ofh n ASP 17 N 0.06 -1.16 -2.37 1.64 5.75 -0.93 -1.04 116.55 118.51 1ofh n ASP 17 Ca -0.17 -0.89 -0.02 0.00 -0.01 0.00 0.00 54.79 53.70 1ofh n ASP 17 Cb 0.62 -0.46 0.05 0.00 -1.03 0.00 0.00 41.12 40.30 1ofh n ASP 17 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ofh n GLY 18 N -0.39 2.26 3.68 6.12 0.00 -0.50 -4.52 105.19 111.84 1ofh n GLY 18 Ca 0.07 -1.20 -0.35 0.00 0.00 0.00 0.00 46.02 44.54 1ofh n GLY 18 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ofh s GLN 19 N -2.93 4.00 -0.26 1.61 0.74 -1.25 -2.51 119.66 119.06 1ofh s GLN 19 Ca 0.32 -0.29 0.01 0.00 0.05 0.00 0.00 55.36 55.45 1ofh s GLN 19 Cb 0.35 -3.28 0.05 0.00 1.10 0.00 0.00 33.01 31.23 1ofh s GLN 19 CO -0.06 0.32 -0.10 0.08 -0.55 0.00 0.00 175.29 174.99 1ofh s VAL 20 N 0.25 2.37 0.09 1.34 1.01 0.39 -4.72 120.40 121.13 1ofh s VAL 20 Ca 0.06 -1.46 0.05 0.00 0.00 0.00 0.00 61.98 60.63 1ofh s VAL 20 Cb -0.12 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 1ofh s VAL 20 CO -0.00 0.04 -0.01 -0.44 0.00 0.00 0.00 175.10 174.68 1ofh s SER 21 N 1.17 4.96 -0.56 3.32 0.01 -1.26 0.23 113.70 121.56 1ofh s SER 21 Ca -0.06 -0.20 0.04 0.00 1.31 0.00 0.00 55.95 57.04 1ofh s SER 21 Cb -0.19 -1.16 0.14 0.00 0.21 0.00 0.00 66.02 65.02 1ofh s SER 21 CO -0.05 0.18 0.32 -0.22 0.41 0.00 0.00 173.24 173.87 1ofh s LEU 22 N -2.30 4.38 0.00 2.44 2.96 -0.46 -4.90 118.68 120.80 1ofh s LEU 22 Ca 0.25 -3.22 0.00 0.00 -0.22 0.00 0.00 54.13 50.94 1ofh s LEU 22 Cb -0.12 -1.61 0.00 0.00 0.50 0.00 0.00 46.19 44.96 1ofh s LEU 22 CO 0.18 -0.19 0.00 0.61 -1.32 0.00 0.00 176.35 175.62 1ofh n GLY 23 N 2.82 1.62 0.56 7.98 0.00 -1.26 -3.44 105.19 113.47 1ofh n GLY 23 Ca 0.09 -0.53 0.07 0.00 0.00 0.00 0.00 46.02 45.66 1ofh n GLY 23 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ofh n ASN 24 N 7.07 2.88 -4.17 1.61 3.02 -1.26 -5.01 115.26 119.40 1ofh n ASN 24 Ca 0.00 -3.22 -0.22 0.00 -0.03 0.00 0.00 54.58 51.11 1ofh n ASN 24 Cb 0.00 -0.51 -0.14 0.00 -0.61 0.00 0.00 39.78 38.52 1ofh n ASN 24 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ofh s THR 25 N -2.94 1.30 0.10 3.41 -4.23 -1.22 -5.13 115.64 106.92 1ofh s THR 25 Ca 0.38 -1.01 -0.30 0.00 -1.18 0.00 0.00 61.69 59.58 1ofh s THR 25 Cb 0.33 -1.14 -0.06 0.00 1.34 0.00 0.00 72.50 72.97 1ofh s THR 25 CO 0.04 0.12 1.04 -0.69 -0.54 0.00 0.00 174.62 174.59 1ofh s VAL 26 N -0.76 4.34 -0.16 2.29 1.01 -1.26 -1.36 120.40 124.50 1ofh s VAL 26 Ca 0.04 1.84 0.06 0.00 0.00 0.00 0.00 61.98 63.93 1ofh s VAL 26 Cb -0.08 -4.18 -0.14 0.00 0.00 0.00 0.00 36.38 31.98 1ofh s VAL 26 CO 0.01 0.24 -0.07 0.80 0.00 0.00 0.00 175.10 176.08 1ofh n MET 27 N 3.12 1.02 -3.64 2.72 0.00 0.14 -4.90 117.12 115.57 1ofh n MET 27 Ca 0.04 0.05 -0.09 0.00 0.00 0.00 0.00 57.70 57.71 1ofh n MET 27 Cb 0.48 -1.35 -0.07 0.00 0.00 0.00 0.00 33.22 32.28 1ofh n MET 27 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 175.97 176.18 1ofh s LYS 28 N -2.34 0.73 -0.04 2.12 2.20 -0.81 -4.96 119.74 116.63 1ofh s LYS 28 Ca -0.16 1.13 0.17 0.00 -0.36 0.00 0.00 55.97 56.75 1ofh s LYS 28 Cb 0.05 0.21 -0.26 0.00 -1.51 0.00 0.00 37.83 36.33 1ofh s LYS 28 CO 0.48 -0.13 0.33 0.41 -0.36 0.00 0.00 175.35 176.08 1ofh n GLY 29 N 3.81 -0.78 3.24 5.54 0.00 -1.23 0.15 105.19 115.93 1ofh n GLY 29 Ca -0.18 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 1ofh n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ofh s ASN 30 N -4.08 6.63 0.07 1.61 4.22 -1.09 -3.92 114.94 118.37 1ofh s ASN 30 Ca -0.06 -3.45 0.08 0.00 -2.14 0.00 0.00 52.86 47.29 1ofh s ASN 30 Cb 0.10 -2.08 -0.03 0.00 1.28 0.00 0.00 41.25 40.52 1ofh s ASN 30 CO 0.70 -0.30 -0.22 0.00 -2.04 0.00 0.00 177.10 175.23 1ofh s ALA 31 N -0.99 1.93 -0.34 3.54 0.00 -1.05 -5.05 121.76 119.81 1ofh s ALA 31 Ca 0.27 -1.20 -0.15 0.00 0.00 0.00 0.00 51.96 50.88 1ofh s ALA 31 Cb -0.10 -0.34 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 1ofh s ALA 31 CO -0.09 0.43 0.34 1.03 0.00 0.00 0.00 175.76 177.47 1ofh s ARG 32 N -1.50 3.54 0.00 0.00 0.52 -1.26 -4.28 118.95 115.97 1ofh s ARG 32 Ca 0.09 -0.46 0.10 0.00 -0.52 0.00 0.00 55.73 54.93 1ofh s ARG 32 Cb -0.09 -3.81 0.16 0.00 0.52 0.00 0.00 34.95 31.73 1ofh s ARG 32 CO 0.03 -0.52 0.99 1.63 0.02 0.00 0.00 175.30 177.46 1ofh n LYS 33 N 5.34 1.49 -3.87 3.54 5.02 -1.26 -4.91 118.16 123.51 1ofh n LYS 33 Ca -0.10 -1.48 -0.27 0.00 -2.02 0.00 0.00 58.31 54.44 1ofh n LYS 33 Cb 0.49 -1.21 -0.17 0.00 -0.02 0.00 0.00 35.03 34.13 1ofh n LYS 33 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ofh s VAL 34 N -0.90 0.95 0.26 -0.18 1.01 -1.26 -1.10 120.40 119.18 1ofh s VAL 34 Ca 0.15 -0.39 0.11 0.00 0.00 0.00 0.00 61.98 61.85 1ofh s VAL 34 Cb 0.09 -1.08 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 1ofh s VAL 34 CO 0.13 0.22 -0.11 -0.13 0.00 0.00 0.00 175.10 175.21 1ofh s ARG 35 N 1.72 1.96 -0.20 2.72 0.52 0.54 -4.95 118.95 121.27 1ofh s ARG 35 Ca 0.03 -1.56 -0.15 0.00 -0.52 0.00 0.00 55.73 53.53 1ofh s ARG 35 Cb -0.14 -1.97 -0.04 0.00 0.52 0.00 0.00 34.95 33.32 1ofh s ARG 35 CO -0.08 0.36 0.35 1.03 0.02 0.00 0.00 175.30 176.98 1ofh s ARG 36 N -3.47 4.17 0.43 3.54 0.52 -1.26 -0.66 118.95 122.23 1ofh s ARG 36 Ca 0.30 0.12 0.04 0.00 -0.52 0.00 0.00 55.73 55.67 1ofh s ARG 36 Cb -0.06 -3.52 -0.05 0.00 0.52 0.00 0.00 34.95 31.84 1ofh s ARG 36 CO 0.17 0.02 0.02 -0.51 0.02 0.00 0.00 175.30 175.02 1ofh s LEU 37 N 1.13 2.54 -0.94 2.53 1.43 0.18 -4.64 118.68 120.90 1ofh s LEU 37 Ca 0.17 -1.49 -0.10 0.00 -1.03 0.00 0.00 54.13 51.68 1ofh s LEU 37 Cb -0.14 -0.73 0.01 0.00 0.03 0.00 0.00 46.19 45.36 1ofh s LEU 37 CO 0.07 -0.64 0.68 0.00 0.23 0.00 0.00 176.35 176.69 1ofh n TYR 38 N -1.03 -2.07 -3.80 0.29 4.19 -1.26 -0.57 117.16 112.91 1ofh n TYR 38 Ca -0.09 0.68 -0.28 0.00 3.31 0.00 0.00 57.90 61.51 1ofh n TYR 38 Cb 0.67 -3.16 0.02 0.00 0.49 0.00 0.00 39.34 37.36 1ofh n TYR 38 CO 0.00 0.00 0.00 -1.71 0.91 0.00 0.00 176.86 176.06 1ofh n ASN 39 N -2.41 -2.77 -2.15 2.98 2.85 -1.26 -1.05 115.26 111.44 1ofh n ASN 39 Ca -0.18 -1.00 -0.13 0.00 -0.11 0.00 0.00 54.58 53.17 1ofh n ASN 39 Cb 0.62 -3.29 -0.02 0.00 1.24 0.00 0.00 39.78 38.32 1ofh n ASN 39 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ofh n GLY 40 N -1.80 -0.05 0.01 8.20 0.00 -0.94 -4.79 105.19 105.81 1ofh n GLY 40 Ca -0.21 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.89 1ofh n GLY 40 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ofh n LYS 41 N -2.55 0.60 -3.74 1.61 4.76 -0.22 -4.89 118.16 113.74 1ofh n LYS 41 Ca -0.14 -0.13 -0.29 0.00 -2.87 0.00 0.00 58.31 54.88 1ofh n LYS 41 Cb 0.56 -1.35 -0.16 0.00 -1.84 0.00 0.00 35.03 32.25 1ofh n LYS 41 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1ofh s VAL 42 N -3.00 0.74 0.05 -0.18 1.01 0.27 -4.57 120.40 114.72 1ofh s VAL 42 Ca -0.05 -1.04 -0.26 0.00 0.00 0.00 0.00 61.98 60.63 1ofh s VAL 42 Cb 0.10 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 1ofh s VAL 42 CO 0.63 -0.47 0.82 -1.48 0.00 0.00 0.00 175.10 174.60 1ofh s LEU 43 N 1.72 4.45 0.11 3.92 2.34 -0.92 0.47 118.68 130.77 1ofh s LEU 43 Ca 0.05 1.53 0.04 0.00 0.06 0.00 0.00 54.13 55.81 1ofh s LEU 43 Cb -0.17 -3.33 -0.04 0.00 -0.56 0.00 0.00 46.19 42.09 1ofh s LEU 43 CO -0.18 -0.02 -0.11 0.00 -1.06 0.00 0.00 176.35 174.97 1ofh s ALA 44 N 0.04 1.25 0.01 1.48 0.00 0.16 -2.10 121.76 122.61 1ofh s ALA 44 Ca 0.41 -1.24 0.03 0.00 0.00 0.00 0.00 51.96 51.16 1ofh s ALA 44 Cb -0.21 -0.00 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 1ofh s ALA 44 CO 0.25 -0.00 -0.10 0.20 0.00 0.00 0.00 175.76 176.10 1ofh s GLY 45 N -2.50 0.54 0.24 0.00 0.00 -0.16 -0.33 107.32 105.10 1ofh s GLY 45 Ca 0.07 -0.54 0.09 0.00 0.00 0.00 0.00 44.72 44.34 1ofh s GLY 45 CO 0.01 -0.50 -0.15 -0.11 0.00 0.00 0.00 173.10 172.35 1ofh s PHE 46 N -0.49 1.97 -0.45 1.90 -0.71 -0.26 -1.52 117.98 118.42 1ofh s PHE 46 Ca 0.02 -0.50 0.04 0.00 -1.04 0.00 0.00 56.93 55.45 1ofh s PHE 46 Cb -0.05 -0.92 0.17 0.00 -1.21 0.00 0.00 43.02 41.01 1ofh s PHE 46 CO 0.00 0.49 0.36 0.00 -1.34 0.00 0.00 175.22 174.73 1ofh s ALA 47 N -2.80 1.70 0.00 1.99 0.00 -0.96 -4.88 121.76 116.82 1ofh s ALA 47 Ca 0.26 -2.63 0.00 0.00 0.00 0.00 0.00 51.96 49.59 1ofh s ALA 47 Cb -0.02 -1.66 0.00 0.00 0.00 0.00 0.00 23.12 21.44 1ofh s ALA 47 CO 0.11 -1.99 0.00 0.41 0.00 0.00 0.00 175.76 174.29 1ofh n GLY 48 N 2.73 -0.69 3.72 0.00 0.00 -1.26 -2.96 105.19 106.73 1ofh n GLY 48 Ca 0.29 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 1ofh n GLY 48 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ofh s GLY 49 N 0.00 2.19 0.25 -0.02 0.00 -1.26 -4.90 107.32 103.57 1ofh s GLY 49 Ca 0.00 1.11 -0.04 0.00 0.00 0.00 0.00 44.72 45.79 1ofh s GLY 49 CO 0.00 2.22 1.73 -0.91 0.00 0.00 0.00 173.10 176.15 1ofh h THR 50 N 4.04 0.66 -0.04 0.90 1.35 -1.98 0.28 112.91 118.12 1ofh h THR 50 Ca -0.43 -0.16 0.02 0.00 -0.55 0.00 0.00 66.41 65.29 1ofh h THR 50 Cb 1.21 0.16 -0.03 0.00 -1.73 0.00 0.00 68.15 67.76 1ofh h THR 50 CO 0.82 0.08 -0.09 0.00 -0.25 0.00 0.00 175.52 176.08 1ofh h ALA 51 N 1.55 -0.07 -0.74 6.62 0.00 -1.99 0.69 119.26 125.33 1ofh h ALA 51 Ca 0.42 0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.49 1ofh h ALA 51 Cb 0.64 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.51 1ofh h ALA 51 CO -0.40 -0.58 0.29 -0.44 0.00 0.00 0.00 179.25 178.12 1ofh h ASP 52 N -0.15 0.26 0.48 0.00 3.32 -1.49 -0.19 116.42 118.66 1ofh h ASP 52 Ca 0.05 0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.18 1ofh h ASP 52 Cb 0.21 0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1ofh h ASP 52 CO -0.12 0.10 -0.23 0.00 -1.72 0.00 0.00 179.24 177.27 1ofh h ALA 53 N 1.54 -0.65 -0.83 3.45 0.00 0.09 -2.76 119.26 120.10 1ofh h ALA 53 Ca 0.40 -0.19 0.19 0.00 0.00 0.00 0.00 54.91 55.32 1ofh h ALA 53 Cb 0.60 0.25 -0.12 0.00 0.00 0.00 0.00 17.79 18.53 1ofh h ALA 53 CO -0.40 -0.74 0.29 0.35 0.00 0.00 0.00 179.25 178.75 1ofh h PHE 54 N -0.90 0.46 -0.11 0.00 3.04 0.93 0.91 116.94 121.26 1ofh h PHE 54 Ca -0.07 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.93 1ofh h PHE 54 Cb 0.59 -0.07 -0.01 0.00 2.56 0.00 0.00 35.95 39.02 1ofh h PHE 54 CO 0.00 -0.07 0.07 1.15 -2.02 0.00 0.00 178.31 177.45 1ofh h THR 55 N 0.33 1.03 0.00 4.41 2.02 -0.98 -1.74 112.91 117.98 1ofh h THR 55 Ca 0.49 -0.05 -0.09 0.00 0.77 0.00 0.00 66.41 67.53 1ofh h THR 55 Cb 0.90 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 1ofh h THR 55 CO -0.53 0.03 -1.40 0.18 0.37 0.00 0.00 175.52 174.16 1ofh n LEU 56 N -4.52 0.68 -0.02 2.58 4.77 0.25 -3.48 117.00 117.25 1ofh n LEU 56 Ca -0.01 0.28 -0.17 0.00 -0.03 0.00 0.00 56.01 56.07 1ofh n LEU 56 Cb 0.08 0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.14 1ofh n LEU 56 CO 0.34 0.02 0.27 -0.26 -1.33 0.00 0.00 177.39 176.43 1ofh h PHE 57 N 0.00 1.05 -0.49 -1.77 -1.00 0.80 -2.01 116.94 113.51 1ofh h PHE 57 Ca -0.10 -0.47 -0.10 0.00 2.81 0.00 0.00 57.97 60.12 1ofh h PHE 57 Cb 1.31 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 40.69 1ofh h PHE 57 CO 0.00 1.30 -0.09 1.49 -1.61 0.00 0.00 178.31 179.39 1ofh h GLU 58 N 0.50 0.89 0.00 1.51 4.81 -1.50 -2.58 114.58 118.20 1ofh h GLU 58 Ca -0.05 -0.30 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 1ofh h GLU 58 Cb 1.39 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.70 1ofh h GLU 58 CO 0.16 0.94 0.00 1.25 -0.73 0.00 0.00 179.01 180.63 1ofh h LEU 59 N 0.80 0.00 0.00 1.64 5.85 -1.57 -2.25 115.31 119.78 1ofh h LEU 59 Ca 0.13 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.81 1ofh h LEU 59 Cb 0.61 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1ofh h LEU 59 CO 0.04 0.00 -0.52 0.15 -0.34 0.00 0.00 178.44 177.77 1ofh h PHE 60 N 0.00 0.00 -0.05 1.25 3.57 -0.98 -2.86 116.94 117.87 1ofh h PHE 60 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1ofh h PHE 60 Cb 0.59 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.33 1ofh h PHE 60 CO 0.00 0.20 -0.02 0.93 -2.23 0.00 0.00 178.31 177.20 1ofh h GLU 61 N 0.00 0.10 0.14 1.11 4.39 -1.14 -1.55 114.58 117.64 1ofh h GLU 61 Ca -0.02 -0.04 0.02 0.00 0.34 0.00 0.00 59.36 59.65 1ofh h GLU 61 Cb 1.17 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.79 1ofh h GLU 61 CO 0.02 0.46 -0.27 0.00 -1.16 0.00 0.00 179.01 178.06 1ofh h ARG 62 N -0.26 -0.48 0.00 2.33 3.08 -1.52 -2.01 114.38 115.52 1ofh h ARG 62 Ca 0.01 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 1ofh h ARG 62 Cb 0.43 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.58 1ofh h ARG 62 CO 0.01 -0.32 -0.06 0.87 -1.07 0.00 0.00 179.97 179.39 1ofh h LYS 63 N -0.50 0.00 0.00 0.04 1.79 -1.52 -0.75 116.57 115.64 1ofh h LYS 63 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1ofh h LYS 63 Cb 0.51 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.16 1ofh h LYS 63 CO -0.14 0.06 0.00 1.28 -1.08 0.00 0.00 179.45 179.57 1ofh n LEU 64 N -3.88 0.00 -0.12 2.94 4.77 -0.59 -3.27 117.00 116.85 1ofh n LEU 64 Ca -0.03 0.18 -0.21 0.00 -0.03 0.00 0.00 56.01 55.92 1ofh n LEU 64 Cb 0.15 -0.18 -0.12 0.00 -2.33 0.00 0.00 43.42 40.95 1ofh n LEU 64 CO 0.30 -0.02 -1.32 -0.62 -1.33 0.00 0.00 177.39 174.40 1ofh n GLU 65 N -1.18 0.64 -0.11 3.23 -0.58 -0.30 -2.74 120.64 119.60 1ofh n GLU 65 Ca 0.16 0.19 0.26 0.00 -0.42 0.00 0.00 57.16 57.35 1ofh n GLU 65 Cb 0.17 -1.53 0.71 0.00 -0.57 0.00 0.00 31.44 30.23 1ofh n GLU 65 CO 0.00 0.00 0.00 0.52 -0.48 0.00 0.00 177.13 177.17 1ofh h MET 66 N -0.26 0.00 -6.24 3.49 2.86 -1.50 -3.39 114.93 109.89 1ofh h MET 66 Ca -0.59 0.00 -0.59 0.00 -2.06 0.00 0.00 59.70 56.46 1ofh h MET 66 Cb 1.83 0.00 -0.24 0.00 0.06 0.00 0.00 31.60 33.25 1ofh h MET 66 CO -0.16 0.00 -0.84 -1.01 1.06 0.00 0.00 176.91 175.96 1ofh s HIS 67 N -4.97 1.88 -0.96 -0.22 3.76 -1.22 -5.06 115.29 108.50 1ofh s HIS 67 Ca -0.05 -0.40 -0.26 0.00 -0.15 0.00 0.00 55.06 54.21 1ofh s HIS 67 Cb 0.21 -1.07 -0.15 0.00 1.11 0.00 0.00 32.58 32.68 1ofh s HIS 67 CO 0.75 0.17 2.18 -0.65 -0.85 0.00 0.00 174.74 176.35 1ofh s GLN 68 N -1.61 1.67 0.00 1.40 -0.21 -1.26 -4.14 119.66 115.51 1ofh s GLN 68 Ca 0.08 -0.15 0.00 0.00 0.02 0.00 0.00 55.36 55.30 1ofh s GLN 68 Cb -0.10 -4.95 0.00 0.00 1.00 0.00 0.00 33.01 28.97 1ofh s GLN 68 CO 0.03 -4.65 0.00 0.41 -2.12 0.00 0.00 175.29 168.97 1ofh n GLY 69 N 6.46 -0.12 3.55 3.09 0.00 -1.11 -4.80 105.19 112.27 1ofh n GLY 69 Ca 0.44 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.05 1ofh n GLY 69 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ofh s HIS 70 N -1.13 2.29 0.22 1.61 3.76 -1.26 -4.89 115.29 115.90 1ofh s HIS 70 Ca 0.00 -0.17 -0.18 0.00 -0.15 0.00 0.00 55.06 54.56 1ofh s HIS 70 Cb 0.00 -4.60 0.21 0.00 1.11 0.00 0.00 32.58 29.29 1ofh s HIS 70 CO 0.00 -2.05 1.57 1.25 -0.85 0.00 0.00 174.74 174.66 1ofh h LEU 71 N 13.26 -1.25 -0.15 0.89 5.85 -1.96 -0.24 115.31 131.71 1ofh h LEU 71 Ca -0.16 0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1ofh h LEU 71 Cb 1.05 0.66 -0.01 0.00 0.37 0.00 0.00 40.66 42.72 1ofh h LEU 71 CO 1.31 -0.29 0.09 0.25 -0.34 0.00 0.00 178.44 179.46 1ofh h LEU 72 N -0.07 0.18 -0.27 2.25 5.85 -1.96 0.17 115.31 121.46 1ofh h LEU 72 Ca 0.31 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 59.02 1ofh h LEU 72 Cb 0.58 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1ofh h LEU 72 CO -0.85 0.18 0.04 0.11 -0.34 0.00 0.00 178.44 177.58 1ofh h LYS 73 N 0.17 0.13 -0.84 1.25 1.57 -1.74 0.13 116.57 117.24 1ofh h LYS 73 Ca 0.05 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1ofh h LYS 73 Cb 0.03 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1ofh h LYS 73 CO -0.01 0.09 0.44 0.77 -0.57 0.00 0.00 179.45 180.17 1ofh h SER 74 N 0.14 1.06 0.42 0.86 0.02 -0.88 -2.46 113.55 112.71 1ofh h SER 74 Ca 0.13 -0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1ofh h SER 74 Cb 0.14 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.41 1ofh h SER 74 CO -0.18 0.87 -0.20 0.00 -1.14 0.00 0.00 176.83 176.19 1ofh h ALA 75 N 1.24 -0.90 -1.33 3.77 0.00 0.01 -1.81 119.26 120.23 1ofh h ALA 75 Ca 0.29 -0.12 0.39 0.00 0.00 0.00 0.00 54.91 55.47 1ofh h ALA 75 Cb 0.06 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 17.99 1ofh h ALA 75 CO -0.04 -0.86 0.92 -0.39 0.00 0.00 0.00 179.25 178.88 1ofh h VAL 76 N -0.69 0.30 0.13 0.00 -1.51 -0.81 0.18 116.25 113.84 1ofh h VAL 76 Ca -0.06 -0.03 -0.01 0.00 -1.23 0.00 0.00 66.70 65.37 1ofh h VAL 76 Cb 0.43 0.20 0.00 0.00 -2.13 0.00 0.00 31.29 29.79 1ofh h VAL 76 CO 0.09 0.02 -0.06 -0.33 -1.23 0.00 0.00 177.57 176.06 1ofh h GLU 77 N 0.10 -0.16 -0.41 5.19 4.39 -1.33 -2.85 114.58 119.51 1ofh h GLU 77 Ca 0.69 0.01 0.08 0.00 0.34 0.00 0.00 59.36 60.49 1ofh h GLU 77 Cb 2.45 0.04 -0.09 0.00 -0.10 0.00 0.00 28.75 31.05 1ofh h GLU 77 CO -0.15 0.28 -0.27 1.25 -1.16 0.00 0.00 179.01 178.96 1ofh h LEU 78 N -0.69 -0.91 -2.36 1.33 5.85 0.24 0.92 115.31 119.68 1ofh h LEU 78 Ca -0.02 0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 1ofh h LEU 78 Cb 0.52 0.45 -0.00 0.00 0.37 0.00 0.00 40.66 42.00 1ofh h LEU 78 CO 0.03 -0.29 -0.04 0.00 -0.34 0.00 0.00 178.44 177.81 1ofh h ALA 79 N 0.94 1.35 0.00 1.25 0.00 -1.51 0.28 119.26 121.56 1ofh h ALA 79 Ca 0.19 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1ofh h ALA 79 Cb 0.50 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ofh h ALA 79 CO -0.52 0.05 -0.49 -0.22 0.00 0.00 0.00 179.25 178.06 1ofh h LYS 80 N 0.00 0.00 0.05 0.00 3.11 -0.57 -3.13 116.57 116.03 1ofh h LYS 80 Ca -0.00 0.00 -0.37 0.00 -2.81 0.00 0.00 60.65 57.47 1ofh h LYS 80 Cb 0.12 0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 31.30 1ofh h LYS 80 CO 0.00 0.49 -2.21 -0.25 -2.81 0.00 0.00 179.45 174.68 1ofh n ASP 81 N -3.61 1.75 -0.24 4.20 10.43 -0.25 -3.39 116.55 125.44 1ofh n ASP 81 Ca -0.00 0.06 0.19 0.00 2.57 0.00 0.00 54.79 57.60 1ofh n ASP 81 Cb 0.58 -0.42 0.51 0.00 1.84 0.00 0.00 41.12 43.62 1ofh n ASP 81 CO 0.00 0.00 0.00 -0.25 -1.07 0.00 0.00 177.20 175.88 1ofh h TRP 82 N 0.03 0.54 0.00 1.24 2.91 -0.59 1.43 115.95 121.51 1ofh h TRP 82 Ca -0.49 0.02 -0.23 0.00 1.13 0.00 0.00 58.89 59.32 1ofh h TRP 82 Cb 2.00 -0.17 -0.04 0.00 -0.51 0.00 0.00 29.16 30.44 1ofh h TRP 82 CO 0.04 0.15 -1.56 -2.13 -1.03 0.00 0.00 178.44 173.92 1ofh n ARG 83 N -4.51 0.63 -0.02 2.65 0.63 -1.18 -2.50 116.66 112.35 1ofh n ARG 83 Ca 0.19 0.26 -0.22 0.00 -0.92 0.00 0.00 57.85 57.16 1ofh n ARG 83 Cb 0.68 -1.80 -0.13 0.00 0.45 0.00 0.00 32.46 31.65 1ofh n ARG 83 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1ofh h THR 84 N 0.00 0.82 -2.70 5.15 1.35 -1.23 -3.46 112.91 112.84 1ofh h THR 84 Ca -0.22 -2.32 -0.56 0.00 -0.55 0.00 0.00 66.41 62.75 1ofh h THR 84 Cb 1.80 2.50 -0.02 0.00 -1.73 0.00 0.00 68.15 70.70 1ofh h THR 84 CO 0.06 0.70 1.11 -0.62 -0.25 0.00 0.00 175.52 176.52 1ofh s ASP 85 N -7.01 6.49 0.53 5.36 -1.08 0.48 -4.88 116.67 116.56 1ofh s ASP 85 Ca -0.23 1.84 0.22 0.00 -0.52 0.00 0.00 52.55 53.86 1ofh s ASP 85 Cb 0.06 -2.53 1.39 0.00 -1.46 0.00 0.00 42.92 40.37 1ofh s ASP 85 CO 0.73 -1.13 2.08 0.08 0.52 0.00 0.00 175.17 177.44 1ofh h ARG 86 N 10.29 0.00 0.00 4.34 0.11 -1.87 -1.29 114.38 125.96 1ofh h ARG 86 Ca -0.35 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.55 1ofh h ARG 86 Cb 1.16 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.22 1ofh h ARG 86 CO 0.98 0.00 -0.83 0.00 0.10 0.00 0.00 179.97 180.22 1ofh h ALA 87 N 1.85 0.63 0.01 0.08 0.00 -1.93 -3.30 119.26 116.60 1ofh h ALA 87 Ca 0.13 -0.75 -0.21 0.00 0.00 0.00 0.00 54.91 54.08 1ofh h ALA 87 Cb 0.52 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1ofh h ALA 87 CO -0.00 1.02 -0.92 -0.07 0.00 0.00 0.00 179.25 179.28 1ofh h LEU 88 N 0.01 0.27 0.00 0.00 4.07 -1.49 -3.02 115.31 115.16 1ofh h LEU 88 Ca -0.01 -0.23 0.00 0.00 0.08 0.00 0.00 57.88 57.72 1ofh h LEU 88 Cb 1.47 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 43.12 1ofh h LEU 88 CO 0.11 1.06 0.00 0.54 -1.08 0.00 0.00 178.44 179.07 1ofh n ARG 89 N -3.63 0.50 0.10 1.13 1.74 -1.01 -1.47 116.66 114.02 1ofh n ARG 89 Ca -0.04 0.01 -0.21 0.00 -0.77 0.00 0.00 57.85 56.85 1ofh n ARG 89 Cb 0.84 -1.50 -0.15 0.00 -1.02 0.00 0.00 32.46 30.63 1ofh n ARG 89 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1ofh h LYS 90 N 0.00 0.38 -6.33 5.56 1.79 -1.65 -3.43 116.57 112.89 1ofh h LYS 90 Ca 0.00 -0.65 -0.58 0.00 -2.18 0.00 0.00 60.65 57.24 1ofh h LYS 90 Cb 0.01 0.24 -0.08 0.00 -1.58 0.00 0.00 32.23 30.83 1ofh h LYS 90 CO 0.00 1.29 0.76 -0.51 -1.08 0.00 0.00 179.45 179.91 1ofh s LEU 91 N -7.28 3.88 -0.19 2.94 1.02 -0.54 -5.03 118.68 113.48 1ofh s LEU 91 Ca -0.09 0.64 -0.09 0.00 0.02 0.00 0.00 54.13 54.61 1ofh s LEU 91 Cb 0.06 -3.41 -0.04 0.00 0.02 0.00 0.00 46.19 42.81 1ofh s LEU 91 CO 0.89 -0.99 0.09 -1.61 0.02 0.00 0.00 176.35 174.75 1ofh s GLU 92 N 3.82 4.06 -0.01 1.70 2.02 -1.26 -4.90 118.70 124.14 1ofh s GLU 92 Ca 0.43 -0.28 -0.29 0.00 0.02 0.00 0.00 54.97 54.84 1ofh s GLU 92 Cb -0.10 -3.30 0.11 0.00 0.10 0.00 0.00 34.13 30.93 1ofh s GLU 92 CO 0.22 0.30 1.27 0.00 0.02 0.00 0.00 175.26 177.07 1ofh s ALA 93 N 0.33 -2.31 0.06 5.21 0.00 -1.26 -4.57 121.76 119.22 1ofh s ALA 93 Ca 0.06 0.33 0.09 0.00 0.00 0.00 0.00 51.96 52.44 1ofh s ALA 93 Cb -0.12 0.63 -0.03 0.00 0.00 0.00 0.00 23.12 23.60 1ofh s ALA 93 CO -0.01 -1.10 -0.24 -1.64 0.00 0.00 0.00 175.76 172.77 1ofh s MET 94 N -2.22 1.53 -0.01 0.00 -1.94 -1.15 -4.22 119.30 111.29 1ofh s MET 94 Ca 0.22 -1.08 0.03 0.00 -1.71 0.00 0.00 55.69 53.15 1ofh s MET 94 Cb 0.02 -1.74 -0.01 0.00 2.01 0.00 0.00 34.83 35.12 1ofh s MET 94 CO -0.02 0.44 -0.11 -0.51 -0.01 0.00 0.00 175.02 174.81 1ofh s LEU 95 N -1.38 2.00 -0.08 -0.03 1.43 -0.87 -2.26 118.68 117.49 1ofh s LEU 95 Ca 0.10 -0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.01 1ofh s LEU 95 Cb -0.10 -0.57 0.02 0.00 0.03 0.00 0.00 46.19 45.57 1ofh s LEU 95 CO 0.03 0.13 -0.11 -0.63 0.23 0.00 0.00 176.35 176.00 1ofh s ILE 96 N -0.22 1.12 0.01 -0.59 1.01 -0.57 -0.53 121.20 121.43 1ofh s ILE 96 Ca 0.04 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.30 1ofh s ILE 96 Cb -0.05 -1.06 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 1ofh s ILE 96 CO -0.00 0.36 -0.13 0.68 0.00 0.00 0.00 174.94 175.85 1ofh s VAL 97 N 0.98 1.01 0.04 2.92 -7.23 -0.23 -0.99 120.40 116.91 1ofh s VAL 97 Ca -0.08 -0.70 -0.09 0.00 -1.81 0.00 0.00 61.98 59.29 1ofh s VAL 97 Cb -0.15 -0.88 0.00 0.00 0.56 0.00 0.00 36.38 35.92 1ofh s VAL 97 CO -0.00 0.17 0.19 0.00 -0.31 0.00 0.00 175.10 175.15 1ofh s ALA 98 N -0.50 -0.35 0.00 1.32 0.00 -0.89 -0.23 121.76 121.11 1ofh s ALA 98 Ca 0.03 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.68 1ofh s ALA 98 Cb -0.06 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.36 1ofh s ALA 98 CO 0.00 -0.38 0.00 -0.40 0.00 0.00 0.00 175.76 174.99 1ofh n ASP 99 N 0.61 0.00 0.00 0.00 5.68 -1.22 -2.16 116.55 119.46 1ofh n ASP 99 Ca -0.18 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.11 1ofh n ASP 99 Cb 0.59 0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.72 1ofh n ASP 99 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1ofh n GLU 100 N -2.43 0.17 0.00 0.11 4.07 -1.26 -4.92 120.64 116.38 1ofh n GLU 100 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1ofh n GLU 100 Cb 0.00 -0.01 0.00 0.00 -0.06 0.00 0.00 31.44 31.37 1ofh n GLU 100 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1ofh n LYS 101 N 0.00 1.21 -3.53 5.31 4.81 -1.26 -5.06 118.16 119.64 1ofh n LYS 101 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.35 1ofh n LYS 101 Cb 0.00 -0.92 -0.02 0.00 0.02 0.00 0.00 35.03 34.11 1ofh n LYS 101 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 1ofh s GLU 102 N -1.69 1.20 0.13 1.64 -1.05 -1.26 -5.17 118.70 112.49 1ofh s GLU 102 Ca 0.00 -0.50 0.10 0.00 -0.15 0.00 0.00 54.97 54.42 1ofh s GLU 102 Cb 0.00 0.51 -0.04 0.00 -0.44 0.00 0.00 34.13 34.16 1ofh s GLU 102 CO 0.00 -0.53 -0.25 -1.12 0.95 0.00 0.00 175.26 174.31 1ofh s SER 103 N -2.71 3.12 0.22 0.83 0.01 -1.26 -3.40 113.70 110.51 1ofh s SER 103 Ca 0.05 -0.74 -0.10 0.00 1.31 0.00 0.00 55.95 56.47 1ofh s SER 103 Cb -0.02 -0.20 -0.01 0.00 0.21 0.00 0.00 66.02 66.00 1ofh s SER 103 CO -0.08 0.15 0.37 -0.76 0.41 0.00 0.00 173.24 173.33 1ofh s LEU 104 N -2.04 0.61 -0.06 2.44 1.43 0.68 -4.20 118.68 117.55 1ofh s LEU 104 Ca 0.12 -0.98 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 1ofh s LEU 104 Cb -0.10 1.40 0.02 0.00 0.03 0.00 0.00 46.19 47.54 1ofh s LEU 104 CO 0.06 -1.02 -0.03 -0.63 0.23 0.00 0.00 176.35 174.95 1ofh s ILE 105 N -4.02 0.50 -0.18 -0.59 1.01 -1.06 -1.07 121.20 115.78 1ofh s ILE 105 Ca 0.24 -0.04 -0.04 0.00 0.00 0.00 0.00 60.65 60.80 1ofh s ILE 105 Cb 0.02 -0.57 -0.02 0.00 0.01 0.00 0.00 42.46 41.89 1ofh s ILE 105 CO 0.07 0.24 -0.02 -0.63 0.00 0.00 0.00 174.94 174.60 1ofh s ILE 106 N 1.31 3.85 0.06 2.92 1.09 0.31 -2.17 121.20 128.57 1ofh s ILE 106 Ca -0.05 -0.36 0.07 0.00 -1.10 0.00 0.00 60.65 59.21 1ofh s ILE 106 Cb -0.13 -2.72 -0.03 0.00 -1.06 0.00 0.00 42.46 38.51 1ofh s ILE 106 CO -0.02 0.45 -0.17 0.42 -0.10 0.00 0.00 174.94 175.52 1ofh s THR 107 N 0.79 2.89 -2.00 2.92 -4.23 -1.26 -2.05 115.64 112.70 1ofh s THR 107 Ca -0.01 -1.22 0.11 0.00 -1.18 0.00 0.00 61.69 59.39 1ofh s THR 107 Cb -0.14 -2.25 0.32 0.00 1.34 0.00 0.00 72.50 71.77 1ofh s THR 107 CO 0.02 0.28 1.24 0.61 -0.54 0.00 0.00 174.62 176.23 1ofh n GLY 108 N 1.35 -0.74 0.00 3.99 0.00 -1.26 -4.36 105.19 104.17 1ofh n GLY 108 Ca -0.16 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1ofh n GLY 108 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ofh n ILE 109 N -0.74 0.00 0.00 -0.61 -5.35 -1.26 -4.54 119.36 106.85 1ofh n ILE 109 Ca 0.09 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.57 1ofh n ILE 109 Cb 0.04 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 37.94 1ofh n ILE 109 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ofh n GLY 110 N 4.52 -0.22 0.00 3.28 0.00 -1.26 -4.92 105.19 106.59 1ofh n GLY 110 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ofh n GLY 110 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ofh n ASP 111 N 0.00 0.00 -1.10 1.61 -0.08 -1.26 -4.96 116.55 110.76 1ofh n ASP 111 Ca 0.00 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.17 1ofh n ASP 111 Cb 0.00 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 43.46 1ofh n ASP 111 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1ofh n VAL 112 N -0.98 0.24 -3.73 5.18 0.31 -1.25 -4.63 118.33 113.47 1ofh n VAL 112 Ca 0.00 -0.13 -0.15 0.00 -0.01 0.00 0.00 64.34 64.06 1ofh n VAL 112 Cb 0.00 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 32.78 1ofh n VAL 112 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1ofh s VAL 113 N -0.39 -0.09 0.09 2.52 1.01 -0.92 -4.96 120.40 117.66 1ofh s VAL 113 Ca 0.15 0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.37 1ofh s VAL 113 Cb -0.18 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 1ofh s VAL 113 CO 0.16 0.09 0.20 -1.10 0.00 0.00 0.00 175.10 174.45 1ofh s GLN 114 N 1.39 3.31 1.06 2.72 -0.21 -1.26 -2.57 119.66 124.09 1ofh s GLN 114 Ca -0.07 -0.55 -0.12 0.00 0.02 0.00 0.00 55.36 54.65 1ofh s GLN 114 Cb -0.12 -2.95 0.22 0.00 1.00 0.00 0.00 33.01 31.17 1ofh s GLN 114 CO -0.05 0.57 1.07 -2.14 -2.12 0.00 0.00 175.29 172.62 1ofh s PRO 115 N -2.70 -0.04 0.00 2.91 0.02 -1.26 -5.06 135.00 128.88 1ofh s PRO 115 Ca 0.34 0.74 0.00 0.00 0.02 0.00 0.00 61.00 62.10 1ofh s PRO 115 Cb -0.12 -1.66 0.00 0.00 0.02 0.00 0.00 34.50 32.73 1ofh s PRO 115 CO 0.27 -3.11 0.00 0.39 -0.33 0.00 0.00 177.00 174.22 1ofh n GLU 116 N -4.47 0.92 0.00 5.54 4.71 -1.26 -4.84 120.64 121.23 1ofh n GLU 116 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.20 1ofh n GLU 116 Cb 0.55 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.98 1ofh n GLU 116 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1ofh n GLU 117 N -0.71 0.39 -0.03 3.49 4.71 -1.26 -1.86 120.64 125.37 1ofh n GLU 117 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.16 57.20 1ofh n GLU 117 Cb 0.00 -1.02 -0.15 0.00 -1.01 0.00 0.00 31.44 29.26 1ofh n GLU 117 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 1ofh n ASP 118 N -0.42 0.42 -3.07 1.62 5.68 -1.26 -5.04 116.55 114.48 1ofh n ASP 118 Ca 0.00 0.00 -0.14 0.00 -0.50 0.00 0.00 54.79 54.15 1ofh n ASP 118 Cb 0.01 1.66 0.07 0.00 -1.14 0.00 0.00 41.12 41.71 1ofh n ASP 118 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ofh n GLN 119 N -2.33 -2.72 -3.83 0.11 1.13 -0.78 -4.72 117.38 104.24 1ofh n GLN 119 Ca -0.11 0.77 -0.13 0.00 -1.94 0.00 0.00 57.00 55.59 1ofh n GLN 119 Cb 0.68 -5.38 -0.14 0.00 0.11 0.00 0.00 30.24 25.51 1ofh n GLN 119 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1ofh s ILE 120 N -3.34 -0.01 0.01 5.09 1.01 -1.26 -1.56 121.20 121.14 1ofh s ILE 120 Ca 0.33 0.05 -0.02 0.00 0.00 0.00 0.00 60.65 61.01 1ofh s ILE 120 Cb -0.04 -0.11 -0.01 0.00 0.01 0.00 0.00 42.46 42.30 1ofh s ILE 120 CO 0.66 0.02 0.03 -0.76 0.00 0.00 0.00 174.94 174.88 1ofh s LEU 121 N 0.29 1.99 -0.12 2.97 1.43 -0.17 -4.67 118.68 120.40 1ofh s LEU 121 Ca -0.02 -0.31 -0.14 0.00 -1.03 0.00 0.00 54.13 52.63 1ofh s LEU 121 Cb -0.03 0.25 0.04 0.00 0.03 0.00 0.00 46.19 46.47 1ofh s LEU 121 CO -0.01 -0.26 0.38 0.00 0.23 0.00 0.00 176.35 176.69 1ofh s ALA 122 N -1.15 -0.95 0.24 4.21 0.00 -1.26 0.60 121.76 123.44 1ofh s ALA 122 Ca -0.12 0.97 0.01 0.00 0.00 0.00 0.00 51.96 52.81 1ofh s ALA 122 Cb -0.07 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 1ofh s ALA 122 CO -0.00 -0.20 0.12 0.96 0.00 0.00 0.00 175.76 176.64 1ofh s ILE 123 N -0.11 0.24 0.00 0.00 -4.36 0.23 -4.77 121.20 112.43 1ofh s ILE 123 Ca -0.03 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.36 1ofh s ILE 123 Cb -0.03 -2.55 0.00 0.00 1.25 0.00 0.00 42.46 41.12 1ofh s ILE 123 CO 0.01 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.80 1ofh n GLY 124 N -0.39 1.08 0.46 6.27 0.00 -1.26 -1.74 105.19 109.61 1ofh n GLY 124 Ca 0.01 -1.73 0.33 0.00 0.00 0.00 0.00 46.02 44.63 1ofh n GLY 124 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ofh h SER 125 N 0.00 0.29 -0.02 1.61 4.64 -1.77 0.90 113.55 119.20 1ofh h SER 125 Ca 0.00 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1ofh h SER 125 Cb 0.00 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1ofh h SER 125 CO 0.00 -0.08 -0.02 0.61 -0.87 0.00 0.00 176.83 176.47 1ofh n GLY 126 N -1.53 0.49 0.43 -0.77 0.00 -0.91 -4.59 105.19 98.31 1ofh n GLY 126 Ca 0.33 -0.57 -0.11 0.00 0.00 0.00 0.00 46.02 45.66 1ofh n GLY 126 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ofh h GLY 127 N 4.78 -0.76 1.62 -0.02 0.00 0.81 -0.29 103.07 109.20 1ofh h GLY 127 Ca 0.00 0.68 0.03 0.00 0.00 0.00 0.00 47.33 48.04 1ofh h GLY 127 CO 0.00 -0.10 0.16 3.43 0.00 0.00 0.00 176.54 180.03 1ofh h ASN 128 N -0.26 0.00 0.04 0.19 2.35 -1.81 0.25 115.58 116.34 1ofh h ASN 128 Ca 0.13 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.76 1ofh h ASN 128 Cb 0.55 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.93 1ofh h ASN 128 CO -0.70 0.00 -0.50 1.88 -1.65 0.00 0.00 177.43 176.45 1ofh h TYR 129 N 0.00 0.44 -0.76 1.19 0.05 -1.38 -2.34 116.97 114.15 1ofh h TYR 129 Ca 0.04 -0.26 -0.04 0.00 0.05 0.00 0.00 58.73 58.52 1ofh h TYR 129 Cb 0.37 -0.04 -0.03 0.00 1.01 0.00 0.00 36.73 38.04 1ofh h TYR 129 CO 0.00 1.12 0.31 0.00 -1.05 0.00 0.00 178.16 178.54 1ofh h ALA 130 N 0.21 1.11 -0.30 3.88 0.00 -0.71 -1.94 119.26 121.51 1ofh h ALA 130 Ca -0.07 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.68 1ofh h ALA 130 Cb 1.28 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 1ofh h ALA 130 CO 0.10 0.64 0.12 1.25 0.00 0.00 0.00 179.25 181.36 1ofh h LEU 131 N 1.11 0.15 -0.76 0.00 5.85 -0.60 -0.48 115.31 120.58 1ofh h LEU 131 Ca 0.26 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 59.00 1ofh h LEU 131 Cb 0.20 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 1ofh h LEU 131 CO -0.02 0.12 0.46 0.28 -0.34 0.00 0.00 178.44 178.94 1ofh h SER 132 N 0.26 0.91 0.26 1.25 0.02 -1.00 -0.14 113.55 115.11 1ofh h SER 132 Ca 0.13 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 1ofh h SER 132 Cb 0.08 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1ofh h SER 132 CO -0.12 0.70 -0.12 0.00 -1.14 0.00 0.00 176.83 176.15 1ofh h ALA 133 N 1.24 -0.35 0.32 3.77 0.00 -1.02 -2.92 119.26 120.31 1ofh h ALA 133 Ca 0.27 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1ofh h ALA 133 Cb -0.04 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1ofh h ALA 133 CO -0.05 -0.60 -0.41 0.00 0.00 0.00 0.00 179.25 178.18 1ofh h ALA 134 N 0.16 -1.03 -1.39 0.00 0.00 -0.90 -0.48 119.26 115.62 1ofh h ALA 134 Ca -0.04 -0.14 0.41 0.00 0.00 0.00 0.00 54.91 55.14 1ofh h ALA 134 Cb 0.39 0.69 -0.07 0.00 0.00 0.00 0.00 17.79 18.80 1ofh h ALA 134 CO 0.06 -1.08 0.99 0.00 0.00 0.00 0.00 179.25 179.22 1ofh h ARG 135 N -0.76 0.04 0.09 0.00 3.08 -1.09 0.40 114.38 116.13 1ofh h ARG 135 Ca -0.04 -0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.89 1ofh h ARG 135 Cb 0.68 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.73 1ofh h ARG 135 CO -0.10 0.02 -0.52 0.00 -1.07 0.00 0.00 179.97 178.30 1ofh h ALA 136 N 1.34 -0.06 -0.91 0.04 0.00 -1.18 -3.19 119.26 115.30 1ofh h ALA 136 Ca 0.69 -0.62 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ofh h ALA 136 Cb 2.63 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 20.43 1ofh h ALA 136 CO -0.06 0.24 0.57 -0.07 0.00 0.00 0.00 179.25 179.92 1ofh h LEU 137 N -0.58 1.07 -0.23 0.00 3.38 0.13 -2.16 115.31 116.91 1ofh h LEU 137 Ca -0.09 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1ofh h LEU 137 Cb 1.41 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1ofh h LEU 137 CO 0.10 0.80 0.00 1.62 0.09 0.00 0.00 178.44 181.05 1ofh h VAL 138 N 1.24 0.00 -0.02 1.22 3.04 -0.88 -1.15 116.25 119.71 1ofh h VAL 138 Ca 0.33 -0.49 0.00 0.00 -1.01 0.00 0.00 66.70 65.53 1ofh h VAL 138 Cb -0.09 1.43 0.00 0.00 -2.01 0.00 0.00 31.29 30.62 1ofh h VAL 138 CO -0.06 0.00 -0.23 -0.62 -1.01 0.00 0.00 177.57 175.65 1ofh n GLU 139 N -2.40 1.58 0.00 4.17 1.02 -0.93 -4.56 120.64 119.51 1ofh n GLU 139 Ca 0.04 -1.12 0.00 0.00 -0.02 0.00 0.00 57.16 56.06 1ofh n GLU 139 Cb 0.39 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 30.49 1ofh n GLU 139 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1ofh n ASN 140 N 0.32 0.07 -4.40 1.62 3.02 -0.86 -5.08 115.26 109.96 1ofh n ASN 140 Ca 0.08 -0.49 -0.21 0.00 -0.03 0.00 0.00 54.58 53.94 1ofh n ASN 140 Cb 0.40 0.09 -0.10 0.00 -0.61 0.00 0.00 39.78 39.55 1ofh n ASN 140 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ofh s THR 141 N -0.09 1.01 -1.11 3.41 2.01 -0.44 -5.04 115.64 115.39 1ofh s THR 141 Ca 0.00 -2.00 0.11 0.00 0.31 0.00 0.00 61.69 60.11 1ofh s THR 141 Cb 0.00 -2.73 0.24 0.00 0.01 0.00 0.00 72.50 70.02 1ofh s THR 141 CO 0.00 0.00 1.13 -0.62 -0.69 0.00 0.00 174.62 174.44 1ofh n GLU 142 N -0.65 2.13 -1.60 4.92 -0.58 -1.26 -4.75 120.64 118.86 1ofh n GLU 142 Ca -0.02 -1.78 -0.39 0.00 -0.42 0.00 0.00 57.16 54.54 1ofh n GLU 142 Cb 0.66 -1.26 0.03 0.00 -0.57 0.00 0.00 31.44 30.31 1ofh n GLU 142 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1ofh n LEU 143 N 0.58 2.99 -4.71 -4.62 4.77 -1.26 -4.94 117.00 109.81 1ofh n LEU 143 Ca 0.10 0.90 -0.33 0.00 -0.03 0.00 0.00 56.01 56.65 1ofh n LEU 143 Cb 0.39 -1.36 0.12 0.00 -2.33 0.00 0.00 43.42 40.24 1ofh n LEU 143 CO 0.08 -1.79 0.75 -0.94 -1.33 0.00 0.00 177.39 174.16 1ofh s SER 144 N -1.01 3.73 0.65 -1.43 1.04 -1.26 -4.76 113.70 110.65 1ofh s SER 144 Ca 0.69 2.27 0.42 0.00 0.48 0.00 0.00 55.95 59.81 1ofh s SER 144 Cb -0.47 -2.58 2.24 0.00 0.10 0.00 0.00 66.02 65.31 1ofh s SER 144 CO 0.52 -2.57 2.31 0.00 0.98 0.00 0.00 173.24 174.48 1ofh h ALA 145 N -0.94 1.03 0.06 5.32 0.00 -1.91 -0.51 119.26 122.31 1ofh h ALA 145 Ca -0.46 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.13 1ofh h ALA 145 Cb 1.28 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1ofh h ALA 145 CO 0.47 0.00 -1.80 1.25 0.00 0.00 0.00 179.25 179.17 1ofh h HIS 146 N 0.00 0.23 0.00 0.00 -0.00 -1.90 -3.12 115.15 110.36 1ofh h HIS 146 Ca -0.00 -0.17 -0.01 0.00 -0.00 0.00 0.00 60.37 60.19 1ofh h HIS 146 Cb 0.09 -0.01 -0.00 0.00 -0.00 0.00 0.00 27.41 27.49 1ofh h HIS 146 CO 0.00 1.35 -0.05 0.93 -0.00 0.00 0.00 177.93 180.16 1ofh h GLU 147 N 0.04 0.00 0.09 5.26 5.08 -1.63 -2.40 114.58 121.02 1ofh h GLU 147 Ca -0.33 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.02 1ofh h GLU 147 Cb 2.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.27 1ofh h GLU 147 CO 0.09 0.05 -0.04 0.82 -1.00 0.00 0.00 179.01 178.93 1ofh h ILE 148 N 0.00 0.32 -0.74 3.13 2.04 -1.25 -2.95 117.51 118.06 1ofh h ILE 148 Ca -0.00 -1.12 0.16 0.00 1.00 0.00 0.00 64.86 64.90 1ofh h ILE 148 Cb 0.77 0.58 -0.11 0.00 -0.74 0.00 0.00 36.82 37.33 1ofh h ILE 148 CO 0.01 0.10 0.21 0.58 0.00 0.00 0.00 178.15 179.05 1ofh h VAL 149 N -1.01 0.55 -0.32 1.67 2.07 -1.61 0.22 116.25 117.82 1ofh h VAL 149 Ca -0.01 -0.11 0.04 0.00 0.82 0.00 0.00 66.70 67.44 1ofh h VAL 149 Cb 0.26 0.21 -0.06 0.00 -1.52 0.00 0.00 31.29 30.17 1ofh h VAL 149 CO 0.02 0.06 -0.45 -0.08 0.02 0.00 0.00 177.57 177.14 1ofh h GLU 150 N 0.31 -0.32 -0.30 1.57 4.57 -1.51 -2.00 114.58 116.90 1ofh h GLU 150 Ca 0.42 0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.62 1ofh h GLU 150 Cb 0.70 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.35 1ofh h GLU 150 CO -0.48 -0.21 0.17 0.87 -1.18 0.00 0.00 179.01 178.18 1ofh h LYS 151 N -0.33 0.41 -0.92 1.92 1.57 -1.06 -2.96 116.57 115.19 1ofh h LYS 151 Ca 0.06 -0.04 0.16 0.00 -1.87 0.00 0.00 60.65 58.96 1ofh h LYS 151 Cb 0.48 -0.08 -0.08 0.00 0.08 0.00 0.00 32.23 32.63 1ofh h LYS 151 CO -0.47 0.34 0.59 0.77 -0.57 0.00 0.00 179.45 180.10 1ofh h SER 152 N 0.38 0.65 -0.53 0.86 0.02 -0.67 -0.37 113.55 113.89 1ofh h SER 152 Ca 0.11 0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 61.02 1ofh h SER 152 Cb 0.03 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1ofh h SER 152 CO -0.02 0.30 -0.02 -0.07 -1.14 0.00 0.00 176.83 175.88 1ofh h LEU 153 N 0.67 0.93 -0.04 5.07 3.38 -1.20 -1.50 115.31 122.62 1ofh h LEU 153 Ca 0.48 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 58.14 1ofh h LEU 153 Cb 0.83 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1ofh h LEU 153 CO -0.24 1.02 -0.00 -0.09 0.09 0.00 0.00 178.44 179.22 1ofh h ARG 154 N 0.82 0.01 0.02 1.13 9.65 -1.06 0.11 114.38 125.06 1ofh h ARG 154 Ca 0.15 -0.00 0.01 0.00 -1.10 0.00 0.00 59.98 59.04 1ofh h ARG 154 Cb 0.55 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.12 1ofh h ARG 154 CO 0.03 0.01 -0.06 0.82 2.80 0.00 0.00 179.97 183.56 1ofh h ILE 155 N 0.01 0.84 0.34 1.20 2.04 -1.12 -2.01 117.51 118.81 1ofh h ILE 155 Ca 0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 1ofh h ILE 155 Cb 0.02 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1ofh h ILE 155 CO -0.03 0.00 -0.16 0.00 0.00 0.00 0.00 178.15 177.95 1ofh h ALA 156 N 0.85 -0.45 -0.60 1.87 0.00 -1.17 -2.62 119.26 117.15 1ofh h ALA 156 Ca 0.02 -0.12 0.17 0.00 0.00 0.00 0.00 54.91 54.98 1ofh h ALA 156 Cb 0.14 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1ofh h ALA 156 CO -0.05 -0.72 0.54 0.78 0.00 0.00 0.00 179.25 179.79 1ofh h GLY 157 N -0.51 0.00 1.91 0.00 0.00 -0.70 0.21 103.07 103.98 1ofh h GLY 157 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1ofh h GLY 157 CO 0.08 0.00 -0.08 -0.55 0.00 0.00 0.00 176.54 175.99 1ofh h ASP 158 N 0.00 0.00 0.00 0.19 3.45 -0.97 -3.35 116.42 115.73 1ofh h ASP 158 Ca 0.28 -0.01 -0.37 0.00 0.43 0.00 0.00 57.03 57.36 1ofh h ASP 158 Cb 1.35 0.00 -0.07 0.00 -0.56 0.00 0.00 39.33 40.06 1ofh h ASP 158 CO -0.00 0.01 -2.39 -0.38 -1.57 0.00 0.00 179.24 174.90 1ofh n ILE 159 N -2.68 1.40 -2.91 0.35 5.41 0.53 -4.94 119.36 116.51 1ofh n ILE 159 Ca 0.04 -0.52 -0.41 0.00 1.00 0.00 0.00 62.75 62.87 1ofh n ILE 159 Cb 0.49 -1.40 -0.04 0.00 -0.71 0.00 0.00 39.64 37.97 1ofh n ILE 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ofh n VAL 161 N 3.61 0.00 -0.20 0.00 0.24 -1.26 -3.24 118.33 117.48 1ofh n VAL 161 Ca 0.01 -0.07 0.06 0.00 -2.04 0.00 0.00 64.34 62.30 1ofh n VAL 161 Cb 0.51 -0.20 0.17 0.00 -1.47 0.00 0.00 33.84 32.85 1ofh n VAL 161 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1ofh n PHE 162 N -0.70 0.52 -4.63 6.34 0.99 -1.26 -4.96 117.46 113.76 1ofh n PHE 162 Ca 0.21 -0.50 -0.23 0.00 -0.00 0.00 0.00 57.45 56.94 1ofh n PHE 162 Cb 0.19 -0.02 -0.15 0.00 -1.00 0.00 0.00 39.48 38.50 1ofh n PHE 162 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 1ofh s THR 163 N -1.00 1.18 0.00 4.37 2.01 -1.20 -2.08 115.64 118.92 1ofh s THR 163 Ca 0.26 -0.72 0.00 0.00 0.31 0.00 0.00 61.69 61.54 1ofh s THR 163 Cb 0.14 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.64 1ofh s THR 163 CO 0.18 0.27 0.00 -0.46 -0.69 0.00 0.00 174.62 173.92 1ofh n ASN 164 N 2.54 0.31 -0.07 3.53 0.23 -1.26 -4.72 115.26 115.81 1ofh n ASN 164 Ca -0.15 0.00 0.03 0.00 -0.53 0.00 0.00 54.58 53.93 1ofh n ASN 164 Cb 0.55 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 38.23 1ofh n ASN 164 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1ofh n THR 165 N 0.00 0.00 -2.48 5.53 -2.24 -1.26 -4.57 114.28 109.26 1ofh n THR 165 Ca 0.00 -0.39 -0.41 0.00 -2.27 0.00 0.00 64.05 60.98 1ofh n THR 165 Cb 0.00 1.04 -0.03 0.00 -2.10 0.00 0.00 70.33 69.24 1ofh n THR 165 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1ofh s ASN 166 N -1.34 6.10 0.11 3.42 0.02 -1.26 -4.96 114.94 117.03 1ofh s ASN 166 Ca 0.04 -0.21 -0.08 0.00 -1.02 0.00 0.00 52.86 51.59 1ofh s ASN 166 Cb 0.05 -2.55 -0.06 0.00 0.02 0.00 0.00 41.25 38.71 1ofh s ASN 166 CO 0.21 -1.84 0.41 -0.36 0.02 0.00 0.00 177.10 175.55 1ofh s PHE 167 N 6.04 3.54 -0.66 2.20 2.99 -1.26 -1.42 117.98 129.41 1ofh s PHE 167 Ca 0.41 0.73 0.05 0.00 0.00 0.00 0.00 56.93 58.13 1ofh s PHE 167 Cb -0.09 -2.13 0.18 0.00 0.00 0.00 0.00 43.02 40.98 1ofh s PHE 167 CO 0.18 0.47 0.49 2.41 -0.00 0.00 0.00 175.22 178.77 1ofh n THR 168 N 0.58 1.25 -2.83 0.64 -1.04 -0.21 -4.95 114.28 107.73 1ofh n THR 168 Ca -0.06 -4.68 -0.42 0.00 -2.04 0.00 0.00 64.05 56.86 1ofh n THR 168 Cb 0.52 -2.10 -0.04 0.00 -1.82 0.00 0.00 70.33 66.89 1ofh n THR 168 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1ofh s ILE 169 N -1.31 4.85 -0.30 12.58 1.01 -1.26 -3.46 121.20 133.31 1ofh s ILE 169 Ca 0.27 1.76 0.00 0.00 0.00 0.00 0.00 60.65 62.68 1ofh s ILE 169 Cb -0.02 -4.19 0.06 0.00 0.01 0.00 0.00 42.46 38.32 1ofh s ILE 169 CO -0.17 0.02 -0.02 -1.61 0.00 0.00 0.00 174.94 173.17 1ofh s GLU 170 N 2.09 2.26 0.38 2.79 0.41 0.56 -4.97 118.70 122.22 1ofh s GLU 170 Ca 0.41 -1.38 -0.04 0.00 -0.41 0.00 0.00 54.97 53.56 1ofh s GLU 170 Cb -0.17 -3.11 0.08 0.00 -1.78 0.00 0.00 34.13 29.15 1ofh s GLU 170 CO 0.14 -0.66 0.52 -1.91 -0.49 0.00 0.00 175.26 172.86 1ofh n GLU 171 N 4.53 -0.13 -3.65 1.61 2.13 -1.26 -1.94 120.64 121.92 1ofh n GLU 171 Ca -0.11 -1.09 0.02 0.00 0.66 0.00 0.00 57.16 56.64 1ofh n GLU 171 Cb 0.43 -0.45 -0.06 0.00 0.27 0.00 0.00 31.44 31.62 1ofh n GLU 171 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1ofh s LEU 172 N 0.00 -0.07 -0.02 4.31 0.20 -1.14 -4.79 118.68 117.17 1ofh s LEU 172 Ca 0.32 0.11 -0.26 0.00 0.69 0.00 0.00 54.13 54.99 1ofh s LEU 172 Cb -0.01 1.10 -0.20 0.00 -0.43 0.00 0.00 46.19 46.64 1ofh s LEU 172 CO 0.22 -0.02 1.25 1.55 -0.29 0.00 0.00 176.35 179.06 1ofh h PRO 173 N 4.95 0.01 0.00 0.98 0.13 -1.88 -3.08 132.00 133.11 1ofh h PRO 173 Ca -0.26 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1ofh h PRO 173 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1ofh h PRO 173 CO 0.23 0.52 0.00 0.27 -0.23 0.00 0.00 178.00 178.79