#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h3h s ARG 17 N 0.00 1.69 -1.14 1.61 3.00 -1.26 -5.04 118.95 117.82 1h3h s ARG 17 Ca 0.00 -1.88 -0.15 0.00 0.00 0.00 0.00 55.73 53.69 1h3h s ARG 17 Cb 0.00 -3.36 0.16 0.00 0.00 0.00 0.00 34.95 31.75 1h3h s ARG 17 CO 0.00 -1.00 1.36 0.14 0.00 0.00 0.00 175.30 175.81 1h3h s VAL 18 N 0.95 4.93 -0.49 3.52 -7.23 -1.26 -4.81 120.40 116.01 1h3h s VAL 18 Ca 0.10 -2.34 0.08 0.00 -1.81 0.00 0.00 61.98 58.01 1h3h s VAL 18 Cb -0.21 -4.88 0.36 0.00 0.56 0.00 0.00 36.38 32.21 1h3h s VAL 18 CO -0.06 -1.60 0.93 -2.11 -0.31 0.00 0.00 175.10 171.94 1h3h n ARG 19 N 5.96 2.60 -4.06 4.82 1.85 -1.26 -4.87 116.66 121.70 1h3h n ARG 19 Ca 0.34 -4.35 -0.08 0.00 -1.00 0.00 0.00 57.85 52.76 1h3h n ARG 19 Cb 0.44 -2.05 -0.10 0.00 -1.05 0.00 0.00 32.46 29.70 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 -3.22 0.44 -0.27 2.89 0.52 -1.26 -0.05 118.94 117.99 1h3h s TRP 20 Ca 0.45 -0.90 -0.01 0.00 0.02 0.00 0.00 56.10 55.66 1h3h s TRP 20 Cb 0.33 -0.33 0.08 0.00 -1.15 0.00 0.00 33.47 32.40 1h3h s TRP 20 CO -0.12 -0.32 0.05 0.00 0.02 0.00 0.00 176.95 176.58 1h3h s ALA 21 N -3.16 1.54 -0.38 0.98 0.00 0.47 -2.70 121.76 118.51 1h3h s ALA 21 Ca -0.00 -1.40 -0.10 0.00 0.00 0.00 0.00 51.96 50.45 1h3h s ALA 21 Cb 0.02 -1.49 0.04 0.00 0.00 0.00 0.00 23.12 21.69 1h3h s ALA 21 CO -0.07 -1.46 0.20 0.50 0.00 0.00 0.00 175.76 174.93 1h3h s ARG 22 N 1.61 2.76 -0.24 0.00 3.52 0.13 -1.04 118.95 125.68 1h3h s ARG 22 Ca 0.04 -1.15 -0.29 0.00 -0.13 0.00 0.00 55.73 54.20 1h3h s ARG 22 Cb -0.18 -3.71 0.00 0.00 -1.56 0.00 0.00 34.95 29.51 1h3h s ARG 22 CO -0.17 -0.74 1.15 0.00 -0.81 0.00 0.00 175.30 174.74 1h3h s ALA 23 N 1.52 3.60 -0.39 6.12 0.00 -0.49 -2.71 121.76 129.41 1h3h s ALA 23 Ca 0.01 0.20 0.23 0.00 0.00 0.00 0.00 51.96 52.41 1h3h s ALA 23 Cb -0.20 -3.63 0.02 0.00 0.00 0.00 0.00 23.12 19.32 1h3h s ALA 23 CO 0.06 -1.28 1.01 1.28 0.00 0.00 0.00 175.76 176.83 1h3h n LEU 24 N 6.70 0.65 -4.43 0.00 4.77 -1.26 0.13 117.00 123.56 1h3h n LEU 24 Ca 0.13 0.16 -0.23 0.00 -0.03 0.00 0.00 56.01 56.04 1h3h n LEU 24 Cb 0.46 -0.08 -0.08 0.00 -2.33 0.00 0.00 43.42 41.38 1h3h n LEU 24 CO 0.56 -0.07 -0.17 -0.31 -1.33 0.00 0.00 177.39 176.06 1h3h s TYR 25 N -3.30 1.75 1.21 -1.77 1.51 -1.26 -4.44 117.35 111.04 1h3h s TYR 25 Ca 0.01 -1.39 -0.18 0.00 -1.01 0.00 0.00 57.07 54.50 1h3h s TYR 25 Cb 0.12 -1.00 0.27 0.00 -0.11 0.00 0.00 41.96 41.24 1h3h s TYR 25 CO 0.80 -0.47 0.59 -0.40 -1.11 0.00 0.00 175.55 174.96 1h3h n ASP 26 N -1.30 -3.45 -4.85 2.29 5.75 -1.26 -3.62 116.55 110.11 1h3h n ASP 26 Ca -0.02 -0.58 -0.33 0.00 -0.01 0.00 0.00 54.79 53.86 1h3h n ASP 26 Cb 0.64 -0.89 -0.06 0.00 -1.03 0.00 0.00 41.12 39.79 1h3h n ASP 26 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 1h3h s PHE 27 N -2.10 3.42 -2.17 2.11 -0.71 -1.15 -4.88 117.98 112.49 1h3h s PHE 27 Ca 0.50 0.26 0.22 0.00 -1.04 0.00 0.00 56.93 56.87 1h3h s PHE 27 Cb -0.10 -1.77 0.55 0.00 -1.21 0.00 0.00 43.02 40.50 1h3h s PHE 27 CO 0.44 0.59 1.47 0.39 -1.34 0.00 0.00 175.22 176.78 1h3h n GLU 28 N 0.91 2.50 -2.07 1.99 -0.58 -1.26 -4.90 120.64 117.23 1h3h n GLU 28 Ca -0.11 -2.31 -0.40 0.00 -0.42 0.00 0.00 57.16 53.93 1h3h n GLU 28 Cb 0.52 -1.51 -0.03 0.00 -0.57 0.00 0.00 31.44 29.85 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 -1.26 2.40 -0.35 0.62 0.00 -1.26 -4.73 121.76 117.18 1h3h s ALA 29 Ca 0.42 -0.44 0.13 0.00 0.00 0.00 0.00 51.96 52.08 1h3h s ALA 29 Cb 0.23 -4.21 -0.17 0.00 0.00 0.00 0.00 23.12 18.96 1h3h s ALA 29 CO 0.31 -3.50 0.44 1.28 0.00 0.00 0.00 175.76 174.28 1h3h n LEU 30 N 11.85 0.34 -4.97 0.00 4.77 -1.26 -4.80 117.00 122.93 1h3h n LEU 30 Ca 0.20 -0.28 -0.22 0.00 -0.03 0.00 0.00 56.01 55.69 1h3h n LEU 30 Cb 0.51 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.63 1h3h n LEU 30 CO 0.70 0.08 0.34 -0.70 -1.33 0.00 0.00 177.39 176.49 1h3h s GLU 31 N -2.54 2.69 0.07 3.23 2.12 -1.26 -5.02 118.70 117.98 1h3h s GLU 31 Ca 0.01 -0.71 0.11 0.00 0.36 0.00 0.00 54.97 54.73 1h3h s GLU 31 Cb 0.09 -2.51 -0.19 0.00 0.26 0.00 0.00 34.13 31.79 1h3h s GLU 31 CO 0.54 -0.59 1.02 1.05 -0.54 0.00 0.00 175.26 176.74 1h3h h GLU 32 N 0.16 0.00 0.00 4.30 4.11 -2.02 -3.25 114.58 117.89 1h3h h GLU 32 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1h3h h GLU 32 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1h3h h GLU 32 CO 0.53 0.70 0.00 -3.47 0.07 0.00 0.00 179.01 176.84 1h3h n ASP 33 N -3.18 0.00 -3.58 3.06 -0.08 -1.26 -4.81 116.55 106.70 1h3h n ASP 33 Ca -0.07 -1.17 -0.13 0.00 -1.51 0.00 0.00 54.79 51.91 1h3h n ASP 33 Cb 0.96 0.00 0.01 0.00 2.34 0.00 0.00 41.12 44.43 1h3h n ASP 33 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1h3h n GLU 34 N -0.88 0.95 -4.08 -0.67 1.02 -1.23 -2.43 120.64 113.32 1h3h n GLU 34 Ca 0.17 -1.82 -0.15 0.00 -0.02 0.00 0.00 57.16 55.33 1h3h n GLU 34 Cb 0.08 0.08 -0.14 0.00 -0.02 0.00 0.00 31.44 31.43 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 1.93 -0.10 -4.62 2.96 0.88 -4.27 118.68 115.46 1h3h s LEU 35 Ca 0.23 -0.07 0.01 0.00 -0.22 0.00 0.00 54.13 54.08 1h3h s LEU 35 Cb -0.02 -0.22 -0.02 0.00 0.50 0.00 0.00 46.19 46.44 1h3h s LEU 35 CO 0.15 0.04 -0.13 -0.83 -1.32 0.00 0.00 176.35 174.25 1h3h s GLY 36 N 0.01 1.55 0.41 7.98 0.00 -1.26 -4.42 107.32 111.59 1h3h s GLY 36 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 43.81 1h3h s GLY 36 CO -0.00 -0.41 0.00 1.97 0.00 0.00 0.00 173.10 174.66 1h3h n PHE 37 N 3.04 0.93 -4.37 1.90 1.16 -1.26 -5.02 117.46 113.84 1h3h n PHE 37 Ca -0.18 -2.01 -0.19 0.00 -1.87 0.00 0.00 57.45 53.20 1h3h n PHE 37 Cb 0.53 -0.27 -0.10 0.00 -1.61 0.00 0.00 39.48 38.02 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 -3.48 1.42 0.44 3.97 0.52 -1.26 -2.95 118.95 117.62 1h3h s ARG 38 Ca 0.00 -1.73 -0.23 0.00 -0.52 0.00 0.00 55.73 53.25 1h3h s ARG 38 Cb -0.00 -0.76 -0.10 0.00 0.52 0.00 0.00 34.95 34.60 1h3h s ARG 38 CO 0.00 -0.08 0.95 0.45 0.02 0.00 0.00 175.30 176.64 1h3h n SER 39 N -0.49 0.94 -3.49 0.23 2.88 -1.24 -2.93 113.62 109.53 1h3h n SER 39 Ca -0.05 0.99 -0.18 0.00 -1.33 0.00 0.00 58.87 58.30 1h3h n SER 39 Cb 0.64 -1.33 0.07 0.00 -0.75 0.00 0.00 64.21 62.84 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 1.27 -0.49 2.86 0.46 0.00 0.36 -4.94 105.19 104.71 1h3h n GLY 40 Ca 0.10 0.19 -0.17 0.00 0.00 0.00 0.00 46.02 46.14 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 -5.41 0.43 -0.07 1.61 0.41 -1.15 -4.99 118.70 109.53 1h3h s GLU 41 Ca 0.09 -0.00 -0.14 0.00 -0.41 0.00 0.00 54.97 54.50 1h3h s GLU 41 Cb -0.02 -0.54 -0.05 0.00 -1.78 0.00 0.00 34.13 31.75 1h3h s GLU 41 CO 0.76 -0.09 0.37 0.08 -0.49 0.00 0.00 175.26 175.89 1h3h s VAL 42 N 0.81 5.17 0.03 2.63 1.01 -1.26 -1.40 120.40 127.39 1h3h s VAL 42 Ca -0.09 0.73 0.04 0.00 0.00 0.00 0.00 61.98 62.66 1h3h s VAL 42 Cb -0.12 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 1h3h s VAL 42 CO -0.01 0.49 -0.13 -0.69 0.00 0.00 0.00 175.10 174.76 1h3h s VAL 43 N -0.37 0.99 -0.40 2.92 1.01 -0.21 -4.76 120.40 119.57 1h3h s VAL 43 Ca 0.21 -0.85 -0.19 0.00 0.00 0.00 0.00 61.98 61.16 1h3h s VAL 43 Cb -0.15 -0.89 0.01 0.00 0.00 0.00 0.00 36.38 35.36 1h3h s VAL 43 CO 0.10 0.04 0.54 -0.70 0.00 0.00 0.00 175.10 175.08 1h3h s GLU 44 N -0.92 3.34 0.19 2.72 2.12 -1.10 -0.40 118.70 124.66 1h3h s GLU 44 Ca 0.01 -0.41 -0.30 0.00 0.36 0.00 0.00 54.97 54.64 1h3h s GLU 44 Cb -0.07 -3.91 -0.08 0.00 0.26 0.00 0.00 34.13 30.33 1h3h s GLU 44 CO 0.01 -0.85 0.94 0.08 -0.54 0.00 0.00 175.26 174.90 1h3h s VAL 45 N 2.49 4.24 -0.19 3.70 1.01 0.92 -1.45 120.40 131.13 1h3h s VAL 45 Ca 0.18 2.06 0.22 0.00 0.00 0.00 0.00 61.98 64.44 1h3h s VAL 45 Cb -0.15 -4.31 -0.20 0.00 0.00 0.00 0.00 36.38 31.71 1h3h s VAL 45 CO 0.16 0.44 0.74 0.18 0.00 0.00 0.00 175.10 176.61 1h3h n LEU 46 N 1.96 0.38 -3.15 3.92 4.77 -0.10 -4.71 117.00 120.07 1h3h n LEU 46 Ca -0.01 0.09 0.04 0.00 -0.03 0.00 0.00 56.01 56.11 1h3h n LEU 46 Cb 0.48 -0.03 -0.00 0.00 -2.33 0.00 0.00 43.42 41.54 1h3h n LEU 46 CO 0.50 -0.05 0.13 -1.81 -1.33 0.00 0.00 177.39 174.82 1h3h s ASP 47 N -4.70 -1.56 0.00 -1.43 1.01 0.13 -5.00 116.67 105.13 1h3h s ASP 47 Ca -0.04 0.30 0.23 0.00 0.71 0.00 0.00 52.55 53.75 1h3h s ASP 47 Cb 0.13 2.04 0.89 0.00 1.01 0.00 0.00 42.92 46.98 1h3h s ASP 47 CO 0.86 -0.29 1.63 -1.20 0.21 0.00 0.00 175.17 176.38 1h3h n SER 48 N 5.41 1.43 -4.62 0.27 7.64 -1.26 -1.84 113.62 120.66 1h3h n SER 48 Ca 0.04 -1.61 -0.43 0.00 1.01 0.00 0.00 58.87 57.88 1h3h n SER 48 Cb 0.54 -0.07 -0.02 0.00 -1.01 0.00 0.00 64.21 63.65 1h3h n SER 48 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1h3h s SER 49 N -1.69 6.59 0.00 6.43 0.15 -1.26 -4.85 113.70 119.08 1h3h s SER 49 Ca 0.34 1.09 0.00 0.00 0.70 0.00 0.00 55.95 58.07 1h3h s SER 49 Cb 0.18 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.95 1h3h s SER 49 CO 0.28 -1.17 0.00 0.59 1.20 0.00 0.00 173.24 174.14 1h3h n ASN 50 N 7.91 0.00 -0.67 5.45 3.02 -1.26 -4.87 115.26 124.83 1h3h n ASN 50 Ca 0.15 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.82 1h3h n ASN 50 Cb 0.47 0.00 0.37 0.00 -0.61 0.00 0.00 39.78 40.01 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 -0.90 1.91 0.00 3.52 -0.04 -1.26 -4.77 135.00 133.46 1h3h n PRO 51 Ca 0.00 -1.34 0.00 0.00 -0.04 0.00 0.00 63.50 62.12 1h3h n PRO 51 Cb 0.00 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 1h3h n PRO 51 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1h3h n SER 52 N 0.59 0.00 -4.28 3.54 7.64 -1.26 -5.03 113.62 114.82 1h3h n SER 52 Ca 0.17 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.69 1h3h n SER 52 Cb 0.42 0.04 -0.13 0.00 -1.01 0.00 0.00 64.21 63.53 1h3h n SER 52 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1h3h s TRP 53 N -1.15 3.16 0.06 1.43 0.52 -1.26 -0.10 118.94 121.60 1h3h s TRP 53 Ca 0.00 -1.27 0.04 0.00 0.02 0.00 0.00 56.10 54.89 1h3h s TRP 53 Cb 0.00 -2.20 -0.04 0.00 -1.15 0.00 0.00 33.47 30.08 1h3h s TRP 53 CO 0.00 -0.66 -0.01 -1.58 0.02 0.00 0.00 176.95 174.72 1h3h s TRP 54 N 1.42 3.00 -0.19 -1.98 0.51 -1.03 -4.71 118.94 115.96 1h3h s TRP 54 Ca 0.01 -0.00 -0.20 0.00 -2.12 0.00 0.00 56.10 53.78 1h3h s TRP 54 Cb -0.18 -1.57 -0.03 0.00 -0.81 0.00 0.00 33.47 30.88 1h3h s TRP 54 CO 0.01 0.47 0.60 0.99 -0.51 0.00 0.00 176.95 178.51 1h3h s THR 55 N -1.24 5.05 0.30 2.01 2.01 -0.76 -1.11 115.64 121.90 1h3h s THR 55 Ca 0.24 1.14 -0.08 0.00 0.31 0.00 0.00 61.69 63.30 1h3h s THR 55 Cb -0.12 -3.92 0.00 0.00 0.01 0.00 0.00 72.50 68.47 1h3h s THR 55 CO 0.16 0.14 0.49 -0.83 -0.69 0.00 0.00 174.62 173.89 1h3h s GLY 56 N 1.14 0.97 -0.03 4.40 0.00 -0.89 -0.69 107.32 112.22 1h3h s GLY 56 Ca 0.28 -1.18 0.02 0.00 0.00 0.00 0.00 44.72 43.84 1h3h s GLY 56 CO 0.11 -0.79 -0.06 1.09 0.00 0.00 0.00 173.10 173.45 1h3h s ARG 57 N -3.43 0.80 -0.33 2.90 1.70 -0.53 -0.51 118.95 119.56 1h3h s ARG 57 Ca 0.26 -0.18 -0.13 0.00 -0.47 0.00 0.00 55.73 55.21 1h3h s ARG 57 Cb -0.01 -0.78 -0.02 0.00 -0.57 0.00 0.00 34.95 33.57 1h3h s ARG 57 CO 0.14 0.01 0.25 -1.17 -1.08 0.00 0.00 175.30 173.45 1h3h s LEU 58 N 0.53 4.45 0.00 -1.89 0.20 0.12 -2.70 118.68 119.39 1h3h s LEU 58 Ca -0.07 -0.34 0.00 0.00 0.69 0.00 0.00 54.13 54.40 1h3h s LEU 58 Cb -0.11 -2.16 0.00 0.00 -0.43 0.00 0.00 46.19 43.49 1h3h s LEU 58 CO 0.00 -0.22 0.00 1.41 -0.29 0.00 0.00 176.35 177.25 1h3h n HIS 59 N 5.14 0.00 -1.04 5.38 8.25 -1.26 -0.91 115.22 130.78 1h3h n HIS 59 Ca -0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.34 1h3h n HIS 59 Cb 0.50 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.61 1h3h n HIS 59 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1h3h n ASN 60 N 2.32 0.00 -4.51 0.41 5.15 -1.26 -5.06 115.26 112.31 1h3h n ASN 60 Ca 0.00 -1.00 -0.35 0.00 -0.60 0.00 0.00 54.58 52.63 1h3h n ASN 60 Cb 0.00 0.00 -0.12 0.00 -0.53 0.00 0.00 39.78 39.13 1h3h n ASN 60 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1h3h s LYS 61 N 0.00 3.73 -0.00 1.20 1.02 -0.08 -5.10 119.74 120.49 1h3h s LYS 61 Ca 0.00 -0.47 -0.01 0.00 0.02 0.00 0.00 55.97 55.51 1h3h s LYS 61 Cb 0.00 -3.10 -0.04 0.00 -0.52 0.00 0.00 37.83 34.17 1h3h s LYS 61 CO 0.00 0.11 0.11 -0.51 -0.92 0.00 0.00 175.35 174.14 1h3h s LEU 62 N 0.76 4.01 0.00 3.17 1.02 -1.26 0.13 118.68 126.51 1h3h s LEU 62 Ca 0.01 0.19 0.00 0.00 0.02 0.00 0.00 54.13 54.35 1h3h s LEU 62 Cb -0.14 -2.36 0.00 0.00 0.02 0.00 0.00 46.19 43.71 1h3h s LEU 62 CO 0.02 0.27 0.00 0.61 0.02 0.00 0.00 176.35 177.27 1h3h n GLY 63 N 1.12 2.64 3.66 -3.19 0.00 0.34 -4.55 105.19 105.20 1h3h n GLY 63 Ca -0.12 -0.79 -0.30 0.00 0.00 0.00 0.00 46.02 44.81 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 2.04 0.16 0.99 1.43 -1.02 -2.09 118.68 120.19 1h3h s LEU 64 Ca 0.00 1.62 -0.16 0.00 -1.03 0.00 0.00 54.13 54.56 1h3h s LEU 64 Cb 0.00 -3.92 0.03 0.00 0.03 0.00 0.00 46.19 42.33 1h3h s LEU 64 CO 0.00 -3.08 0.45 0.72 0.23 0.00 0.00 176.35 174.67 1h3h s PHE 65 N -2.77 -0.12 -0.60 0.29 -0.12 -0.26 -0.08 117.98 114.31 1h3h s PHE 65 Ca 0.65 -0.21 -0.27 0.00 -0.05 0.00 0.00 56.93 57.05 1h3h s PHE 65 Cb -0.20 0.30 0.03 0.00 -0.63 0.00 0.00 43.02 42.52 1h3h s PHE 65 CO 0.59 -0.81 1.14 -1.25 -0.05 0.00 0.00 175.22 174.84 1h3h s PRO 66 N -3.85 3.41 0.00 1.99 0.04 -1.26 -2.47 135.00 132.86 1h3h s PRO 66 Ca 0.07 0.02 0.11 0.00 0.04 0.00 0.00 61.00 61.24 1h3h s PRO 66 Cb 0.01 -4.06 0.51 0.00 0.04 0.00 0.00 34.50 31.00 1h3h s PRO 66 CO -0.07 -1.71 1.31 0.00 0.04 0.00 0.00 177.00 176.57 1h3h n ALA 67 N 8.33 1.58 -0.03 8.56 0.00 0.86 -2.01 120.51 137.80 1h3h n ALA 67 Ca 0.06 -0.04 -0.07 0.00 0.00 0.00 0.00 53.44 53.38 1h3h n ALA 67 Cb 0.49 -1.18 -0.14 0.00 0.00 0.00 0.00 19.45 18.62 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 -1.41 0.65 0.10 0.00 5.15 -1.26 -4.28 115.26 114.21 1h3h n ASN 68 Ca 0.04 0.31 -0.19 0.00 -0.60 0.00 0.00 54.58 54.13 1h3h n ASN 68 Cb 0.11 0.26 -0.15 0.00 -0.53 0.00 0.00 39.78 39.48 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 0.00 0.62 -3.58 1.20 5.03 -1.78 -3.46 116.97 115.00 1h3h h TYR 69 Ca -0.32 -0.45 -0.61 0.00 2.58 0.00 0.00 58.73 59.93 1h3h h TYR 69 Cb 1.97 -0.02 -0.20 0.00 1.55 0.00 0.00 36.73 40.02 1h3h h TYR 69 CO 0.00 1.43 -0.83 0.14 -1.32 0.00 0.00 178.16 177.58 1h3h s VAL 70 N -2.62 2.04 0.13 1.81 -7.23 -1.00 -4.43 120.40 109.10 1h3h s VAL 70 Ca -0.08 -1.81 0.09 0.00 -1.81 0.00 0.00 61.98 58.36 1h3h s VAL 70 Cb 0.06 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 35.08 1h3h s VAL 70 CO 0.89 -0.10 -0.16 0.00 -0.31 0.00 0.00 175.10 175.42 1h3h s ALA 71 N -1.48 2.76 1.37 1.32 0.00 -1.10 -4.56 121.76 120.08 1h3h s ALA 71 Ca 0.14 -1.38 -0.22 0.00 0.00 0.00 0.00 51.96 50.51 1h3h s ALA 71 Cb -0.08 -0.68 0.34 0.00 0.00 0.00 0.00 23.12 22.69 1h3h s ALA 71 CO 0.07 0.57 0.76 -2.30 0.00 0.00 0.00 175.76 174.86 1h3h n PRO 72 N 0.61 -4.09 -3.29 0.00 -0.02 -1.10 -0.70 135.00 126.41 1h3h n PRO 72 Ca -0.14 -1.28 -0.08 0.00 -2.02 0.00 0.00 63.50 59.98 1h3h n PRO 72 Cb 0.53 -1.79 -0.05 0.00 -0.02 0.00 0.00 33.50 32.17 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 -4.70 0.44 -0.46 -0.52 1.75 -1.26 -4.60 119.30 109.96 1h3h s MET 73 Ca 0.59 0.13 -0.28 0.00 -1.25 0.00 0.00 55.69 54.88 1h3h s MET 73 Cb -0.10 -0.26 -0.01 0.00 2.84 0.00 0.00 34.83 37.29 1h3h s MET 73 CO 0.49 -1.05 1.72 1.41 -0.65 0.00 0.00 175.02 176.95 1h3h s MET 74 N 2.53 3.14 0.00 4.11 1.75 -1.26 -4.77 119.30 124.80 1h3h s MET 74 Ca 0.10 0.99 0.17 0.00 -1.25 0.00 0.00 55.69 55.70 1h3h s MET 74 Cb -0.12 -4.22 1.03 0.00 2.84 0.00 0.00 34.83 34.36 1h3h s MET 74 CO -0.29 -2.10 1.43 0.54 -0.65 0.00 0.00 175.02 173.95