#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 2.80 0.02 1.61 3.00 -1.26 -5.05 118.95 120.07 1h3h s ARG 17 Ca 0.00 -2.19 -0.30 0.00 0.00 0.00 0.00 55.73 53.24 1h3h s ARG 17 Cb 0.00 -4.00 -0.07 0.00 0.00 0.00 0.00 34.95 30.88 1h3h s ARG 17 CO 0.00 -1.21 1.68 0.14 0.00 0.00 0.00 175.30 175.91 1h3h s VAL 18 N 0.60 3.26 -0.34 3.52 -7.23 -1.26 -4.91 120.40 114.05 1h3h s VAL 18 Ca 0.12 0.53 0.16 0.00 -1.81 0.00 0.00 61.98 60.99 1h3h s VAL 18 Cb -0.20 -3.34 0.43 0.00 0.56 0.00 0.00 36.38 33.83 1h3h s VAL 18 CO -0.04 -0.02 0.94 -2.11 -0.31 0.00 0.00 175.10 173.56 1h3h n ARG 19 N 6.38 1.11 -4.00 4.82 1.85 -1.26 -4.80 116.66 120.76 1h3h n ARG 19 Ca 0.17 -3.18 -0.08 0.00 -1.00 0.00 0.00 57.85 53.76 1h3h n ARG 19 Cb 0.41 -1.26 -0.10 0.00 -1.05 0.00 0.00 32.46 30.47 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 -2.77 0.34 -0.26 2.89 0.52 -1.26 -0.45 118.94 117.94 1h3h s TRP 20 Ca 0.29 -0.75 -0.01 0.00 0.02 0.00 0.00 56.10 55.64 1h3h s TRP 20 Cb 0.44 -0.24 0.08 0.00 -1.15 0.00 0.00 33.47 32.59 1h3h s TRP 20 CO 0.01 -0.36 0.06 0.00 0.02 0.00 0.00 176.95 176.68 1h3h s ALA 21 N -3.11 1.38 -0.35 0.98 0.00 0.68 -2.87 121.76 118.45 1h3h s ALA 21 Ca -0.01 -1.30 -0.07 0.00 0.00 0.00 0.00 51.96 50.58 1h3h s ALA 21 Cb 0.02 -1.45 0.04 0.00 0.00 0.00 0.00 23.12 21.73 1h3h s ALA 21 CO -0.07 -1.46 0.14 0.50 0.00 0.00 0.00 175.76 174.87 1h3h s ARG 22 N 1.69 2.64 0.02 0.00 3.52 0.14 -0.28 118.95 126.67 1h3h s ARG 22 Ca 0.05 -1.20 -0.30 0.00 -0.13 0.00 0.00 55.73 54.14 1h3h s ARG 22 Cb -0.17 -3.54 -0.04 0.00 -1.56 0.00 0.00 34.95 29.63 1h3h s ARG 22 CO -0.18 -0.71 1.09 0.00 -0.81 0.00 0.00 175.30 174.69 1h3h s ALA 23 N 1.43 3.29 -0.32 6.12 0.00 -0.29 -2.60 121.76 129.39 1h3h s ALA 23 Ca -0.00 0.68 0.22 0.00 0.00 0.00 0.00 51.96 52.85 1h3h s ALA 23 Cb -0.20 -3.40 -0.20 0.00 0.00 0.00 0.00 23.12 19.32 1h3h s ALA 23 CO 0.03 -0.36 0.72 1.28 0.00 0.00 0.00 175.76 177.43 1h3h n LEU 24 N 4.02 0.38 -4.33 0.00 4.77 -1.26 0.11 117.00 120.69 1h3h n LEU 24 Ca 0.08 -0.03 -0.21 0.00 -0.03 0.00 0.00 56.01 55.81 1h3h n LEU 24 Cb 0.49 -0.03 -0.08 0.00 -2.33 0.00 0.00 43.42 41.47 1h3h n LEU 24 CO 0.54 0.02 -0.13 -0.31 -1.33 0.00 0.00 177.39 176.18 1h3h s TYR 25 N -3.36 1.76 0.61 -1.77 1.51 -1.26 -4.42 117.35 110.42 1h3h s TYR 25 Ca -0.02 -1.59 -0.08 0.00 -1.01 0.00 0.00 57.07 54.37 1h3h s TYR 25 Cb 0.14 -0.80 0.12 0.00 -0.11 0.00 0.00 41.96 41.30 1h3h s TYR 25 CO 0.87 -0.76 0.27 -3.47 -1.11 0.00 0.00 175.55 171.35 1h3h n ASP 26 N -1.50 -2.30 -4.87 2.29 -0.08 -1.26 -3.70 116.55 105.12 1h3h n ASP 26 Ca 0.05 -0.27 -0.33 0.00 -1.51 0.00 0.00 54.79 52.73 1h3h n ASP 26 Cb 0.63 -0.46 -0.05 0.00 2.34 0.00 0.00 41.12 43.58 1h3h n ASP 26 CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 1h3h s PHE 27 N -1.44 3.45 -1.77 -0.67 -0.71 -1.17 -4.83 117.98 110.84 1h3h s PHE 27 Ca 0.21 0.28 0.20 0.00 -1.04 0.00 0.00 56.93 56.57 1h3h s PHE 27 Cb -0.04 -1.78 0.62 0.00 -1.21 0.00 0.00 43.02 40.62 1h3h s PHE 27 CO 0.18 0.60 1.52 0.39 -1.34 0.00 0.00 175.22 176.57 1h3h n GLU 28 N 0.84 2.84 -2.08 1.99 -0.58 -1.26 -4.91 120.64 117.48 1h3h n GLU 28 Ca -0.10 -2.51 -0.41 0.00 -0.42 0.00 0.00 57.16 53.73 1h3h n GLU 28 Cb 0.52 -1.62 -0.03 0.00 -0.57 0.00 0.00 31.44 29.75 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 -1.30 2.52 -0.60 0.62 0.00 -1.26 -4.75 121.76 116.99 1h3h s ALA 29 Ca 0.46 -0.30 0.09 0.00 0.00 0.00 0.00 51.96 52.21 1h3h s ALA 29 Cb 0.26 -4.16 -0.05 0.00 0.00 0.00 0.00 23.12 19.17 1h3h s ALA 29 CO 0.29 -3.28 0.47 1.28 0.00 0.00 0.00 175.76 174.52 1h3h n LEU 30 N 11.37 0.75 -4.96 0.00 4.77 -1.26 -4.85 117.00 122.83 1h3h n LEU 30 Ca 0.20 -0.63 -0.20 0.00 -0.03 0.00 0.00 56.01 55.36 1h3h n LEU 30 Cb 0.50 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.57 1h3h n LEU 30 CO 0.70 0.16 0.01 -0.70 -1.33 0.00 0.00 177.39 176.23 1h3h s GLU 31 N -1.54 3.11 0.15 3.23 -6.30 -1.26 -5.03 118.70 111.06 1h3h s GLU 31 Ca 0.05 -1.01 0.01 0.00 -2.50 0.00 0.00 54.97 51.52 1h3h s GLU 31 Cb 0.07 -2.77 -0.04 0.00 0.00 0.00 0.00 34.13 31.39 1h3h s GLU 31 CO 0.29 0.15 1.35 1.05 0.02 0.00 0.00 175.26 178.12 1h3h h GLU 32 N 1.02 0.22 -0.62 4.30 4.11 -2.03 -3.15 114.58 118.43 1h3h h GLU 32 Ca -0.47 -0.25 0.00 0.00 0.07 0.00 0.00 59.36 58.71 1h3h h GLU 32 Cb 1.25 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.58 1h3h h GLU 32 CO 0.55 0.99 0.00 -0.25 0.07 0.00 0.00 179.01 180.37 1h3h n ASP 33 N -3.65 1.77 -4.72 3.06 9.92 -1.26 -4.86 116.55 116.80 1h3h n ASP 33 Ca -0.04 -2.15 -0.28 0.00 -0.53 0.00 0.00 54.79 51.79 1h3h n ASP 33 Cb 0.83 -0.39 -0.02 0.00 -0.64 0.00 0.00 41.12 40.90 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 0.12 0.73 -4.38 -1.24 1.02 -1.19 -2.71 120.64 112.99 1h3h n GLU 34 Ca 0.07 -3.46 -0.19 0.00 -0.02 0.00 0.00 57.16 53.56 1h3h n GLU 34 Cb 0.37 0.58 -0.15 0.00 -0.02 0.00 0.00 31.44 32.22 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 1.97 -0.14 -4.62 2.96 0.36 -4.43 118.68 114.78 1h3h s LEU 35 Ca 0.19 -0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 53.92 1h3h s LEU 35 Cb -0.02 -0.49 -0.02 0.00 0.50 0.00 0.00 46.19 46.17 1h3h s LEU 35 CO 0.12 0.10 -0.11 -0.83 -1.32 0.00 0.00 176.35 174.32 1h3h s GLY 36 N -0.13 1.57 0.17 7.98 0.00 -1.26 -4.43 107.32 111.23 1h3h s GLY 36 Ca 0.02 -0.90 0.01 0.00 0.00 0.00 0.00 44.72 43.85 1h3h s GLY 36 CO -0.00 -0.11 0.10 1.97 0.00 0.00 0.00 173.10 175.06 1h3h n PHE 37 N 3.64 -0.89 -4.42 1.90 1.16 -1.26 -5.00 117.46 112.59 1h3h n PHE 37 Ca -0.18 -0.76 -0.20 0.00 -1.87 0.00 0.00 57.45 54.44 1h3h n PHE 37 Cb 0.52 -0.14 -0.10 0.00 -1.61 0.00 0.00 39.48 38.15 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 -2.70 1.60 0.32 3.97 0.52 -1.26 -3.04 118.95 118.37 1h3h s ARG 38 Ca 0.08 -1.88 -0.28 0.00 -0.52 0.00 0.00 55.73 53.13 1h3h s ARG 38 Cb -0.01 -0.69 -0.13 0.00 0.52 0.00 0.00 34.95 34.65 1h3h s ARG 38 CO 0.05 -0.23 1.19 -1.13 0.02 0.00 0.00 175.30 175.20 1h3h n SER 39 N -0.65 2.24 -3.46 0.23 3.41 -1.24 -2.97 113.62 111.18 1h3h n SER 39 Ca -0.02 1.20 -0.21 0.00 -0.26 0.00 0.00 58.87 59.58 1h3h n SER 39 Cb 0.66 -1.42 0.06 0.00 -0.26 0.00 0.00 64.21 63.26 1h3h n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1h3h n GLY 40 N 0.93 -0.91 2.87 5.00 0.00 0.30 -4.96 105.19 108.42 1h3h n GLY 40 Ca 0.06 0.43 -0.17 0.00 0.00 0.00 0.00 46.02 46.34 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 -5.19 0.47 -0.09 1.61 0.41 -1.14 -4.96 118.70 109.81 1h3h s GLU 41 Ca 0.35 -0.04 -0.12 0.00 -0.41 0.00 0.00 54.97 54.75 1h3h s GLU 41 Cb -0.08 -0.55 -0.05 0.00 -1.78 0.00 0.00 34.13 31.67 1h3h s GLU 41 CO 0.79 -0.06 0.30 0.08 -0.49 0.00 0.00 175.26 175.87 1h3h s VAL 42 N 0.70 5.26 0.01 2.63 1.01 -1.26 -1.14 120.40 127.61 1h3h s VAL 42 Ca -0.08 0.57 0.05 0.00 0.00 0.00 0.00 61.98 62.52 1h3h s VAL 42 Cb -0.11 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 1h3h s VAL 42 CO -0.01 0.51 -0.14 -0.69 0.00 0.00 0.00 175.10 174.78 1h3h s VAL 43 N -0.45 1.12 -0.44 2.92 1.01 0.61 -4.78 120.40 120.38 1h3h s VAL 43 Ca 0.19 -0.80 -0.22 0.00 0.00 0.00 0.00 61.98 61.16 1h3h s VAL 43 Cb -0.14 -0.97 0.02 0.00 0.00 0.00 0.00 36.38 35.29 1h3h s VAL 43 CO 0.07 0.17 0.70 -0.70 0.00 0.00 0.00 175.10 175.34 1h3h s GLU 44 N -0.72 3.33 0.18 2.72 2.12 -1.09 -0.23 118.70 125.00 1h3h s GLU 44 Ca 0.04 -0.27 -0.30 0.00 0.36 0.00 0.00 54.97 54.80 1h3h s GLU 44 Cb -0.07 -3.94 -0.08 0.00 0.26 0.00 0.00 34.13 30.31 1h3h s GLU 44 CO 0.00 -1.05 0.95 0.08 -0.54 0.00 0.00 175.26 174.71 1h3h s VAL 45 N 2.99 4.27 -0.54 3.70 1.01 0.40 -1.59 120.40 130.65 1h3h s VAL 45 Ca 0.25 2.08 0.05 0.00 0.00 0.00 0.00 61.98 64.36 1h3h s VAL 45 Cb -0.13 -4.33 0.07 0.00 0.00 0.00 0.00 36.38 31.99 1h3h s VAL 45 CO 0.20 0.42 0.79 0.18 0.00 0.00 0.00 175.10 176.69 1h3h n LEU 46 N 2.09 1.70 -2.77 3.92 4.77 -0.49 -4.70 117.00 121.52 1h3h n LEU 46 Ca -0.00 -1.29 -0.09 0.00 -0.03 0.00 0.00 56.01 54.59 1h3h n LEU 46 Cb 0.48 -0.03 0.06 0.00 -2.33 0.00 0.00 43.42 41.60 1h3h n LEU 46 CO 0.50 0.39 0.24 0.47 -1.33 0.00 0.00 177.39 177.66 1h3h n ASP 47 N 0.17 -2.42 0.00 -1.43 9.92 0.98 -4.95 116.55 118.83 1h3h n ASP 47 Ca 0.03 -3.47 0.08 0.00 -0.53 0.00 0.00 54.79 50.91 1h3h n ASP 47 Cb 0.18 1.72 0.39 0.00 -0.64 0.00 0.00 41.12 42.78 1h3h n ASP 47 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1h3h n SER 48 N 0.98 0.00 -4.62 -2.24 7.64 -1.26 -2.07 113.62 112.05 1h3h n SER 48 Ca 0.08 0.35 -0.43 0.00 1.01 0.00 0.00 58.87 59.89 1h3h n SER 48 Cb 0.66 -0.43 -0.02 0.00 -1.01 0.00 0.00 64.21 63.41 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 -2.86 6.38 0.00 6.43 0.15 -1.26 -4.83 113.70 117.70 1h3h s SER 49 Ca 0.11 1.31 0.00 0.00 0.70 0.00 0.00 55.95 58.07 1h3h s SER 49 Cb 0.11 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.89 1h3h s SER 49 CO 0.30 -1.31 0.00 0.59 1.20 0.00 0.00 173.24 174.02 1h3h n ASN 50 N 8.56 0.00 -0.42 5.45 3.02 -1.26 -4.88 115.26 125.73 1h3h n ASN 50 Ca 0.18 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.86 1h3h n ASN 50 Cb 0.46 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 -0.86 1.30 0.00 3.52 -0.04 -1.26 -4.78 135.00 132.88 1h3h n PRO 51 Ca 0.00 -0.85 0.00 0.00 -0.04 0.00 0.00 63.50 62.61 1h3h n PRO 51 Cb 0.00 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.98 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 -0.11 0.00 -4.35 3.54 7.64 -1.26 -5.03 113.62 114.05 1h3h n SER 52 Ca 0.14 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.64 1h3h n SER 52 Cb 0.39 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.47 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 -0.95 3.20 -0.07 1.43 0.52 -1.26 -0.72 118.94 121.09 1h3h s TRP 53 Ca 0.00 -1.01 0.01 0.00 0.02 0.00 0.00 56.10 55.12 1h3h s TRP 53 Cb 0.00 -2.31 -0.03 0.00 -1.15 0.00 0.00 33.47 29.98 1h3h s TRP 53 CO 0.00 -0.61 -0.08 -1.58 0.02 0.00 0.00 176.95 174.70 1h3h s TRP 54 N 1.51 2.89 -0.33 -1.98 0.51 -1.14 -4.68 118.94 115.73 1h3h s TRP 54 Ca 0.02 -0.04 -0.23 0.00 -2.12 0.00 0.00 56.10 53.72 1h3h s TRP 54 Cb -0.18 -1.71 0.00 0.00 -0.81 0.00 0.00 33.47 30.77 1h3h s TRP 54 CO 0.04 0.27 0.79 0.99 -0.51 0.00 0.00 176.95 178.53 1h3h s THR 55 N -0.71 4.77 0.21 2.01 2.01 -0.88 -1.85 115.64 121.20 1h3h s THR 55 Ca 0.11 1.09 0.04 0.00 0.31 0.00 0.00 61.69 63.24 1h3h s THR 55 Cb -0.11 -4.17 -0.02 0.00 0.01 0.00 0.00 72.50 68.21 1h3h s THR 55 CO 0.01 -0.31 0.15 0.61 -0.69 0.00 0.00 174.62 174.40 1h3h n GLY 56 N 4.31 3.40 2.85 4.40 0.00 -0.93 -0.02 105.19 119.22 1h3h n GLY 56 Ca 0.03 -1.84 -0.14 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.83 0.02 -0.30 1.61 1.70 -0.62 -0.81 118.95 117.72 1h3h s ARG 57 Ca 0.22 0.18 -0.12 0.00 -0.47 0.00 0.00 55.73 55.54 1h3h s ARG 57 Cb 0.01 -0.14 -0.04 0.00 -0.57 0.00 0.00 34.95 34.22 1h3h s ARG 57 CO 0.15 -0.11 0.22 -1.17 -1.08 0.00 0.00 175.30 173.31 1h3h s LEU 58 N 0.72 4.20 0.00 -1.89 0.20 0.36 -2.69 118.68 119.58 1h3h s LEU 58 Ca -0.06 -0.14 0.00 0.00 0.69 0.00 0.00 54.13 54.62 1h3h s LEU 58 Cb -0.08 -2.14 0.00 0.00 -0.43 0.00 0.00 46.19 43.54 1h3h s LEU 58 CO -0.03 -0.12 0.00 1.41 -0.29 0.00 0.00 176.35 177.32 1h3h n HIS 59 N 5.09 0.00 -1.11 5.38 8.25 -1.26 -1.04 115.22 130.53 1h3h n HIS 59 Ca -0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 1h3h n HIS 59 Cb 0.51 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.62 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 3.03 0.00 -4.57 0.41 2.85 -1.26 -5.07 115.26 110.65 1h3h n ASN 60 Ca 0.00 -1.10 -0.34 0.00 -0.11 0.00 0.00 54.58 53.03 1h3h n ASN 60 Cb 0.00 -0.02 -0.11 0.00 1.24 0.00 0.00 39.78 40.89 1h3h n ASN 60 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1h3h s LYS 61 N 0.00 3.61 -0.08 1.20 1.02 -0.20 -5.10 119.74 120.17 1h3h s LYS 61 Ca 0.00 -0.45 -0.04 0.00 0.02 0.00 0.00 55.97 55.50 1h3h s LYS 61 Cb 0.00 -2.96 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 1h3h s LYS 61 CO 0.00 0.35 0.10 -0.51 -0.92 0.00 0.00 175.35 174.36 1h3h s LEU 62 N 0.10 4.08 0.00 3.17 1.02 -1.26 -0.49 118.68 125.30 1h3h s LEU 62 Ca 0.01 0.32 0.00 0.00 0.02 0.00 0.00 54.13 54.48 1h3h s LEU 62 Cb -0.13 -2.07 0.00 0.00 0.02 0.00 0.00 46.19 44.01 1h3h s LEU 62 CO 0.02 0.37 0.00 0.61 0.02 0.00 0.00 176.35 177.37 1h3h n GLY 63 N 1.83 1.57 3.78 -3.19 0.00 0.01 -4.65 105.19 104.54 1h3h n GLY 63 Ca -0.18 -0.67 -0.31 0.00 0.00 0.00 0.00 46.02 44.86 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 2.82 0.12 0.99 1.43 -1.10 -2.18 118.68 120.76 1h3h s LEU 64 Ca 0.00 1.58 -0.12 0.00 -1.03 0.00 0.00 54.13 54.56 1h3h s LEU 64 Cb 0.00 -4.26 0.01 0.00 0.03 0.00 0.00 46.19 41.97 1h3h s LEU 64 CO 0.00 -1.97 0.31 0.72 0.23 0.00 0.00 176.35 175.64 1h3h s PHE 65 N -3.01 0.02 -0.45 0.29 -0.12 -0.77 -0.49 117.98 113.45 1h3h s PHE 65 Ca 0.61 -0.39 -0.29 0.00 -0.05 0.00 0.00 56.93 56.81 1h3h s PHE 65 Cb -0.16 0.10 0.03 0.00 -0.63 0.00 0.00 43.02 42.36 1h3h s PHE 65 CO 0.55 -0.65 1.12 -1.25 -0.05 0.00 0.00 175.22 174.94 1h3h s PRO 66 N -3.85 3.77 0.59 1.99 0.04 -1.26 -2.86 135.00 133.41 1h3h s PRO 66 Ca 0.06 0.62 0.37 0.00 0.04 0.00 0.00 61.00 62.09 1h3h s PRO 66 Cb 0.03 -3.88 1.74 0.00 0.04 0.00 0.00 34.50 32.42 1h3h s PRO 66 CO -0.10 -1.31 2.12 0.00 0.04 0.00 0.00 177.00 177.76 1h3h h ALA 67 N 9.06 1.01 0.00 8.56 0.00 -1.18 -2.56 119.26 134.15 1h3h h ALA 67 Ca -0.23 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.45 1h3h h ALA 67 Cb 1.06 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 1h3h h ALA 67 CO 1.11 0.01 -1.36 -2.95 0.00 0.00 0.00 179.25 176.06 1h3h h ASN 68 N 0.00 0.00 -0.09 0.00 -1.07 -1.91 -3.36 115.58 109.16 1h3h h ASN 68 Ca -0.00 0.00 -0.22 0.00 0.07 0.00 0.00 56.30 56.15 1h3h h ASN 68 Cb 0.33 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 36.60 1h3h h ASN 68 CO 0.00 0.89 -0.82 0.22 0.07 0.00 0.00 177.43 177.80 1h3h h TYR 69 N 0.00 0.99 -3.96 4.14 3.20 -1.85 -3.45 116.97 116.03 1h3h h TYR 69 Ca -0.16 -0.48 -0.62 0.00 3.14 0.00 0.00 58.73 60.61 1h3h h TYR 69 Cb 1.82 -0.14 -0.22 0.00 1.54 0.00 0.00 36.73 39.73 1h3h h TYR 69 CO 0.00 1.30 -0.85 0.14 -1.64 0.00 0.00 178.16 177.12 1h3h s VAL 70 N -3.56 1.93 0.05 1.81 -7.23 -1.06 -4.48 120.40 107.87 1h3h s VAL 70 Ca -0.11 -1.58 0.03 0.00 -1.81 0.00 0.00 61.98 58.51 1h3h s VAL 70 Cb 0.07 -1.73 -0.04 0.00 0.56 0.00 0.00 36.38 35.25 1h3h s VAL 70 CO 0.89 0.04 0.01 0.00 -0.31 0.00 0.00 175.10 175.73 1h3h s ALA 71 N -1.07 3.32 1.43 1.32 0.00 -1.07 -4.61 121.76 121.07 1h3h s ALA 71 Ca 0.10 -1.03 -0.23 0.00 0.00 0.00 0.00 51.96 50.80 1h3h s ALA 71 Cb -0.10 -1.28 0.35 0.00 0.00 0.00 0.00 23.12 22.09 1h3h s ALA 71 CO 0.05 0.68 0.80 -2.30 0.00 0.00 0.00 175.76 174.99 1h3h n PRO 72 N 0.93 -4.49 -3.46 0.00 -0.02 -1.14 -0.69 135.00 126.14 1h3h n PRO 72 Ca -0.12 -1.35 -0.18 0.00 -2.02 0.00 0.00 63.50 59.83 1h3h n PRO 72 Cb 0.52 -1.81 -0.12 0.00 -0.02 0.00 0.00 33.50 32.08 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 -4.86 0.24 -0.47 -0.52 1.75 -1.26 -4.60 119.30 109.58 1h3h s MET 73 Ca 0.62 0.09 -0.28 0.00 -1.25 0.00 0.00 55.69 54.87 1h3h s MET 73 Cb -0.11 -1.00 -0.01 0.00 2.84 0.00 0.00 34.83 36.54 1h3h s MET 73 CO 0.52 -0.78 1.73 1.41 -0.65 0.00 0.00 175.02 177.25 1h3h s MET 74 N 2.34 3.10 0.00 4.11 1.75 -1.26 -4.73 119.30 124.62 1h3h s MET 74 Ca 0.08 0.97 0.05 0.00 -1.25 0.00 0.00 55.69 55.54 1h3h s MET 74 Cb -0.15 -4.24 0.30 0.00 2.84 0.00 0.00 34.83 33.58 1h3h s MET 74 CO -0.19 -2.15 0.77 0.54 -0.65 0.00 0.00 175.02 173.33