#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 0.94 -0.45 1.61 0.52 -1.26 -5.09 118.95 115.22 1h3h s ARG 17 Ca 0.00 -1.43 -0.19 0.00 -0.52 0.00 0.00 55.73 53.59 1h3h s ARG 17 Cb 0.00 -2.17 0.03 0.00 0.52 0.00 0.00 34.95 33.33 1h3h s ARG 17 CO 0.00 -1.04 0.56 0.14 0.02 0.00 0.00 175.30 174.98 1h3h s VAL 18 N 1.16 4.94 -0.37 3.52 -7.23 -1.26 -4.87 120.40 116.30 1h3h s VAL 18 Ca 0.12 -0.27 0.13 0.00 -1.81 0.00 0.00 61.98 60.16 1h3h s VAL 18 Cb -0.20 -4.17 0.41 0.00 0.56 0.00 0.00 36.38 32.98 1h3h s VAL 18 CO -0.15 -0.60 1.08 -2.11 -0.31 0.00 0.00 175.10 173.00 1h3h n ARG 19 N 5.97 1.12 -4.04 4.82 1.85 -1.26 -4.93 116.66 120.20 1h3h n ARG 19 Ca -0.05 -2.65 -0.08 0.00 -1.00 0.00 0.00 57.85 54.07 1h3h n ARG 19 Cb 0.47 -0.88 -0.10 0.00 -1.05 0.00 0.00 32.46 30.90 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 -1.55 0.41 -0.29 2.89 0.52 -1.26 0.10 118.94 119.75 1h3h s TRP 20 Ca 0.27 -0.86 0.02 0.00 0.02 0.00 0.00 56.10 55.54 1h3h s TRP 20 Cb 0.41 -0.30 0.08 0.00 -1.15 0.00 0.00 33.47 32.51 1h3h s TRP 20 CO -0.03 -0.34 0.01 0.00 0.02 0.00 0.00 176.95 176.61 1h3h s ALA 21 N -3.17 2.35 -0.39 0.98 0.00 0.11 -2.50 121.76 119.14 1h3h s ALA 21 Ca -0.00 -1.95 -0.11 0.00 0.00 0.00 0.00 51.96 49.89 1h3h s ALA 21 Cb 0.02 -1.71 0.03 0.00 0.00 0.00 0.00 23.12 21.47 1h3h s ALA 21 CO -0.07 -1.48 0.23 0.50 0.00 0.00 0.00 175.76 174.94 1h3h s ARG 22 N 1.19 2.81 0.23 0.00 3.52 -0.26 -0.35 118.95 126.10 1h3h s ARG 22 Ca 0.03 -1.13 -0.30 0.00 -0.13 0.00 0.00 55.73 54.20 1h3h s ARG 22 Cb -0.19 -3.78 -0.09 0.00 -1.56 0.00 0.00 34.95 29.33 1h3h s ARG 22 CO -0.10 -0.75 1.05 0.00 -0.81 0.00 0.00 175.30 174.68 1h3h s ALA 23 N 1.56 3.37 -0.25 6.12 0.00 -0.03 -2.73 121.76 129.79 1h3h s ALA 23 Ca 0.02 0.78 0.06 0.00 0.00 0.00 0.00 51.96 52.83 1h3h s ALA 23 Cb -0.20 -3.30 -0.07 0.00 0.00 0.00 0.00 23.12 19.55 1h3h s ALA 23 CO 0.07 -0.06 0.24 1.28 0.00 0.00 0.00 175.76 177.29 1h3h n LEU 24 N 1.64 0.25 -4.24 0.00 4.77 -1.26 0.59 117.00 118.75 1h3h n LEU 24 Ca -0.00 -0.43 -0.18 0.00 -0.03 0.00 0.00 56.01 55.37 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 0.53 0.06 -0.08 -0.31 -1.33 0.00 0.00 177.39 176.26 1h3h s TYR 25 N -1.70 1.55 0.79 -1.77 1.51 -1.26 -4.51 117.35 111.96 1h3h s TYR 25 Ca 0.02 -1.56 -0.11 0.00 -1.01 0.00 0.00 57.07 54.41 1h3h s TYR 25 Cb 0.05 -0.58 0.18 0.00 -0.11 0.00 0.00 41.96 41.49 1h3h s TYR 25 CO 0.25 -0.89 0.40 -3.47 -1.11 0.00 0.00 175.55 170.73 1h3h n ASP 26 N -1.35 -2.81 -4.88 2.29 2.03 -1.26 -3.42 116.55 107.15 1h3h n ASP 26 Ca 0.06 -0.40 -0.33 0.00 0.52 0.00 0.00 54.79 54.63 1h3h n ASP 26 Cb 0.63 -0.57 -0.05 0.00 -0.72 0.00 0.00 41.12 40.41 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 -1.62 3.48 -1.73 -0.67 -0.71 -1.22 -4.80 117.98 110.73 1h3h s PHE 27 Ca 0.31 0.31 0.21 0.00 -1.04 0.00 0.00 56.93 56.71 1h3h s PHE 27 Cb -0.05 -1.80 0.66 0.00 -1.21 0.00 0.00 43.02 40.62 1h3h s PHE 27 CO 0.26 0.62 1.56 0.39 -1.34 0.00 0.00 175.22 176.71 1h3h n GLU 28 N 0.89 3.01 -2.05 1.99 -0.58 -1.26 -4.91 120.64 117.72 1h3h n GLU 28 Ca -0.10 -2.67 -0.40 0.00 -0.42 0.00 0.00 57.16 53.57 1h3h n GLU 28 Cb 0.52 -1.67 -0.03 0.00 -0.57 0.00 0.00 31.44 29.70 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 2.40 -1.11 0.62 0.00 -1.26 -4.74 121.76 116.36 1h3h s ALA 29 Ca 0.49 -0.41 0.11 0.00 0.00 0.00 0.00 51.96 52.15 1h3h s ALA 29 Cb 0.28 -4.21 0.02 0.00 0.00 0.00 0.00 23.12 19.20 1h3h s ALA 29 CO 0.30 -3.50 0.72 1.28 0.00 0.00 0.00 175.76 174.56 1h3h n LEU 30 N 11.90 1.44 -4.78 0.00 4.77 -1.26 -4.83 117.00 124.24 1h3h n LEU 30 Ca 0.21 -0.82 -0.22 0.00 -0.03 0.00 0.00 56.01 55.14 1h3h n LEU 30 Cb 0.51 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.54 1h3h n LEU 30 CO 0.70 0.28 -0.15 -0.70 -1.33 0.00 0.00 177.39 176.19 1h3h s GLU 31 N -1.33 2.53 0.09 3.23 2.12 -1.26 -5.04 118.70 119.03 1h3h s GLU 31 Ca 0.10 -1.43 -0.12 0.00 0.36 0.00 0.00 54.97 53.88 1h3h s GLU 31 Cb 0.09 -2.31 -0.18 0.00 0.26 0.00 0.00 34.13 31.99 1h3h s GLU 31 CO 0.25 0.12 1.25 1.05 -0.54 0.00 0.00 175.26 177.38 1h3h h GLU 32 N 1.43 0.70 0.00 4.30 9.09 -2.01 -2.98 114.58 125.10 1h3h h GLU 32 Ca -0.44 -0.68 0.00 0.00 0.05 0.00 0.00 59.36 58.29 1h3h h GLU 32 Cb 1.25 0.18 0.00 0.00 -1.65 0.00 0.00 28.75 28.53 1h3h h GLU 32 CO 0.61 1.27 0.00 -3.47 0.05 0.00 0.00 179.01 177.48 1h3h n ASP 33 N -3.87 0.00 -4.90 3.06 2.03 -1.26 -4.73 116.55 106.88 1h3h n ASP 33 Ca -0.09 -0.06 -0.23 0.00 0.52 0.00 0.00 54.79 54.93 1h3h n ASP 33 Cb 0.83 -0.24 -0.03 0.00 -0.72 0.00 0.00 41.12 40.96 1h3h n ASP 33 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1h3h s GLU 34 N -2.48 3.23 0.03 -0.67 2.02 -1.13 -1.91 118.70 117.79 1h3h s GLU 34 Ca 0.18 -0.83 0.07 0.00 0.02 0.00 0.00 54.97 54.41 1h3h s GLU 34 Cb 0.12 -2.78 -0.03 0.00 0.10 0.00 0.00 34.13 31.54 1h3h s GLU 34 CO 0.26 0.44 -0.19 -0.48 0.02 0.00 0.00 175.26 175.32 1h3h s LEU 35 N -3.72 2.57 -0.09 1.80 2.34 -0.09 -4.57 118.68 116.91 1h3h s LEU 35 Ca 0.33 -0.42 0.02 0.00 0.06 0.00 0.00 54.13 54.13 1h3h s LEU 35 Cb -0.09 -1.50 -0.02 0.00 -0.56 0.00 0.00 46.19 44.02 1h3h s LEU 35 CO 0.27 0.27 -0.15 -0.83 -1.06 0.00 0.00 176.35 174.84 1h3h s GLY 36 N -1.33 1.50 0.00 -3.48 0.00 -1.26 -4.42 107.32 98.33 1h3h s GLY 36 Ca 0.14 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 43.92 1h3h s GLY 36 CO 0.04 -0.45 0.00 1.97 0.00 0.00 0.00 173.10 174.66 1h3h n PHE 37 N 3.03 -0.95 -4.33 1.90 1.16 -1.26 -5.02 117.46 111.98 1h3h n PHE 37 Ca -0.18 0.00 -0.17 0.00 -1.87 0.00 0.00 57.45 55.23 1h3h n PHE 37 Cb 0.52 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.29 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 -1.66 1.32 0.11 3.97 0.52 -1.26 -3.40 118.95 118.55 1h3h s ARG 38 Ca 0.00 -1.64 -0.34 0.00 -0.52 0.00 0.00 55.73 53.23 1h3h s ARG 38 Cb 0.00 -0.78 -0.14 0.00 0.52 0.00 0.00 34.95 34.56 1h3h s ARG 38 CO 0.00 -0.01 1.63 0.45 0.02 0.00 0.00 175.30 177.39 1h3h n SER 39 N -0.40 3.10 -2.21 0.23 2.88 -1.22 -3.11 113.62 112.89 1h3h n SER 39 Ca -0.06 1.06 -0.06 0.00 -1.33 0.00 0.00 58.87 58.48 1h3h n SER 39 Cb 0.63 -1.41 0.03 0.00 -0.75 0.00 0.00 64.21 62.71 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 3.57 0.06 2.98 0.46 0.00 0.20 -4.93 105.19 107.53 1h3h n GLY 40 Ca 0.18 0.07 -0.11 0.00 0.00 0.00 0.00 46.02 46.16 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 -3.61 0.25 -0.13 1.61 0.41 -1.12 -4.94 118.70 111.16 1h3h s GLU 41 Ca 0.18 -0.29 -0.08 0.00 -0.41 0.00 0.00 54.97 54.36 1h3h s GLU 41 Cb -0.02 0.10 -0.04 0.00 -1.78 0.00 0.00 34.13 32.38 1h3h s GLU 41 CO 0.30 -0.05 0.16 0.08 -0.49 0.00 0.00 175.26 175.27 1h3h s VAL 42 N -0.85 5.45 0.02 2.63 1.01 -1.26 -0.86 120.40 126.54 1h3h s VAL 42 Ca -0.09 0.27 0.04 0.00 0.00 0.00 0.00 61.98 62.20 1h3h s VAL 42 Cb -0.06 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 1h3h s VAL 42 CO -0.00 0.57 -0.13 -0.69 0.00 0.00 0.00 175.10 174.85 1h3h s VAL 43 N -0.69 1.03 -0.40 2.92 1.01 0.53 -4.64 120.40 120.16 1h3h s VAL 43 Ca 0.14 -0.81 -0.18 0.00 0.00 0.00 0.00 61.98 61.13 1h3h s VAL 43 Cb -0.12 -0.91 0.01 0.00 0.00 0.00 0.00 36.38 35.36 1h3h s VAL 43 CO 0.04 0.09 0.51 -0.70 0.00 0.00 0.00 175.10 175.04 1h3h s GLU 44 N -0.82 3.35 0.21 2.72 2.12 -0.78 0.09 118.70 125.60 1h3h s GLU 44 Ca 0.02 -0.43 -0.30 0.00 0.36 0.00 0.00 54.97 54.62 1h3h s GLU 44 Cb -0.07 -3.90 -0.08 0.00 0.26 0.00 0.00 34.13 30.34 1h3h s GLU 44 CO 0.01 -0.80 0.95 0.08 -0.54 0.00 0.00 175.26 174.95 1h3h s VAL 45 N 2.40 4.14 -0.13 3.70 1.01 0.11 -1.73 120.40 129.91 1h3h s VAL 45 Ca 0.17 2.06 0.14 0.00 0.00 0.00 0.00 61.98 64.36 1h3h s VAL 45 Cb -0.16 -4.32 -0.20 0.00 0.00 0.00 0.00 36.38 31.71 1h3h s VAL 45 CO 0.15 0.45 0.11 -0.11 0.00 0.00 0.00 175.10 175.70 1h3h n LEU 46 N 1.77 0.00 -3.30 3.92 0.00 -0.57 -4.77 117.00 114.06 1h3h n LEU 46 Ca -0.01 0.00 -0.20 0.00 0.00 0.00 0.00 56.01 55.80 1h3h n LEU 46 Cb 0.47 0.31 -0.08 0.00 0.00 0.00 0.00 43.42 44.13 1h3h n LEU 46 CO 0.50 0.31 -0.20 -1.81 0.00 0.00 0.00 177.39 176.20 1h3h s ASP 47 N -4.72 1.12 0.00 1.96 1.01 0.03 -4.95 116.67 111.12 1h3h s ASP 47 Ca -0.07 -2.21 0.25 0.00 0.71 0.00 0.00 52.55 51.23 1h3h s ASP 47 Cb 0.06 0.27 1.48 0.00 1.01 0.00 0.00 42.92 45.74 1h3h s ASP 47 CO 0.64 -0.20 1.86 -1.20 0.21 0.00 0.00 175.17 176.48 1h3h n SER 48 N 3.53 0.00 -4.62 0.27 7.64 -1.26 -2.73 113.62 116.45 1h3h n SER 48 Ca 0.19 -0.71 -0.43 0.00 1.01 0.00 0.00 58.87 58.93 1h3h n SER 48 Cb 0.46 -0.03 -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 -0.94 -3.01 0.00 0.00 175.04 171.09 1h3h s SER 49 N -2.06 6.65 0.00 6.43 1.04 -1.26 -4.85 113.70 119.64 1h3h s SER 49 Ca 0.36 1.00 0.00 0.00 0.48 0.00 0.00 55.95 57.79 1h3h s SER 49 Cb 0.17 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.75 1h3h s SER 49 CO 0.30 -1.14 0.00 0.59 0.98 0.00 0.00 173.24 173.97 1h3h n ASN 50 N 7.76 0.00 -0.94 7.02 3.02 -1.26 -4.87 115.26 125.99 1h3h n ASN 50 Ca 0.14 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.75 1h3h n ASN 50 Cb 0.47 0.00 0.20 0.00 -0.61 0.00 0.00 39.78 39.84 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 -0.95 2.35 0.05 3.52 -0.04 -1.26 -4.75 135.00 133.91 1h3h n PRO 51 Ca 0.00 -1.62 0.00 0.00 -0.04 0.00 0.00 63.50 61.84 1h3h n PRO 51 Cb 0.00 -1.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.95 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 0.64 -0.98 -4.55 3.54 7.64 -1.26 -5.06 113.62 113.58 1h3h n SER 52 Ca 0.15 0.46 -0.39 0.00 1.01 0.00 0.00 58.87 60.10 1h3h n SER 52 Cb 0.48 1.20 -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 -0.01 1.43 0.52 -1.26 -1.23 118.94 119.61 1h3h s TRP 53 Ca 0.00 -0.09 0.03 0.00 0.02 0.00 0.00 56.10 56.06 1h3h s TRP 53 Cb 0.00 -2.43 -0.03 0.00 -1.15 0.00 0.00 33.47 29.86 1h3h s TRP 53 CO 0.00 -0.28 -0.09 -1.58 0.02 0.00 0.00 176.95 175.02 1h3h s TRP 54 N 1.73 2.84 -0.11 -1.98 0.51 -1.15 -4.70 118.94 116.09 1h3h s TRP 54 Ca 0.06 -0.06 -0.22 0.00 -2.12 0.00 0.00 56.10 53.76 1h3h s TRP 54 Cb -0.17 -1.61 -0.04 0.00 -0.81 0.00 0.00 33.47 30.84 1h3h s TRP 54 CO 0.10 0.33 0.63 0.99 -0.51 0.00 0.00 176.95 178.50 1h3h s THR 55 N -0.93 5.08 0.00 2.01 2.01 -1.10 -1.95 115.64 120.76 1h3h s THR 55 Ca 0.15 1.27 0.00 0.00 0.31 0.00 0.00 61.69 63.43 1h3h s THR 55 Cb -0.11 -3.97 0.00 0.00 0.01 0.00 0.00 72.50 68.43 1h3h s THR 55 CO 0.05 0.24 0.00 0.61 -0.69 0.00 0.00 174.62 174.84 1h3h n GLY 56 N 3.27 2.44 3.22 4.40 0.00 -0.19 -0.79 105.19 117.54 1h3h n GLY 56 Ca -0.03 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.82 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 -1.44 0.39 -0.26 1.61 1.70 -0.70 -1.16 118.95 119.09 1h3h s ARG 57 Ca 0.00 0.45 -0.04 0.00 -0.47 0.00 0.00 55.73 55.67 1h3h s ARG 57 Cb 0.00 0.19 0.01 0.00 -0.57 0.00 0.00 34.95 34.58 1h3h s ARG 57 CO 0.00 -0.05 -0.00 -1.17 -1.08 0.00 0.00 175.30 173.00 1h3h s LEU 58 N 0.17 3.39 0.00 -1.89 0.20 -0.19 -1.87 118.68 118.48 1h3h s LEU 58 Ca -0.00 -0.71 0.00 0.00 0.69 0.00 0.00 54.13 54.11 1h3h s LEU 58 Cb -0.02 -1.76 0.00 0.00 -0.43 0.00 0.00 46.19 43.97 1h3h s LEU 58 CO 0.00 -0.13 0.00 1.57 -0.29 0.00 0.00 176.35 177.51 1h3h n HIS 59 N 4.77 0.00 -1.49 5.38 -0.00 -1.26 -1.12 115.22 121.49 1h3h n HIS 59 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.56 1h3h n HIS 59 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.47 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 1.85 0.00 -4.60 0.26 5.15 -1.26 -5.08 115.26 111.58 1h3h n ASN 60 Ca 0.00 -1.15 -0.36 0.00 -0.60 0.00 0.00 54.58 52.47 1h3h n ASN 60 Cb 0.00 -0.03 -0.10 0.00 -0.53 0.00 0.00 39.78 39.12 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 3.94 -0.12 1.20 1.02 -0.28 -5.09 119.74 120.41 1h3h s LYS 61 Ca 0.00 -0.35 -0.04 0.00 0.02 0.00 0.00 55.97 55.61 1h3h s LYS 61 Cb 0.00 -3.38 -0.03 0.00 -0.52 0.00 0.00 37.83 33.89 1h3h s LYS 61 CO 0.00 0.07 0.02 -0.51 -0.92 0.00 0.00 175.35 174.01 1h3h s LEU 62 N 0.98 3.65 0.00 3.17 1.02 -1.26 -1.02 118.68 125.22 1h3h s LEU 62 Ca 0.05 0.12 0.00 0.00 0.02 0.00 0.00 54.13 54.32 1h3h s LEU 62 Cb -0.14 -1.87 0.00 0.00 0.02 0.00 0.00 46.19 44.21 1h3h s LEU 62 CO 0.03 0.30 0.00 0.61 0.02 0.00 0.00 176.35 177.32 1h3h n GLY 63 N 2.65 -1.93 3.90 -3.19 0.00 -0.31 -4.50 105.19 101.81 1h3h n GLY 63 Ca -0.18 -1.18 -0.29 0.00 0.00 0.00 0.00 46.02 44.37 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 4.07 0.09 0.99 1.43 -0.81 -1.02 118.68 123.44 1h3h s LEU 64 Ca 0.00 0.74 -0.02 0.00 -1.03 0.00 0.00 54.13 53.82 1h3h s LEU 64 Cb 0.00 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.64 1h3h s LEU 64 CO 0.00 -0.18 0.04 0.72 0.23 0.00 0.00 176.35 177.16 1h3h s PHE 65 N -2.05 0.64 -0.49 0.29 -0.12 -0.82 -0.92 117.98 114.51 1h3h s PHE 65 Ca 0.44 -1.09 -0.28 0.00 -0.05 0.00 0.00 56.93 55.95 1h3h s PHE 65 Cb -0.11 -0.39 0.03 0.00 -0.63 0.00 0.00 43.02 41.93 1h3h s PHE 65 CO 0.29 -0.47 1.12 -1.25 -0.05 0.00 0.00 175.22 174.86 1h3h s PRO 66 N -3.97 3.68 0.00 1.99 0.04 -1.26 -2.92 135.00 132.55 1h3h s PRO 66 Ca 0.15 0.48 0.14 0.00 0.04 0.00 0.00 61.00 61.81 1h3h s PRO 66 Cb 0.07 -3.92 0.64 0.00 0.04 0.00 0.00 34.50 31.33 1h3h s PRO 66 CO -0.04 -1.40 1.43 0.00 0.04 0.00 0.00 177.00 177.03 1h3h n ALA 67 N 7.83 1.70 -0.06 8.56 0.00 -0.37 -2.32 120.51 135.86 1h3h n ALA 67 Ca 0.11 -0.06 -0.11 0.00 0.00 0.00 0.00 53.44 53.39 1h3h n ALA 67 Cb 0.49 -1.23 -0.15 0.00 0.00 0.00 0.00 19.45 18.56 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 -1.42 0.70 -0.04 0.00 5.15 -1.26 -4.33 115.26 114.06 1h3h n ASN 68 Ca 0.05 0.21 -0.16 0.00 -0.60 0.00 0.00 54.58 54.07 1h3h n ASN 68 Cb 0.15 0.26 -0.07 0.00 -0.53 0.00 0.00 39.78 39.59 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 0.01 0.93 -3.25 1.20 3.20 -1.85 -3.45 116.97 113.75 1h3h h TYR 69 Ca -0.42 -0.39 -0.58 0.00 3.14 0.00 0.00 58.73 60.49 1h3h h TYR 69 Cb 2.10 -0.15 -0.18 0.00 1.54 0.00 0.00 36.73 40.03 1h3h h TYR 69 CO 0.01 1.19 -0.80 0.14 -1.64 0.00 0.00 178.16 177.06 1h3h s VAL 70 N -3.83 2.03 0.13 1.81 -7.23 -1.08 -4.53 120.40 107.70 1h3h s VAL 70 Ca -0.11 -1.96 0.11 0.00 -1.81 0.00 0.00 61.98 58.21 1h3h s VAL 70 Cb 0.08 -1.95 -0.04 0.00 0.56 0.00 0.00 36.38 35.03 1h3h s VAL 70 CO 0.87 -0.23 -0.27 0.00 -0.31 0.00 0.00 175.10 175.16 1h3h s ALA 71 N -1.88 2.40 1.37 1.32 0.00 -1.11 -4.59 121.76 119.27 1h3h s ALA 71 Ca 0.18 -1.48 -0.21 0.00 0.00 0.00 0.00 51.96 50.45 1h3h s ALA 71 Cb -0.07 -0.38 0.32 0.00 0.00 0.00 0.00 23.12 23.00 1h3h s ALA 71 CO 0.08 0.53 0.73 -2.30 0.00 0.00 0.00 175.76 174.80 1h3h n PRO 72 N 0.86 -4.16 -3.40 0.00 -0.02 -1.04 -1.10 135.00 126.12 1h3h n PRO 72 Ca -0.18 -1.23 -0.18 0.00 -2.02 0.00 0.00 63.50 59.90 1h3h n PRO 72 Cb 0.53 -1.67 -0.10 0.00 -0.02 0.00 0.00 33.50 32.25 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 -4.66 0.34 -0.46 -0.52 1.75 -1.26 -4.66 119.30 109.84 1h3h s MET 73 Ca 0.56 -0.21 -0.28 0.00 -1.25 0.00 0.00 55.69 54.52 1h3h s MET 73 Cb -0.10 -0.68 -0.00 0.00 2.84 0.00 0.00 34.83 36.88 1h3h s MET 73 CO 0.47 -1.04 1.62 1.41 -0.65 0.00 0.00 175.02 176.83 1h3h s MET 74 N 2.29 3.26 0.00 4.11 1.75 -1.26 -4.86 119.30 124.59 1h3h s MET 74 Ca 0.10 0.92 0.22 0.00 -1.25 0.00 0.00 55.69 55.68 1h3h s MET 74 Cb -0.14 -4.17 0.18 0.00 2.84 0.00 0.00 34.83 33.54 1h3h s MET 74 CO -0.31 -1.96 1.21 2.89 -0.65 0.00 0.00 175.02 176.19