#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 -4.04 -2.97 1.61 1.74 -1.26 -4.94 116.66 106.80 1h3h n ARG 17 Ca 0.00 3.12 -0.41 0.00 -0.77 0.00 0.00 57.85 59.79 1h3h n ARG 17 Cb 0.00 -5.11 -0.05 0.00 -1.02 0.00 0.00 32.46 26.28 1h3h n ARG 17 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1h3h s VAL 18 N -1.10 4.92 -0.38 1.55 -7.23 -1.26 -4.93 120.40 111.97 1h3h s VAL 18 Ca -0.15 1.44 0.12 0.00 -1.81 0.00 0.00 61.98 61.57 1h3h s VAL 18 Cb 0.01 -4.06 0.40 0.00 0.56 0.00 0.00 36.38 33.29 1h3h s VAL 18 CO 0.77 0.02 1.16 -2.11 -0.31 0.00 0.00 175.10 174.64 1h3h n ARG 19 N 5.45 1.15 -4.07 4.82 1.85 -1.26 -4.80 116.66 119.80 1h3h n ARG 19 Ca 0.03 -2.38 -0.08 0.00 -1.00 0.00 0.00 57.85 54.41 1h3h n ARG 19 Cb 0.49 -0.64 -0.10 0.00 -1.05 0.00 0.00 32.46 31.16 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 -0.99 0.50 -0.26 2.89 0.52 -1.26 -0.28 118.94 120.05 1h3h s TRP 20 Ca 0.25 -0.87 -0.02 0.00 0.02 0.00 0.00 56.10 55.48 1h3h s TRP 20 Cb 0.40 -0.35 0.08 0.00 -1.15 0.00 0.00 33.47 32.46 1h3h s TRP 20 CO -0.04 -0.28 0.07 0.00 0.02 0.00 0.00 176.95 176.71 1h3h s ALA 21 N -3.06 1.22 -0.37 0.98 0.00 0.59 -2.75 121.76 118.37 1h3h s ALA 21 Ca 0.00 -1.21 -0.09 0.00 0.00 0.00 0.00 51.96 50.66 1h3h s ALA 21 Cb 0.02 -1.42 0.04 0.00 0.00 0.00 0.00 23.12 21.76 1h3h s ALA 21 CO -0.06 -1.47 0.17 0.50 0.00 0.00 0.00 175.76 174.90 1h3h s ARG 22 N 1.77 2.70 -0.22 0.00 3.52 -0.02 -1.17 118.95 125.54 1h3h s ARG 22 Ca 0.05 -1.17 -0.29 0.00 -0.13 0.00 0.00 55.73 54.19 1h3h s ARG 22 Cb -0.17 -3.62 -0.01 0.00 -1.56 0.00 0.00 34.95 29.59 1h3h s ARG 22 CO -0.20 -0.72 1.26 0.00 -0.81 0.00 0.00 175.30 174.84 1h3h s ALA 23 N 1.47 3.55 -0.35 6.12 0.00 -0.79 -2.79 121.76 128.98 1h3h s ALA 23 Ca 0.01 0.31 0.23 0.00 0.00 0.00 0.00 51.96 52.50 1h3h s ALA 23 Cb -0.20 -3.67 0.16 0.00 0.00 0.00 0.00 23.12 19.41 1h3h s ALA 23 CO 0.04 -1.39 1.26 -0.07 0.00 0.00 0.00 175.76 175.61 1h3h h LEU 24 N 10.14 0.00 -9.21 0.00 3.38 -1.84 1.09 115.31 118.86 1h3h h LEU 24 Ca -0.26 -0.02 -0.51 0.00 0.09 0.00 0.00 57.88 57.18 1h3h h LEU 24 Cb 1.10 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.72 1h3h h LEU 24 CO 0.99 0.01 -0.51 -0.31 0.09 0.00 0.00 178.44 178.71 1h3h s TYR 25 N -3.29 1.74 0.93 1.13 2.02 -1.26 -4.36 117.35 114.26 1h3h s TYR 25 Ca 0.03 -1.43 -0.13 0.00 -0.37 0.00 0.00 57.07 55.17 1h3h s TYR 25 Cb 0.09 -0.97 0.21 0.00 -0.40 0.00 0.00 41.96 40.88 1h3h s TYR 25 CO 0.74 -0.52 0.46 -3.47 -1.57 0.00 0.00 175.55 171.20 1h3h n ASP 26 N -1.34 -3.05 -4.88 2.29 2.03 -1.26 -3.67 116.55 106.67 1h3h n ASP 26 Ca -0.01 -0.47 -0.33 0.00 0.52 0.00 0.00 54.79 54.50 1h3h n ASP 26 Cb 0.64 -0.67 -0.05 0.00 -0.72 0.00 0.00 41.12 40.32 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 -1.80 3.48 -1.70 -0.67 -0.71 -1.17 -4.85 117.98 110.56 1h3h s PHE 27 Ca 0.36 0.31 0.21 0.00 -1.04 0.00 0.00 56.93 56.77 1h3h s PHE 27 Cb -0.06 -1.80 0.68 0.00 -1.21 0.00 0.00 43.02 40.63 1h3h s PHE 27 CO 0.30 0.62 1.58 0.39 -1.34 0.00 0.00 175.22 176.77 1h3h n GLU 28 N 0.91 3.08 -2.08 1.99 -0.58 -1.26 -4.92 120.64 117.78 1h3h n GLU 28 Ca -0.11 -2.75 -0.40 0.00 -0.42 0.00 0.00 57.16 53.48 1h3h n GLU 28 Cb 0.52 -1.68 -0.03 0.00 -0.57 0.00 0.00 31.44 29.68 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 -1.28 2.41 -0.58 0.62 0.00 -1.26 -4.73 121.76 116.93 1h3h s ALA 29 Ca 0.50 -0.47 0.13 0.00 0.00 0.00 0.00 51.96 52.12 1h3h s ALA 29 Cb 0.28 -4.21 -0.14 0.00 0.00 0.00 0.00 23.12 19.05 1h3h s ALA 29 CO 0.31 -3.50 0.53 1.28 0.00 0.00 0.00 175.76 174.38 1h3h n LEU 30 N 11.78 0.58 -5.01 0.00 4.77 -1.26 -4.87 117.00 122.99 1h3h n LEU 30 Ca 0.20 -0.49 -0.22 0.00 -0.03 0.00 0.00 56.01 55.47 1h3h n LEU 30 Cb 0.51 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.68 1h3h n LEU 30 CO 0.70 0.15 0.46 -1.61 -1.33 0.00 0.00 177.39 175.76 1h3h s GLU 31 N -2.21 1.93 -0.10 3.23 0.41 -1.26 -5.05 118.70 115.65 1h3h s GLU 31 Ca 0.05 -1.36 -0.13 0.00 -0.41 0.00 0.00 54.97 53.11 1h3h s GLU 31 Cb 0.10 -2.47 -0.27 0.00 -1.78 0.00 0.00 34.13 29.70 1h3h s GLU 31 CO 0.52 -1.20 0.52 1.05 -0.49 0.00 0.00 175.26 175.66 1h3h h GLU 32 N -0.23 0.27 -0.95 1.61 4.11 -2.02 -3.32 114.58 114.06 1h3h h GLU 32 Ca -0.33 -0.47 0.00 0.00 0.07 0.00 0.00 59.36 58.63 1h3h h GLU 32 Cb 1.28 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.70 1h3h h GLU 32 CO 0.40 1.22 0.00 -0.25 0.07 0.00 0.00 179.01 180.45 1h3h n ASP 33 N -3.77 1.04 -4.87 3.06 9.92 -1.26 -4.81 116.55 115.86 1h3h n ASP 33 Ca -0.27 -1.88 -0.24 0.00 -0.53 0.00 0.00 54.79 51.87 1h3h n ASP 33 Cb 0.96 -0.47 -0.03 0.00 -0.64 0.00 0.00 41.12 40.95 1h3h n ASP 33 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1h3h s GLU 34 N -0.94 2.35 -0.02 -1.24 2.02 -1.25 -2.40 118.70 117.21 1h3h s GLU 34 Ca 0.00 -1.81 0.05 0.00 0.02 0.00 0.00 54.97 53.23 1h3h s GLU 34 Cb 0.00 -2.19 -0.01 0.00 0.10 0.00 0.00 34.13 32.03 1h3h s GLU 34 CO 0.00 -0.38 -0.17 -1.17 0.02 0.00 0.00 175.26 173.55 1h3h s LEU 35 N -4.17 1.99 -0.14 1.80 2.96 0.59 -4.44 118.68 117.27 1h3h s LEU 35 Ca 0.41 -0.33 0.02 0.00 -0.22 0.00 0.00 54.13 54.01 1h3h s LEU 35 Cb -0.01 -0.92 0.00 0.00 0.50 0.00 0.00 46.19 45.76 1h3h s LEU 35 CO 0.24 0.19 -0.20 -0.83 -1.32 0.00 0.00 176.35 174.44 1h3h s GLY 36 N -0.26 1.40 0.15 7.98 0.00 -1.26 -4.28 107.32 111.05 1h3h s GLY 36 Ca 0.03 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 43.70 1h3h s GLY 36 CO 0.00 -0.06 0.03 1.97 0.00 0.00 0.00 173.10 175.05 1h3h n PHE 37 N 3.98 -0.04 -4.41 1.90 1.16 -1.26 -5.00 117.46 113.79 1h3h n PHE 37 Ca -0.20 -0.73 -0.20 0.00 -1.87 0.00 0.00 57.45 54.45 1h3h n PHE 37 Cb 0.52 -0.11 -0.10 0.00 -1.61 0.00 0.00 39.48 38.18 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 -2.58 1.55 0.51 3.97 0.52 -1.26 -3.04 118.95 118.62 1h3h s ARG 38 Ca 0.02 -1.84 -0.22 0.00 -0.52 0.00 0.00 55.73 53.18 1h3h s ARG 38 Cb -0.00 -0.76 -0.08 0.00 0.52 0.00 0.00 34.95 34.63 1h3h s ARG 38 CO 0.01 -0.17 1.04 0.43 0.02 0.00 0.00 175.30 176.64 1h3h n SER 39 N -0.60 1.30 -3.82 0.23 7.64 -1.24 -2.84 113.62 114.30 1h3h n SER 39 Ca -0.03 0.94 -0.23 0.00 1.01 0.00 0.00 58.87 60.56 1h3h n SER 39 Cb 0.66 -1.40 0.01 0.00 -1.01 0.00 0.00 64.21 62.46 1h3h n SER 39 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1h3h n GLY 40 N 1.15 -0.26 3.11 0.23 0.00 0.37 -4.95 105.19 104.85 1h3h n GLY 40 Ca 0.11 0.14 -0.25 0.00 0.00 0.00 0.00 46.02 46.01 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 -6.24 1.70 -0.10 1.61 0.41 -1.13 -4.98 118.70 109.97 1h3h s GLU 41 Ca 0.01 -0.56 -0.16 0.00 -0.41 0.00 0.00 54.97 53.85 1h3h s GLU 41 Cb -0.01 -1.48 -0.05 0.00 -1.78 0.00 0.00 34.13 30.82 1h3h s GLU 41 CO 0.85 0.21 0.42 0.08 -0.49 0.00 0.00 175.26 176.33 1h3h s VAL 42 N 0.11 5.17 -0.00 2.63 1.01 -1.26 -1.89 120.40 126.16 1h3h s VAL 42 Ca -0.05 0.84 0.04 0.00 0.00 0.00 0.00 61.98 62.81 1h3h s VAL 42 Cb -0.12 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 1h3h s VAL 42 CO 0.02 0.40 -0.12 -0.69 0.00 0.00 0.00 175.10 174.71 1h3h s VAL 43 N 0.17 0.96 -0.36 2.92 1.01 -0.31 -4.64 120.40 120.14 1h3h s VAL 43 Ca 0.23 -0.56 -0.20 0.00 0.00 0.00 0.00 61.98 61.45 1h3h s VAL 43 Cb -0.15 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.42 1h3h s VAL 43 CO 0.10 0.24 0.61 -0.70 0.00 0.00 0.00 175.10 175.35 1h3h s GLU 44 N -0.37 3.63 0.19 2.72 2.12 -1.04 -0.30 118.70 125.65 1h3h s GLU 44 Ca 0.04 -0.03 -0.28 0.00 0.36 0.00 0.00 54.97 55.06 1h3h s GLU 44 Cb -0.05 -3.82 -0.08 0.00 0.26 0.00 0.00 34.13 30.44 1h3h s GLU 44 CO -0.00 -0.74 0.89 0.08 -0.54 0.00 0.00 175.26 174.95 1h3h s VAL 45 N 2.64 4.24 -0.28 3.70 1.01 0.61 -1.60 120.40 130.73 1h3h s VAL 45 Ca 0.23 1.95 0.19 0.00 0.00 0.00 0.00 61.98 64.35 1h3h s VAL 45 Cb -0.15 -4.26 -0.27 0.00 0.00 0.00 0.00 36.38 31.70 1h3h s VAL 45 CO 0.15 0.48 0.53 0.18 0.00 0.00 0.00 175.10 176.44 1h3h n LEU 46 N 1.73 0.26 -3.16 3.92 4.77 -0.19 -4.72 117.00 119.61 1h3h n LEU 46 Ca -0.03 -0.15 0.04 0.00 -0.03 0.00 0.00 56.01 55.84 1h3h n LEU 46 Cb 0.48 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.56 1h3h n LEU 46 CO 0.49 0.06 0.12 -1.81 -1.33 0.00 0.00 177.39 174.93 1h3h s ASP 47 N -3.80 -1.46 0.00 -1.43 1.01 0.17 -4.99 116.67 106.17 1h3h s ASP 47 Ca -0.03 0.50 0.24 0.00 0.71 0.00 0.00 52.55 53.97 1h3h s ASP 47 Cb 0.13 2.07 0.50 0.00 1.01 0.00 0.00 42.92 46.63 1h3h s ASP 47 CO 0.79 -0.28 1.43 -1.20 0.21 0.00 0.00 175.17 176.13 1h3h n SER 48 N 5.42 2.67 -4.62 0.27 7.64 -1.26 -0.52 113.62 123.23 1h3h n SER 48 Ca 0.02 -1.87 -0.43 0.00 1.01 0.00 0.00 58.87 57.60 1h3h n SER 48 Cb 0.52 -0.10 -0.02 0.00 -1.01 0.00 0.00 64.21 63.61 1h3h n SER 48 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1h3h s SER 49 N -1.77 6.68 0.00 6.43 0.01 -1.26 -4.86 113.70 118.93 1h3h s SER 49 Ca 0.34 0.95 0.00 0.00 1.31 0.00 0.00 55.95 58.55 1h3h s SER 49 Cb 0.21 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.89 1h3h s SER 49 CO 0.30 -1.12 0.00 0.59 0.41 0.00 0.00 173.24 173.43 1h3h n ASN 50 N 7.65 0.00 -0.78 2.44 3.02 -1.26 -4.87 115.26 121.46 1h3h n ASN 50 Ca 0.14 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 54.77 1h3h n ASN 50 Cb 0.47 0.00 0.25 0.00 -0.61 0.00 0.00 39.78 39.89 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 -0.87 1.99 0.07 3.52 -0.04 -1.26 -4.78 135.00 133.63 1h3h n PRO 51 Ca 0.00 -1.52 0.00 0.00 -0.04 0.00 0.00 63.50 61.94 1h3h n PRO 51 Cb 0.00 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 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 0.73 -1.21 -4.52 3.54 7.64 -1.26 -5.04 113.62 113.50 1h3h n SER 52 Ca 0.16 0.43 -0.41 0.00 1.01 0.00 0.00 58.87 60.06 1h3h n SER 52 Cb 0.38 1.37 -0.10 0.00 -1.01 0.00 0.00 64.21 64.86 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 0.07 1.43 0.52 -1.26 -0.79 118.94 120.12 1h3h s TRP 53 Ca 0.00 -0.21 0.03 0.00 0.02 0.00 0.00 56.10 55.94 1h3h s TRP 53 Cb 0.00 -2.61 -0.04 0.00 -1.15 0.00 0.00 33.47 29.67 1h3h s TRP 53 CO 0.00 -0.45 0.04 -1.58 0.02 0.00 0.00 176.95 174.98 1h3h s TRP 54 N 1.87 3.11 -0.27 -1.98 0.51 -1.04 -4.71 118.94 116.42 1h3h s TRP 54 Ca 0.09 0.05 -0.22 0.00 -2.12 0.00 0.00 56.10 53.90 1h3h s TRP 54 Cb -0.17 -1.61 -0.01 0.00 -0.81 0.00 0.00 33.47 30.87 1h3h s TRP 54 CO 0.11 0.50 0.70 0.99 -0.51 0.00 0.00 176.95 178.75 1h3h s THR 55 N -1.31 4.91 0.29 2.01 2.01 0.32 -1.26 115.64 122.62 1h3h s THR 55 Ca 0.26 1.20 -0.06 0.00 0.31 0.00 0.00 61.69 63.40 1h3h s THR 55 Cb -0.12 -4.03 -0.00 0.00 0.01 0.00 0.00 72.50 68.36 1h3h s THR 55 CO 0.19 -0.07 0.44 -0.83 -0.69 0.00 0.00 174.62 173.65 1h3h s GLY 56 N 1.50 1.14 -0.02 4.40 0.00 -1.08 0.43 107.32 113.68 1h3h s GLY 56 Ca 0.29 -1.31 0.01 0.00 0.00 0.00 0.00 44.72 43.72 1h3h s GLY 56 CO 0.09 -0.91 -0.05 1.09 0.00 0.00 0.00 173.10 173.33 1h3h s ARG 57 N -3.51 0.62 -0.32 2.90 1.70 -0.63 -0.87 118.95 118.84 1h3h s ARG 57 Ca 0.29 -0.15 -0.13 0.00 -0.47 0.00 0.00 55.73 55.27 1h3h s ARG 57 Cb 0.00 -0.63 -0.03 0.00 -0.57 0.00 0.00 34.95 33.73 1h3h s ARG 57 CO 0.15 0.02 0.27 -1.17 -1.08 0.00 0.00 175.30 173.49 1h3h s LEU 58 N 0.39 4.34 0.00 -1.89 0.20 0.15 -2.51 118.68 119.35 1h3h s LEU 58 Ca -0.05 -0.22 0.00 0.00 0.69 0.00 0.00 54.13 54.56 1h3h s LEU 58 Cb -0.08 -2.20 0.00 0.00 -0.43 0.00 0.00 46.19 43.47 1h3h s LEU 58 CO -0.00 -0.21 0.00 1.57 -0.29 0.00 0.00 176.35 177.42 1h3h n HIS 59 N 5.17 0.00 -1.69 5.38 -0.00 -1.26 -0.80 115.22 122.03 1h3h n HIS 59 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.60 1h3h n HIS 59 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.49 1h3h n HIS 59 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 1h3h n ASN 60 N 1.64 0.00 -4.36 0.26 2.85 -1.26 -5.07 115.26 109.32 1h3h n ASN 60 Ca 0.00 -1.39 -0.33 0.00 -0.11 0.00 0.00 54.58 52.74 1h3h n ASN 60 Cb 0.00 -0.08 -0.14 0.00 1.24 0.00 0.00 39.78 40.80 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 3.39 -0.02 1.20 1.02 0.02 -5.12 119.74 120.23 1h3h s LYS 61 Ca 0.00 -0.67 -0.02 0.00 0.02 0.00 0.00 55.97 55.30 1h3h s LYS 61 Cb 0.00 -2.70 -0.04 0.00 -0.52 0.00 0.00 37.83 34.57 1h3h s LYS 61 CO 0.00 0.14 0.12 -0.51 -0.92 0.00 0.00 175.35 174.18 1h3h s LEU 62 N 0.54 4.09 0.00 3.17 1.02 -1.26 0.30 118.68 126.54 1h3h s LEU 62 Ca -0.08 0.25 0.00 0.00 0.02 0.00 0.00 54.13 54.32 1h3h s LEU 62 Cb -0.15 -2.34 0.00 0.00 0.02 0.00 0.00 46.19 43.72 1h3h s LEU 62 CO 0.04 0.29 0.00 0.61 0.02 0.00 0.00 176.35 177.30 1h3h n GLY 63 N 1.24 2.48 3.77 -3.19 0.00 -0.05 -4.66 105.19 104.77 1h3h n GLY 63 Ca -0.13 -0.76 -0.38 0.00 0.00 0.00 0.00 46.02 44.75 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 4.08 0.13 0.99 1.43 -1.01 -2.64 118.68 121.66 1h3h s LEU 64 Ca 0.00 2.52 0.04 0.00 -1.03 0.00 0.00 54.13 55.66 1h3h s LEU 64 Cb 0.00 -4.09 -0.04 0.00 0.03 0.00 0.00 46.19 42.08 1h3h s LEU 64 CO 0.00 -0.98 -0.09 0.72 0.23 0.00 0.00 176.35 176.23 1h3h s PHE 65 N -1.38 1.16 -0.49 0.29 -0.12 -0.39 -0.30 117.98 116.75 1h3h s PHE 65 Ca 0.62 -0.80 -0.29 0.00 -0.05 0.00 0.00 56.93 56.41 1h3h s PHE 65 Cb -0.34 -0.61 0.03 0.00 -0.63 0.00 0.00 43.02 41.47 1h3h s PHE 65 CO 0.43 0.02 1.20 -1.25 -0.05 0.00 0.00 175.22 175.56 1h3h s PRO 66 N -3.74 3.65 0.00 1.99 0.04 -1.26 -2.51 135.00 133.17 1h3h s PRO 66 Ca 0.15 0.55 0.18 0.00 0.04 0.00 0.00 61.00 61.92 1h3h s PRO 66 Cb 0.03 -3.95 0.81 0.00 0.04 0.00 0.00 34.50 31.43 1h3h s PRO 66 CO -0.01 -1.48 1.55 0.00 0.04 0.00 0.00 177.00 177.09 1h3h n ALA 67 N 8.15 1.87 -0.01 8.56 0.00 0.03 -2.27 120.51 136.84 1h3h n ALA 67 Ca 0.12 -0.07 -0.04 0.00 0.00 0.00 0.00 53.44 53.45 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 -1.40 0.62 0.12 0.00 5.15 -1.26 -4.30 115.26 114.19 1h3h n ASN 68 Ca 0.06 0.28 -0.24 0.00 -0.60 0.00 0.00 54.58 54.09 1h3h n ASN 68 Cb 0.18 0.40 -0.15 0.00 -0.53 0.00 0.00 39.78 39.67 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 0.87 -2.91 1.20 3.20 -1.84 -3.47 116.97 114.02 1h3h h TYR 69 Ca -0.27 -0.63 -0.56 0.00 3.14 0.00 0.00 58.73 60.40 1h3h h TYR 69 Cb 1.80 -0.03 -0.16 0.00 1.54 0.00 0.00 36.73 39.88 1h3h h TYR 69 CO 0.00 1.61 -0.78 0.14 -1.64 0.00 0.00 178.16 177.49 1h3h s VAL 70 N -2.59 2.11 0.13 1.81 -7.23 -0.99 -4.42 120.40 109.21 1h3h s VAL 70 Ca -0.12 -2.12 0.10 0.00 -1.81 0.00 0.00 61.98 58.03 1h3h s VAL 70 Cb 0.05 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.88 1h3h s VAL 70 CO 0.91 -0.34 -0.24 0.00 -0.31 0.00 0.00 175.10 175.12 1h3h s ALA 71 N -2.23 2.49 0.28 1.32 0.00 -1.12 -4.57 121.76 117.93 1h3h s ALA 71 Ca 0.22 -1.45 -0.30 0.00 0.00 0.00 0.00 51.96 50.44 1h3h s ALA 71 Cb -0.05 -0.46 -0.11 0.00 0.00 0.00 0.00 23.12 22.50 1h3h s ALA 71 CO 0.10 0.55 1.48 -2.14 0.00 0.00 0.00 175.76 175.74 1h3h s PRO 72 N -2.14 4.21 -0.71 0.00 0.02 -1.11 -0.84 135.00 134.43 1h3h s PRO 72 Ca 0.16 2.41 -0.27 0.00 0.02 0.00 0.00 61.00 63.32 1h3h s PRO 72 Cb -0.10 -3.06 0.03 0.00 0.02 0.00 0.00 34.50 31.39 1h3h s PRO 72 CO 0.08 -0.48 1.27 1.41 -0.33 0.00 0.00 177.00 178.95 1h3h s MET 73 N -0.74 3.25 -0.45 5.54 1.75 -1.26 -4.86 119.30 122.53 1h3h s MET 73 Ca 0.59 -0.14 -0.26 0.00 -1.25 0.00 0.00 55.69 54.62 1h3h s MET 73 Cb -0.44 -4.15 0.03 0.00 2.84 0.00 0.00 34.83 33.10 1h3h s MET 73 CO 0.48 -2.07 0.97 1.41 -0.65 0.00 0.00 175.02 175.16 1h3h s MET 74 N 5.60 3.64 0.00 4.11 1.75 -1.26 -4.81 119.30 128.33 1h3h s MET 74 Ca 0.37 0.33 0.07 0.00 -1.25 0.00 0.00 55.69 55.21 1h3h s MET 74 Cb -0.08 -3.90 0.40 0.00 2.84 0.00 0.00 34.83 34.10 1h3h s MET 74 CO 0.17 -1.20 0.86 0.54 -0.65 0.00 0.00 175.02 174.74