#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h3h n ARG 17 N 0.00 2.43 -2.30 1.61 5.12 -1.26 -5.05 116.66 117.21 1h3h n ARG 17 Ca 0.00 -3.74 -0.43 0.00 -1.93 0.00 0.00 57.85 51.76 1h3h n ARG 17 Cb 0.00 -1.84 -0.02 0.00 -1.16 0.00 0.00 32.46 29.44 1h3h n ARG 17 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1h3h s VAL 18 N -4.04 3.83 -0.41 1.55 -7.23 -1.26 -4.83 120.40 108.01 1h3h s VAL 18 Ca 0.37 0.83 0.09 0.00 -1.81 0.00 0.00 61.98 61.46 1h3h s VAL 18 Cb 0.36 -4.14 0.37 0.00 0.56 0.00 0.00 36.38 33.53 1h3h s VAL 18 CO -0.01 -0.75 1.19 -2.11 -0.31 0.00 0.00 175.10 173.12 1h3h n ARG 19 N 8.19 1.12 -4.05 4.82 1.85 -1.26 -4.93 116.66 122.40 1h3h n ARG 19 Ca 0.17 -2.13 -0.08 0.00 -1.00 0.00 0.00 57.85 54.82 1h3h n ARG 19 Cb 0.48 -0.60 -0.10 0.00 -1.05 0.00 0.00 32.46 31.18 1h3h n ARG 19 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1h3h s TRP 20 N -0.34 0.44 -0.29 2.89 0.52 -1.26 -0.50 118.94 120.39 1h3h s TRP 20 Ca 0.24 -0.90 0.02 0.00 0.02 0.00 0.00 56.10 55.47 1h3h s TRP 20 Cb 0.37 -0.32 0.08 0.00 -1.15 0.00 0.00 33.47 32.45 1h3h s TRP 20 CO -0.06 -0.33 0.02 0.00 0.02 0.00 0.00 176.95 176.59 1h3h s ALA 21 N -3.23 2.21 -0.38 0.98 0.00 0.13 -2.33 121.76 119.14 1h3h s ALA 21 Ca 0.01 -1.87 -0.10 0.00 0.00 0.00 0.00 51.96 49.99 1h3h s ALA 21 Cb 0.03 -1.68 0.04 0.00 0.00 0.00 0.00 23.12 21.51 1h3h s ALA 21 CO -0.07 -1.49 0.20 0.50 0.00 0.00 0.00 175.76 174.90 1h3h s ARG 22 N 1.26 2.74 0.05 0.00 3.52 -0.50 -0.37 118.95 125.64 1h3h s ARG 22 Ca 0.04 -1.18 -0.30 0.00 -0.13 0.00 0.00 55.73 54.15 1h3h s ARG 22 Cb -0.19 -3.70 -0.05 0.00 -1.56 0.00 0.00 34.95 29.45 1h3h s ARG 22 CO -0.12 -0.75 1.20 0.00 -0.81 0.00 0.00 175.30 174.82 1h3h s ALA 23 N 1.50 3.40 -0.06 6.12 0.00 -0.45 -2.89 121.76 129.38 1h3h s ALA 23 Ca 0.01 0.82 0.21 0.00 0.00 0.00 0.00 51.96 53.00 1h3h s ALA 23 Cb -0.20 -3.45 -0.32 0.00 0.00 0.00 0.00 23.12 19.15 1h3h s ALA 23 CO 0.05 -0.47 0.43 1.28 0.00 0.00 0.00 175.76 177.05 1h3h n LEU 24 N 4.09 0.01 -4.36 0.00 4.77 -1.26 0.10 117.00 120.34 1h3h n LEU 24 Ca 0.09 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.86 1h3h n LEU 24 Cb 0.46 0.07 -0.08 0.00 -2.33 0.00 0.00 43.42 41.55 1h3h n LEU 24 CO 0.55 0.07 -0.15 -0.31 -1.33 0.00 0.00 177.39 176.23 1h3h s TYR 25 N -3.36 1.72 0.95 -1.77 2.02 -1.26 -4.46 117.35 111.19 1h3h s TYR 25 Ca -0.08 -1.51 -0.13 0.00 -0.37 0.00 0.00 57.07 54.99 1h3h s TYR 25 Cb 0.13 -0.87 0.20 0.00 -0.40 0.00 0.00 41.96 41.02 1h3h s TYR 25 CO 0.90 -0.64 0.45 -3.47 -1.57 0.00 0.00 175.55 171.21 1h3h n ASP 26 N -1.37 -3.04 -4.86 2.29 2.03 -1.26 -3.78 116.55 106.56 1h3h n ASP 26 Ca 0.02 -0.45 -0.32 0.00 0.52 0.00 0.00 54.79 54.55 1h3h n ASP 26 Cb 0.64 -0.70 -0.05 0.00 -0.72 0.00 0.00 41.12 40.28 1h3h n ASP 26 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1h3h s PHE 27 N -1.88 3.42 -2.07 -0.67 -0.71 -1.16 -4.86 117.98 110.05 1h3h s PHE 27 Ca 0.35 0.26 0.23 0.00 -1.04 0.00 0.00 56.93 56.73 1h3h s PHE 27 Cb -0.06 -1.77 0.63 0.00 -1.21 0.00 0.00 43.02 40.61 1h3h s PHE 27 CO 0.29 0.59 1.53 0.39 -1.34 0.00 0.00 175.22 176.68 1h3h n GLU 28 N 0.84 2.70 -2.08 1.99 -0.58 -1.26 -4.91 120.64 117.33 1h3h n GLU 28 Ca -0.10 -2.63 -0.40 0.00 -0.42 0.00 0.00 57.16 53.61 1h3h n GLU 28 Cb 0.52 -1.57 -0.03 0.00 -0.57 0.00 0.00 31.44 29.79 1h3h n GLU 28 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1h3h s ALA 29 N -1.07 2.44 -0.48 0.62 0.00 -1.26 -4.74 121.76 117.27 1h3h s ALA 29 Ca 0.48 -0.43 0.12 0.00 0.00 0.00 0.00 51.96 52.14 1h3h s ALA 29 Cb 0.26 -4.20 -0.15 0.00 0.00 0.00 0.00 23.12 19.03 1h3h s ALA 29 CO 0.34 -3.44 0.48 1.28 0.00 0.00 0.00 175.76 174.42 1h3h n LEU 30 N 11.67 0.48 -4.95 0.00 4.77 -1.26 -4.79 117.00 122.91 1h3h n LEU 30 Ca 0.20 -0.41 -0.23 0.00 -0.03 0.00 0.00 56.01 55.54 1h3h n LEU 30 Cb 0.50 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1h3h n LEU 30 CO 0.70 0.12 0.12 -0.70 -1.33 0.00 0.00 177.39 176.30 1h3h s GLU 31 N -2.30 3.46 0.38 3.23 2.56 -1.26 -5.01 118.70 119.76 1h3h s GLU 31 Ca 0.03 -0.46 0.20 0.00 0.00 0.00 0.00 54.97 54.74 1h3h s GLU 31 Cb 0.09 -2.72 0.24 0.00 2.00 0.00 0.00 34.13 33.75 1h3h s GLU 31 CO 0.51 0.21 1.55 1.05 -0.56 0.00 0.00 175.26 178.02 1h3h h GLU 32 N 0.85 0.00 -0.00 4.30 4.11 -2.03 -3.13 114.58 118.67 1h3h h GLU 32 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 1h3h h GLU 32 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1h3h h GLU 32 CO 0.61 0.19 -0.00 -0.25 0.07 0.00 0.00 179.01 179.62 1h3h n ASP 33 N -3.15 0.28 -1.71 3.06 9.92 -1.26 -4.85 116.55 118.84 1h3h n ASP 33 Ca 0.03 -1.05 0.00 0.00 -0.53 0.00 0.00 54.79 53.24 1h3h n ASP 33 Cb 0.60 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 41.07 1h3h n ASP 33 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1h3h n GLU 34 N -0.80 1.83 -3.87 -1.24 1.02 -1.18 -3.03 120.64 113.38 1h3h n GLU 34 Ca 0.23 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.25 1h3h n GLU 34 Cb 0.16 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.46 1h3h n GLU 34 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1h3h s LEU 35 N 0.00 1.78 -0.10 -4.62 2.96 0.67 -4.35 118.68 115.03 1h3h s LEU 35 Ca 0.00 0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.94 1h3h s LEU 35 Cb 0.00 0.27 -0.02 0.00 0.50 0.00 0.00 46.19 46.94 1h3h s LEU 35 CO 0.00 -0.10 -0.13 -0.83 -1.32 0.00 0.00 176.35 173.98 1h3h s GLY 36 N -0.31 1.56 0.22 7.98 0.00 -1.26 -4.48 107.32 111.02 1h3h s GLY 36 Ca -0.04 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 43.77 1h3h s GLY 36 CO 0.00 -0.44 0.04 1.97 0.00 0.00 0.00 173.10 174.67 1h3h n PHE 37 N 2.97 0.12 -4.41 1.90 1.16 -1.26 -5.01 117.46 112.93 1h3h n PHE 37 Ca -0.18 -1.03 -0.20 0.00 -1.87 0.00 0.00 57.45 54.17 1h3h n PHE 37 Cb 0.53 -0.15 -0.10 0.00 -1.61 0.00 0.00 39.48 38.14 1h3h n PHE 37 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 1h3h s ARG 38 N -2.80 1.57 0.42 3.97 0.52 -1.26 -2.98 118.95 118.39 1h3h s ARG 38 Ca 0.03 -1.86 -0.24 0.00 -0.52 0.00 0.00 55.73 53.14 1h3h s ARG 38 Cb -0.00 -0.74 -0.11 0.00 0.52 0.00 0.00 34.95 34.62 1h3h s ARG 38 CO 0.02 -0.19 0.92 0.45 0.02 0.00 0.00 175.30 176.52 1h3h n SER 39 N -0.61 0.85 -3.53 0.23 2.88 -1.25 -3.11 113.62 109.08 1h3h n SER 39 Ca -0.02 1.01 -0.25 0.00 -1.33 0.00 0.00 58.87 58.27 1h3h n SER 39 Cb 0.66 -1.31 0.05 0.00 -0.75 0.00 0.00 64.21 62.86 1h3h n SER 39 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1h3h n GLY 40 N 1.30 -1.06 2.79 0.46 0.00 0.28 -4.95 105.19 104.01 1h3h n GLY 40 Ca 0.10 0.50 -0.20 0.00 0.00 0.00 0.00 46.02 46.42 1h3h n GLY 40 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h3h s GLU 41 N -5.37 0.47 0.01 1.61 2.02 -1.15 -4.95 118.70 111.33 1h3h s GLU 41 Ca 0.45 0.10 -0.23 0.00 0.02 0.00 0.00 54.97 55.31 1h3h s GLU 41 Cb -0.13 -0.75 -0.05 0.00 0.10 0.00 0.00 34.13 33.30 1h3h s GLU 41 CO 0.82 -0.22 0.69 0.08 0.02 0.00 0.00 175.26 176.64 1h3h s VAL 42 N 1.55 4.84 0.02 2.63 1.01 -1.26 -1.35 120.40 127.85 1h3h s VAL 42 Ca -0.02 1.44 0.04 0.00 0.00 0.00 0.00 61.98 63.45 1h3h s VAL 42 Cb -0.13 -4.03 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 1h3h s VAL 42 CO -0.03 0.37 -0.13 -0.69 0.00 0.00 0.00 175.10 174.62 1h3h s VAL 43 N -0.01 1.04 -0.30 2.92 1.01 0.50 -4.65 120.40 120.91 1h3h s VAL 43 Ca 0.35 -0.86 -0.17 0.00 0.00 0.00 0.00 61.98 61.30 1h3h s VAL 43 Cb -0.19 -0.93 -0.02 0.00 0.00 0.00 0.00 36.38 35.24 1h3h s VAL 43 CO 0.20 0.07 0.48 -0.70 0.00 0.00 0.00 175.10 175.15 1h3h s GLU 44 N -0.90 3.88 0.02 2.72 2.12 -1.05 0.22 118.70 125.72 1h3h s GLU 44 Ca 0.02 0.08 -0.30 0.00 0.36 0.00 0.00 54.97 55.13 1h3h s GLU 44 Cb -0.07 -3.71 -0.04 0.00 0.26 0.00 0.00 34.13 30.57 1h3h s GLU 44 CO 0.01 -0.45 0.99 0.08 -0.54 0.00 0.00 175.26 175.35 1h3h s VAL 45 N 2.29 4.75 -0.21 3.70 1.01 0.35 -1.59 120.40 130.70 1h3h s VAL 45 Ca 0.19 2.02 0.22 0.00 0.00 0.00 0.00 61.98 64.40 1h3h s VAL 45 Cb -0.16 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 1h3h s VAL 45 CO 0.11 0.18 0.97 0.18 0.00 0.00 0.00 175.10 176.54 1h3h n LEU 46 N 3.71 0.78 -3.11 3.92 4.77 0.42 -4.80 117.00 122.70 1h3h n LEU 46 Ca 0.06 0.31 0.03 0.00 -0.03 0.00 0.00 56.01 56.38 1h3h n LEU 46 Cb 0.50 -0.04 -0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1h3h n LEU 46 CO 0.52 -0.13 0.26 -0.62 -1.33 0.00 0.00 177.39 176.09 1h3h s ASP 47 N -5.35 -1.11 0.00 -1.43 -1.08 0.32 -4.99 116.67 103.04 1h3h s ASP 47 Ca -0.01 -0.13 0.24 0.00 -0.52 0.00 0.00 52.55 52.13 1h3h s ASP 47 Cb 0.10 1.58 1.41 0.00 -1.46 0.00 0.00 42.92 44.55 1h3h s ASP 47 CO 0.80 -0.17 1.90 -1.54 0.52 0.00 0.00 175.17 176.68 1h3h n SER 48 N 4.85 0.00 -4.62 -0.34 3.41 -1.26 -2.27 113.62 113.39 1h3h n SER 48 Ca 0.08 -1.23 -0.43 0.00 -0.26 0.00 0.00 58.87 57.03 1h3h n SER 48 Cb 0.57 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.50 1h3h n SER 48 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1h3h s SER 49 N -1.75 6.57 0.00 4.04 0.15 -1.26 -4.84 113.70 116.61 1h3h s SER 49 Ca 0.36 1.13 0.00 0.00 0.70 0.00 0.00 55.95 58.14 1h3h s SER 49 Cb 0.16 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.93 1h3h s SER 49 CO 0.27 -1.18 0.00 0.59 1.20 0.00 0.00 173.24 174.13 1h3h n ASN 50 N 7.97 0.00 -0.13 5.45 3.02 -1.26 -4.85 115.26 125.46 1h3h n ASN 50 Ca 0.15 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.83 1h3h n ASN 50 Cb 0.47 0.00 0.35 0.00 -0.61 0.00 0.00 39.78 39.98 1h3h n ASN 50 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1h3h n PRO 51 N -0.99 0.45 0.00 3.52 -0.04 -1.26 -4.78 135.00 131.90 1h3h n PRO 51 Ca 0.00 -0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.21 1h3h n PRO 51 Cb 0.00 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.97 1h3h n PRO 51 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1h3h n SER 52 N -1.05 0.00 -4.39 3.54 2.88 -1.26 -5.03 113.62 108.31 1h3h n SER 52 Ca 0.09 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.24 1h3h n SER 52 Cb 0.34 0.07 -0.12 0.00 -0.75 0.00 0.00 64.21 63.76 1h3h n SER 52 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 1h3h s TRP 53 N -1.20 3.20 0.04 0.66 0.52 -1.26 -0.57 118.94 120.34 1h3h s TRP 53 Ca 0.00 -0.86 0.03 0.00 0.02 0.00 0.00 56.10 55.30 1h3h s TRP 53 Cb 0.00 -2.36 -0.04 0.00 -1.15 0.00 0.00 33.47 29.92 1h3h s TRP 53 CO 0.00 -0.57 -0.01 -1.58 0.02 0.00 0.00 176.95 174.81 1h3h s TRP 54 N 1.55 3.00 -0.31 -1.98 0.51 -1.10 -4.70 118.94 115.91 1h3h s TRP 54 Ca 0.03 0.01 -0.23 0.00 -2.12 0.00 0.00 56.10 53.78 1h3h s TRP 54 Cb -0.18 -1.59 0.00 0.00 -0.81 0.00 0.00 33.47 30.89 1h3h s TRP 54 CO 0.05 0.46 0.79 0.99 -0.51 0.00 0.00 176.95 178.73 1h3h s THR 55 N -1.18 4.79 0.10 2.01 2.01 -0.96 -1.53 115.64 120.87 1h3h s THR 55 Ca 0.22 1.16 0.02 0.00 0.31 0.00 0.00 61.69 63.40 1h3h s THR 55 Cb -0.12 -4.15 -0.01 0.00 0.01 0.00 0.00 72.50 68.24 1h3h s THR 55 CO 0.14 -0.26 0.09 0.61 -0.69 0.00 0.00 174.62 174.50 1h3h n GLY 56 N 4.22 3.65 3.13 4.40 0.00 -1.07 -0.43 105.19 119.10 1h3h n GLY 56 Ca 0.04 -1.71 -0.12 0.00 0.00 0.00 0.00 46.02 44.22 1h3h n GLY 56 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1h3h s ARG 57 N -2.38 0.28 -0.28 1.61 1.70 -0.62 -0.73 118.95 118.53 1h3h s ARG 57 Ca 0.11 0.53 -0.11 0.00 -0.47 0.00 0.00 55.73 55.80 1h3h s ARG 57 Cb 0.01 -0.01 -0.05 0.00 -0.57 0.00 0.00 34.95 34.33 1h3h s ARG 57 CO 0.08 -0.12 0.18 -1.17 -1.08 0.00 0.00 175.30 173.19 1h3h s LEU 58 N 0.92 3.99 0.00 -1.89 0.20 0.26 -2.52 118.68 119.65 1h3h s LEU 58 Ca -0.06 -0.01 0.00 0.00 0.69 0.00 0.00 54.13 54.75 1h3h s LEU 58 Cb -0.07 -2.11 0.00 0.00 -0.43 0.00 0.00 46.19 43.58 1h3h s LEU 58 CO -0.06 -0.04 0.00 1.41 -0.29 0.00 0.00 176.35 177.37 1h3h n HIS 59 N 4.99 0.00 -0.75 5.38 8.25 -1.26 -0.86 115.22 130.97 1h3h n HIS 59 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.32 1h3h n HIS 59 Cb 0.52 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.63 1h3h n HIS 59 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1h3h n ASN 60 N 3.69 0.34 -4.75 0.41 4.13 -1.26 -5.06 115.26 112.76 1h3h n ASN 60 Ca 0.00 -1.09 -0.36 0.00 1.68 0.00 0.00 54.58 54.80 1h3h n ASN 60 Cb 0.00 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.17 1h3h n ASN 60 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1h3h s LYS 61 N -0.09 4.12 0.07 3.52 1.02 -0.04 -5.09 119.74 123.25 1h3h s LYS 61 Ca 0.00 0.01 0.02 0.00 0.02 0.00 0.00 55.97 56.01 1h3h s LYS 61 Cb 0.00 -3.38 -0.04 0.00 -0.52 0.00 0.00 37.83 33.89 1h3h s LYS 61 CO 0.00 0.35 0.15 -0.51 -0.92 0.00 0.00 175.35 174.42 1h3h s LEU 62 N 0.15 4.08 0.00 3.17 1.43 -1.26 -0.57 118.68 125.68 1h3h s LEU 62 Ca 0.15 0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.37 1h3h s LEU 62 Cb -0.13 -2.72 0.00 0.00 0.03 0.00 0.00 46.19 43.37 1h3h s LEU 62 CO 0.03 0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.39 1h3h n GLY 63 N 0.33 3.53 3.58 -3.19 0.00 0.09 -4.62 105.19 104.91 1h3h n GLY 63 Ca -0.07 -0.68 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 1h3h n GLY 63 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h3h s LEU 64 N 0.00 1.40 0.14 0.99 1.43 -1.17 -2.59 118.68 118.87 1h3h s LEU 64 Ca 0.00 1.53 -0.18 0.00 -1.03 0.00 0.00 54.13 54.45 1h3h s LEU 64 Cb 0.00 -3.61 0.04 0.00 0.03 0.00 0.00 46.19 42.65 1h3h s LEU 64 CO 0.00 -3.68 0.45 0.72 0.23 0.00 0.00 176.35 174.07 1h3h s PHE 65 N -2.64 -0.27 -0.65 0.29 -0.12 -0.58 -0.23 117.98 113.77 1h3h s PHE 65 Ca 0.67 -0.02 -0.27 0.00 -0.05 0.00 0.00 56.93 57.25 1h3h s PHE 65 Cb -0.23 0.33 0.03 0.00 -0.63 0.00 0.00 43.02 42.53 1h3h s PHE 65 CO 0.61 -0.74 1.20 -1.25 -0.05 0.00 0.00 175.22 174.99 1h3h s PRO 66 N -3.80 3.35 0.06 1.99 0.04 -1.26 -2.72 135.00 132.66 1h3h s PRO 66 Ca 0.03 -0.04 0.09 0.00 0.04 0.00 0.00 61.00 61.12 1h3h s PRO 66 Cb 0.01 -4.10 0.40 0.00 0.04 0.00 0.00 34.50 30.85 1h3h s PRO 66 CO -0.12 -1.87 1.27 0.00 0.04 0.00 0.00 177.00 176.32 1h3h n ALA 67 N 8.74 1.25 -0.02 8.56 0.00 0.27 -1.52 120.51 137.78 1h3h n ALA 67 Ca 0.05 0.02 -0.10 0.00 0.00 0.00 0.00 53.44 53.40 1h3h n ALA 67 Cb 0.49 -1.14 -0.14 0.00 0.00 0.00 0.00 19.45 18.66 1h3h n ALA 67 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1h3h n ASN 68 N -1.65 1.03 0.01 0.00 5.15 -1.26 -4.21 115.26 114.34 1h3h n ASN 68 Ca 0.01 0.37 -0.19 0.00 -0.60 0.00 0.00 54.58 54.17 1h3h n ASN 68 Cb 0.07 -0.15 -0.09 0.00 -0.53 0.00 0.00 39.78 39.08 1h3h n ASN 68 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1h3h h TYR 69 N 0.01 1.01 -2.64 1.20 3.20 -1.65 -3.46 116.97 114.64 1h3h h TYR 69 Ca -0.31 -0.51 -0.55 0.00 3.14 0.00 0.00 58.73 60.49 1h3h h TYR 69 Cb 2.02 -0.13 -0.15 0.00 1.54 0.00 0.00 36.73 40.01 1h3h h TYR 69 CO 0.01 1.34 -0.76 0.14 -1.64 0.00 0.00 178.16 177.26 1h3h s VAL 70 N -3.47 2.15 0.12 1.81 -7.23 -0.98 -4.46 120.40 108.34 1h3h s VAL 70 Ca -0.10 -2.25 0.08 0.00 -1.81 0.00 0.00 61.98 57.89 1h3h s VAL 70 Cb 0.07 -2.15 -0.04 0.00 0.56 0.00 0.00 36.38 34.83 1h3h s VAL 70 CO 0.91 -0.43 -0.19 0.00 -0.31 0.00 0.00 175.10 175.07 1h3h s ALA 71 N -2.53 1.82 1.41 1.32 0.00 -1.14 -4.55 121.76 118.09 1h3h s ALA 71 Ca 0.25 -1.32 -0.21 0.00 0.00 0.00 0.00 51.96 50.68 1h3h s ALA 71 Cb -0.04 -0.20 0.33 0.00 0.00 0.00 0.00 23.12 23.20 1h3h s ALA 71 CO 0.11 0.29 0.77 -2.30 0.00 0.00 0.00 175.76 174.62 1h3h n PRO 72 N 0.79 -4.41 -3.38 0.00 -0.02 -0.98 -1.41 135.00 125.59 1h3h n PRO 72 Ca -0.17 -1.28 -0.15 0.00 -2.02 0.00 0.00 63.50 59.87 1h3h n PRO 72 Cb 0.55 -1.63 -0.09 0.00 -0.02 0.00 0.00 33.50 32.31 1h3h n PRO 72 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1h3h s MET 73 N -4.83 0.37 -0.52 -0.52 1.75 -1.26 -4.71 119.30 109.58 1h3h s MET 73 Ca 0.58 -0.14 -0.28 0.00 -1.25 0.00 0.00 55.69 54.60 1h3h s MET 73 Cb -0.10 -0.58 0.01 0.00 2.84 0.00 0.00 34.83 37.00 1h3h s MET 73 CO 0.49 -1.05 1.45 1.41 -0.65 0.00 0.00 175.02 176.67 1h3h s MET 74 N 2.33 3.32 0.00 4.11 1.75 -1.26 -4.86 119.30 124.69 1h3h s MET 74 Ca 0.10 0.60 0.25 0.00 -1.25 0.00 0.00 55.69 55.39 1h3h s MET 74 Cb -0.14 -4.12 0.30 0.00 2.84 0.00 0.00 34.83 33.72 1h3h s MET 74 CO -0.30 -1.90 1.32 2.89 -0.65 0.00 0.00 175.02 176.38