#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n9y h ILE 17 N 0.00 1.24 -2.29 -0.61 2.04 -1.97 -3.44 117.51 112.48 1n9y h ILE 17 Ca 0.00 -2.86 -0.57 0.00 1.00 0.00 0.00 64.86 62.43 1n9y h ILE 17 Cb 0.00 2.81 0.04 0.00 -0.74 0.00 0.00 36.82 38.93 1n9y h ILE 17 CO 0.00 0.83 1.04 0.41 0.00 0.00 0.00 178.15 180.44 1n9y n THR 18 N -3.48 0.38 -3.23 -0.27 -1.04 -1.26 -4.81 114.28 100.57 1n9y n THR 18 Ca -0.14 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 1n9y n THR 18 Cb 1.04 -1.93 0.00 0.00 -1.82 0.00 0.00 70.33 67.62 1n9y n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1n9y n GLY 19 N 4.12 -0.49 3.37 3.41 0.00 0.04 -4.99 105.19 110.65 1n9y n GLY 19 Ca 0.19 -1.30 -0.34 0.00 0.00 0.00 0.00 46.02 44.57 1n9y n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n9y s THR 20 N -2.92 3.30 0.21 2.61 2.01 -1.26 -1.46 115.64 118.12 1n9y s THR 20 Ca 0.00 -0.55 0.09 0.00 0.31 0.00 0.00 61.69 61.54 1n9y s THR 20 Cb 0.00 -2.44 -0.05 0.00 0.01 0.00 0.00 72.50 70.03 1n9y s THR 20 CO 0.00 0.49 -0.18 0.26 -0.69 0.00 0.00 174.62 174.50 1n9y s TRP 21 N 0.72 1.93 0.00 4.92 0.52 0.66 -4.48 118.94 123.21 1n9y s TRP 21 Ca -0.04 -0.46 0.03 0.00 0.02 0.00 0.00 56.10 55.65 1n9y s TRP 21 Cb -0.15 -0.91 -0.01 0.00 -1.15 0.00 0.00 33.47 31.25 1n9y s TRP 21 CO 0.02 0.44 -0.11 0.71 0.02 0.00 0.00 176.95 178.04 1n9y s TYR 22 N -2.42 0.94 0.64 -1.98 1.51 -0.27 -1.16 117.35 114.61 1n9y s TYR 22 Ca 0.22 -0.21 -0.00 0.00 -1.01 0.00 0.00 57.07 56.06 1n9y s TYR 22 Cb -0.04 -0.59 0.13 0.00 -0.11 0.00 0.00 41.96 41.34 1n9y s TYR 22 CO 0.09 -0.01 0.88 0.27 -1.11 0.00 0.00 175.55 175.67 1n9y n ASN 23 N 2.63 1.17 0.17 2.29 0.23 -0.90 -2.00 115.26 118.86 1n9y n ASN 23 Ca -0.15 -1.99 0.14 0.00 -0.53 0.00 0.00 54.58 52.05 1n9y n ASN 23 Cb 0.56 -0.57 0.49 0.00 -2.08 0.00 0.00 39.78 38.18 1n9y n ASN 23 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 1n9y h GLN 24 N 0.00 0.00 -0.43 -3.83 -0.00 -1.90 -1.76 115.11 107.19 1n9y h GLN 24 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.36 1n9y h GLN 24 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.55 1n9y h GLN 24 CO 0.31 0.00 0.00 1.28 -0.00 0.00 0.00 178.83 180.42 1n9y n LEU 25 N -2.56 3.46 -0.14 0.06 4.77 -1.26 -4.97 117.00 116.36 1n9y n LEU 25 Ca 0.03 -1.60 -0.02 0.00 -0.03 0.00 0.00 56.01 54.39 1n9y n LEU 25 Cb 0.32 -0.28 -0.01 0.00 -2.33 0.00 0.00 43.42 41.12 1n9y n LEU 25 CO 0.25 0.77 -0.02 0.61 -1.33 0.00 0.00 177.39 177.68 1n9y n GLY 26 N 1.42 0.54 3.74 -0.72 0.00 -0.66 -4.75 105.19 104.76 1n9y n GLY 26 Ca 0.19 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 1n9y n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n9y s ALA 27 N -1.98 2.08 -0.14 4.61 0.00 -1.26 -3.01 121.76 122.05 1n9y s ALA 27 Ca 0.00 0.52 0.01 0.00 0.00 0.00 0.00 51.96 52.49 1n9y s ALA 27 Cb 0.00 -3.36 0.02 0.00 0.00 0.00 0.00 23.12 19.78 1n9y s ALA 27 CO 0.00 -1.94 -0.14 0.99 0.00 0.00 0.00 175.76 174.67 1n9y s THR 28 N -2.55 1.56 -0.30 0.00 2.01 -0.71 -2.11 115.64 113.53 1n9y s THR 28 Ca 0.66 -0.63 0.01 0.00 0.31 0.00 0.00 61.69 62.04 1n9y s THR 28 Cb -0.21 -1.45 0.07 0.00 0.01 0.00 0.00 72.50 70.91 1n9y s THR 28 CO 0.51 0.46 -0.02 0.12 -0.69 0.00 0.00 174.62 175.00 1n9y s PHE 29 N 1.38 3.39 -0.36 4.92 5.36 -0.31 -1.56 117.98 130.80 1n9y s PHE 29 Ca 0.02 -2.33 -0.09 0.00 -0.96 0.00 0.00 56.93 53.57 1n9y s PHE 29 Cb -0.13 -2.29 0.04 0.00 -0.34 0.00 0.00 43.02 40.29 1n9y s PHE 29 CO -0.09 -0.88 0.17 0.42 -1.46 0.00 0.00 175.22 173.38 1n9y s ILE 30 N 1.11 4.21 0.04 3.12 1.01 -0.77 -0.25 121.20 129.68 1n9y s ILE 30 Ca -0.03 -1.03 0.04 0.00 0.00 0.00 0.00 60.65 59.63 1n9y s ILE 30 Cb -0.20 -3.39 -0.02 0.00 0.01 0.00 0.00 42.46 38.86 1n9y s ILE 30 CO -0.04 -0.24 -0.13 0.54 0.00 0.00 0.00 174.94 175.07 1n9y s VAL 31 N 1.48 0.98 -0.06 2.92 0.11 -0.54 -1.56 120.40 123.73 1n9y s VAL 31 Ca 0.01 -1.04 0.03 0.00 -2.93 0.00 0.00 61.98 58.05 1n9y s VAL 31 Cb -0.20 -0.92 0.00 0.00 -1.53 0.00 0.00 36.38 33.74 1n9y s VAL 31 CO 0.05 -0.10 -0.15 -0.89 -3.33 0.00 0.00 175.10 170.67 1n9y s THR 32 N -0.99 1.33 -0.32 5.04 2.01 -0.23 -0.78 115.64 121.70 1n9y s THR 32 Ca -0.01 -0.62 -0.07 0.00 0.31 0.00 0.00 61.69 61.29 1n9y s THR 32 Cb -0.08 -1.17 0.02 0.00 0.01 0.00 0.00 72.50 71.28 1n9y s THR 32 CO 0.01 0.39 0.11 0.00 -0.69 0.00 0.00 174.62 174.45 1n9y s ALA 33 N 0.36 3.10 0.74 7.40 0.00 -1.26 -1.74 121.76 130.36 1n9y s ALA 33 Ca -0.10 -1.60 -0.02 0.00 0.00 0.00 0.00 51.96 50.23 1n9y s ALA 33 Cb -0.14 -2.28 0.14 0.00 0.00 0.00 0.00 23.12 20.84 1n9y s ALA 33 CO 0.04 -1.15 0.91 0.41 0.00 0.00 0.00 175.76 175.97 1n9y n GLY 34 N 4.87 0.37 0.84 0.00 0.00 0.13 -4.89 105.19 106.52 1n9y n GLY 34 Ca -0.13 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 43.91 1n9y n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n9y n ALA 35 N -3.03 -0.87 -4.10 4.61 0.00 -1.26 -2.79 120.51 113.07 1n9y n ALA 35 Ca -0.15 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.98 1n9y n ALA 35 Cb 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1n9y n ALA 35 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1n9y n ASP 36 N 0.89 -1.64 0.00 0.00 4.64 -1.26 -3.82 116.55 115.36 1n9y n ASP 36 Ca 0.00 -1.03 0.00 0.00 -1.38 0.00 0.00 54.79 52.38 1n9y n ASP 36 Cb 0.00 -2.82 0.00 0.00 -1.04 0.00 0.00 41.12 37.26 1n9y n ASP 36 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1n9y n GLY 37 N -1.76 0.94 3.79 0.27 0.00 -1.12 -4.88 105.19 102.43 1n9y n GLY 37 Ca -0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 1n9y n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n9y s ALA 38 N -2.00 3.31 -0.12 4.61 0.00 -1.25 -1.02 121.76 125.29 1n9y s ALA 38 Ca 0.00 0.37 0.01 0.00 0.00 0.00 0.00 51.96 52.34 1n9y s ALA 38 Cb 0.00 -3.02 -0.01 0.00 0.00 0.00 0.00 23.12 20.08 1n9y s ALA 38 CO 0.00 0.24 -0.15 -0.51 0.00 0.00 0.00 175.76 175.35 1n9y s LEU 39 N -1.94 2.64 0.03 0.00 1.43 0.72 -0.70 118.68 120.87 1n9y s LEU 39 Ca 0.46 -0.35 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 1n9y s LEU 39 Cb -0.18 -1.58 -0.02 0.00 0.03 0.00 0.00 46.19 44.43 1n9y s LEU 39 CO 0.23 0.18 -0.06 -0.89 0.23 0.00 0.00 176.35 176.04 1n9y s THR 40 N 0.26 0.34 -5.00 5.49 2.01 -0.71 -1.02 115.64 117.00 1n9y s THR 40 Ca -0.10 -1.00 0.00 0.00 0.31 0.00 0.00 61.69 60.90 1n9y s THR 40 Cb -0.16 -0.44 0.00 0.00 0.01 0.00 0.00 72.50 71.91 1n9y s THR 40 CO 0.06 -0.44 0.00 0.61 -0.69 0.00 0.00 174.62 174.16 1n9y n GLY 41 N 1.53 -0.26 3.11 4.40 0.00 -1.10 -1.06 105.19 111.82 1n9y n GLY 41 Ca -0.23 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 44.59 1n9y n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1n9y s THR 42 N -3.47 0.50 -0.03 2.61 -4.23 -0.60 -1.77 115.64 108.66 1n9y s THR 42 Ca 0.00 -1.59 0.03 0.00 -1.18 0.00 0.00 61.69 58.95 1n9y s THR 42 Cb 0.00 -1.24 -0.00 0.00 1.34 0.00 0.00 72.50 72.60 1n9y s THR 42 CO 0.00 -0.74 -0.13 -0.47 -0.54 0.00 0.00 174.62 172.75 1n9y s TYR 43 N -2.91 1.23 0.24 3.99 6.14 0.32 -1.84 117.35 124.52 1n9y s TYR 43 Ca 0.03 -0.30 -0.02 0.00 0.64 0.00 0.00 57.07 57.41 1n9y s TYR 43 Cb 0.00 -0.83 0.01 0.00 0.42 0.00 0.00 41.96 41.56 1n9y s TYR 43 CO -0.04 -0.09 0.36 -0.85 0.64 0.00 0.00 175.55 175.57 1n9y n GLU 44 N 3.08 0.52 -3.37 4.97 0.28 -0.60 -0.56 120.64 124.96 1n9y n GLU 44 Ca -0.17 -1.85 -0.25 0.00 -0.16 0.00 0.00 57.16 54.73 1n9y n GLU 44 Cb 0.54 1.84 -0.02 0.00 1.43 0.00 0.00 31.44 35.24 1n9y n GLU 44 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1n9y s SER 45 N -2.46 6.32 0.57 -1.84 1.04 -1.24 -1.73 113.70 114.36 1n9y s SER 45 Ca 0.18 0.51 0.32 0.00 0.48 0.00 0.00 55.95 57.44 1n9y s SER 45 Cb -0.01 -2.06 1.75 0.00 0.10 0.00 0.00 66.02 65.80 1n9y s SER 45 CO 0.13 -0.27 2.18 0.00 0.98 0.00 0.00 173.24 176.26 1n9y h ALA 46 N 0.97 1.27 -0.43 5.32 0.00 -1.83 -1.60 119.26 122.96 1n9y h ALA 46 Ca -0.49 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.42 1n9y h ALA 46 Cb 1.21 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1n9y h ALA 46 CO 0.63 0.07 0.29 0.28 0.00 0.00 0.00 179.25 180.51 1n9y h VAL 47 N 0.00 0.98 -0.48 0.00 2.07 -1.94 -3.47 116.25 113.42 1n9y h VAL 47 Ca -0.00 -0.13 -0.11 0.00 0.82 0.00 0.00 66.70 67.28 1n9y h VAL 47 Cb 0.19 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1n9y h VAL 47 CO 0.01 0.07 -0.12 0.61 0.02 0.00 0.00 177.57 178.16 1n9y n GLY 48 N -1.51 0.52 3.87 2.17 0.00 -0.60 -5.04 105.19 104.59 1n9y n GLY 48 Ca 0.05 -0.75 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 1n9y n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n9y s ASN 49 N -2.86 6.55 0.41 1.61 4.22 -1.26 -4.97 114.94 118.64 1n9y s ASN 49 Ca 0.00 1.25 0.21 0.00 -2.14 0.00 0.00 52.86 52.18 1n9y s ASN 49 Cb 0.00 -2.37 0.81 0.00 1.28 0.00 0.00 41.25 40.97 1n9y s ASN 49 CO 0.00 -0.44 1.79 0.00 -2.04 0.00 0.00 177.10 176.40 1n9y h ALA 50 N 1.19 1.02 0.00 3.54 0.00 -1.96 -2.16 119.26 120.90 1n9y h ALA 50 Ca -0.47 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.17 1n9y h ALA 50 Cb 1.19 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1n9y h ALA 50 CO 0.63 0.37 0.00 0.93 0.00 0.00 0.00 179.25 181.19 1n9y h GLU 51 N 0.00 0.00 -0.74 0.00 3.07 -2.01 -1.84 114.58 113.06 1n9y h GLU 51 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1n9y h GLU 51 Cb 0.81 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.72 1n9y h GLU 51 CO 0.04 0.00 0.00 -1.13 -1.40 0.00 0.00 179.01 176.52 1n9y n SER 52 N -2.74 3.94 -4.60 1.42 3.41 -0.81 -4.77 113.62 109.47 1n9y n SER 52 Ca -0.01 -2.01 -0.34 0.00 -0.26 0.00 0.00 58.87 56.25 1n9y n SER 52 Cb 0.13 -0.49 -0.11 0.00 -0.26 0.00 0.00 64.21 63.48 1n9y n SER 52 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1n9y s ARG 53 N -1.03 3.32 0.06 4.33 3.52 -0.69 -3.66 118.95 124.79 1n9y s ARG 53 Ca 0.49 -0.45 0.05 0.00 -0.13 0.00 0.00 55.73 55.69 1n9y s ARG 53 Cb 0.26 -2.86 -0.03 0.00 -1.56 0.00 0.00 34.95 30.76 1n9y s ARG 53 CO 0.33 0.49 -0.14 0.71 -0.81 0.00 0.00 175.30 175.88 1n9y s TYR 54 N -0.30 1.18 0.39 5.12 1.51 0.27 -4.85 117.35 120.68 1n9y s TYR 54 Ca 0.06 -0.44 -0.25 0.00 -1.01 0.00 0.00 57.07 55.43 1n9y s TYR 54 Cb -0.12 -0.67 -0.09 0.00 -0.11 0.00 0.00 41.96 40.97 1n9y s TYR 54 CO 0.02 0.04 1.13 0.08 -1.11 0.00 0.00 175.55 175.72 1n9y s VAL 55 N -1.20 3.33 0.06 0.71 1.01 -1.26 -0.52 120.40 122.53 1n9y s VAL 55 Ca -0.02 1.10 0.06 0.00 0.00 0.00 0.00 61.98 63.12 1n9y s VAL 55 Cb -0.10 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1n9y s VAL 55 CO 0.02 0.09 -0.16 -1.48 0.00 0.00 0.00 175.10 173.57 1n9y s LEU 56 N -2.46 2.24 0.05 3.92 0.05 -0.73 -4.31 118.68 117.44 1n9y s LEU 56 Ca 0.56 -0.57 0.01 0.00 0.05 0.00 0.00 54.13 54.19 1n9y s LEU 56 Cb -0.28 -0.63 -0.03 0.00 -2.05 0.00 0.00 46.19 43.20 1n9y s LEU 56 CO 0.36 -0.00 -0.06 0.42 -0.55 0.00 0.00 176.35 176.52 1n9y s THR 57 N -1.09 0.40 0.00 5.48 -4.23 -1.05 -2.69 115.64 112.47 1n9y s THR 57 Ca 0.01 -1.25 0.00 0.00 -1.18 0.00 0.00 61.69 59.27 1n9y s THR 57 Cb -0.09 -0.79 0.00 0.00 1.34 0.00 0.00 72.50 72.96 1n9y s THR 57 CO 0.02 -0.57 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 1n9y n GLY 58 N 1.10 1.46 3.12 3.99 0.00 -0.19 -1.46 105.19 113.21 1n9y n GLY 58 Ca -0.20 -0.73 -0.08 0.00 0.00 0.00 0.00 46.02 45.00 1n9y n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n9y s ARG 59 N 0.08 0.63 0.09 1.61 1.81 -0.65 -0.20 118.95 122.33 1n9y s ARG 59 Ca 0.00 -0.95 -0.06 0.00 -1.72 0.00 0.00 55.73 53.00 1n9y s ARG 59 Cb 0.00 0.24 -0.02 0.00 -0.45 0.00 0.00 34.95 34.72 1n9y s ARG 59 CO 0.00 -0.15 0.13 1.52 -0.68 0.00 0.00 175.30 176.11 1n9y s TYR 60 N -3.25 0.34 -0.38 -0.53 1.13 -0.19 -1.29 117.35 113.18 1n9y s TYR 60 Ca 0.01 -0.79 -0.29 0.00 -1.41 0.00 0.00 57.07 54.58 1n9y s TYR 60 Cb 0.03 -0.19 0.01 0.00 -1.10 0.00 0.00 41.96 40.71 1n9y s TYR 60 CO -0.08 -0.51 1.33 0.34 -2.51 0.00 0.00 175.55 174.12 1n9y s ASP 61 N -2.90 6.51 0.00 -0.18 2.15 -0.46 -4.40 116.67 117.38 1n9y s ASP 61 Ca 0.08 0.91 0.26 0.00 0.43 0.00 0.00 52.55 54.24 1n9y s ASP 61 Cb 0.06 -2.54 1.17 0.00 -0.30 0.00 0.00 42.92 41.31 1n9y s ASP 61 CO -0.09 -1.27 1.80 -1.54 -0.17 0.00 0.00 175.17 173.90 1n9y n SER 62 N 8.22 1.05 -3.16 -0.34 3.41 -1.26 -4.20 113.62 117.34 1n9y n SER 62 Ca 0.15 -1.43 -0.22 0.00 -0.26 0.00 0.00 58.87 57.11 1n9y n SER 62 Cb 0.48 -0.02 -0.06 0.00 -0.26 0.00 0.00 64.21 64.34 1n9y n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n9y n ALA 63 N -0.15 1.95 -0.93 7.33 0.00 -1.26 -5.02 120.51 122.43 1n9y n ALA 63 Ca 0.19 -3.05 -0.29 0.00 0.00 0.00 0.00 53.44 50.29 1n9y n ALA 63 Cb 0.26 -0.88 0.20 0.00 0.00 0.00 0.00 19.45 19.04 1n9y n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1n9y s PRO 64 N -0.69 0.04 0.92 0.00 0.04 -1.26 -5.00 135.00 129.05 1n9y s PRO 64 Ca 0.34 0.71 -0.11 0.00 0.04 0.00 0.00 61.00 61.97 1n9y s PRO 64 Cb 0.15 -1.68 0.15 0.00 0.04 0.00 0.00 34.50 33.16 1n9y s PRO 64 CO -0.14 -3.05 1.09 0.00 0.04 0.00 0.00 177.00 174.95 1n9y s ALA 65 N -2.77 1.32 -0.39 8.56 0.00 -1.26 -4.96 121.76 122.27 1n9y s ALA 65 Ca 0.66 0.05 0.05 0.00 0.00 0.00 0.00 51.96 52.73 1n9y s ALA 65 Cb -0.21 -3.24 0.48 0.00 0.00 0.00 0.00 23.12 20.15 1n9y s ALA 65 CO 0.60 -2.57 1.51 0.25 0.00 0.00 0.00 175.76 175.55 1n9y n THR 66 N -4.05 2.82 -0.01 0.00 -2.24 -1.26 -4.59 114.28 104.95 1n9y n THR 66 Ca 0.07 -3.35 0.02 0.00 -2.27 0.00 0.00 64.05 58.52 1n9y n THR 66 Cb 0.54 -0.84 0.04 0.00 -2.10 0.00 0.00 70.33 67.97 1n9y n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1n9y n ASP 67 N -0.92 2.03 0.00 3.42 5.75 -1.26 -4.98 116.55 120.59 1n9y n ASP 67 Ca 0.45 -1.80 0.00 0.00 -0.01 0.00 0.00 54.79 53.43 1n9y n ASP 67 Cb 0.93 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.97 1n9y n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1n9y n GLY 68 N -0.12 0.45 3.79 6.12 0.00 -1.26 -5.08 105.19 109.09 1n9y n GLY 68 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1n9y n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n9y s SER 69 N -2.28 5.83 1.06 1.61 0.01 -1.26 -5.05 113.70 113.62 1n9y s SER 69 Ca 0.00 1.90 -0.15 0.00 1.31 0.00 0.00 55.95 59.01 1n9y s SER 69 Cb 0.00 -2.55 0.20 0.00 0.21 0.00 0.00 66.02 63.89 1n9y s SER 69 CO 0.00 -1.14 1.03 0.61 0.41 0.00 0.00 173.24 174.15 1n9y n GLY 70 N -0.64 -1.82 3.23 3.44 0.00 -1.26 -4.78 105.19 103.36 1n9y n GLY 70 Ca 0.09 -1.64 -0.35 0.00 0.00 0.00 0.00 46.02 44.12 1n9y n GLY 70 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n9y s THR 71 N -3.16 3.13 0.48 2.61 2.01 -0.33 -4.75 115.64 115.63 1n9y s THR 71 Ca 0.61 -0.99 -0.22 0.00 0.31 0.00 0.00 61.69 61.40 1n9y s THR 71 Cb -0.03 -2.62 -0.07 0.00 0.01 0.00 0.00 72.50 69.79 1n9y s THR 71 CO 0.44 0.14 1.17 0.00 -0.69 0.00 0.00 174.62 175.68 1n9y s ALA 72 N 1.36 2.91 0.35 7.40 0.00 -1.26 -0.68 121.76 131.84 1n9y s ALA 72 Ca 0.00 0.94 -0.17 0.00 0.00 0.00 0.00 51.96 52.73 1n9y s ALA 72 Cb -0.17 -3.39 0.06 0.00 0.00 0.00 0.00 23.12 19.62 1n9y s ALA 72 CO -0.03 -0.72 0.82 -0.48 0.00 0.00 0.00 175.76 175.36 1n9y s LEU 73 N -3.19 -0.00 -0.21 0.00 -0.00 -0.28 -1.36 118.68 113.63 1n9y s LEU 73 Ca 0.66 -1.06 -0.36 0.00 -0.00 0.00 0.00 54.13 53.36 1n9y s LEU 73 Cb -0.28 2.74 0.14 0.00 -0.00 0.00 0.00 46.19 48.79 1n9y s LEU 73 CO 0.34 -1.59 1.25 -0.83 -0.00 0.00 0.00 176.35 175.53 1n9y s GLY 74 N -3.11 -0.27 0.22 -3.48 0.00 -0.41 -1.93 107.32 98.34 1n9y s GLY 74 Ca 0.16 1.68 -0.21 0.00 0.00 0.00 0.00 44.72 46.35 1n9y s GLY 74 CO 0.10 0.56 0.63 0.66 0.00 0.00 0.00 173.10 175.06 1n9y s TRP 75 N -2.32 -0.27 0.04 1.90 -2.14 -0.33 -1.63 118.94 114.19 1n9y s TRP 75 Ca 0.10 -0.08 0.06 0.00 2.66 0.00 0.00 56.10 58.84 1n9y s TRP 75 Cb -0.01 0.58 -0.02 0.00 -3.10 0.00 0.00 33.47 30.92 1n9y s TRP 75 CO -0.04 -1.04 -0.18 0.99 -2.66 0.00 0.00 176.95 174.02 1n9y s THR 76 N -3.86 1.46 -0.15 0.66 2.01 -0.54 -0.62 115.64 114.60 1n9y s THR 76 Ca 0.08 -1.13 0.00 0.00 0.31 0.00 0.00 61.69 60.95 1n9y s THR 76 Cb -0.03 -1.28 0.02 0.00 0.01 0.00 0.00 72.50 71.22 1n9y s THR 76 CO -0.01 0.12 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.20 1n9y s VAL 77 N -0.83 1.63 -0.08 3.82 1.01 0.50 -2.51 120.40 123.93 1n9y s VAL 77 Ca 0.05 -0.67 -0.23 0.00 0.00 0.00 0.00 61.98 61.14 1n9y s VAL 77 Cb -0.08 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1n9y s VAL 77 CO 0.02 0.47 0.68 0.00 0.00 0.00 0.00 175.10 176.26 1n9y s ALA 78 N 1.47 3.36 -0.16 5.51 0.00 -1.26 -1.25 121.76 129.43 1n9y s ALA 78 Ca 0.05 0.08 -0.05 0.00 0.00 0.00 0.00 51.96 52.04 1n9y s ALA 78 Cb -0.13 -2.94 -0.17 0.00 0.00 0.00 0.00 23.12 19.89 1n9y s ALA 78 CO -0.11 -0.13 3.36 0.91 0.00 0.00 0.00 175.76 179.79 1n9y n TRP 79 N 3.86 0.51 -4.89 0.00 7.02 0.98 -4.74 117.44 120.19 1n9y n TRP 79 Ca -0.02 -1.65 -0.26 0.00 -1.02 0.00 0.00 57.50 54.55 1n9y n TRP 79 Cb 0.51 -1.54 -0.16 0.00 -2.42 0.00 0.00 31.31 27.70 1n9y n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1n9y s LYS 80 N 0.19 1.75 0.00 -0.99 2.20 -1.26 -2.26 119.74 119.37 1n9y s LYS 80 Ca 0.65 -0.65 0.00 0.00 -0.36 0.00 0.00 55.97 55.61 1n9y s LYS 80 Cb 0.34 -1.57 0.00 0.00 -1.51 0.00 0.00 37.83 35.09 1n9y s LYS 80 CO -0.07 0.31 0.00 0.27 -0.36 0.00 0.00 175.35 175.50 1n9y n ASN 81 N 2.96 0.00 0.00 1.43 0.23 -0.70 -4.79 115.26 114.39 1n9y n ASN 81 Ca -0.17 -0.31 0.10 0.00 -0.53 0.00 0.00 54.58 53.68 1n9y n ASN 81 Cb 0.53 0.00 0.48 0.00 -2.08 0.00 0.00 39.78 38.71 1n9y n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1n9y n ASN 82 N -0.82 0.00 -0.03 0.53 3.02 -1.26 -3.80 115.26 112.91 1n9y n ASN 82 Ca 0.00 0.30 -0.03 0.00 -0.03 0.00 0.00 54.58 54.82 1n9y n ASN 82 Cb 0.00 -0.42 -0.04 0.00 -0.61 0.00 0.00 39.78 38.71 1n9y n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1n9y n TYR 83 N -1.42 0.00 -3.88 3.10 4.01 -1.26 -5.08 117.16 112.64 1n9y n TYR 83 Ca 0.07 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.70 1n9y n TYR 83 Cb 0.22 -0.27 -0.10 0.00 -0.31 0.00 0.00 39.34 38.87 1n9y n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1n9y s ARG 84 N -2.13 0.44 -0.21 -0.72 0.52 -1.25 -5.13 118.95 110.46 1n9y s ARG 84 Ca -0.03 -0.37 -0.04 0.00 -0.52 0.00 0.00 55.73 54.77 1n9y s ARG 84 Cb 0.02 0.18 0.09 0.00 0.52 0.00 0.00 34.95 35.76 1n9y s ARG 84 CO 0.22 -0.10 0.20 1.21 0.02 0.00 0.00 175.30 176.85 1n9y s ASN 85 N -1.26 1.68 0.00 0.23 3.84 -1.26 -1.72 114.94 116.46 1n9y s ASN 85 Ca -0.13 -0.39 0.26 0.00 0.21 0.00 0.00 52.86 52.81 1n9y s ASN 85 Cb -0.07 0.24 0.71 0.00 -0.55 0.00 0.00 41.25 41.58 1n9y s ASN 85 CO 0.01 -0.34 1.54 0.00 -2.79 0.00 0.00 177.10 175.52 1n9y n ALA 86 N 5.31 3.08 -3.64 1.71 0.00 -0.96 -4.98 120.51 121.03 1n9y n ALA 86 Ca -0.06 -0.43 -0.26 0.00 0.00 0.00 0.00 53.44 52.69 1n9y n ALA 86 Cb 0.49 -1.10 0.04 0.00 0.00 0.00 0.00 19.45 18.88 1n9y n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1n9y n HIS 87 N -0.51 -1.98 -3.67 0.00 8.25 -1.26 -4.82 115.22 111.22 1n9y n HIS 87 Ca 0.12 0.61 -0.07 0.00 -0.26 0.00 0.00 57.72 58.13 1n9y n HIS 87 Cb 0.36 -3.76 -0.02 0.00 1.12 0.00 0.00 29.99 27.70 1n9y n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1n9y s SER 88 N -3.70 -0.30 -0.14 0.41 1.04 -1.26 -1.09 113.70 108.66 1n9y s SER 88 Ca 0.34 -0.30 -0.16 0.00 0.48 0.00 0.00 55.95 56.32 1n9y s SER 88 Cb -0.11 0.54 0.04 0.00 0.10 0.00 0.00 66.02 66.60 1n9y s SER 88 CO 0.83 -0.96 0.43 0.00 0.98 0.00 0.00 173.24 174.52 1n9y s ALA 89 N -3.48 -1.06 -0.11 5.32 0.00 0.22 -0.02 121.76 122.64 1n9y s ALA 89 Ca 0.09 1.11 -0.03 0.00 0.00 0.00 0.00 51.96 53.12 1n9y s ALA 89 Cb -0.02 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 1n9y s ALA 89 CO -0.02 -0.22 0.02 0.99 0.00 0.00 0.00 175.76 176.54 1n9y s THR 90 N -0.02 4.49 -0.06 0.00 2.01 -0.38 -0.62 115.64 121.06 1n9y s THR 90 Ca -0.02 -0.17 0.04 0.00 0.31 0.00 0.00 61.69 61.85 1n9y s THR 90 Cb -0.03 -2.92 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 1n9y s THR 90 CO 0.01 0.58 -0.18 0.42 -0.69 0.00 0.00 174.62 174.77 1n9y s THR 91 N -0.63 2.74 -0.13 -0.82 -4.23 -0.43 -0.37 115.64 111.76 1n9y s THR 91 Ca 0.11 -0.83 -0.01 0.00 -1.18 0.00 0.00 61.69 59.78 1n9y s THR 91 Cb -0.12 -2.06 -0.02 0.00 1.34 0.00 0.00 72.50 71.64 1n9y s THR 91 CO 0.02 0.57 -0.12 0.26 -0.54 0.00 0.00 174.62 174.82 1n9y s TRP 92 N -0.41 2.84 -0.09 3.99 0.51 0.21 -1.34 118.94 124.64 1n9y s TRP 92 Ca 0.04 -0.60 0.04 0.00 -2.12 0.00 0.00 56.10 53.46 1n9y s TRP 92 Cb -0.12 -1.86 -0.01 0.00 -0.81 0.00 0.00 33.47 30.67 1n9y s TRP 92 CO 0.02 -0.19 -0.20 0.45 -0.51 0.00 0.00 176.95 176.52 1n9y s SER 93 N 0.35 3.44 0.00 2.95 0.15 -0.51 -1.19 113.70 118.90 1n9y s SER 93 Ca -0.10 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.11 1n9y s SER 93 Cb -0.16 -1.21 0.00 0.00 -1.71 0.00 0.00 66.02 62.94 1n9y s SER 93 CO 0.05 0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.32 1n9y n GLY 94 N 3.19 1.37 2.97 9.45 0.00 -0.81 -1.76 105.19 119.59 1n9y n GLY 94 Ca -0.18 -0.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.92 1n9y n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1n9y s GLN 95 N -0.64 0.34 -0.07 1.61 -2.07 -0.95 -1.12 119.66 116.76 1n9y s GLN 95 Ca 0.00 -0.35 -0.20 0.00 -1.82 0.00 0.00 55.36 53.00 1n9y s GLN 95 Cb 0.00 -0.22 -0.04 0.00 -1.09 0.00 0.00 33.01 31.66 1n9y s GLN 95 CO 0.00 0.05 0.55 -0.47 -1.32 0.00 0.00 175.29 174.10 1n9y s TYR 96 N -0.59 3.58 -0.09 9.60 5.04 0.14 -2.20 117.35 132.82 1n9y s TYR 96 Ca -0.04 1.04 0.03 0.00 -2.44 0.00 0.00 57.07 55.67 1n9y s TYR 96 Cb -0.05 -2.60 0.01 0.00 0.35 0.00 0.00 41.96 39.67 1n9y s TYR 96 CO -0.00 0.22 -0.19 0.14 -1.34 0.00 0.00 175.55 174.38 1n9y s VAL 97 N 0.37 1.67 0.60 3.14 -7.23 -0.56 -1.19 120.40 117.19 1n9y s VAL 97 Ca 0.29 -0.78 0.04 0.00 -1.81 0.00 0.00 61.98 59.72 1n9y s VAL 97 Cb -0.16 -1.47 0.08 0.00 0.56 0.00 0.00 36.38 35.38 1n9y s VAL 97 CO 0.14 0.47 0.82 -0.83 -0.31 0.00 0.00 175.10 175.39 1n9y s GLY 98 N 0.56 1.80 0.47 2.32 0.00 -1.26 -2.39 107.32 108.82 1n9y s GLY 98 Ca -0.15 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 42.82 1n9y s GLY 98 CO 0.05 -1.33 0.00 0.61 0.00 0.00 0.00 173.10 172.43 1n9y n GLY 99 N -2.41 -2.51 2.43 0.20 0.00 -1.26 -4.81 105.19 96.83 1n9y n GLY 99 Ca 0.13 -1.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.00 1n9y n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n9y n ALA 100 N -3.31 -0.74 -1.18 4.61 0.00 -1.26 -3.83 120.51 114.80 1n9y n ALA 100 Ca -0.04 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1n9y n ALA 100 Cb 0.67 -1.65 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1n9y n ALA 100 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1n9y n GLU 101 N -2.84 0.00 -2.02 0.00 -0.58 -1.26 -4.96 120.64 108.98 1n9y n GLU 101 Ca -0.17 0.44 -0.39 0.00 -0.42 0.00 0.00 57.16 56.63 1n9y n GLU 101 Cb 0.63 -0.74 0.00 0.00 -0.57 0.00 0.00 31.44 30.76 1n9y n GLU 101 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n9y s ALA 102 N 0.00 3.17 0.04 0.62 0.00 -1.25 -4.88 121.76 119.46 1n9y s ALA 102 Ca 0.00 1.24 0.01 0.00 0.00 0.00 0.00 51.96 53.20 1n9y s ALA 102 Cb 0.00 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 1n9y s ALA 102 CO 0.00 -0.91 -0.05 1.03 0.00 0.00 0.00 175.76 175.83 1n9y s ARG 103 N -2.40 0.48 -0.22 0.00 0.52 -1.01 -4.35 118.95 111.97 1n9y s ARG 103 Ca 0.60 -0.83 0.01 0.00 -0.52 0.00 0.00 55.73 54.99 1n9y s ARG 103 Cb -0.38 -0.03 0.05 0.00 0.52 0.00 0.00 34.95 35.11 1n9y s ARG 103 CO 0.48 -0.03 -0.09 0.42 0.02 0.00 0.00 175.30 176.11 1n9y s ILE 104 N -2.07 1.68 -0.23 1.52 1.01 -0.07 -1.50 121.20 121.54 1n9y s ILE 104 Ca -0.07 -1.18 -0.11 0.00 0.00 0.00 0.00 60.65 59.29 1n9y s ILE 104 Cb -0.05 -1.83 -0.05 0.00 0.01 0.00 0.00 42.46 40.54 1n9y s ILE 104 CO -0.02 0.04 0.17 0.20 0.00 0.00 0.00 174.94 175.33 1n9y s ASN 105 N 1.35 6.15 0.18 3.58 0.01 -0.94 -0.49 114.94 124.78 1n9y s ASN 105 Ca -0.04 0.15 0.02 0.00 -0.71 0.00 0.00 52.86 52.29 1n9y s ASN 105 Cb -0.18 -2.11 -0.05 0.00 0.41 0.00 0.00 41.25 39.32 1n9y s ASN 105 CO -0.07 0.07 -0.01 0.42 -1.51 0.00 0.00 177.10 176.00 1n9y s THR 106 N 1.00 0.76 0.12 1.60 -4.23 -0.49 -2.24 115.64 112.15 1n9y s THR 106 Ca 0.08 -1.99 0.11 0.00 -1.18 0.00 0.00 61.69 58.71 1n9y s THR 106 Cb -0.13 -2.13 -0.04 0.00 1.34 0.00 0.00 72.50 71.54 1n9y s THR 106 CO 0.04 -0.48 -0.27 -1.10 -0.54 0.00 0.00 174.62 172.28 1n9y s GLN 107 N -3.90 1.45 0.10 3.99 -1.52 -0.72 -2.12 119.66 116.94 1n9y s GLN 107 Ca 0.24 -1.31 0.01 0.00 -1.95 0.00 0.00 55.36 52.35 1n9y s GLN 107 Cb 0.06 -1.89 -0.04 0.00 -0.22 0.00 0.00 33.01 30.91 1n9y s GLN 107 CO 0.04 0.46 -0.02 1.67 -0.25 0.00 0.00 175.29 177.18 1n9y s TRP 108 N -1.02 0.83 -0.10 0.91 1.48 0.61 -1.42 118.94 120.22 1n9y s TRP 108 Ca 0.13 -1.03 0.00 0.00 -1.06 0.00 0.00 56.10 54.15 1n9y s TRP 108 Cb -0.10 -0.50 0.02 0.00 -1.16 0.00 0.00 33.47 31.73 1n9y s TRP 108 CO 0.05 -0.28 -0.10 -0.51 -4.06 0.00 0.00 176.95 172.05 1n9y s LEU 109 N -3.03 1.37 -0.28 -4.66 1.43 -0.45 -1.43 118.68 111.63 1n9y s LEU 109 Ca 0.14 -0.32 -0.06 0.00 -1.03 0.00 0.00 54.13 52.86 1n9y s LEU 109 Cb 0.07 -0.88 0.01 0.00 0.03 0.00 0.00 46.19 45.41 1n9y s LEU 109 CO -0.04 -0.07 0.05 -0.22 0.23 0.00 0.00 176.35 176.30 1n9y s LEU 110 N 1.40 3.67 -0.15 1.79 2.96 0.06 -1.32 118.68 127.09 1n9y s LEU 110 Ca -0.00 -0.71 -0.04 0.00 -0.22 0.00 0.00 54.13 53.16 1n9y s LEU 110 Cb -0.13 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.69 1n9y s LEU 110 CO -0.05 -0.17 -0.03 -0.89 -1.32 0.00 0.00 176.35 173.89 1n9y s THR 111 N 1.47 3.98 -0.13 3.68 2.01 0.21 -0.74 115.64 126.11 1n9y s THR 111 Ca 0.02 -0.33 -0.06 0.00 0.31 0.00 0.00 61.69 61.63 1n9y s THR 111 Cb -0.17 -2.73 -0.04 0.00 0.01 0.00 0.00 72.50 69.57 1n9y s THR 111 CO 0.01 0.50 0.08 -0.44 -0.69 0.00 0.00 174.62 174.08 1n9y s SER 112 N 0.21 5.86 0.16 3.53 0.01 0.21 -0.61 113.70 123.07 1n9y s SER 112 Ca -0.02 0.27 -0.32 0.00 1.31 0.00 0.00 55.95 57.20 1n9y s SER 112 Cb -0.14 -1.86 -0.10 0.00 0.21 0.00 0.00 66.02 64.13 1n9y s SER 112 CO 0.03 0.34 1.59 -0.83 0.41 0.00 0.00 173.24 174.78 1n9y s GLY 113 N -0.60 1.53 0.04 3.44 0.00 -0.25 -4.76 107.32 106.72 1n9y s GLY 113 Ca 0.11 1.38 -0.02 0.00 0.00 0.00 0.00 44.72 46.20 1n9y s GLY 113 CO 0.02 2.69 -0.01 -0.51 0.00 0.00 0.00 173.10 175.29 1n9y s THR 114 N 1.31 0.18 0.95 0.90 -4.23 -1.26 -5.02 115.64 108.49 1n9y s THR 114 Ca 0.71 -1.52 -0.12 0.00 -1.18 0.00 0.00 61.69 59.58 1n9y s THR 114 Cb -0.44 -1.18 0.16 0.00 1.34 0.00 0.00 72.50 72.38 1n9y s THR 114 CO 0.31 -0.84 1.09 0.42 -0.54 0.00 0.00 174.62 175.06 1n9y s THR 115 N -3.26 2.43 0.25 3.99 -4.23 -1.26 -4.83 115.64 108.73 1n9y s THR 115 Ca 0.01 0.14 -0.05 0.00 -1.18 0.00 0.00 61.69 60.61 1n9y s THR 115 Cb 0.03 -2.48 0.26 0.00 1.34 0.00 0.00 72.50 71.65 1n9y s THR 115 CO -0.08 -0.18 1.91 -0.33 -0.54 0.00 0.00 174.62 175.41 1n9y h GLU 116 N -1.81 1.27 0.00 3.99 4.39 -2.01 -2.20 114.58 118.21 1n9y h GLU 116 Ca -0.51 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.11 1n9y h GLU 116 Cb 1.29 -0.29 -0.00 0.00 -0.10 0.00 0.00 28.75 29.66 1n9y h GLU 116 CO 0.52 0.84 -0.01 0.00 -1.16 0.00 0.00 179.01 179.20 1n9y h ALA 117 N 1.39 1.11 -0.15 3.43 0.00 -2.06 -1.83 119.26 121.16 1n9y h ALA 117 Ca 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1n9y h ALA 117 Cb -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1n9y h ALA 117 CO -0.11 0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.25 1n9y n ASN 118 N -3.26 2.24 0.29 0.00 3.02 -0.96 -4.64 115.26 111.95 1n9y n ASN 118 Ca -0.02 -1.76 0.16 0.00 -0.03 0.00 0.00 54.58 52.93 1n9y n ASN 118 Cb 0.11 -0.10 0.90 0.00 -0.61 0.00 0.00 39.78 40.09 1n9y n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n9y h ALA 119 N 1.30 1.26 0.00 5.41 0.00 -0.72 -1.43 119.26 125.08 1n9y h ALA 119 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1n9y h ALA 119 Cb 0.52 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1n9y h ALA 119 CO 0.00 0.06 -0.04 0.11 0.00 0.00 0.00 179.25 179.38 1n9y h TRP 120 N 0.00 0.00 -0.47 0.00 5.08 -1.82 -1.77 115.95 116.98 1n9y h TRP 120 Ca -0.00 0.00 -0.14 0.00 1.08 0.00 0.00 58.89 59.83 1n9y h TRP 120 Cb 0.17 0.00 -0.08 0.00 -3.00 0.00 0.00 29.16 26.25 1n9y h TRP 120 CO 0.00 0.04 0.09 0.36 -1.28 0.00 0.00 178.44 177.65 1n9y n LYS 121 N -3.56 2.88 0.15 0.12 2.85 -0.54 -4.65 118.16 115.41 1n9y n LYS 121 Ca -0.02 -3.02 0.07 0.00 -1.05 0.00 0.00 58.31 54.28 1n9y n LYS 121 Cb 0.14 -1.97 0.06 0.00 -0.65 0.00 0.00 35.03 32.61 1n9y n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1n9y h SER 122 N 1.84 0.00 -3.24 -5.58 4.64 -1.38 -3.47 113.55 106.37 1n9y h SER 122 Ca 0.17 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.95 1n9y h SER 122 Cb 1.84 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 63.58 1n9y h SER 122 CO 0.47 0.26 -0.81 -0.89 -0.87 0.00 0.00 176.83 174.98 1n9y s THR 123 N -3.10 1.19 0.12 2.95 2.01 -1.26 -0.62 115.64 116.93 1n9y s THR 123 Ca 0.04 -0.42 -0.04 0.00 0.31 0.00 0.00 61.69 61.58 1n9y s THR 123 Cb 0.07 -1.14 -0.05 0.00 0.01 0.00 0.00 72.50 71.38 1n9y s THR 123 CO 0.73 0.39 0.33 -0.76 -0.69 0.00 0.00 174.62 174.62 1n9y s LEU 124 N 1.35 4.29 0.09 4.42 1.43 0.08 -4.91 118.68 125.43 1n9y s LEU 124 Ca -0.01 0.51 0.06 0.00 -1.03 0.00 0.00 54.13 53.67 1n9y s LEU 124 Cb -0.14 -3.21 -0.03 0.00 0.03 0.00 0.00 46.19 42.84 1n9y s LEU 124 CO -0.05 0.09 -0.17 0.54 0.23 0.00 0.00 176.35 176.99 1n9y s VAL 125 N -1.61 1.37 0.00 -1.59 0.11 -1.26 -0.76 120.40 116.66 1n9y s VAL 125 Ca 0.39 -1.47 0.00 0.00 -2.93 0.00 0.00 61.98 57.97 1n9y s VAL 125 Cb -0.12 -1.33 0.00 0.00 -1.53 0.00 0.00 36.38 33.39 1n9y s VAL 125 CO 0.25 -0.20 0.00 0.61 -3.33 0.00 0.00 175.10 172.43 1n9y n GLY 126 N 1.06 1.90 3.08 6.54 0.00 -0.51 -4.99 105.19 112.27 1n9y n GLY 126 Ca -0.19 -0.85 -0.11 0.00 0.00 0.00 0.00 46.02 44.87 1n9y n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1n9y s HIS 127 N -5.12 -0.02 -0.01 1.61 -3.43 -1.26 -0.29 115.29 106.77 1n9y s HIS 127 Ca 0.00 0.03 0.01 0.00 -0.80 0.00 0.00 55.06 54.29 1n9y s HIS 127 Cb 0.00 -0.02 0.00 0.00 -1.43 0.00 0.00 32.58 31.13 1n9y s HIS 127 CO 0.00 -0.22 -0.03 -0.51 -2.00 0.00 0.00 174.74 171.98 1n9y s ASP 128 N -0.94 0.39 -0.10 7.38 1.01 -0.90 -4.95 116.67 118.56 1n9y s ASP 128 Ca -0.10 -0.05 0.01 0.00 0.71 0.00 0.00 52.55 53.11 1n9y s ASP 128 Cb -0.06 -0.08 -0.02 0.00 1.01 0.00 0.00 42.92 43.77 1n9y s ASP 128 CO 0.01 0.01 -0.12 -0.89 0.21 0.00 0.00 175.17 174.40 1n9y s THR 129 N 0.13 3.22 0.05 -1.27 2.01 -1.26 -1.40 115.64 117.12 1n9y s THR 129 Ca -0.01 -0.63 0.09 0.00 0.31 0.00 0.00 61.69 61.46 1n9y s THR 129 Cb -0.04 -2.33 -0.03 0.00 0.01 0.00 0.00 72.50 70.11 1n9y s THR 129 CO -0.00 0.55 -0.26 -0.36 -0.69 0.00 0.00 174.62 173.85 1n9y s PHE 130 N -0.08 2.32 0.17 4.92 0.08 0.35 -3.36 117.98 122.37 1n9y s PHE 130 Ca -0.01 -0.41 0.00 0.00 0.12 0.00 0.00 56.93 56.63 1n9y s PHE 130 Cb -0.14 -1.39 -0.04 0.00 -0.57 0.00 0.00 43.02 40.88 1n9y s PHE 130 CO 0.03 0.13 0.05 0.95 -0.10 0.00 0.00 175.22 176.28 1n9y s THR 131 N -0.81 0.34 -2.07 0.64 -4.23 -0.85 -0.89 115.64 107.77 1n9y s THR 131 Ca 0.12 -1.95 0.13 0.00 -1.18 0.00 0.00 61.69 58.81 1n9y s THR 131 Cb -0.10 -2.18 0.34 0.00 1.34 0.00 0.00 72.50 71.89 1n9y s THR 131 CO 0.02 -0.37 1.40 0.29 -0.54 0.00 0.00 174.62 175.42 1n9y n LYS 132 N -0.20 1.36 -4.36 3.99 5.02 -1.26 -1.12 118.16 121.59 1n9y n LYS 132 Ca -0.04 -0.56 -0.33 0.00 -2.02 0.00 0.00 58.31 55.36 1n9y n LYS 132 Cb 0.64 -1.24 -0.09 0.00 -0.02 0.00 0.00 35.03 34.31 1n9y n LYS 132 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1n9y s VAL 133 N -1.84 4.03 -2.12 -0.18 1.01 -1.26 -4.87 120.40 115.16 1n9y s VAL 133 Ca 0.21 -0.59 0.31 0.00 0.00 0.00 0.00 61.98 61.92 1n9y s VAL 133 Cb 0.11 -2.76 0.82 0.00 0.00 0.00 0.00 36.38 34.55 1n9y s VAL 133 CO 0.16 0.43 2.11 0.29 0.00 0.00 0.00 175.10 178.09