#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 2.81 -1.64 1.61 1.85 -1.26 -4.98 116.66 115.06 1h3h n ARG 17 Ca 0.00 -3.44 -0.39 0.00 -1.00 0.00 0.00 57.85 53.02 1h3h n ARG 17 Cb 0.00 -2.27 -0.03 0.00 -1.05 0.00 0.00 32.46 29.11 1h3h n ARG 17 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 1h3h s VAL 18 N -4.65 3.06 -0.29 8.89 -7.23 -1.26 -4.79 120.40 114.13 1h3h s VAL 18 Ca 0.61 0.05 0.19 0.00 -1.81 0.00 0.00 61.98 61.02 1h3h s VAL 18 Cb 0.49 -3.12 0.49 0.00 0.56 0.00 0.00 36.38 34.80 1h3h s VAL 18 CO 0.01 -0.10 1.08 -2.11 -0.31 0.00 0.00 175.10 173.67 1h3h n ARG 19 N 8.89 1.89 -4.06 4.82 1.85 -1.26 -4.79 116.66 124.00 1h3h n ARG 19 Ca 0.32 -3.57 -0.08 0.00 -1.00 0.00 0.00 57.85 53.52 1h3h n ARG 19 Cb 0.50 -1.63 -0.10 0.00 -1.05 0.00 0.00 32.46 30.19 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 -3.59 0.44 -0.27 2.89 0.52 -1.26 0.07 118.94 117.73 1h3h s TRP 20 Ca 0.31 -0.91 -0.01 0.00 0.02 0.00 0.00 56.10 55.51 1h3h s TRP 20 Cb 0.37 -0.33 0.08 0.00 -1.15 0.00 0.00 33.47 32.44 1h3h s TRP 20 CO -0.02 -0.33 0.05 0.00 0.02 0.00 0.00 176.95 176.68 1h3h s ALA 21 N -3.21 1.61 -0.37 0.98 0.00 0.85 -2.74 121.76 118.88 1h3h s ALA 21 Ca 0.00 -1.46 -0.10 0.00 0.00 0.00 0.00 51.96 50.41 1h3h s ALA 21 Cb 0.03 -1.51 0.03 0.00 0.00 0.00 0.00 23.12 21.67 1h3h s ALA 21 CO -0.07 -1.46 0.19 0.50 0.00 0.00 0.00 175.76 174.91 1h3h s ARG 22 N 1.57 2.76 0.01 0.00 3.52 -0.28 -0.68 118.95 125.85 1h3h s ARG 22 Ca 0.04 -1.13 -0.30 0.00 -0.13 0.00 0.00 55.73 54.21 1h3h s ARG 22 Cb -0.18 -3.68 -0.05 0.00 -1.56 0.00 0.00 34.95 29.48 1h3h s ARG 22 CO -0.16 -0.71 1.23 0.00 -0.81 0.00 0.00 175.30 174.84 1h3h s ALA 23 N 1.51 3.46 -0.22 6.12 0.00 -0.95 -2.88 121.76 128.80 1h3h s ALA 23 Ca 0.01 0.77 0.22 0.00 0.00 0.00 0.00 51.96 52.96 1h3h s ALA 23 Cb -0.19 -3.49 -0.32 0.00 0.00 0.00 0.00 23.12 19.12 1h3h s ALA 23 CO 0.06 -0.63 0.56 1.28 0.00 0.00 0.00 175.76 177.04 1h3h n LEU 24 N 4.61 0.20 -4.37 0.00 4.77 -1.26 0.11 117.00 121.06 1h3h n LEU 24 Ca 0.10 -0.09 -0.21 0.00 -0.03 0.00 0.00 56.01 55.77 1h3h n LEU 24 Cb 0.46 -0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.47 1h3h n LEU 24 CO 0.56 0.05 -0.15 -0.31 -1.33 0.00 0.00 177.39 176.21 1h3h s TYR 25 N -3.42 1.73 0.42 -1.77 2.02 -1.26 -4.47 117.35 110.60 1h3h s TYR 25 Ca -0.05 -1.51 -0.06 0.00 -0.37 0.00 0.00 57.07 55.09 1h3h s TYR 25 Cb 0.14 -0.87 0.09 0.00 -0.40 0.00 0.00 41.96 40.92 1h3h s TYR 25 CO 0.90 -0.64 0.21 -3.47 -1.57 0.00 0.00 175.55 170.98 1h3h n ASP 26 N -1.38 -2.11 -4.85 2.29 2.03 -1.26 -3.72 116.55 107.55 1h3h n ASP 26 Ca 0.02 -0.21 -0.33 0.00 0.52 0.00 0.00 54.79 54.79 1h3h n ASP 26 Cb 0.64 -0.30 -0.06 0.00 -0.72 0.00 0.00 41.12 40.68 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 -1.17 3.42 -1.53 -0.67 -0.71 -1.19 -4.82 117.98 111.31 1h3h s PHE 27 Ca 0.16 0.26 0.20 0.00 -1.04 0.00 0.00 56.93 56.52 1h3h s PHE 27 Cb -0.03 -1.77 0.70 0.00 -1.21 0.00 0.00 43.02 40.71 1h3h s PHE 27 CO 0.14 0.59 1.60 0.39 -1.34 0.00 0.00 175.22 176.60 1h3h n GLU 28 N 0.86 3.30 -2.06 1.99 -0.58 -1.26 -4.92 120.64 117.97 1h3h n GLU 28 Ca -0.10 -2.81 -0.40 0.00 -0.42 0.00 0.00 57.16 53.43 1h3h n GLU 28 Cb 0.52 -1.75 -0.03 0.00 -0.57 0.00 0.00 31.44 29.61 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 -1.46 2.41 -0.69 0.62 0.00 -1.26 -4.74 121.76 116.64 1h3h s ALA 29 Ca 0.51 -0.41 0.15 0.00 0.00 0.00 0.00 51.96 52.21 1h3h s ALA 29 Cb 0.30 -4.21 -0.17 0.00 0.00 0.00 0.00 23.12 19.04 1h3h s ALA 29 CO 0.29 -3.47 0.63 1.28 0.00 0.00 0.00 175.76 174.49 1h3h n LEU 30 N 11.81 0.69 -4.99 0.00 4.77 -1.26 -4.87 117.00 123.14 1h3h n LEU 30 Ca 0.20 -0.48 -0.19 0.00 -0.03 0.00 0.00 56.01 55.51 1h3h n LEU 30 Cb 0.50 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.62 1h3h n LEU 30 CO 0.70 0.17 0.20 -1.61 -1.33 0.00 0.00 177.39 175.52 1h3h s GLU 31 N -2.46 2.54 -0.04 3.23 0.41 -1.26 -5.04 118.70 116.07 1h3h s GLU 31 Ca 0.05 -1.50 0.12 0.00 -0.41 0.00 0.00 54.97 53.23 1h3h s GLU 31 Cb 0.11 -2.61 -0.23 0.00 -1.78 0.00 0.00 34.13 29.63 1h3h s GLU 31 CO 0.62 -0.52 0.69 1.05 -0.49 0.00 0.00 175.26 176.61 1h3h h GLU 32 N 0.53 0.00 0.00 1.61 4.11 -2.03 -3.32 114.58 115.48 1h3h h GLU 32 Ca -0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.07 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 0.46 0.50 0.00 -3.47 0.07 0.00 0.00 179.01 176.57 1h3h n ASP 33 N -3.05 0.00 -2.18 3.06 2.03 -1.26 -4.82 116.55 110.33 1h3h n ASP 33 Ca -0.16 -1.46 -0.01 0.00 0.52 0.00 0.00 54.79 53.67 1h3h n ASP 33 Cb 1.05 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.45 1h3h n ASP 33 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1h3h n GLU 34 N -0.76 1.22 -3.92 -0.67 1.02 -1.25 -2.97 120.64 113.30 1h3h n GLU 34 Ca 0.12 -0.21 -0.13 0.00 -0.02 0.00 0.00 57.16 56.93 1h3h n GLU 34 Cb 0.06 0.01 -0.14 0.00 -0.02 0.00 0.00 31.44 31.34 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 1.99 -0.12 -4.62 2.96 0.11 -4.25 118.68 114.75 1h3h s LEU 35 Ca 0.03 -0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.93 1h3h s LEU 35 Cb -0.00 -0.05 -0.01 0.00 0.50 0.00 0.00 46.19 46.63 1h3h s LEU 35 CO 0.02 0.01 -0.16 -0.83 -1.32 0.00 0.00 176.35 174.07 1h3h s GLY 36 N -0.01 1.49 0.22 7.98 0.00 -1.26 -4.39 107.32 111.36 1h3h s GLY 36 Ca 0.00 -0.91 0.01 0.00 0.00 0.00 0.00 44.72 43.82 1h3h s GLY 36 CO -0.00 -0.25 0.10 1.97 0.00 0.00 0.00 173.10 174.92 1h3h n PHE 37 N 3.47 -0.53 -4.32 1.90 1.16 -1.26 -5.01 117.46 112.87 1h3h n PHE 37 Ca -0.18 -0.97 -0.17 0.00 -1.87 0.00 0.00 57.45 54.26 1h3h n PHE 37 Cb 0.53 -0.16 -0.10 0.00 -1.61 0.00 0.00 39.48 38.13 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 -2.85 1.27 0.26 3.97 0.52 -1.26 -3.13 118.95 117.73 1h3h s ARG 38 Ca 0.08 -1.60 -0.28 0.00 -0.52 0.00 0.00 55.73 53.41 1h3h s ARG 38 Cb -0.01 -0.81 -0.15 0.00 0.52 0.00 0.00 34.95 34.50 1h3h s ARG 38 CO 0.05 0.04 0.84 -1.13 0.02 0.00 0.00 175.30 175.12 1h3h n SER 39 N -0.36 0.41 -3.38 0.23 3.41 -1.24 -3.14 113.62 109.54 1h3h n SER 39 Ca -0.08 1.16 -0.17 0.00 -0.26 0.00 0.00 58.87 59.52 1h3h n SER 39 Cb 0.62 -1.17 0.03 0.00 -0.26 0.00 0.00 64.21 63.43 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 1.49 -1.15 3.24 5.00 0.00 0.30 -4.97 105.19 109.09 1h3h n GLY 40 Ca 0.12 0.52 -0.13 0.00 0.00 0.00 0.00 46.02 46.53 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 -4.53 1.12 -0.09 1.61 2.02 -1.14 -4.95 118.70 112.74 1h3h s GLU 41 Ca 0.29 -1.54 0.04 0.00 0.02 0.00 0.00 54.97 53.78 1h3h s GLU 41 Cb -0.07 -0.23 -0.01 0.00 0.10 0.00 0.00 34.13 33.93 1h3h s GLU 41 CO 0.80 -0.15 -0.23 0.08 0.02 0.00 0.00 175.26 175.77 1h3h s VAL 42 N -3.69 2.15 0.01 2.63 1.01 -1.26 -2.24 120.40 119.01 1h3h s VAL 42 Ca 0.25 -1.00 0.04 0.00 0.00 0.00 0.00 61.98 61.27 1h3h s VAL 42 Cb 0.06 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.62 1h3h s VAL 42 CO 0.04 0.56 -0.13 -0.69 0.00 0.00 0.00 175.10 174.88 1h3h s VAL 43 N 0.13 1.04 -0.39 2.92 1.01 0.14 -4.59 120.40 120.66 1h3h s VAL 43 Ca -0.12 -0.71 -0.17 0.00 0.00 0.00 0.00 61.98 60.98 1h3h s VAL 43 Cb -0.16 -0.90 0.01 0.00 0.00 0.00 0.00 36.38 35.33 1h3h s VAL 43 CO 0.07 0.18 0.44 -0.70 0.00 0.00 0.00 175.10 175.09 1h3h s GLU 44 N -0.60 3.32 -0.10 2.72 2.12 -1.03 -0.10 118.70 125.03 1h3h s GLU 44 Ca 0.04 -0.55 -0.30 0.00 0.36 0.00 0.00 54.97 54.53 1h3h s GLU 44 Cb -0.06 -3.90 -0.01 0.00 0.26 0.00 0.00 34.13 30.42 1h3h s GLU 44 CO 0.00 -0.74 1.03 0.08 -0.54 0.00 0.00 175.26 175.09 1h3h s VAL 45 N 2.19 4.72 -2.77 3.70 1.01 0.11 -1.60 120.40 127.76 1h3h s VAL 45 Ca 0.14 1.99 0.23 0.00 0.00 0.00 0.00 61.98 64.33 1h3h s VAL 45 Cb -0.16 -4.28 0.22 0.00 0.00 0.00 0.00 36.38 32.16 1h3h s VAL 45 CO 0.13 0.01 1.25 0.18 0.00 0.00 0.00 175.10 176.67 1h3h n LEU 46 N 5.01 2.99 -2.72 3.92 4.77 -0.60 -4.70 117.00 125.67 1h3h n LEU 46 Ca 0.09 -1.09 -0.06 0.00 -0.03 0.00 0.00 56.01 54.93 1h3h n LEU 46 Cb 0.48 -0.04 0.05 0.00 -2.33 0.00 0.00 43.42 41.58 1h3h n LEU 46 CO 0.52 0.53 0.31 -0.67 -1.33 0.00 0.00 177.39 176.76 1h3h n ASP 47 N 1.31 -2.46 0.00 -1.43 -0.08 0.62 -4.95 116.55 109.55 1h3h n ASP 47 Ca 0.14 -2.58 0.11 0.00 -1.51 0.00 0.00 54.79 50.94 1h3h n ASP 47 Cb 0.57 1.42 0.58 0.00 2.34 0.00 0.00 41.12 46.04 1h3h n ASP 47 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1h3h n SER 48 N 1.99 0.00 -4.62 1.67 3.41 -1.26 -2.23 113.62 112.58 1h3h n SER 48 Ca 0.09 -0.33 -0.43 0.00 -0.26 0.00 0.00 58.87 57.94 1h3h n SER 48 Cb 0.64 -0.15 -0.02 0.00 -0.26 0.00 0.00 64.21 64.41 1h3h n SER 48 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1h3h s SER 49 N -2.30 6.58 0.00 4.04 0.01 -1.26 -4.85 113.70 115.93 1h3h s SER 49 Ca 0.26 1.14 0.00 0.00 1.31 0.00 0.00 55.95 58.66 1h3h s SER 49 Cb 0.14 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.84 1h3h s SER 49 CO 0.29 -1.17 0.00 0.59 0.41 0.00 0.00 173.24 173.36 1h3h n ASN 50 N 7.92 0.00 -0.67 2.44 3.02 -1.26 -4.86 115.26 121.85 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 0.36 0.00 -0.61 0.00 0.00 39.78 40.00 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 -0.89 1.90 0.06 3.52 -0.04 -1.26 -4.80 135.00 133.49 1h3h n PRO 51 Ca 0.00 -1.33 0.00 0.00 -0.04 0.00 0.00 63.50 62.13 1h3h n PRO 51 Cb 0.00 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.01 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 0.58 -1.10 -4.53 3.54 7.64 -1.26 -5.05 113.62 113.44 1h3h n SER 52 Ca 0.17 0.32 -0.39 0.00 1.01 0.00 0.00 58.87 59.98 1h3h n SER 52 Cb 0.41 1.27 -0.11 0.00 -1.01 0.00 0.00 64.21 64.78 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 -2.00 3.22 0.02 1.43 0.52 -1.26 -0.98 118.94 119.88 1h3h s TRP 53 Ca 0.00 -0.17 0.02 0.00 0.02 0.00 0.00 56.10 55.97 1h3h s TRP 53 Cb 0.00 -2.43 -0.04 0.00 -1.15 0.00 0.00 33.47 29.85 1h3h s TRP 53 CO 0.00 -0.32 -0.01 -1.58 0.02 0.00 0.00 176.95 175.06 1h3h s TRP 54 N 1.72 3.02 -0.33 -1.98 0.51 -1.13 -4.73 118.94 116.03 1h3h s TRP 54 Ca 0.06 0.04 -0.21 0.00 -2.12 0.00 0.00 56.10 53.87 1h3h s TRP 54 Cb -0.17 -1.63 -0.00 0.00 -0.81 0.00 0.00 33.47 30.86 1h3h s TRP 54 CO 0.10 0.45 0.66 0.99 -0.51 0.00 0.00 176.95 178.64 1h3h s THR 55 N -1.12 4.88 0.00 2.01 2.01 -0.94 -1.94 115.64 120.55 1h3h s THR 55 Ca 0.20 0.80 0.00 0.00 0.31 0.00 0.00 61.69 63.00 1h3h s THR 55 Cb -0.11 -4.06 0.00 0.00 0.01 0.00 0.00 72.50 68.33 1h3h s THR 55 CO 0.11 -0.24 0.00 0.61 -0.69 0.00 0.00 174.62 174.41 1h3h n GLY 56 N 4.50 4.40 3.18 4.40 0.00 -0.75 -0.28 105.19 120.64 1h3h n GLY 56 Ca -0.00 -1.53 -0.12 0.00 0.00 0.00 0.00 46.02 44.37 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 -0.78 0.32 -0.33 1.61 1.70 -0.63 -0.74 118.95 120.11 1h3h s ARG 57 Ca 0.00 0.64 -0.12 0.00 -0.47 0.00 0.00 55.73 55.77 1h3h s ARG 57 Cb 0.00 -0.02 -0.02 0.00 -0.57 0.00 0.00 34.95 34.34 1h3h s ARG 57 CO 0.00 -0.14 0.23 -1.17 -1.08 0.00 0.00 175.30 173.14 1h3h s LEU 58 N 1.13 4.42 0.00 -1.89 0.20 0.35 -2.45 118.68 120.44 1h3h s LEU 58 Ca -0.08 -0.35 0.00 0.00 0.69 0.00 0.00 54.13 54.40 1h3h s LEU 58 Cb -0.08 -2.13 0.00 0.00 -0.43 0.00 0.00 46.19 43.55 1h3h s LEU 58 CO -0.09 -0.20 0.00 1.41 -0.29 0.00 0.00 176.35 177.18 1h3h n HIS 59 N 5.09 0.00 -1.03 5.38 8.25 -1.26 -1.19 115.22 130.46 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 0.50 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 3.10 0.00 -4.60 0.41 5.15 -1.26 -5.07 115.26 112.99 1h3h n ASN 60 Ca 0.00 -1.00 -0.34 0.00 -0.60 0.00 0.00 54.58 52.64 1h3h n ASN 60 Cb 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.15 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 3.91 -0.15 1.20 1.02 -0.33 -5.10 119.74 120.30 1h3h s LYS 61 Ca 0.00 -0.38 -0.06 0.00 0.02 0.00 0.00 55.97 55.55 1h3h s LYS 61 Cb 0.00 -3.16 -0.04 0.00 -0.52 0.00 0.00 37.83 34.11 1h3h s LYS 61 CO 0.00 0.26 0.08 -0.51 -0.92 0.00 0.00 175.35 174.25 1h3h s LEU 62 N 0.40 3.95 0.00 3.17 1.43 -1.26 -0.49 118.68 125.87 1h3h s LEU 62 Ca 0.02 0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.33 1h3h s LEU 62 Cb -0.13 -1.97 0.00 0.00 0.03 0.00 0.00 46.19 44.12 1h3h s LEU 62 CO 0.01 0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.48 1h3h n GLY 63 N 2.84 0.60 3.88 -3.19 0.00 0.08 -4.73 105.19 104.67 1h3h n GLY 63 Ca -0.18 -0.87 -0.30 0.00 0.00 0.00 0.00 46.02 44.67 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 3.15 0.12 0.99 1.43 -1.16 -1.81 118.68 121.40 1h3h s LEU 64 Ca 0.00 1.25 -0.12 0.00 -1.03 0.00 0.00 54.13 54.24 1h3h s LEU 64 Cb 0.00 -4.20 0.01 0.00 0.03 0.00 0.00 46.19 42.03 1h3h s LEU 64 CO 0.00 -1.01 0.30 0.72 0.23 0.00 0.00 176.35 176.58 1h3h s PHE 65 N -3.20 0.07 -0.49 0.29 -0.12 -0.82 0.06 117.98 113.77 1h3h s PHE 65 Ca 0.55 -0.44 -0.29 0.00 -0.05 0.00 0.00 56.93 56.71 1h3h s PHE 65 Cb -0.11 0.08 0.03 0.00 -0.63 0.00 0.00 43.02 42.39 1h3h s PHE 65 CO 0.52 -0.66 1.12 -1.25 -0.05 0.00 0.00 175.22 174.91 1h3h s PRO 66 N -3.86 3.68 0.00 1.99 0.04 -1.26 -2.82 135.00 132.77 1h3h s PRO 66 Ca 0.07 0.48 0.18 0.00 0.04 0.00 0.00 61.00 61.77 1h3h s PRO 66 Cb 0.03 -3.92 0.82 0.00 0.04 0.00 0.00 34.50 31.47 1h3h s PRO 66 CO -0.09 -1.40 1.54 0.00 0.04 0.00 0.00 177.00 177.10 1h3h n ALA 67 N 7.84 1.88 -0.01 8.56 0.00 -0.16 -2.18 120.51 136.44 1h3h n ALA 67 Ca 0.11 -0.07 -0.03 0.00 0.00 0.00 0.00 53.44 53.44 1h3h n ALA 67 Cb 0.49 -1.28 -0.12 0.00 0.00 0.00 0.00 19.45 18.53 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 -1.38 0.60 0.14 0.00 5.15 -1.26 -4.27 115.26 114.24 1h3h n ASN 68 Ca 0.06 0.27 -0.24 0.00 -0.60 0.00 0.00 54.58 54.08 1h3h n ASN 68 Cb 0.17 0.44 -0.16 0.00 -0.53 0.00 0.00 39.78 39.70 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 0.95 -2.98 1.20 3.20 -1.82 -3.47 116.97 114.05 1h3h h TYR 69 Ca -0.26 -0.69 -0.59 0.00 3.14 0.00 0.00 58.73 60.33 1h3h h TYR 69 Cb 1.79 -0.04 -0.17 0.00 1.54 0.00 0.00 36.73 39.85 1h3h h TYR 69 CO 0.00 1.56 -0.79 0.14 -1.64 0.00 0.00 178.16 177.43 1h3h s VAL 70 N -2.60 2.16 0.08 1.81 -7.23 -1.03 -4.49 120.40 109.10 1h3h s VAL 70 Ca -0.09 -2.09 0.08 0.00 -1.81 0.00 0.00 61.98 58.06 1h3h s VAL 70 Cb 0.04 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 34.88 1h3h s VAL 70 CO 0.94 -0.28 -0.18 0.00 -0.31 0.00 0.00 175.10 175.27 1h3h s ALA 71 N -2.08 2.65 0.29 1.32 0.00 -1.14 -4.59 121.76 118.21 1h3h s ALA 71 Ca 0.21 -1.26 -0.29 0.00 0.00 0.00 0.00 51.96 50.62 1h3h s ALA 71 Cb -0.06 -0.71 -0.10 0.00 0.00 0.00 0.00 23.12 22.25 1h3h s ALA 71 CO 0.10 0.58 1.42 -2.14 0.00 0.00 0.00 175.76 175.72 1h3h s PRO 72 N -1.77 4.26 -0.68 0.00 0.02 -1.11 -1.12 135.00 134.59 1h3h s PRO 72 Ca 0.16 2.34 -0.24 0.00 0.02 0.00 0.00 61.00 63.29 1h3h s PRO 72 Cb -0.11 -3.07 0.06 0.00 0.02 0.00 0.00 34.50 31.41 1h3h s PRO 72 CO 0.08 -0.39 1.04 1.41 -0.33 0.00 0.00 177.00 178.81 1h3h s MET 73 N -1.05 3.13 -0.46 5.54 1.75 -1.26 -4.87 119.30 122.09 1h3h s MET 73 Ca 0.56 -0.71 -0.26 0.00 -1.25 0.00 0.00 55.69 54.03 1h3h s MET 73 Cb -0.42 -4.22 0.03 0.00 2.84 0.00 0.00 34.83 33.05 1h3h s MET 73 CO 0.49 -1.89 0.93 1.41 -0.65 0.00 0.00 175.02 175.31 1h3h s MET 74 N 4.44 3.56 0.00 4.11 1.75 -1.26 -4.80 119.30 127.10 1h3h s MET 74 Ca 0.25 0.20 0.08 0.00 -1.25 0.00 0.00 55.69 54.98 1h3h s MET 74 Cb -0.15 -3.92 0.50 0.00 2.84 0.00 0.00 34.83 34.10 1h3h s MET 74 CO 0.11 -1.21 0.95 0.54 -0.65 0.00 0.00 175.02 174.76