#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 1.36 -0.72 1.61 1.81 -1.26 -5.05 118.95 116.69 1h3h s ARG 17 Ca 0.00 -1.82 -0.11 0.00 -1.72 0.00 0.00 55.73 52.07 1h3h s ARG 17 Cb 0.00 -2.85 0.19 0.00 -0.45 0.00 0.00 34.95 31.84 1h3h s ARG 17 CO 0.00 -1.00 0.63 0.14 -0.68 0.00 0.00 175.30 174.39 1h3h s VAL 18 N 0.82 5.03 -0.30 3.52 -7.23 -1.26 -4.47 120.40 116.51 1h3h s VAL 18 Ca 0.12 -2.43 0.19 0.00 -1.81 0.00 0.00 61.98 58.06 1h3h s VAL 18 Cb -0.20 -4.16 0.48 0.00 0.56 0.00 0.00 36.38 33.05 1h3h s VAL 18 CO -0.10 -0.96 1.03 -2.11 -0.31 0.00 0.00 175.10 172.65 1h3h n ARG 19 N 4.07 1.53 -4.01 4.82 1.85 -1.26 -4.84 116.66 118.82 1h3h n ARG 19 Ca 0.08 -3.43 -0.08 0.00 -1.00 0.00 0.00 57.85 53.42 1h3h n ARG 19 Cb 0.44 -1.46 -0.10 0.00 -1.05 0.00 0.00 32.46 30.29 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 -3.44 0.36 -0.28 2.89 0.52 -1.26 0.21 118.94 117.95 1h3h s TRP 20 Ca 0.28 -0.81 0.01 0.00 0.02 0.00 0.00 56.10 55.60 1h3h s TRP 20 Cb 0.40 -0.26 0.08 0.00 -1.15 0.00 0.00 33.47 32.54 1h3h s TRP 20 CO -0.00 -0.38 0.03 0.00 0.02 0.00 0.00 176.95 176.62 1h3h s ALA 21 N -3.32 1.97 -0.40 0.98 0.00 0.92 -2.43 121.76 119.48 1h3h s ALA 21 Ca 0.01 -1.68 -0.12 0.00 0.00 0.00 0.00 51.96 50.17 1h3h s ALA 21 Cb 0.03 -1.60 0.04 0.00 0.00 0.00 0.00 23.12 21.59 1h3h s ALA 21 CO -0.08 -1.46 0.25 0.50 0.00 0.00 0.00 175.76 174.97 1h3h s ARG 22 N 1.39 2.84 -0.24 0.00 3.52 -0.31 -0.44 118.95 125.70 1h3h s ARG 22 Ca 0.03 -1.14 -0.29 0.00 -0.13 0.00 0.00 55.73 54.20 1h3h s ARG 22 Cb -0.18 -3.83 0.01 0.00 -1.56 0.00 0.00 34.95 29.39 1h3h s ARG 22 CO -0.13 -0.77 1.10 0.00 -0.81 0.00 0.00 175.30 174.69 1h3h s ALA 23 N 1.57 3.63 -0.55 6.12 0.00 -0.87 -2.92 121.76 128.75 1h3h s ALA 23 Ca 0.03 0.18 0.23 0.00 0.00 0.00 0.00 51.96 52.40 1h3h s ALA 23 Cb -0.20 -3.60 0.13 0.00 0.00 0.00 0.00 23.12 19.45 1h3h s ALA 23 CO 0.07 -1.19 1.11 1.28 0.00 0.00 0.00 175.76 177.02 1h3h n LEU 24 N 6.54 0.65 -4.36 0.00 4.77 -1.26 0.14 117.00 123.49 1h3h n LEU 24 Ca 0.12 0.11 -0.21 0.00 -0.03 0.00 0.00 56.01 56.01 1h3h n LEU 24 Cb 0.46 -0.12 -0.08 0.00 -2.33 0.00 0.00 43.42 41.35 1h3h n LEU 24 CO 0.55 -0.02 -0.16 -0.31 -1.33 0.00 0.00 177.39 176.11 1h3h s TYR 25 N -3.22 1.69 1.06 -1.77 2.02 -1.26 -4.36 117.35 111.51 1h3h s TYR 25 Ca 0.04 -1.47 -0.16 0.00 -0.37 0.00 0.00 57.07 55.11 1h3h s TYR 25 Cb 0.13 -0.87 0.24 0.00 -0.40 0.00 0.00 41.96 41.07 1h3h s TYR 25 CO 0.78 -0.61 0.55 -3.47 -1.57 0.00 0.00 175.55 171.23 1h3h n ASP 26 N -1.26 -3.33 -4.84 2.29 2.03 -1.26 -3.68 116.55 106.50 1h3h n ASP 26 Ca 0.02 -0.55 -0.32 0.00 0.52 0.00 0.00 54.79 54.45 1h3h n ASP 26 Cb 0.64 -0.75 -0.06 0.00 -0.72 0.00 0.00 41.12 40.23 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 -1.91 3.39 -0.92 -0.67 -0.71 -1.19 -4.86 117.98 111.13 1h3h s PHE 27 Ca 0.42 0.25 0.16 0.00 -1.04 0.00 0.00 56.93 56.72 1h3h s PHE 27 Cb -0.07 -1.76 0.53 0.00 -1.21 0.00 0.00 43.02 40.51 1h3h s PHE 27 CO 0.36 0.59 1.45 0.39 -1.34 0.00 0.00 175.22 176.66 1h3h n GLU 28 N 0.89 3.20 -2.00 1.99 1.02 -1.26 -4.94 120.64 119.55 1h3h n GLU 28 Ca -0.11 -2.58 -0.39 0.00 -0.02 0.00 0.00 57.16 54.06 1h3h n GLU 28 Cb 0.52 -1.65 -0.03 0.00 -0.02 0.00 0.00 31.44 30.27 1h3h n GLU 28 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1h3h s ALA 29 N -1.71 2.31 -0.93 0.62 0.00 -1.26 -4.73 121.76 116.06 1h3h s ALA 29 Ca 0.40 -0.37 0.18 0.00 0.00 0.00 0.00 51.96 52.16 1h3h s ALA 29 Cb 0.26 -4.23 -0.17 0.00 0.00 0.00 0.00 23.12 18.97 1h3h s ALA 29 CO 0.19 -3.61 0.78 1.28 0.00 0.00 0.00 175.76 174.39 1h3h n LEU 30 N 12.35 0.94 -4.91 0.00 4.77 -1.26 -4.85 117.00 124.04 1h3h n LEU 30 Ca 0.22 -0.53 -0.28 0.00 -0.03 0.00 0.00 56.01 55.39 1h3h n LEU 30 Cb 0.51 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.56 1h3h n LEU 30 CO 0.70 0.22 -0.14 -1.61 -1.33 0.00 0.00 177.39 175.24 1h3h s GLU 31 N -2.62 3.33 0.28 3.23 2.02 -1.26 -5.01 118.70 118.67 1h3h s GLU 31 Ca 0.08 -0.58 0.11 0.00 0.02 0.00 0.00 54.97 54.59 1h3h s GLU 31 Cb 0.14 -2.94 0.36 0.00 0.10 0.00 0.00 34.13 31.79 1h3h s GLU 31 CO 0.70 0.55 1.61 1.05 0.02 0.00 0.00 175.26 179.19 1h3h h GLU 32 N 2.58 0.00 0.00 1.61 4.11 -2.02 -2.77 114.58 118.09 1h3h h GLU 32 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1h3h h GLU 32 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1h3h h GLU 32 CO 0.70 0.61 0.00 -0.25 0.07 0.00 0.00 179.01 180.14 1h3h n ASP 33 N -3.79 0.00 -4.41 3.06 9.92 -1.26 -4.81 116.55 115.27 1h3h n ASP 33 Ca -0.01 -1.00 -0.21 0.00 -0.53 0.00 0.00 54.79 53.04 1h3h n ASP 33 Cb 0.61 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 41.10 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 -0.93 0.79 -4.35 -1.24 1.02 -1.04 -2.72 120.64 112.17 1h3h n GLU 34 Ca 0.18 -2.87 -0.20 0.00 -0.02 0.00 0.00 57.16 54.25 1h3h n GLU 34 Cb 0.08 0.25 -0.13 0.00 -0.02 0.00 0.00 31.44 31.62 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 2.17 -0.10 -4.62 2.96 0.16 -4.45 118.68 114.80 1h3h s LEU 35 Ca 0.29 -0.45 0.03 0.00 -0.22 0.00 0.00 54.13 53.78 1h3h s LEU 35 Cb -0.02 -0.58 -0.01 0.00 0.50 0.00 0.00 46.19 46.07 1h3h s LEU 35 CO 0.19 0.03 -0.20 -0.83 -1.32 0.00 0.00 176.35 174.21 1h3h s GLY 36 N -1.12 1.41 0.18 7.98 0.00 -1.26 -4.42 107.32 110.09 1h3h s GLY 36 Ca 0.01 -0.95 0.01 0.00 0.00 0.00 0.00 44.72 43.79 1h3h s GLY 36 CO 0.01 -0.35 0.07 1.97 0.00 0.00 0.00 173.10 174.81 1h3h n PHE 37 N 3.38 -0.44 -4.34 1.90 1.16 -1.26 -5.01 117.46 112.84 1h3h n PHE 37 Ca -0.18 -0.83 -0.18 0.00 -1.87 0.00 0.00 57.45 54.39 1h3h n PHE 37 Cb 0.53 -0.14 -0.10 0.00 -1.61 0.00 0.00 39.48 38.16 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 1.34 0.40 3.97 0.52 -1.26 -3.14 118.95 118.08 1h3h s ARG 38 Ca 0.06 -1.66 -0.25 0.00 -0.52 0.00 0.00 55.73 53.36 1h3h s ARG 38 Cb -0.00 -0.80 -0.11 0.00 0.52 0.00 0.00 34.95 34.55 1h3h s ARG 38 CO 0.04 -0.01 0.96 0.45 0.02 0.00 0.00 175.30 176.75 1h3h n SER 39 N -0.42 1.01 -3.49 0.23 2.88 -1.24 -2.98 113.62 109.62 1h3h n SER 39 Ca -0.06 1.04 -0.20 0.00 -1.33 0.00 0.00 58.87 58.32 1h3h n SER 39 Cb 0.63 -1.32 0.06 0.00 -0.75 0.00 0.00 64.21 62.83 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 1.26 -0.68 3.43 0.46 0.00 0.38 -4.96 105.19 105.09 1h3h n GLY 40 Ca 0.10 0.31 -0.21 0.00 0.00 0.00 0.00 46.02 46.21 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 -5.33 1.57 -0.05 1.61 0.41 -1.01 -4.96 118.70 110.94 1h3h s GLU 41 Ca 0.21 -1.81 0.03 0.00 -0.41 0.00 0.00 54.97 52.98 1h3h s GLU 41 Cb -0.04 -1.10 0.01 0.00 -1.78 0.00 0.00 34.13 31.22 1h3h s GLU 41 CO 0.78 -0.01 -0.13 0.08 -0.49 0.00 0.00 175.26 175.49 1h3h s VAL 42 N -3.07 1.14 0.02 2.63 1.01 -1.26 -2.06 120.40 118.82 1h3h s VAL 42 Ca 0.31 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.82 1h3h s VAL 42 Cb 0.05 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 1h3h s VAL 42 CO 0.13 0.35 -0.16 -0.69 0.00 0.00 0.00 175.10 174.72 1h3h s VAL 43 N 0.41 1.26 -0.44 2.92 1.01 0.41 -4.65 120.40 121.32 1h3h s VAL 43 Ca -0.09 -0.94 -0.20 0.00 0.00 0.00 0.00 61.98 60.75 1h3h s VAL 43 Cb -0.13 -1.10 0.03 0.00 0.00 0.00 0.00 36.38 35.17 1h3h s VAL 43 CO 0.03 0.15 0.59 -0.70 0.00 0.00 0.00 175.10 175.17 1h3h s GLU 44 N -0.91 3.21 0.22 2.72 2.12 -0.99 -0.06 118.70 125.02 1h3h s GLU 44 Ca 0.04 -0.53 -0.30 0.00 0.36 0.00 0.00 54.97 54.54 1h3h s GLU 44 Cb -0.07 -3.97 -0.09 0.00 0.26 0.00 0.00 34.13 30.26 1h3h s GLU 44 CO 0.01 -1.00 0.95 0.08 -0.54 0.00 0.00 175.26 174.76 1h3h s VAL 45 N 2.64 4.11 -0.06 3.70 1.01 0.13 -1.61 120.40 130.32 1h3h s VAL 45 Ca 0.19 2.06 0.15 0.00 0.00 0.00 0.00 61.98 64.38 1h3h s VAL 45 Cb -0.15 -4.31 -0.23 0.00 0.00 0.00 0.00 36.38 31.69 1h3h s VAL 45 CO 0.17 0.47 0.25 0.18 0.00 0.00 0.00 175.10 176.16 1h3h n LEU 46 N 1.68 0.00 -3.19 3.92 4.77 -0.51 -4.73 117.00 118.94 1h3h n LEU 46 Ca -0.01 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.79 1h3h n LEU 46 Cb 0.47 0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.63 1h3h n LEU 46 CO 0.50 0.12 -0.14 -1.81 -1.33 0.00 0.00 177.39 174.74 1h3h s ASP 47 N -4.17 0.45 0.00 -1.43 1.01 -0.08 -4.95 116.67 107.49 1h3h s ASP 47 Ca -0.06 -2.27 0.29 0.00 0.71 0.00 0.00 52.55 51.22 1h3h s ASP 47 Cb 0.08 0.55 1.69 0.00 1.01 0.00 0.00 42.92 46.26 1h3h s ASP 47 CO 0.65 -0.16 2.07 -1.54 0.21 0.00 0.00 175.17 176.40 1h3h n SER 48 N 3.24 0.00 -4.62 0.27 3.41 -1.26 -2.30 113.62 112.35 1h3h n SER 48 Ca 0.21 -0.76 -0.43 0.00 -0.26 0.00 0.00 58.87 57.64 1h3h n SER 48 Cb 0.50 -0.06 -0.02 0.00 -0.26 0.00 0.00 64.21 64.37 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 -2.12 6.64 0.00 4.04 0.15 -1.26 -4.85 113.70 116.31 1h3h s SER 49 Ca 0.41 1.05 0.00 0.00 0.70 0.00 0.00 55.95 58.11 1h3h s SER 49 Cb 0.20 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.97 1h3h s SER 49 CO 0.36 -1.13 0.00 0.59 1.20 0.00 0.00 173.24 174.26 1h3h n ASN 50 N 7.76 0.00 -0.60 5.45 3.02 -1.26 -4.89 115.26 124.73 1h3h n ASN 50 Ca 0.14 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 39.99 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 -0.81 1.76 0.00 3.52 -0.04 -1.26 -4.79 135.00 133.38 1h3h n PRO 51 Ca 0.00 -1.21 0.00 0.00 -0.04 0.00 0.00 63.50 62.25 1h3h n PRO 51 Cb 0.00 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 31.99 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 0.44 0.00 -4.30 3.54 7.64 -1.26 -5.02 113.62 114.66 1h3h n SER 52 Ca 0.16 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.68 1h3h n SER 52 Cb 0.44 0.01 -0.13 0.00 -1.01 0.00 0.00 64.21 63.52 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 -1.05 3.15 -0.02 1.43 0.52 -1.26 -0.37 118.94 121.34 1h3h s TRP 53 Ca 0.00 -1.19 0.02 0.00 0.02 0.00 0.00 56.10 54.95 1h3h s TRP 53 Cb 0.00 -2.21 -0.03 0.00 -1.15 0.00 0.00 33.47 30.08 1h3h s TRP 53 CO 0.00 -0.64 -0.06 -1.58 0.02 0.00 0.00 176.95 174.70 1h3h s TRP 54 N 1.44 2.94 -0.32 -1.98 0.51 -1.13 -4.72 118.94 115.69 1h3h s TRP 54 Ca 0.01 0.01 -0.24 0.00 -2.12 0.00 0.00 56.10 53.76 1h3h s TRP 54 Cb -0.17 -1.65 0.00 0.00 -0.81 0.00 0.00 33.47 30.84 1h3h s TRP 54 CO 0.01 0.38 0.81 0.99 -0.51 0.00 0.00 176.95 178.63 1h3h s THR 55 N -0.95 4.76 0.20 2.01 2.01 -0.97 -1.61 115.64 121.08 1h3h s THR 55 Ca 0.16 1.16 -0.06 0.00 0.31 0.00 0.00 61.69 63.26 1h3h s THR 55 Cb -0.11 -4.18 -0.02 0.00 0.01 0.00 0.00 72.50 68.19 1h3h s THR 55 CO 0.06 -0.31 0.25 -0.83 -0.69 0.00 0.00 174.62 173.10 1h3h s GLY 56 N 1.67 0.94 -0.06 4.40 0.00 0.11 -0.91 107.32 113.47 1h3h s GLY 56 Ca 0.33 -1.28 0.03 0.00 0.00 0.00 0.00 44.72 43.80 1h3h s GLY 56 CO 0.14 -1.07 -0.15 1.09 0.00 0.00 0.00 173.10 173.11 1h3h s ARG 57 N -4.07 1.83 -0.31 2.90 1.70 -0.63 -1.25 118.95 119.12 1h3h s ARG 57 Ca 0.28 -0.51 -0.12 0.00 -0.47 0.00 0.00 55.73 54.91 1h3h s ARG 57 Cb 0.04 -1.52 -0.03 0.00 -0.57 0.00 0.00 34.95 32.87 1h3h s ARG 57 CO 0.07 0.11 0.22 -1.17 -1.08 0.00 0.00 175.30 173.45 1h3h s LEU 58 N 0.44 4.29 0.00 -1.89 0.20 0.10 -2.35 118.68 119.48 1h3h s LEU 58 Ca -0.12 -0.23 0.00 0.00 0.69 0.00 0.00 54.13 54.47 1h3h s LEU 58 Cb -0.15 -2.14 0.00 0.00 -0.43 0.00 0.00 46.19 43.48 1h3h s LEU 58 CO 0.04 -0.16 0.00 1.41 -0.29 0.00 0.00 176.35 177.35 1h3h n HIS 59 N 5.09 0.00 -1.04 5.38 8.25 -1.26 -0.93 115.22 130.72 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 2.57 0.00 -4.50 0.41 5.15 -1.26 -5.06 115.26 112.57 1h3h n ASN 60 Ca 0.00 -1.01 -0.35 0.00 -0.60 0.00 0.00 54.58 52.62 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 3.72 0.04 1.20 1.02 -0.10 -5.10 119.74 120.51 1h3h s LYS 61 Ca 0.00 -0.47 0.01 0.00 0.02 0.00 0.00 55.97 55.53 1h3h s LYS 61 Cb 0.00 -3.13 -0.04 0.00 -0.52 0.00 0.00 37.83 34.14 1h3h s LYS 61 CO 0.00 0.07 0.10 -0.51 -0.92 0.00 0.00 175.35 174.09 1h3h s LEU 62 N 0.87 3.94 0.00 3.17 1.02 -1.26 0.03 118.68 126.44 1h3h s LEU 62 Ca 0.02 0.11 0.00 0.00 0.02 0.00 0.00 54.13 54.27 1h3h s LEU 62 Cb -0.14 -2.46 0.00 0.00 0.02 0.00 0.00 46.19 43.61 1h3h s LEU 62 CO 0.02 0.22 0.00 0.61 0.02 0.00 0.00 176.35 177.22 1h3h n GLY 63 N 0.76 -1.36 3.91 -3.19 0.00 -0.38 -4.67 105.19 100.26 1h3h n GLY 63 Ca -0.10 -1.11 -0.32 0.00 0.00 0.00 0.00 46.02 44.49 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 4.33 0.12 0.99 1.43 -1.10 0.07 118.68 124.52 1h3h s LEU 64 Ca 0.00 0.28 0.01 0.00 -1.03 0.00 0.00 54.13 53.39 1h3h s LEU 64 Cb 0.00 -2.84 -0.04 0.00 0.03 0.00 0.00 46.19 43.34 1h3h s LEU 64 CO 0.00 0.20 -0.03 0.72 0.23 0.00 0.00 176.35 177.46 1h3h s PHE 65 N -1.45 0.95 -0.57 0.29 -0.12 -0.63 -0.66 117.98 115.78 1h3h s PHE 65 Ca 0.32 -0.99 -0.28 0.00 -0.05 0.00 0.00 56.93 55.94 1h3h s PHE 65 Cb -0.13 -0.55 0.02 0.00 -0.63 0.00 0.00 43.02 41.73 1h3h s PHE 65 CO 0.25 -0.22 1.26 -1.25 -0.05 0.00 0.00 175.22 175.21 1h3h s PRO 66 N -3.88 3.46 0.18 1.99 0.04 -1.26 -2.81 135.00 132.71 1h3h s PRO 66 Ca 0.16 0.33 0.18 0.00 0.04 0.00 0.00 61.00 61.71 1h3h s PRO 66 Cb 0.06 -4.05 0.82 0.00 0.04 0.00 0.00 34.50 31.37 1h3h s PRO 66 CO -0.02 -1.75 1.55 0.00 0.04 0.00 0.00 177.00 176.82 1h3h n ALA 67 N 8.78 1.44 -0.01 8.56 0.00 0.50 -1.88 120.51 137.91 1h3h n ALA 67 Ca 0.10 0.07 -0.09 0.00 0.00 0.00 0.00 53.44 53.52 1h3h n ALA 67 Cb 0.49 -1.29 -0.14 0.00 0.00 0.00 0.00 19.45 18.51 1h3h n ALA 67 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1h3h h ASN 68 N 0.00 0.02 0.08 0.00 -1.24 -1.90 -3.37 115.58 109.18 1h3h h ASN 68 Ca 0.00 -0.04 -0.26 0.00 0.71 0.00 0.00 56.30 56.71 1h3h h ASN 68 Cb 0.21 -0.01 0.02 0.00 0.73 0.00 0.00 38.32 39.28 1h3h h ASN 68 CO 0.00 1.04 -1.05 0.22 -1.29 0.00 0.00 177.43 176.35 1h3h h TYR 69 N 0.00 0.90 -2.40 0.67 3.20 -1.75 -3.47 116.97 114.12 1h3h h TYR 69 Ca -0.25 -0.55 -0.54 0.00 3.14 0.00 0.00 58.73 60.53 1h3h h TYR 69 Cb 1.98 -0.08 -0.14 0.00 1.54 0.00 0.00 36.73 40.03 1h3h h TYR 69 CO 0.00 1.39 -0.70 0.14 -1.64 0.00 0.00 178.16 177.35 1h3h s VAL 70 N -3.02 1.99 0.10 1.81 -7.23 -0.98 -4.55 120.40 108.53 1h3h s VAL 70 Ca -0.11 -2.22 0.06 0.00 -1.81 0.00 0.00 61.98 57.90 1h3h s VAL 70 Cb 0.05 -2.40 -0.03 0.00 0.56 0.00 0.00 36.38 34.55 1h3h s VAL 70 CO 0.90 -0.34 -0.15 0.00 -0.31 0.00 0.00 175.10 175.20 1h3h s ALA 71 N -2.79 1.39 1.38 1.32 0.00 -1.15 -4.56 121.76 117.35 1h3h s ALA 71 Ca 0.29 -1.18 -0.20 0.00 0.00 0.00 0.00 51.96 50.87 1h3h s ALA 71 Cb 0.01 -0.09 0.31 0.00 0.00 0.00 0.00 23.12 23.35 1h3h s ALA 71 CO 0.13 0.14 0.77 -2.30 0.00 0.00 0.00 175.76 174.50 1h3h n PRO 72 N 0.85 -4.16 -3.41 0.00 -0.02 -1.02 -1.16 135.00 126.07 1h3h n PRO 72 Ca -0.18 -1.28 -0.18 0.00 -2.02 0.00 0.00 63.50 59.84 1h3h n PRO 72 Cb 0.56 -1.56 -0.10 0.00 -0.02 0.00 0.00 33.50 32.37 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 -4.82 0.32 -0.40 -0.52 1.75 -1.26 -4.71 119.30 109.66 1h3h s MET 73 Ca 0.57 -0.18 -0.28 0.00 -1.25 0.00 0.00 55.69 54.55 1h3h s MET 73 Cb -0.09 -0.69 -0.01 0.00 2.84 0.00 0.00 34.83 36.87 1h3h s MET 73 CO 0.47 -1.03 1.69 1.41 -0.65 0.00 0.00 175.02 176.91 1h3h s MET 74 N 2.33 3.30 0.00 4.11 1.75 -1.26 -4.84 119.30 124.69 1h3h s MET 74 Ca 0.09 1.15 0.02 0.00 -1.25 0.00 0.00 55.69 55.70 1h3h s MET 74 Cb -0.14 -4.18 0.13 0.00 2.84 0.00 0.00 34.83 33.48 1h3h s MET 74 CO -0.33 -1.91 0.61 0.54 -0.65 0.00 0.00 175.02 173.29