#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x61 s SER 2 N 0.00 6.38 -0.01 1.61 0.01 -1.26 -5.05 113.70 115.38 1x61 s SER 2 Ca 0.00 0.47 -0.18 0.00 1.31 0.00 0.00 55.95 57.56 1x61 s SER 2 Cb 0.00 -2.04 -0.10 0.00 0.21 0.00 0.00 66.02 64.09 1x61 s SER 2 CO 0.00 -0.14 0.84 0.28 0.41 0.00 0.00 173.24 174.63 1x61 h SER 3 N 1.59 -0.54 -1.79 2.44 0.02 -2.14 -3.46 113.55 109.67 1x61 h SER 3 Ca -0.48 0.02 -0.48 0.00 -0.84 0.00 0.00 61.79 60.00 1x61 h SER 3 Cb 1.20 0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.85 1x61 h SER 3 CO 0.66 -0.21 -0.41 -0.83 -1.14 0.00 0.00 176.83 174.89 1x61 s GLY 4 N -2.41 1.78 0.20 -3.77 0.00 -1.26 -5.14 107.32 96.72 1x61 s GLY 4 Ca -0.09 -1.64 -0.00 0.00 0.00 0.00 0.00 44.72 42.99 1x61 s GLY 4 CO 0.28 -1.54 0.11 -0.56 0.00 0.00 0.00 173.10 171.38 1x61 s SER 5 N -4.06 0.44 -0.62 1.64 0.01 -1.26 -5.11 113.70 104.75 1x61 s SER 5 Ca 0.43 -1.36 -0.23 0.00 1.31 0.00 0.00 55.95 56.10 1x61 s SER 5 Cb -0.06 0.31 0.06 0.00 0.21 0.00 0.00 66.02 66.54 1x61 s SER 5 CO 0.28 -0.79 0.93 -0.55 0.41 0.00 0.00 173.24 173.52 1x61 s SER 6 N -3.18 6.22 0.40 2.44 0.15 -1.26 -5.03 113.70 113.45 1x61 s SER 6 Ca 0.36 -0.81 0.08 0.00 0.70 0.00 0.00 55.95 56.29 1x61 s SER 6 Cb 0.07 -2.41 -0.01 0.00 -1.71 0.00 0.00 66.02 61.96 1x61 s SER 6 CO 0.11 -1.34 0.47 -0.83 1.20 0.00 0.00 173.24 172.85 1x61 s GLY 7 N 3.37 1.97 -0.41 9.45 0.00 -1.26 -2.57 107.32 117.87 1x61 s GLY 7 Ca 0.24 -1.72 -0.17 0.00 0.00 0.00 0.00 44.72 43.06 1x61 s GLY 7 CO 0.13 -1.56 0.45 0.00 0.00 0.00 0.00 173.10 172.12 1x61 h GLY 9 N 9.07 0.00 0.00 0.00 0.00 -0.89 0.24 103.07 111.49 1x61 h GLY 9 Ca -0.27 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1x61 h GLY 9 CO 0.79 0.00 -0.00 -1.33 0.00 0.00 0.00 176.54 176.00 1x61 h GLY 10 N 0.00 -0.00 0.00 4.60 0.00 -1.92 -3.42 103.07 102.32 1x61 h GLY 10 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.11 1x61 h GLY 10 CO -0.00 -0.00 -1.55 0.00 0.00 0.00 0.00 176.54 174.99 1x61 n GLY 12 N 1.40 3.21 3.62 0.00 0.00 0.86 -4.99 105.19 109.29 1x61 n GLY 12 Ca -0.34 -0.48 -0.43 0.00 0.00 0.00 0.00 46.02 44.77 1x61 n GLY 12 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x61 n GLU 13 N 0.00 1.56 -1.72 1.61 1.02 -1.26 -2.93 120.64 118.93 1x61 n GLU 13 Ca 0.00 0.55 -0.43 0.00 -0.02 0.00 0.00 57.16 57.26 1x61 n GLU 13 Cb 0.00 -2.03 -0.02 0.00 -0.02 0.00 0.00 31.44 29.37 1x61 n GLU 13 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1x61 n ASP 14 N 0.90 3.31 -4.48 1.62 8.00 -1.26 -2.16 116.55 122.48 1x61 n ASP 14 Ca 0.08 1.17 -0.43 0.00 0.71 0.00 0.00 54.79 56.32 1x61 n ASP 14 Cb 0.35 -1.52 -0.04 0.00 -0.02 0.00 0.00 41.12 39.89 1x61 n ASP 14 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1x61 s VAL 15 N -0.34 4.38 0.70 2.53 1.01 -1.06 -4.86 120.40 122.76 1x61 s VAL 15 Ca 0.63 -0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.53 1x61 s VAL 15 Cb -0.56 -4.60 0.13 0.00 0.00 0.00 0.00 36.38 31.35 1x61 s VAL 15 CO 0.53 -1.28 0.96 0.68 0.00 0.00 0.00 175.10 175.99 1x61 s VAL 16 N 3.95 2.03 0.00 2.92 -7.23 -1.26 -4.84 120.40 115.97 1x61 s VAL 16 Ca 0.25 -0.73 0.00 0.00 -1.81 0.00 0.00 61.98 59.69 1x61 s VAL 16 Cb -0.15 -2.30 0.00 0.00 0.56 0.00 0.00 36.38 34.49 1x61 s VAL 16 CO 0.14 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.54 1x61 n GLY 17 N -2.72 -0.67 3.39 2.32 0.00 -1.26 -4.49 105.19 101.76 1x61 n GLY 17 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 1x61 n GLY 17 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x61 n ASP 18 N 0.00 -4.62 0.00 1.61 8.00 -1.26 -3.39 116.55 116.88 1x61 n ASP 18 Ca 0.00 -0.44 0.00 0.00 0.71 0.00 0.00 54.79 55.06 1x61 n ASP 18 Cb 0.00 -3.76 0.00 0.00 -0.02 0.00 0.00 41.12 37.34 1x61 n ASP 18 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x61 n GLY 19 N -1.38 0.84 3.50 0.44 0.00 -1.26 -5.15 105.19 102.18 1x61 n GLY 19 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 1x61 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x61 s ALA 20 N 0.00 -0.02 0.00 4.61 0.00 -1.22 -4.99 121.76 120.14 1x61 s ALA 20 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.37 1x61 s ALA 20 Cb 0.00 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 20.08 1x61 s ALA 20 CO 0.00 -3.81 0.00 0.41 0.00 0.00 0.00 175.76 172.36 1x61 n GLY 21 N 0.11 2.46 3.58 0.00 0.00 -1.26 -4.82 105.19 105.26 1x61 n GLY 21 Ca 0.08 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 1x61 n GLY 21 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x61 s VAL 22 N 0.00 3.96 -0.32 1.61 1.01 -1.08 -4.90 120.40 120.69 1x61 s VAL 22 Ca 0.00 0.84 -0.29 0.00 0.00 0.00 0.00 61.98 62.53 1x61 s VAL 22 Cb 0.00 -4.69 0.01 0.00 0.00 0.00 0.00 36.38 31.70 1x61 s VAL 22 CO 0.00 -1.35 1.11 -0.69 0.00 0.00 0.00 175.10 174.17 1x61 s VAL 23 N 5.18 4.45 -0.11 2.92 1.01 -1.26 -2.32 120.40 130.27 1x61 s VAL 23 Ca 0.44 1.67 -0.04 0.00 0.00 0.00 0.00 61.98 64.04 1x61 s VAL 23 Cb -0.08 -4.37 0.05 0.00 0.00 0.00 0.00 36.38 31.98 1x61 s VAL 23 CO 0.25 -0.48 0.23 0.00 0.00 0.00 0.00 175.10 175.09 1x61 s ALA 24 N 3.76 -0.44 -1.12 5.51 0.00 -0.04 -4.89 121.76 124.54 1x61 s ALA 24 Ca 0.47 0.85 -0.05 0.00 0.00 0.00 0.00 51.96 53.23 1x61 s ALA 24 Cb -0.13 -0.82 0.01 0.00 0.00 0.00 0.00 23.12 22.17 1x61 s ALA 24 CO 0.17 -0.46 0.96 1.28 0.00 0.00 0.00 175.76 177.70 1x61 n LEU 25 N 4.95 -3.42 -2.67 0.00 4.77 -1.26 -2.15 117.00 117.22 1x61 n LEU 25 Ca -0.13 -0.49 -0.21 0.00 -0.03 0.00 0.00 56.01 55.15 1x61 n LEU 25 Cb 0.51 -2.71 0.01 0.00 -2.33 0.00 0.00 43.42 38.89 1x61 n LEU 25 CO 0.07 0.48 -0.15 0.47 -1.33 0.00 0.00 177.39 176.93 1x61 n ASP 26 N -2.56 -5.72 -4.13 -1.43 8.00 -1.26 -4.96 116.55 104.49 1x61 n ASP 26 Ca -0.09 -0.11 -0.13 0.00 0.71 0.00 0.00 54.79 55.17 1x61 n ASP 26 Cb 0.59 -4.71 -0.10 0.00 -0.02 0.00 0.00 41.12 36.88 1x61 n ASP 26 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1x61 s ARG 27 N -5.33 1.25 -0.08 -1.24 1.81 -0.91 -5.16 118.95 109.29 1x61 s ARG 27 Ca 0.13 -1.66 0.03 0.00 -1.72 0.00 0.00 55.73 52.51 1x61 s ARG 27 Cb -0.06 0.28 0.01 0.00 -0.45 0.00 0.00 34.95 34.73 1x61 s ARG 27 CO 0.16 -0.41 -0.16 0.08 -0.68 0.00 0.00 175.30 174.28 1x61 s VAL 28 N -4.10 1.47 0.01 3.52 1.01 -1.26 -0.86 120.40 120.19 1x61 s VAL 28 Ca 0.39 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.72 1x61 s VAL 28 Cb 0.07 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.13 1x61 s VAL 28 CO 0.13 0.43 -0.09 -0.36 0.00 0.00 0.00 175.10 175.21 1x61 s PHE 29 N 0.54 0.83 0.23 5.22 0.40 -0.98 -0.16 117.98 124.06 1x61 s PHE 29 Ca -0.16 -0.22 -0.32 0.00 -0.60 0.00 0.00 56.93 55.63 1x61 s PHE 29 Cb -0.17 -0.52 -0.12 0.00 0.51 0.00 0.00 43.02 42.72 1x61 s PHE 29 CO 0.06 -0.01 1.62 0.72 0.70 0.00 0.00 175.22 178.30 1x61 n HIS 30 N 2.54 2.64 -0.39 0.36 8.25 -1.26 -2.62 115.22 124.74 1x61 n HIS 30 Ca -0.15 0.19 0.31 0.00 -0.26 0.00 0.00 57.72 57.81 1x61 n HIS 30 Cb 0.56 -2.60 0.51 0.00 1.12 0.00 0.00 29.99 29.58 1x61 n HIS 30 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1x61 n VAL 31 N 3.02 -0.11 -0.04 1.59 0.24 -1.26 0.13 118.33 121.90 1x61 n VAL 31 Ca 0.13 1.17 -0.19 0.00 -2.04 0.00 0.00 64.34 63.42 1x61 n VAL 31 Cb 0.34 -1.93 -0.13 0.00 -1.47 0.00 0.00 33.84 30.65 1x61 n VAL 31 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1x61 h GLY 32 N 0.00 0.11 0.57 7.63 0.00 -2.04 -3.37 103.07 105.96 1x61 h GLY 32 Ca 0.63 -0.29 0.04 0.00 0.00 0.00 0.00 47.33 47.71 1x61 h GLY 32 CO -0.21 0.25 -0.08 0.00 0.00 0.00 0.00 176.54 176.51 1x61 n PHE 34 N -5.23 1.39 -3.88 0.00 7.35 -0.13 -4.87 117.46 112.10 1x61 n PHE 34 Ca -0.03 0.14 -0.09 0.00 -0.76 0.00 0.00 57.45 56.72 1x61 n PHE 34 Cb 0.15 -2.60 -0.04 0.00 0.35 0.00 0.00 39.48 37.34 1x61 n PHE 34 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1x61 s VAL 35 N 10.80 0.01 1.08 -2.13 -7.23 -1.26 -3.23 120.40 118.44 1x61 s VAL 35 Ca 1.05 -1.10 -0.15 0.00 -1.81 0.00 0.00 61.98 59.97 1x61 s VAL 35 Cb -0.42 -1.93 0.15 0.00 0.56 0.00 0.00 36.38 34.74 1x61 s VAL 35 CO 0.33 -0.05 0.50 0.00 -0.31 0.00 0.00 175.10 175.57 1x61 n SER 37 N -2.84 0.25 -0.02 0.00 2.88 -0.35 -3.33 113.62 110.21 1x61 n SER 37 Ca 0.04 0.10 -0.02 0.00 -1.33 0.00 0.00 58.87 57.66 1x61 n SER 37 Cb 0.57 1.29 -0.01 0.00 -0.75 0.00 0.00 64.21 65.31 1x61 n SER 37 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1x61 n THR 38 N -2.52 0.42 0.57 2.46 -1.04 -1.26 -4.62 114.28 108.28 1x61 n THR 38 Ca -0.11 0.40 0.13 0.00 -2.04 0.00 0.00 64.05 62.43 1x61 n THR 38 Cb 0.74 -1.74 0.32 0.00 -1.82 0.00 0.00 70.33 67.82 1x61 n THR 38 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1x61 n ARG 40 N -2.30 -5.19 -3.54 0.00 3.00 -1.21 -4.91 116.66 102.50 1x61 n ARG 40 Ca 0.05 0.62 -0.33 0.00 -0.01 0.00 0.00 57.85 58.18 1x61 n ARG 40 Cb 0.44 -5.29 -0.05 0.00 0.00 0.00 0.00 32.46 27.56 1x61 n ARG 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1x61 s ALA 41 N -3.55 3.69 -0.08 7.54 0.00 -1.26 -4.53 121.76 123.57 1x61 s ALA 41 Ca 0.22 -0.39 -0.35 0.00 0.00 0.00 0.00 51.96 51.44 1x61 s ALA 41 Cb -0.11 -2.29 -0.13 0.00 0.00 0.00 0.00 23.12 20.59 1x61 s ALA 41 CO 0.82 0.58 1.80 1.04 0.00 0.00 0.00 175.76 179.99 1x61 n GLN 42 N 0.27 1.98 -0.46 0.00 6.02 -1.26 -1.91 117.38 122.02 1x61 n GLN 42 Ca -0.03 0.72 0.08 0.00 -0.01 0.00 0.00 57.00 57.76 1x61 n GLN 42 Cb 0.52 -2.53 0.27 0.00 1.02 0.00 0.00 30.24 29.52 1x61 n GLN 42 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1x61 n LEU 43 N 5.84 4.03 -4.73 1.08 4.77 -1.20 -4.93 117.00 121.86 1x61 n LEU 43 Ca 0.22 -2.67 -0.41 0.00 -0.03 0.00 0.00 56.01 53.12 1x61 n LEU 43 Cb 0.26 -0.49 -0.04 0.00 -2.33 0.00 0.00 43.42 40.82 1x61 n LEU 43 CO 0.73 0.71 0.75 -0.60 -1.33 0.00 0.00 177.39 177.65 1x61 s ARG 44 N -2.22 4.60 -1.35 3.23 3.52 -1.26 -3.55 118.95 121.92 1x61 s ARG 44 Ca 0.41 1.61 -0.08 0.00 -0.13 0.00 0.00 55.73 57.53 1x61 s ARG 44 Cb 0.30 -3.34 0.01 0.00 -1.56 0.00 0.00 34.95 30.36 1x61 s ARG 44 CO 0.14 0.07 1.18 0.41 -0.81 0.00 0.00 175.30 176.28 1x61 n GLY 45 N 2.34 -0.54 3.61 8.12 0.00 -1.26 -4.98 105.19 112.49 1x61 n GLY 45 Ca 0.04 0.25 -0.10 0.00 0.00 0.00 0.00 46.02 46.21 1x61 n GLY 45 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1x61 s GLN 46 N -6.26 1.50 0.75 1.61 -2.07 -1.23 -5.17 119.66 108.79 1x61 s GLN 46 Ca 0.55 -0.74 -0.11 0.00 -1.82 0.00 0.00 55.36 53.24 1x61 s GLN 46 Cb -0.24 0.59 0.04 0.00 -1.09 0.00 0.00 33.01 32.31 1x61 s GLN 46 CO 0.73 -0.67 1.10 -3.38 -1.32 0.00 0.00 175.29 171.75 1x61 s HIS 47 N -3.84 3.07 0.28 9.60 0.00 -1.26 -5.00 115.29 118.14 1x61 s HIS 47 Ca 0.06 1.10 -0.19 0.00 -3.00 0.00 0.00 55.06 53.03 1x61 s HIS 47 Cb -0.03 -3.10 0.06 0.00 -4.00 0.00 0.00 32.58 25.51 1x61 s HIS 47 CO -0.03 -1.49 0.90 -0.59 -1.00 0.00 0.00 174.74 172.53 1x61 s PHE 48 N -3.25 0.06 0.21 0.38 -0.71 -1.26 -4.55 117.98 108.86 1x61 s PHE 48 Ca 0.60 -0.59 0.11 0.00 -1.04 0.00 0.00 56.93 56.00 1x61 s PHE 48 Cb -0.13 0.76 -0.05 0.00 -1.21 0.00 0.00 43.02 42.40 1x61 s PHE 48 CO 0.53 -1.24 -0.21 0.71 -1.34 0.00 0.00 175.22 173.66 1x61 s TYR 49 N -2.41 2.18 -0.22 3.49 1.51 0.16 -4.92 117.35 117.13 1x61 s TYR 49 Ca 0.17 -0.38 0.01 0.00 -1.01 0.00 0.00 57.07 55.86 1x61 s TYR 49 Cb -0.04 -1.04 0.05 0.00 -0.11 0.00 0.00 41.96 40.82 1x61 s TYR 49 CO 0.08 0.52 -0.09 0.00 -1.11 0.00 0.00 175.55 174.95 1x61 s ALA 50 N -2.03 2.09 -0.06 3.71 0.00 -1.26 -1.43 121.76 122.79 1x61 s ALA 50 Ca 0.22 -1.35 -0.02 0.00 0.00 0.00 0.00 51.96 50.81 1x61 s ALA 50 Cb -0.06 -1.38 0.03 0.00 0.00 0.00 0.00 23.12 21.70 1x61 s ALA 50 CO 0.10 -1.00 0.05 0.08 0.00 0.00 0.00 175.76 174.99 1x61 s VAL 51 N 1.34 0.00 -1.17 0.00 1.01 -1.19 -4.84 120.40 115.55 1x61 s VAL 51 Ca -0.04 0.31 -0.07 0.00 0.00 0.00 0.00 61.98 62.18 1x61 s VAL 51 Cb -0.18 -0.27 0.01 0.00 0.00 0.00 0.00 36.38 35.94 1x61 s VAL 51 CO -0.07 0.16 0.91 -0.62 0.00 0.00 0.00 175.10 175.48 1x61 n GLU 52 N 5.26 -6.24 -3.40 2.72 1.02 -1.26 -2.41 120.64 116.34 1x61 n GLU 52 Ca -0.04 0.71 -0.20 0.00 -0.02 0.00 0.00 57.16 57.61 1x61 n GLU 52 Cb 0.50 -5.34 0.07 0.00 -0.02 0.00 0.00 31.44 26.64 1x61 n GLU 52 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1x61 n ARG 53 N -4.15 -6.61 -4.49 3.49 1.74 -1.26 -5.01 116.66 100.38 1x61 n ARG 53 Ca -0.01 0.70 -0.25 0.00 -0.77 0.00 0.00 57.85 57.52 1x61 n ARG 53 Cb 0.56 -5.34 -0.08 0.00 -1.02 0.00 0.00 32.46 26.58 1x61 n ARG 53 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1x61 s ARG 54 N -6.08 1.90 -0.14 5.56 0.52 -1.01 -5.15 118.95 114.55 1x61 s ARG 54 Ca 0.48 -2.15 -0.00 0.00 -0.52 0.00 0.00 55.73 53.54 1x61 s ARG 54 Cb -0.21 -0.52 0.03 0.00 0.52 0.00 0.00 34.95 34.77 1x61 s ARG 54 CO 0.60 -0.49 -0.08 0.00 0.02 0.00 0.00 175.30 175.36 1x61 s ALA 55 N -3.25 1.45 -0.07 2.13 0.00 -1.26 -3.16 121.76 117.60 1x61 s ALA 55 Ca 0.26 -0.69 0.05 0.00 0.00 0.00 0.00 51.96 51.58 1x61 s ALA 55 Cb 0.03 -1.00 -0.00 0.00 0.00 0.00 0.00 23.12 22.14 1x61 s ALA 55 CO 0.16 -0.54 -0.22 0.71 0.00 0.00 0.00 175.76 175.87 1x61 s TYR 56 N 1.65 2.25 0.36 0.00 2.02 -0.51 -1.21 117.35 121.91 1x61 s TYR 56 Ca 0.04 -0.76 -0.25 0.00 -0.37 0.00 0.00 57.07 55.72 1x61 s TYR 56 Cb -0.13 -1.50 -0.09 0.00 -0.40 0.00 0.00 41.96 39.84 1x61 s TYR 56 CO -0.08 -0.27 1.05 0.00 -1.57 0.00 0.00 175.55 174.67 1x61 n GLU 58 N 0.28 -0.11 0.17 0.00 0.00 -1.26 -0.13 120.64 119.60 1x61 n GLU 58 Ca 0.03 1.04 -0.15 0.00 0.00 0.00 0.00 57.16 58.09 1x61 n GLU 58 Cb 0.49 -1.55 -0.09 0.00 0.00 0.00 0.00 31.44 30.29 1x61 n GLU 58 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.13 177.91 1x61 h GLY 59 N 0.00 -1.19 0.61 8.31 0.00 -1.98 -0.27 103.07 108.55 1x61 h GLY 59 Ca 0.28 0.60 0.02 0.00 0.00 0.00 0.00 47.33 48.23 1x61 h GLY 59 CO -0.68 -0.33 -0.17 0.00 0.00 0.00 0.00 176.54 175.36 1x61 h TYR 61 N -0.29 0.29 -0.19 0.00 3.20 -0.54 0.26 116.97 119.69 1x61 h TYR 61 Ca 0.05 0.05 -0.21 0.00 3.14 0.00 0.00 58.73 61.76 1x61 h TYR 61 Cb 0.35 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.63 1x61 h TYR 61 CO -0.21 -0.15 -0.70 0.28 -1.64 0.00 0.00 178.16 175.74 1x61 h VAL 62 N 0.24 1.28 -0.57 1.81 2.07 -0.47 -3.17 116.25 117.45 1x61 h VAL 62 Ca 0.48 -1.90 0.01 0.00 0.82 0.00 0.00 66.70 66.10 1x61 h VAL 62 Cb 0.88 1.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.49 1x61 h VAL 62 CO -0.59 0.61 0.37 0.00 0.02 0.00 0.00 177.57 177.98 1x61 h ALA 63 N 0.64 0.73 -0.59 1.67 0.00 0.18 -2.64 119.26 119.24 1x61 h ALA 63 Ca -0.03 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.91 1x61 h ALA 63 Cb 1.31 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 1x61 h ALA 63 CO 0.14 0.15 0.29 1.79 0.00 0.00 0.00 179.25 181.63 1x61 h THR 64 N 0.76 0.92 -0.79 0.00 1.35 -0.63 0.35 112.91 114.88 1x61 h THR 64 Ca 0.21 -0.19 0.10 0.00 -0.55 0.00 0.00 66.41 65.98 1x61 h THR 64 Cb -0.07 0.32 -0.07 0.00 -1.73 0.00 0.00 68.15 66.60 1x61 h THR 64 CO -0.05 0.10 0.43 -0.07 -0.25 0.00 0.00 175.52 175.68 1x61 h LEU 65 N 0.55 0.59 0.09 3.87 3.38 -1.44 -3.20 115.31 119.14 1x61 h LEU 65 Ca 0.27 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.29 1x61 h LEU 65 Cb 0.20 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1x61 h LEU 65 CO -0.20 0.33 -0.04 -0.08 0.09 0.00 0.00 178.44 178.54 1x61 h GLU 66 N 0.71 -0.12 -5.98 1.13 4.57 -1.16 -3.46 114.58 110.27 1x61 h GLU 66 Ca 0.39 0.01 -0.68 0.00 -1.18 0.00 0.00 59.36 57.90 1x61 h GLU 66 Cb 0.39 0.03 -0.21 0.00 -0.16 0.00 0.00 28.75 28.80 1x61 h GLU 66 CO -0.26 -0.08 -0.71 0.45 -1.18 0.00 0.00 179.01 177.22 1x61 s SER 67 N -4.34 4.47 0.00 1.04 0.15 0.12 -5.08 113.70 110.05 1x61 s SER 67 Ca -0.02 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.53 1x61 s SER 67 Cb 0.00 -1.24 0.00 0.00 -1.71 0.00 0.00 66.02 63.08 1x61 s SER 67 CO 0.05 0.31 0.00 0.61 1.20 0.00 0.00 173.24 175.42 1x61 n GLY 68 N 2.56 3.88 3.55 9.45 0.00 -1.25 -3.68 105.19 119.70 1x61 n GLY 68 Ca -0.18 -0.22 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 1x61 n GLY 68 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x61 s PRO 69 N -1.02 2.62 -0.02 1.61 0.04 -1.26 -4.94 135.00 132.02 1x61 s PRO 69 Ca 0.00 0.53 -0.06 0.00 0.04 0.00 0.00 61.00 61.50 1x61 s PRO 69 Cb 0.00 -4.45 0.01 0.00 0.04 0.00 0.00 34.50 30.10 1x61 s PRO 69 CO 0.00 -2.80 0.14 0.45 0.04 0.00 0.00 177.00 174.84 1x61 s SER 70 N 8.11 -0.05 0.50 6.66 0.15 -1.26 -5.17 113.70 122.64 1x61 s SER 70 Ca 0.67 0.01 0.02 0.00 0.70 0.00 0.00 55.95 57.35 1x61 s SER 70 Cb -0.12 0.26 -0.02 0.00 -1.71 0.00 0.00 66.02 64.43 1x61 s SER 70 CO 0.19 -0.24 0.01 -0.94 1.20 0.00 0.00 173.24 173.46 1x61 s SER 71 N -0.78 4.12 0.00 5.45 1.04 -1.26 -5.26 113.70 117.01 1x61 s SER 71 Ca -0.09 -1.61 0.00 0.00 0.48 0.00 0.00 55.95 54.73 1x61 s SER 71 Cb -0.05 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1x61 s SER 71 CO 0.01 -0.82 0.16 0.61 0.98 0.00 0.00 173.24 174.18