#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rti h GLU 14 N 0.00 0.36 -0.80 0.00 -0.00 -1.91 -3.17 114.58 109.06 2rti h GLU 14 Ca 0.00 -0.18 0.13 0.00 -0.00 0.00 0.00 59.36 59.31 2rti h GLU 14 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 28.75 28.66 2rti h GLU 14 CO 0.00 0.72 0.39 0.00 -0.00 0.00 0.00 179.01 180.12 2rti h ALA 15 N 0.64 1.16 -0.69 1.06 0.00 -1.92 0.59 119.26 120.10 2rti h ALA 15 Ca 0.03 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2rti h ALA 15 Cb 0.64 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2rti h ALA 15 CO 0.03 -0.11 0.23 0.78 0.00 0.00 0.00 179.25 180.18 2rti h GLY 16 N 0.58 1.13 1.09 0.00 0.00 -1.99 -3.10 103.07 100.77 2rti h GLY 16 Ca 0.43 -0.64 -0.26 0.00 0.00 0.00 0.00 47.33 46.86 2rti h GLY 16 CO -0.35 0.60 -1.06 -2.22 0.00 0.00 0.00 176.54 173.52 2rti h ILE 17 N 1.02 1.33 -2.80 2.60 2.04 -1.36 -3.45 117.51 116.89 2rti h ILE 17 Ca 0.23 -2.36 -0.58 0.00 1.00 0.00 0.00 64.86 63.14 2rti h ILE 17 Cb 0.27 2.68 0.09 0.00 -0.74 0.00 0.00 36.82 39.12 2rti h ILE 17 CO -0.01 0.71 0.61 0.41 0.00 0.00 0.00 178.15 179.87 2rti n THR 18 N -3.92 1.11 -0.45 -0.27 -1.04 0.14 -4.81 114.28 105.04 2rti n THR 18 Ca -0.13 -0.28 0.00 0.00 -2.04 0.00 0.00 64.05 61.61 2rti n THR 18 Cb 0.90 -1.52 0.00 0.00 -1.82 0.00 0.00 70.33 67.89 2rti n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2rti n GLY 19 N 1.96 0.71 3.67 3.41 0.00 -0.52 -4.40 105.19 110.02 2rti n GLY 19 Ca 0.10 -1.83 -0.35 0.00 0.00 0.00 0.00 46.02 43.94 2rti n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rti s THR 20 N -2.07 4.54 0.08 2.61 2.01 0.15 -1.98 115.64 120.98 2rti s THR 20 Ca 0.00 -0.14 0.03 0.00 0.31 0.00 0.00 61.69 61.88 2rti s THR 20 Cb 0.00 -2.97 -0.03 0.00 0.01 0.00 0.00 72.50 69.51 2rti s THR 20 CO 0.00 0.56 -0.09 0.26 -0.69 0.00 0.00 174.62 174.66 2rti s TRP 21 N -0.42 0.91 0.08 4.92 0.52 -0.06 -1.08 118.94 123.80 2rti s TRP 21 Ca 0.09 -0.65 0.02 0.00 0.02 0.00 0.00 56.10 55.58 2rti s TRP 21 Cb -0.12 -0.52 -0.04 0.00 -1.15 0.00 0.00 33.47 31.65 2rti s TRP 21 CO 0.02 -0.05 -0.07 1.52 0.02 0.00 0.00 176.95 178.39 2rti s TYR 22 N -2.27 0.80 0.53 -1.98 -0.85 -0.49 -0.92 117.35 112.17 2rti s TYR 22 Ca 0.01 -0.76 0.01 0.00 -0.52 0.00 0.00 57.07 55.82 2rti s TYR 22 Cb -0.04 -0.47 0.00 0.00 0.38 0.00 0.00 41.96 41.83 2rti s TYR 22 CO -0.01 -0.13 0.07 0.54 -1.52 0.00 0.00 175.55 174.51 2rti s ASN 23 N -2.48 4.23 0.40 -0.18 2.20 -1.04 -0.52 114.94 117.56 2rti s ASN 23 Ca 0.03 -1.61 0.27 0.00 -0.94 0.00 0.00 52.86 50.62 2rti s ASN 23 Cb -0.01 0.59 1.46 0.00 -2.00 0.00 0.00 41.25 41.29 2rti s ASN 23 CO -0.03 -0.93 1.84 0.06 -2.94 0.00 0.00 177.10 175.10 2rti h GLN 24 N 1.21 0.00 0.00 3.55 -0.00 -1.91 -1.04 115.11 116.92 2rti h GLN 24 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 2rti h GLN 24 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.80 2rti h GLN 24 CO 0.71 0.00 -0.82 -0.07 -0.00 0.00 0.00 178.83 178.65 2rti h LEU 25 N 0.00 0.00 0.00 0.06 3.38 -1.95 -3.47 115.31 113.33 2rti h LEU 25 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2rti h LEU 25 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2rti h LEU 25 CO 0.00 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.15 2rti n GLY 26 N 1.19 1.13 3.86 0.83 0.00 -0.39 -4.78 105.19 107.01 2rti n GLY 26 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2rti n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rti s SER 27 N -2.00 6.52 -0.10 1.61 0.01 -1.26 -4.56 113.70 113.93 2rti s SER 27 Ca 0.00 1.39 0.00 0.00 1.31 0.00 0.00 55.95 58.66 2rti s SER 27 Cb 0.00 -2.44 -0.02 0.00 0.21 0.00 0.00 66.02 63.77 2rti s SER 27 CO 0.00 -0.58 -0.10 -0.89 0.41 0.00 0.00 173.24 172.08 2rti s THR 28 N -2.64 3.38 -0.14 1.44 2.01 0.68 -2.50 115.64 117.87 2rti s THR 28 Ca 0.56 -0.57 -0.00 0.00 0.31 0.00 0.00 61.69 61.98 2rti s THR 28 Cb -0.10 -2.40 0.03 0.00 0.01 0.00 0.00 72.50 70.04 2rti s THR 28 CO 0.35 0.56 -0.09 0.12 -0.69 0.00 0.00 174.62 174.87 2rti s PHE 29 N -0.24 1.75 -0.23 4.92 5.36 -0.09 -0.82 117.98 128.63 2rti s PHE 29 Ca 0.02 -0.97 -0.03 0.00 -0.96 0.00 0.00 56.93 54.99 2rti s PHE 29 Cb -0.13 -1.37 0.00 0.00 -0.34 0.00 0.00 43.02 41.19 2rti s PHE 29 CO 0.03 -0.59 -0.05 0.42 -1.46 0.00 0.00 175.22 173.57 2rti s ILE 30 N 1.62 3.22 0.07 3.12 -1.09 0.07 -0.89 121.20 127.32 2rti s ILE 30 Ca 0.04 -0.66 0.01 0.00 -2.23 0.00 0.00 60.65 57.81 2rti s ILE 30 Cb -0.13 -2.51 -0.04 0.00 -1.58 0.00 0.00 42.46 38.20 2rti s ILE 30 CO -0.09 0.35 -0.06 0.54 -1.23 0.00 0.00 174.94 174.46 2rti s VAL 31 N 1.43 0.48 -0.06 2.92 0.11 -0.84 -1.74 120.40 122.71 2rti s VAL 31 Ca 0.04 -1.61 0.01 0.00 -2.93 0.00 0.00 61.98 57.50 2rti s VAL 31 Cb -0.15 -1.26 0.02 0.00 -1.53 0.00 0.00 36.38 33.46 2rti s VAL 31 CO -0.04 -0.76 -0.09 -0.89 -3.33 0.00 0.00 175.10 170.00 2rti s THR 32 N -2.97 0.92 -0.25 5.04 2.01 -0.76 -1.44 115.64 118.20 2rti s THR 32 Ca 0.03 -0.33 -0.09 0.00 0.31 0.00 0.00 61.69 61.61 2rti s THR 32 Cb 0.01 -0.88 -0.04 0.00 0.01 0.00 0.00 72.50 71.60 2rti s THR 32 CO -0.04 0.31 0.13 0.00 -0.69 0.00 0.00 174.62 174.33 2rti s ALA 33 N 0.89 3.42 0.31 7.40 0.00 -1.26 -2.64 121.76 129.88 2rti s ALA 33 Ca -0.11 -1.00 -0.03 0.00 0.00 0.00 0.00 51.96 50.82 2rti s ALA 33 Cb -0.15 -2.24 -0.04 0.00 0.00 0.00 0.00 23.12 20.68 2rti s ALA 33 CO 0.01 -0.34 0.55 0.20 0.00 0.00 0.00 175.76 176.18 2rti s GLY 34 N 1.34 1.67 0.41 0.00 0.00 0.58 -4.74 107.32 106.59 2rti s GLY 34 Ca 0.06 -0.69 0.19 0.00 0.00 0.00 0.00 44.72 44.28 2rti s GLY 34 CO 0.06 -0.60 1.80 0.00 0.00 0.00 0.00 173.10 174.35 2rti h ALA 35 N 1.34 2.28 0.00 3.20 0.00 -1.98 -1.65 119.26 122.45 2rti h ALA 35 Ca -0.48 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2rti h ALA 35 Cb 1.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2rti h ALA 35 CO 0.65 -0.65 0.00 -0.40 0.00 0.00 0.00 179.25 178.85 2rti n ASP 36 N -4.56 0.00 0.00 0.00 5.75 -1.26 -4.84 116.55 111.63 2rti n ASP 36 Ca 0.23 -1.63 0.00 0.00 -0.01 0.00 0.00 54.79 53.39 2rti n ASP 36 Cb 0.85 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.94 2rti n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2rti n GLY 37 N 0.58 0.76 3.89 6.12 0.00 -0.62 -4.93 105.19 110.98 2rti n GLY 37 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 2rti n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rti s ALA 38 N -2.20 3.60 -0.05 4.61 0.00 -1.23 -0.87 121.76 125.62 2rti s ALA 38 Ca 0.00 -0.38 0.03 0.00 0.00 0.00 0.00 51.96 51.61 2rti s ALA 38 Cb 0.00 -2.38 0.00 0.00 0.00 0.00 0.00 23.12 20.75 2rti s ALA 38 CO 0.00 0.43 -0.13 -0.51 0.00 0.00 0.00 175.76 175.55 2rti s LEU 39 N -3.05 1.79 0.03 0.00 1.43 -0.40 -0.31 118.68 118.17 2rti s LEU 39 Ca 0.46 -0.30 -0.04 0.00 -1.03 0.00 0.00 54.13 53.22 2rti s LEU 39 Cb -0.11 -0.82 -0.01 0.00 0.03 0.00 0.00 46.19 45.27 2rti s LEU 39 CO 0.24 0.09 0.07 0.42 0.23 0.00 0.00 176.35 177.40 2rti s THR 40 N 0.31 0.13 -4.45 5.49 -4.23 -1.08 -1.37 115.64 110.44 2rti s THR 40 Ca -0.08 -1.10 0.00 0.00 -1.18 0.00 0.00 61.69 59.33 2rti s THR 40 Cb -0.12 -0.81 0.00 0.00 1.34 0.00 0.00 72.50 72.91 2rti s THR 40 CO 0.02 -0.60 0.00 0.61 -0.54 0.00 0.00 174.62 174.11 2rti n GLY 41 N 0.90 -0.50 3.13 3.99 0.00 -1.11 -1.82 105.19 109.78 2rti n GLY 41 Ca -0.20 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.66 2rti n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rti s THR 42 N -3.08 0.70 -0.03 2.61 -4.23 -0.71 -1.60 115.64 109.30 2rti s THR 42 Ca 0.00 -1.55 0.03 0.00 -1.18 0.00 0.00 61.69 58.99 2rti s THR 42 Cb 0.00 -1.21 0.00 0.00 1.34 0.00 0.00 72.50 72.63 2rti s THR 42 CO 0.00 -0.61 -0.11 -0.47 -0.54 0.00 0.00 174.62 172.88 2rti s TYR 43 N -2.51 1.17 -0.17 3.99 6.14 -0.45 -0.75 117.35 124.78 2rti s TYR 43 Ca 0.02 -0.32 0.00 0.00 0.64 0.00 0.00 57.07 57.42 2rti s TYR 43 Cb -0.02 -0.82 0.03 0.00 0.42 0.00 0.00 41.96 41.57 2rti s TYR 43 CO -0.02 -0.13 -0.11 -2.00 0.64 0.00 0.00 175.55 173.94 2rti s GLU 44 N 0.19 2.02 -0.01 4.97 2.12 0.00 -1.36 118.70 126.63 2rti s GLU 44 Ca -0.04 -0.64 -0.08 0.00 0.36 0.00 0.00 54.97 54.57 2rti s GLU 44 Cb -0.10 -2.18 -0.05 0.00 0.26 0.00 0.00 34.13 32.07 2rti s GLU 44 CO 0.01 -0.34 0.27 0.45 -0.54 0.00 0.00 175.26 175.11 2rti s SER 45 N 1.49 6.53 0.20 -1.70 0.15 -1.26 -0.23 113.70 118.88 2rti s SER 45 Ca 0.02 0.62 0.24 0.00 0.70 0.00 0.00 55.95 57.53 2rti s SER 45 Cb -0.14 -2.11 0.39 0.00 -1.71 0.00 0.00 66.02 62.45 2rti s SER 45 CO -0.09 0.29 1.42 0.00 1.20 0.00 0.00 173.24 176.06 2rti h ALA 46 N 4.25 0.72 -1.97 5.45 0.00 -1.86 -3.47 119.26 122.38 2rti h ALA 46 Ca -0.51 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 53.93 2rti h ALA 46 Cb 1.21 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.86 2rti h ALA 46 CO 0.64 0.00 -0.58 0.14 0.00 0.00 0.00 179.25 179.45 2rti s VAL 47 N -3.19 0.90 0.00 0.00 -7.23 -1.26 -5.03 120.40 104.59 2rti s VAL 47 Ca 0.06 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.23 2rti s VAL 47 Cb 0.11 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 34.42 2rti s VAL 47 CO 0.70 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 176.10 2rti n GLY 48 N -0.71 -2.60 3.25 2.32 0.00 -1.26 -4.50 105.19 101.69 2rti n GLY 48 Ca -0.03 -1.75 -0.44 0.00 0.00 0.00 0.00 46.02 43.81 2rti n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rti n ASN 49 N -0.04 5.37 -3.78 1.61 5.15 -1.26 -4.88 115.26 117.43 2rti n ASN 49 Ca 0.00 -3.07 -0.13 0.00 -0.60 0.00 0.00 54.58 50.79 2rti n ASN 49 Cb 0.00 -1.48 -0.12 0.00 -0.53 0.00 0.00 39.78 37.65 2rti n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2rti s ALA 50 N 0.30 -0.56 -0.10 5.20 0.00 -1.26 -4.55 121.76 120.79 2rti s ALA 50 Ca 0.39 0.73 -0.04 0.00 0.00 0.00 0.00 51.96 53.03 2rti s ALA 50 Cb -0.00 -0.44 0.05 0.00 0.00 0.00 0.00 23.12 22.73 2rti s ALA 50 CO -0.00 -0.13 0.22 -1.83 0.00 0.00 0.00 175.76 174.02 2rti s GLU 51 N 0.41 0.16 2.04 0.00 -1.05 -1.26 -4.94 118.70 114.05 2rti s GLU 51 Ca -0.02 0.52 0.00 0.00 -0.15 0.00 0.00 54.97 55.32 2rti s GLU 51 Cb -0.04 -0.14 0.00 0.00 -0.44 0.00 0.00 34.13 33.52 2rti s GLU 51 CO -0.02 -0.19 0.00 0.45 0.95 0.00 0.00 175.26 176.45 2rti n SER 52 N 4.45 -0.04 -4.92 0.83 2.88 -1.26 -4.74 113.62 110.82 2rti n SER 52 Ca -0.22 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.05 2rti n SER 52 Cb 0.52 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.95 2rti n SER 52 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2rti s ARG 53 N 0.00 3.55 0.09 -1.46 0.52 -1.26 -4.54 118.95 115.85 2rti s ARG 53 Ca 0.00 -0.25 0.07 0.00 -0.52 0.00 0.00 55.73 55.03 2rti s ARG 53 Cb 0.00 -2.80 -0.03 0.00 0.52 0.00 0.00 34.95 32.64 2rti s ARG 53 CO 0.00 0.36 -0.18 0.71 0.02 0.00 0.00 175.30 176.21 2rti s TYR 54 N -1.91 1.58 0.28 -0.53 1.51 -0.46 -4.87 117.35 112.95 2rti s TYR 54 Ca 0.40 -0.43 -0.26 0.00 -1.01 0.00 0.00 57.07 55.77 2rti s TYR 54 Cb -0.11 -0.88 -0.09 0.00 -0.11 0.00 0.00 41.96 40.77 2rti s TYR 54 CO 0.29 0.14 0.91 0.08 -1.11 0.00 0.00 175.55 175.86 2rti s VAL 55 N -1.17 4.23 0.08 0.71 1.01 -1.26 -1.34 120.40 122.66 2rti s VAL 55 Ca 0.04 1.82 0.05 0.00 0.00 0.00 0.00 61.98 63.89 2rti s VAL 55 Cb -0.10 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 2rti s VAL 55 CO 0.03 0.26 -0.14 -1.48 0.00 0.00 0.00 175.10 173.78 2rti s LEU 56 N -1.77 2.31 -0.02 3.92 0.05 -0.63 -4.38 118.68 118.15 2rti s LEU 56 Ca 0.46 -0.66 -0.05 0.00 0.05 0.00 0.00 54.13 53.94 2rti s LEU 56 Cb -0.20 -0.51 0.01 0.00 -2.05 0.00 0.00 46.19 43.43 2rti s LEU 56 CO 0.26 -0.10 0.11 0.28 -0.55 0.00 0.00 176.35 176.34 2rti s THR 57 N -1.48 0.03 0.05 5.48 -1.32 -1.01 -2.76 115.64 114.63 2rti s THR 57 Ca 0.00 -0.28 -0.03 0.00 -1.21 0.00 0.00 61.69 60.17 2rti s THR 57 Cb -0.09 -0.25 0.01 0.00 -1.51 0.00 0.00 72.50 70.66 2rti s THR 57 CO 0.02 -0.16 0.14 0.61 -2.21 0.00 0.00 174.62 173.02 2rti n GLY 58 N 2.44 1.67 3.10 6.08 0.00 -0.47 -1.07 105.19 116.94 2rti n GLY 58 Ca -0.16 -1.03 -0.08 0.00 0.00 0.00 0.00 46.02 44.74 2rti n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rti s ARG 59 N -2.01 0.59 0.16 1.61 1.81 -0.69 -1.28 118.95 119.14 2rti s ARG 59 Ca 0.03 -0.91 -0.09 0.00 -1.72 0.00 0.00 55.73 53.04 2rti s ARG 59 Cb -0.01 0.22 -0.01 0.00 -0.45 0.00 0.00 34.95 34.71 2rti s ARG 59 CO 0.02 -0.14 0.27 1.52 -0.68 0.00 0.00 175.30 176.29 2rti s TYR 60 N -3.03 0.39 -0.50 -0.53 1.13 -0.05 -1.90 117.35 112.85 2rti s TYR 60 Ca -0.01 -0.76 -0.29 0.00 -1.41 0.00 0.00 57.07 54.60 2rti s TYR 60 Cb 0.01 -0.07 0.02 0.00 -1.10 0.00 0.00 41.96 40.83 2rti s TYR 60 CO -0.07 -0.70 1.23 0.34 -2.51 0.00 0.00 175.55 173.85 2rti s ASP 61 N -2.96 6.47 0.23 -0.18 3.68 -0.70 -4.57 116.67 118.64 2rti s ASP 61 Ca 0.16 0.42 0.25 0.00 2.13 0.00 0.00 52.55 55.51 2rti s ASP 61 Cb 0.04 -2.55 0.90 0.00 -1.45 0.00 0.00 42.92 39.86 2rti s ASP 61 CO -0.01 -1.40 1.75 -1.54 0.13 0.00 0.00 175.17 174.10 2rti n SER 62 N 8.38 0.73 -3.41 -0.34 3.41 -1.26 -3.85 113.62 117.27 2rti n SER 62 Ca 0.12 0.62 -0.26 0.00 -0.26 0.00 0.00 58.87 59.08 2rti n SER 62 Cb 0.49 -0.80 -0.08 0.00 -0.26 0.00 0.00 64.21 63.56 2rti n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rti n ALA 63 N -1.77 3.45 -1.00 7.33 0.00 -1.26 -4.69 120.51 122.57 2rti n ALA 63 Ca 0.04 -4.25 -0.00 0.00 0.00 0.00 0.00 53.44 49.23 2rti n ALA 63 Cb 0.33 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.90 2rti n ALA 63 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2rti n PRO 64 N 1.27 -1.50 -3.84 0.00 -0.04 -1.25 -5.02 135.00 124.62 2rti n PRO 64 Ca 0.26 -0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.38 2rti n PRO 64 Cb 0.44 -0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.85 2rti n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rti s ALA 65 N -2.00 3.91 -1.22 0.55 0.00 -1.26 -4.99 121.76 116.74 2rti s ALA 65 Ca 0.00 -0.68 -0.18 0.00 0.00 0.00 0.00 51.96 51.11 2rti s ALA 65 Cb -0.00 -1.97 -0.02 0.00 0.00 0.00 0.00 23.12 21.13 2rti s ALA 65 CO 0.00 0.70 2.05 0.25 0.00 0.00 0.00 175.76 178.76 2rti n THR 66 N 1.03 2.95 -2.95 0.00 -2.24 -1.26 -4.59 114.28 107.22 2rti n THR 66 Ca -0.11 -2.69 0.00 0.00 -2.27 0.00 0.00 64.05 58.98 2rti n THR 66 Cb 0.53 -2.46 0.00 0.00 -2.10 0.00 0.00 70.33 66.30 2rti n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2rti n ASP 67 N 7.45 0.00 -3.44 3.42 5.68 -1.26 -5.02 116.55 123.38 2rti n ASP 67 Ca 0.50 -0.75 -0.39 0.00 -0.50 0.00 0.00 54.79 53.65 2rti n ASP 67 Cb 0.41 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.39 2rti n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rti n GLY 68 N 0.00 5.47 3.79 6.12 0.00 -1.26 -4.92 105.19 114.38 2rti n GLY 68 Ca 0.00 -2.22 -0.26 0.00 0.00 0.00 0.00 46.02 43.54 2rti n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rti s SER 69 N -0.22 5.45 0.63 1.61 0.01 -1.26 -5.11 113.70 114.81 2rti s SER 69 Ca 0.50 -0.16 -0.04 0.00 1.31 0.00 0.00 55.95 57.56 2rti s SER 69 Cb 0.21 -1.40 0.04 0.00 0.21 0.00 0.00 66.02 65.08 2rti s SER 69 CO -0.13 0.07 0.91 -0.83 0.41 0.00 0.00 173.24 173.67 2rti s GLY 70 N -3.11 1.72 -0.27 3.44 0.00 -1.26 -4.87 107.32 102.96 2rti s GLY 70 Ca 0.31 -1.03 -0.10 0.00 0.00 0.00 0.00 44.72 43.90 2rti s GLY 70 CO 0.23 -0.68 0.16 -1.59 0.00 0.00 0.00 173.10 171.22 2rti s THR 71 N -3.04 5.11 0.30 0.90 2.01 0.27 -4.80 115.64 116.40 2rti s THR 71 Ca 0.58 0.10 -0.28 0.00 0.31 0.00 0.00 61.69 62.40 2rti s THR 71 Cb -0.11 -3.42 -0.09 0.00 0.01 0.00 0.00 72.50 68.89 2rti s THR 71 CO 0.43 0.27 1.04 0.00 -0.69 0.00 0.00 174.62 175.67 2rti s ALA 72 N 1.68 3.30 0.28 7.40 0.00 -1.26 -0.57 121.76 132.59 2rti s ALA 72 Ca 0.07 0.76 -0.20 0.00 0.00 0.00 0.00 51.96 52.59 2rti s ALA 72 Cb -0.16 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.70 2rti s ALA 72 CO 0.09 -0.07 0.70 -0.48 0.00 0.00 0.00 175.76 176.00 2rti s LEU 73 N -1.72 -0.20 0.08 0.00 -0.00 -0.80 -1.73 118.68 114.30 2rti s LEU 73 Ca 0.47 -0.65 -0.26 0.00 -0.00 0.00 0.00 54.13 53.69 2rti s LEU 73 Cb -0.27 2.66 0.08 0.00 -0.00 0.00 0.00 46.19 48.66 2rti s LEU 73 CO 0.35 -1.34 0.72 -0.83 -0.00 0.00 0.00 176.35 175.25 2rti s GLY 74 N -2.93 -0.55 0.19 -3.48 0.00 -0.80 -2.19 107.32 97.56 2rti s GLY 74 Ca 0.12 0.77 -0.17 0.00 0.00 0.00 0.00 44.72 45.44 2rti s GLY 74 CO 0.07 0.29 0.51 0.66 0.00 0.00 0.00 173.10 174.64 2rti s TRP 75 N -3.31 -0.13 0.05 1.90 -2.14 -0.71 -1.70 118.94 112.90 2rti s TRP 75 Ca 0.02 -0.20 0.05 0.00 2.66 0.00 0.00 56.10 58.63 2rti s TRP 75 Cb -0.01 0.38 -0.02 0.00 -3.10 0.00 0.00 33.47 30.72 2rti s TRP 75 CO -0.10 -0.89 -0.15 0.99 -2.66 0.00 0.00 176.95 174.14 2rti s THR 76 N -3.86 1.18 -0.06 0.66 2.01 -0.23 -1.04 115.64 114.30 2rti s THR 76 Ca 0.08 -1.13 -0.00 0.00 0.31 0.00 0.00 61.69 60.96 2rti s THR 76 Cb -0.01 -1.09 0.02 0.00 0.01 0.00 0.00 72.50 71.44 2rti s THR 76 CO -0.04 -0.05 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.13 2rti s VAL 77 N -0.98 0.51 -0.17 3.82 1.01 -0.71 -2.39 120.40 121.48 2rti s VAL 77 Ca 0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 61.98 61.87 2rti s VAL 77 Cb -0.09 -0.59 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 2rti s VAL 77 CO 0.02 0.25 0.14 0.00 0.00 0.00 0.00 175.10 175.51 2rti s ALA 78 N 1.43 3.75 -1.38 5.51 0.00 -1.26 -1.07 121.76 128.74 2rti s ALA 78 Ca -0.03 -0.67 -0.08 0.00 0.00 0.00 0.00 51.96 51.19 2rti s ALA 78 Cb -0.13 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 20.88 2rti s ALA 78 CO -0.03 0.31 2.73 0.91 0.00 0.00 0.00 175.76 179.67 2rti n TRP 79 N 3.02 2.37 -4.06 0.00 7.02 0.42 -4.79 117.44 121.42 2rti n TRP 79 Ca -0.17 -2.86 -0.17 0.00 -1.02 0.00 0.00 57.50 53.27 2rti n TRP 79 Cb 0.53 -2.12 -0.16 0.00 -2.42 0.00 0.00 31.31 27.14 2rti n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 2rti s LYS 80 N 0.46 0.49 0.00 -0.99 2.20 -1.26 -0.74 119.74 119.90 2rti s LYS 80 Ca 0.62 -0.05 0.00 0.00 -0.36 0.00 0.00 55.97 56.19 2rti s LYS 80 Cb 0.20 -0.56 0.00 0.00 -1.51 0.00 0.00 37.83 35.96 2rti s LYS 80 CO -0.08 -0.05 0.00 0.27 -0.36 0.00 0.00 175.35 175.13 2rti n ASN 81 N 3.79 0.00 0.10 1.43 0.23 0.54 -4.79 115.26 116.57 2rti n ASN 81 Ca -0.23 -0.97 0.11 0.00 -0.53 0.00 0.00 54.58 52.96 2rti n ASN 81 Cb 0.52 0.00 0.45 0.00 -2.08 0.00 0.00 39.78 38.68 2rti n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2rti n ASN 82 N -2.32 0.53 -0.07 0.53 5.03 -1.26 -3.47 115.26 114.24 2rti n ASN 82 Ca 0.00 0.62 -0.06 0.00 0.87 0.00 0.00 54.58 56.01 2rti n ASN 82 Cb 0.00 -0.74 -0.11 0.00 -1.02 0.00 0.00 39.78 37.91 2rti n ASN 82 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2rti n TYR 83 N -2.08 0.00 -3.88 3.10 4.01 -1.26 -5.04 117.16 112.01 2rti n TYR 83 Ca 0.03 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.67 2rti n TYR 83 Cb 0.23 -0.69 -0.09 0.00 -0.31 0.00 0.00 39.34 38.49 2rti n TYR 83 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2rti s ARG 84 N -2.37 0.68 -0.30 -0.72 3.52 -1.23 -5.05 118.95 113.49 2rti s ARG 84 Ca -0.07 -0.73 -0.03 0.00 -0.13 0.00 0.00 55.73 54.77 2rti s ARG 84 Cb 0.04 0.28 0.11 0.00 -1.56 0.00 0.00 34.95 33.82 2rti s ARG 84 CO 0.58 -0.19 0.15 1.21 -0.81 0.00 0.00 175.30 176.24 2rti s ASN 85 N -2.23 3.36 0.00 -2.12 3.84 -1.26 -0.34 114.94 116.20 2rti s ASN 85 Ca -0.03 -1.33 0.24 0.00 0.21 0.00 0.00 52.86 51.95 2rti s ASN 85 Cb -0.00 -0.30 0.92 0.00 -0.55 0.00 0.00 41.25 41.33 2rti s ASN 85 CO -0.05 -0.42 1.66 0.00 -2.79 0.00 0.00 177.10 175.49 2rti n ALA 86 N 5.15 2.55 -3.82 1.71 0.00 0.08 -4.95 120.51 121.22 2rti n ALA 86 Ca -0.04 -0.47 -0.24 0.00 0.00 0.00 0.00 53.44 52.69 2rti n ALA 86 Cb 0.42 -1.14 0.01 0.00 0.00 0.00 0.00 19.45 18.74 2rti n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2rti n HIS 87 N 0.20 -1.78 -3.84 0.00 8.25 -1.26 -4.86 115.22 111.93 2rti n HIS 87 Ca 0.18 0.77 -0.09 0.00 -0.26 0.00 0.00 57.72 58.31 2rti n HIS 87 Cb 0.33 -4.00 -0.04 0.00 1.12 0.00 0.00 29.99 27.40 2rti n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2rti s SER 88 N -4.31 -0.19 -0.04 0.41 1.04 -1.26 -0.98 113.70 108.37 2rti s SER 88 Ca 0.03 -0.64 -0.12 0.00 0.48 0.00 0.00 55.95 55.70 2rti s SER 88 Cb -0.01 0.59 0.02 0.00 0.10 0.00 0.00 66.02 66.72 2rti s SER 88 CO 0.85 -1.10 0.28 0.00 0.98 0.00 0.00 173.24 174.25 2rti s ALA 89 N -3.92 -0.69 0.00 5.32 0.00 -0.53 -0.44 121.76 121.50 2rti s ALA 89 Ca 0.13 0.38 0.07 0.00 0.00 0.00 0.00 51.96 52.54 2rti s ALA 89 Cb -0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 2rti s ALA 89 CO 0.02 -0.22 -0.21 0.99 0.00 0.00 0.00 175.76 176.34 2rti s THR 90 N -0.96 1.63 -0.03 0.00 2.01 -0.23 -1.03 115.64 117.03 2rti s THR 90 Ca -0.10 -0.98 0.06 0.00 0.31 0.00 0.00 61.69 60.98 2rti s THR 90 Cb -0.05 -1.38 -0.01 0.00 0.01 0.00 0.00 72.50 71.07 2rti s THR 90 CO 0.03 0.38 -0.21 0.42 -0.69 0.00 0.00 174.62 174.55 2rti s THR 91 N -0.58 1.66 -0.11 -0.82 -4.23 -0.70 -1.74 115.64 109.13 2rti s THR 91 Ca 0.08 -0.88 0.02 0.00 -1.18 0.00 0.00 61.69 59.73 2rti s THR 91 Cb -0.08 -1.39 -0.01 0.00 1.34 0.00 0.00 72.50 72.36 2rti s THR 91 CO 0.00 0.47 -0.16 0.26 -0.54 0.00 0.00 174.62 174.65 2rti s TRP 92 N -0.33 2.72 -0.10 3.99 0.51 -0.20 -1.75 118.94 123.78 2rti s TRP 92 Ca 0.04 -0.62 0.02 0.00 -2.12 0.00 0.00 56.10 53.42 2rti s TRP 92 Cb -0.10 -1.77 0.01 0.00 -0.81 0.00 0.00 33.47 30.81 2rti s TRP 92 CO 0.00 -0.17 -0.15 0.45 -0.51 0.00 0.00 176.95 176.57 2rti s SER 93 N 0.11 2.34 0.00 2.95 0.15 -0.42 -1.73 113.70 117.11 2rti s SER 93 Ca -0.08 -0.41 0.00 0.00 0.70 0.00 0.00 55.95 56.17 2rti s SER 93 Cb -0.15 -1.06 0.00 0.00 -1.71 0.00 0.00 66.02 63.10 2rti s SER 93 CO 0.05 0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.14 2rti n GLY 94 N 4.03 1.66 3.02 9.45 0.00 -0.93 -1.67 105.19 120.75 2rti n GLY 94 Ca -0.20 -0.63 -0.10 0.00 0.00 0.00 0.00 46.02 45.09 2rti n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rti s GLN 95 N 1.08 0.33 -0.13 1.61 -2.07 -0.36 -1.91 119.66 118.21 2rti s GLN 95 Ca 0.00 -0.38 -0.11 0.00 -1.82 0.00 0.00 55.36 53.05 2rti s GLN 95 Cb 0.00 0.13 -0.05 0.00 -1.09 0.00 0.00 33.01 32.00 2rti s GLN 95 CO 0.00 -0.07 0.23 -0.47 -1.32 0.00 0.00 175.29 173.67 2rti s TYR 96 N -1.11 3.54 -0.15 9.60 5.04 0.26 -1.42 117.35 133.10 2rti s TYR 96 Ca -0.12 0.59 -0.00 0.00 -2.44 0.00 0.00 57.07 55.09 2rti s TYR 96 Cb -0.07 -2.18 0.03 0.00 0.35 0.00 0.00 41.96 40.10 2rti s TYR 96 CO 0.00 0.46 -0.08 0.08 -1.34 0.00 0.00 175.55 174.67 2rti s VAL 97 N -0.25 1.25 0.47 3.14 1.01 -0.06 -0.56 120.40 125.39 2rti s VAL 97 Ca 0.15 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 2rti s VAL 97 Cb -0.13 -1.32 0.09 0.00 0.00 0.00 0.00 36.38 35.03 2rti s VAL 97 CO 0.04 0.26 0.64 0.61 0.00 0.00 0.00 175.10 176.65 2rti n GLY 98 N 4.85 0.61 0.00 4.51 0.00 -1.26 -1.25 105.19 112.64 2rti n GLY 98 Ca -0.13 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 43.90 2rti n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rti n GLY 99 N 0.13 0.84 0.11 -0.02 0.00 -1.26 -4.72 105.19 100.27 2rti n GLY 99 Ca 0.10 -1.79 -0.03 0.00 0.00 0.00 0.00 46.02 44.31 2rti n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rti h ALA 100 N 0.00 0.66 -3.40 4.61 0.00 -2.06 -3.35 119.26 115.72 2rti h ALA 100 Ca 0.00 -0.69 -0.65 0.00 0.00 0.00 0.00 54.91 53.57 2rti h ALA 100 Cb 0.00 -0.12 -0.40 0.00 0.00 0.00 0.00 17.79 17.27 2rti h ALA 100 CO 0.00 0.95 -0.61 -1.21 0.00 0.00 0.00 179.25 178.37 2rti s GLU 101 N -3.13 1.97 0.12 0.00 2.02 -1.26 -5.07 118.70 113.35 2rti s GLU 101 Ca 0.00 -2.52 -0.27 0.00 0.02 0.00 0.00 54.97 52.20 2rti s GLU 101 Cb 0.11 -3.35 -0.07 0.00 0.10 0.00 0.00 34.13 30.92 2rti s GLU 101 CO 0.78 -1.09 0.85 0.00 0.02 0.00 0.00 175.26 175.81 2rti s ALA 102 N -0.11 3.35 0.07 5.21 0.00 -1.26 -4.85 121.76 124.17 2rti s ALA 102 Ca 0.16 0.43 0.01 0.00 0.00 0.00 0.00 51.96 52.57 2rti s ALA 102 Cb -0.25 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 19.74 2rti s ALA 102 CO -0.01 0.11 -0.06 1.03 0.00 0.00 0.00 175.76 176.83 2rti s ARG 103 N -0.46 0.69 -0.14 0.00 1.81 -0.38 -3.25 118.95 117.23 2rti s ARG 103 Ca 0.41 -1.14 -0.00 0.00 -1.72 0.00 0.00 55.73 53.27 2rti s ARG 103 Cb -0.23 -0.13 0.03 0.00 -0.45 0.00 0.00 34.95 34.17 2rti s ARG 103 CO 0.27 -0.02 -0.09 0.42 -0.68 0.00 0.00 175.30 175.19 2rti s ILE 104 N -3.04 1.24 -0.18 1.52 1.01 -0.79 -0.88 121.20 120.08 2rti s ILE 104 Ca 0.04 -0.48 -0.06 0.00 0.00 0.00 0.00 60.65 60.16 2rti s ILE 104 Cb 0.01 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 41.20 2rti s ILE 104 CO -0.04 0.35 0.01 0.20 0.00 0.00 0.00 174.94 175.46 2rti s ASN 105 N 1.61 5.15 0.19 3.58 0.01 -0.51 -0.92 114.94 124.05 2rti s ASN 105 Ca 0.04 -0.06 -0.00 0.00 -0.71 0.00 0.00 52.86 52.13 2rti s ASN 105 Cb -0.13 -1.87 -0.04 0.00 0.41 0.00 0.00 41.25 39.62 2rti s ASN 105 CO -0.09 0.15 0.08 0.42 -1.51 0.00 0.00 177.10 176.15 2rti s THR 106 N 0.51 0.22 0.01 1.60 -4.23 -0.27 -1.22 115.64 112.26 2rti s THR 106 Ca -0.00 -1.97 0.04 0.00 -1.18 0.00 0.00 61.69 58.58 2rti s THR 106 Cb -0.14 -2.34 -0.01 0.00 1.34 0.00 0.00 72.50 71.35 2rti s THR 106 CO 0.02 -0.20 -0.12 -1.10 -0.54 0.00 0.00 174.62 172.68 2rti s GLN 107 N -4.07 0.87 0.11 3.99 -0.21 -0.67 -1.60 119.66 118.08 2rti s GLN 107 Ca 0.32 -0.53 0.03 0.00 0.02 0.00 0.00 55.36 55.21 2rti s GLN 107 Cb 0.07 -0.84 -0.04 0.00 1.00 0.00 0.00 33.01 33.20 2rti s GLN 107 CO 0.08 0.22 -0.09 1.67 -2.12 0.00 0.00 175.29 175.05 2rti s TRP 108 N -0.51 1.04 -0.12 0.91 1.48 0.05 -1.30 118.94 120.49 2rti s TRP 108 Ca 0.02 -0.76 0.01 0.00 -1.06 0.00 0.00 56.10 54.31 2rti s TRP 108 Cb -0.06 -0.57 0.02 0.00 -1.16 0.00 0.00 33.47 31.71 2rti s TRP 108 CO 0.00 -0.03 -0.13 -0.51 -4.06 0.00 0.00 176.95 172.22 2rti s LEU 109 N -2.80 1.60 -0.36 -4.66 1.43 -0.72 -1.86 118.68 111.31 2rti s LEU 109 Ca 0.10 -0.42 -0.06 0.00 -1.03 0.00 0.00 54.13 52.72 2rti s LEU 109 Cb 0.01 -1.07 0.06 0.00 0.03 0.00 0.00 46.19 45.22 2rti s LEU 109 CO -0.01 -0.04 0.14 -0.22 0.23 0.00 0.00 176.35 176.44 2rti s LEU 110 N 1.33 4.58 -0.12 1.79 0.20 0.09 -1.71 118.68 124.83 2rti s LEU 110 Ca 0.00 -1.39 -0.05 0.00 0.69 0.00 0.00 54.13 53.39 2rti s LEU 110 Cb -0.14 -1.86 -0.04 0.00 -0.43 0.00 0.00 46.19 43.73 2rti s LEU 110 CO -0.07 -0.40 0.06 -0.89 -0.29 0.00 0.00 176.35 174.77 2rti s THR 111 N 1.34 4.79 0.16 3.68 2.01 -0.20 -1.41 115.64 126.01 2rti s THR 111 Ca 0.00 -0.06 0.06 0.00 0.31 0.00 0.00 61.69 62.00 2rti s THR 111 Cb -0.21 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 2rti s THR 111 CO 0.01 0.57 0.10 -0.44 -0.69 0.00 0.00 174.62 174.16 2rti s SER 112 N -0.56 5.31 0.08 3.53 0.01 -0.49 -1.45 113.70 120.13 2rti s SER 112 Ca 0.11 -0.20 -0.28 0.00 1.31 0.00 0.00 55.95 56.89 2rti s SER 112 Cb -0.12 -1.33 -0.05 0.00 0.21 0.00 0.00 66.02 64.73 2rti s SER 112 CO 0.02 0.08 0.90 -0.83 0.41 0.00 0.00 173.24 173.82 2rti s GLY 113 N -3.02 2.93 0.34 3.44 0.00 -0.15 -4.87 107.32 105.99 2rti s GLY 113 Ca 0.30 0.47 0.08 0.00 0.00 0.00 0.00 44.72 45.57 2rti s GLY 113 CO 0.22 1.35 0.29 -1.30 0.00 0.00 0.00 173.10 173.66 2rti n THR 114 N 2.88 0.00 -2.14 0.90 -2.24 -1.26 -5.01 114.28 107.41 2rti n THR 114 Ca 0.01 -2.49 -0.30 0.00 -2.27 0.00 0.00 64.05 58.99 2rti n THR 114 Cb 0.50 1.24 -0.00 0.00 -2.10 0.00 0.00 70.33 69.96 2rti n THR 114 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2rti s THR 115 N -3.38 4.72 0.53 4.28 -4.23 -1.26 -4.90 115.64 111.41 2rti s THR 115 Ca 0.40 0.80 0.24 0.00 -1.18 0.00 0.00 61.69 61.95 2rti s THR 115 Cb 0.02 -3.84 0.38 0.00 1.34 0.00 0.00 72.50 70.40 2rti s THR 115 CO 0.29 -1.00 2.02 -0.08 -0.54 0.00 0.00 174.62 175.31 2rti h GLU 116 N 0.04 0.00 -0.21 3.99 4.81 -2.01 -1.76 114.58 119.45 2rti h GLU 116 Ca -0.45 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 58.62 2rti h GLU 116 Cb 1.19 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 2rti h GLU 116 CO 0.62 0.00 -0.51 0.00 -0.73 0.00 0.00 179.01 178.39 2rti h ALA 117 N 1.77 0.72 -0.54 2.92 0.00 -2.06 -3.21 119.26 118.85 2rti h ALA 117 Ca 0.21 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2rti h ALA 117 Cb 0.87 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2rti h ALA 117 CO -0.00 0.68 0.00 0.09 0.00 0.00 0.00 179.25 180.02 2rti n ASN 118 N -3.98 4.42 -0.11 0.00 3.02 -0.69 -4.40 115.26 113.51 2rti n ASN 118 Ca -0.03 -2.51 0.04 0.00 -0.03 0.00 0.00 54.58 52.05 2rti n ASN 118 Cb 0.58 -0.53 0.35 0.00 -0.61 0.00 0.00 39.78 39.58 2rti n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2rti h ALA 119 N 3.40 1.64 -0.51 5.41 0.00 -1.48 -1.82 119.26 125.90 2rti h ALA 119 Ca 0.00 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.02 2rti h ALA 119 Cb 1.38 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2rti h ALA 119 CO 0.21 0.32 0.40 0.11 0.00 0.00 0.00 179.25 180.29 2rti h TRP 120 N 0.74 0.00 -0.90 0.00 5.08 -1.82 -1.78 115.95 117.28 2rti h TRP 120 Ca 0.23 0.00 -0.60 0.00 1.08 0.00 0.00 58.89 59.60 2rti h TRP 120 Cb -0.00 0.00 -0.38 0.00 -3.00 0.00 0.00 29.16 25.78 2rti h TRP 120 CO -0.00 0.00 -0.25 0.36 -1.28 0.00 0.00 178.44 177.27 2rti n LYS 121 N -4.19 3.31 0.05 0.12 2.85 -0.69 -4.68 118.16 114.93 2rti n LYS 121 Ca 0.09 -3.91 0.12 0.00 -1.05 0.00 0.00 58.31 53.56 2rti n LYS 121 Cb 0.62 -2.28 0.08 0.00 -0.65 0.00 0.00 35.03 32.80 2rti n LYS 121 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2rti n SER 122 N -0.76 0.66 -4.27 -5.58 3.41 -0.67 -4.91 113.62 101.51 2rti n SER 122 Ca 0.50 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.79 2rti n SER 122 Cb 0.84 0.50 -0.16 0.00 -0.26 0.00 0.00 64.21 65.13 2rti n SER 122 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2rti s THR 123 N -3.21 2.39 0.07 6.66 2.01 -1.26 -1.40 115.64 120.90 2rti s THR 123 Ca 0.04 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 61.16 2rti s THR 123 Cb 0.13 -1.94 -0.04 0.00 0.01 0.00 0.00 72.50 70.66 2rti s THR 123 CO 0.77 0.55 0.09 -0.76 -0.69 0.00 0.00 174.62 174.57 2rti s LEU 124 N 0.33 3.84 0.05 4.42 1.43 -0.50 -4.93 118.68 123.33 2rti s LEU 124 Ca -0.16 0.02 0.05 0.00 -1.03 0.00 0.00 54.13 53.01 2rti s LEU 124 Cb -0.17 -2.49 -0.02 0.00 0.03 0.00 0.00 46.19 43.54 2rti s LEU 124 CO 0.08 0.18 -0.14 0.54 0.23 0.00 0.00 176.35 177.24 2rti s VAL 125 N -1.37 1.10 0.03 -1.59 0.11 -1.26 -0.73 120.40 116.69 2rti s VAL 125 Ca 0.29 -1.10 -0.02 0.00 -2.93 0.00 0.00 61.98 58.22 2rti s VAL 125 Cb -0.12 -1.02 0.01 0.00 -1.53 0.00 0.00 36.38 33.71 2rti s VAL 125 CO 0.21 -0.08 0.10 0.61 -3.33 0.00 0.00 175.10 172.62 2rti n GLY 126 N 1.68 1.52 3.12 6.54 0.00 -0.78 -4.98 105.19 112.31 2rti n GLY 126 Ca -0.19 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.72 2rti n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2rti s HIS 127 N -6.78 -0.21 0.04 1.61 -3.43 -1.26 -0.77 115.29 104.49 2rti s HIS 127 Ca 0.02 0.51 0.04 0.00 -0.80 0.00 0.00 55.06 54.83 2rti s HIS 127 Cb -0.00 0.07 -0.02 0.00 -1.43 0.00 0.00 32.58 31.19 2rti s HIS 127 CO 0.01 -0.16 -0.12 -0.51 -2.00 0.00 0.00 174.74 171.96 2rti s ASP 128 N -0.15 1.44 -0.10 7.38 1.01 -0.63 -4.96 116.67 120.66 2rti s ASP 128 Ca -0.03 -0.49 0.04 0.00 0.71 0.00 0.00 52.55 52.78 2rti s ASP 128 Cb -0.03 -0.06 0.00 0.00 1.01 0.00 0.00 42.92 43.84 2rti s ASP 128 CO 0.01 -0.04 -0.23 -0.89 0.21 0.00 0.00 175.17 174.23 2rti s THR 129 N -1.00 1.98 -0.04 -1.27 2.01 -1.26 -1.11 115.64 114.93 2rti s THR 129 Ca -0.01 -0.97 0.03 0.00 0.31 0.00 0.00 61.69 61.05 2rti s THR 129 Cb -0.08 -1.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.68 2rti s THR 129 CO 0.01 0.54 -0.12 -0.36 -0.69 0.00 0.00 174.62 174.00 2rti s PHE 130 N 0.40 2.76 -0.07 4.92 0.40 -0.10 -3.28 117.98 123.01 2rti s PHE 130 Ca -0.18 -0.12 0.03 0.00 -0.60 0.00 0.00 56.93 56.06 2rti s PHE 130 Cb -0.18 -1.63 -0.02 0.00 0.51 0.00 0.00 43.02 41.70 2rti s PHE 130 CO 0.08 0.24 -0.16 0.99 0.70 0.00 0.00 175.22 177.07 2rti s THR 131 N -0.78 2.88 0.16 0.64 2.01 0.32 -1.89 115.64 118.98 2rti s THR 131 Ca 0.12 -0.77 -0.16 0.00 0.31 0.00 0.00 61.69 61.19 2rti s THR 131 Cb -0.11 -2.14 -0.07 0.00 0.01 0.00 0.00 72.50 70.19 2rti s THR 131 CO 0.01 0.57 0.60 -0.75 -0.69 0.00 0.00 174.62 174.36 2rti s LYS 132 N -0.31 4.08 0.06 4.92 2.20 -1.20 -1.39 119.74 128.10 2rti s LYS 132 Ca 0.02 0.63 -0.01 0.00 -0.36 0.00 0.00 55.97 56.24 2rti s LYS 132 Cb -0.13 -2.96 -0.00 0.00 -1.51 0.00 0.00 37.83 33.23 2rti s LYS 132 CO 0.03 0.48 -0.03 1.55 -0.36 0.00 0.00 175.35 177.02 2rti n VAL 133 N 0.91 1.08 -4.33 4.02 3.14 -0.25 -4.93 118.33 117.98 2rti n VAL 133 Ca -0.05 0.34 -0.24 0.00 -2.96 0.00 0.00 64.34 61.42 2rti n VAL 133 Cb 0.51 -1.57 -0.08 0.00 -1.06 0.00 0.00 33.84 31.64 2rti n VAL 133 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2rti s LYS 134 N -1.92 2.12 0.00 1.45 1.02 -1.17 -4.96 119.74 116.29 2rti s LYS 134 Ca -0.02 -1.44 0.24 0.00 0.02 0.00 0.00 55.97 54.76 2rti s LYS 134 Cb 0.00 -2.09 1.42 0.00 -0.52 0.00 0.00 37.83 36.64 2rti s LYS 134 CO 0.03 0.38 1.78 -0.35 -0.92 0.00 0.00 175.35 176.27