#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bda s VAL 17 N 0.00 4.84 -1.03 2.52 1.01 -0.47 -4.12 120.40 123.14 2bda s VAL 17 Ca 0.00 1.15 0.00 0.00 0.00 0.00 0.00 61.98 63.13 2bda s VAL 17 Cb 0.00 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.51 2bda s VAL 17 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.23 2bda n GLY 18 N 1.94 0.34 2.64 4.51 0.00 -1.25 -2.30 105.19 111.08 2bda n GLY 18 Ca -0.10 -0.45 -0.15 0.00 0.00 0.00 0.00 46.02 45.32 2bda n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bda n GLY 19 N -1.21 0.90 3.17 -0.02 0.00 -1.26 -4.78 105.19 101.99 2bda n GLY 19 Ca -0.13 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 43.73 2bda n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bda s THR 20 N -1.93 0.84 0.08 2.61 -4.23 0.27 -4.92 115.64 108.37 2bda s THR 20 Ca 0.44 -1.77 -0.31 0.00 -1.18 0.00 0.00 61.69 58.88 2bda s THR 20 Cb -0.03 -1.49 -0.08 0.00 1.34 0.00 0.00 72.50 72.24 2bda s THR 20 CO 0.29 -0.70 1.56 -0.70 -0.54 0.00 0.00 174.62 174.54 2bda s GLU 21 N -3.24 4.23 0.44 3.99 2.12 -1.26 -0.88 118.70 124.09 2bda s GLU 21 Ca 0.08 2.25 -0.24 0.00 0.36 0.00 0.00 54.97 57.41 2bda s GLU 21 Cb 0.01 -3.46 -0.08 0.00 0.26 0.00 0.00 34.13 30.86 2bda s GLU 21 CO -0.02 -0.64 1.25 0.00 -0.54 0.00 0.00 175.26 175.31 2bda s ALA 22 N 2.10 3.10 0.41 6.30 0.00 0.19 -4.84 121.76 129.02 2bda s ALA 22 Ca 0.70 1.12 -0.26 0.00 0.00 0.00 0.00 51.96 53.53 2bda s ALA 22 Cb -0.39 -3.45 -0.09 0.00 0.00 0.00 0.00 23.12 19.19 2bda s ALA 22 CO 0.31 -0.81 1.29 -1.14 0.00 0.00 0.00 175.76 175.41 2bda s GLN 23 N -2.46 3.97 0.40 0.00 2.00 -1.26 -4.87 119.66 117.44 2bda s GLN 23 Ca 0.61 2.13 0.24 0.00 -2.00 0.00 0.00 55.36 56.33 2bda s GLN 23 Cb -0.35 -2.74 1.29 0.00 0.80 0.00 0.00 33.01 32.01 2bda s GLN 23 CO 0.43 -0.48 1.64 -0.09 -0.50 0.00 0.00 175.29 176.29 2bda h ARG 24 N 2.66 0.16 -0.28 1.67 2.43 -1.98 -2.28 114.38 116.77 2bda h ARG 24 Ca -0.50 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 2bda h ARG 24 Cb 1.25 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 2bda h ARG 24 CO 0.62 0.11 0.00 0.27 -1.51 0.00 0.00 179.97 179.46 2bda n ASN 25 N -4.86 3.49 -0.04 -3.80 0.23 -1.26 -4.70 115.26 104.32 2bda n ASN 25 Ca 0.35 -2.67 -0.16 0.00 -0.53 0.00 0.00 54.58 51.57 2bda n ASN 25 Cb 1.24 -0.43 -0.07 0.00 -2.08 0.00 0.00 39.78 38.44 2bda n ASN 25 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2bda h SER 26 N 1.79 0.75 -2.13 0.53 0.02 -1.75 -3.40 113.55 109.36 2bda h SER 26 Ca 0.00 -0.61 -0.56 0.00 -0.84 0.00 0.00 61.79 59.78 2bda h SER 26 Cb 1.18 -0.22 -0.41 0.00 0.14 0.00 0.00 62.40 63.09 2bda h SER 26 CO 0.14 1.23 -0.85 0.79 -1.14 0.00 0.00 176.83 176.99 2bda n TRP 27 N -4.14 2.06 0.52 3.45 7.02 -1.26 -4.96 117.44 120.12 2bda n TRP 27 Ca -0.07 -3.90 0.08 0.00 -1.02 0.00 0.00 57.50 52.58 2bda n TRP 27 Cb 0.62 -0.46 0.33 0.00 -2.42 0.00 0.00 31.31 29.38 2bda n TRP 27 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 2bda n PRO 28 N 0.60 0.01 0.03 -0.99 -0.04 -1.26 -1.39 135.00 131.96 2bda n PRO 28 Ca 0.27 0.25 0.13 0.00 -0.04 0.00 0.00 63.50 64.11 2bda n PRO 28 Cb 0.49 -1.52 0.46 0.00 -0.04 0.00 0.00 33.50 32.89 2bda n PRO 28 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2bda n SER 29 N -1.53 0.35 -4.73 3.54 3.41 -1.21 -1.91 113.62 111.54 2bda n SER 29 Ca 0.04 0.36 -0.42 0.00 -0.26 0.00 0.00 58.87 58.59 2bda n SER 29 Cb 0.18 -0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 63.71 2bda n SER 29 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2bda s GLN 30 N -3.04 4.36 0.25 4.33 2.00 -0.49 -0.91 119.66 126.16 2bda s GLN 30 Ca 0.12 2.09 0.10 0.00 -2.00 0.00 0.00 55.36 55.68 2bda s GLN 30 Cb 0.17 -3.20 -0.05 0.00 0.80 0.00 0.00 33.01 30.73 2bda s GLN 30 CO 0.59 -0.32 -0.18 0.96 -0.50 0.00 0.00 175.29 175.84 2bda s ILE 31 N 0.34 2.20 -0.22 -2.34 -5.25 -0.50 -4.54 121.20 110.89 2bda s ILE 31 Ca 0.59 -2.33 -0.06 0.00 -0.99 0.00 0.00 60.65 57.85 2bda s ILE 31 Cb -0.37 -2.21 -0.03 0.00 2.95 0.00 0.00 42.46 42.80 2bda s ILE 31 CO 0.37 -0.47 0.04 -0.55 -1.79 0.00 0.00 174.94 172.54 2bda s SER 32 N -3.44 5.10 -0.25 4.36 0.15 -0.59 -2.57 113.70 116.47 2bda s SER 32 Ca 0.27 -0.15 -0.11 0.00 0.70 0.00 0.00 55.95 56.65 2bda s SER 32 Cb -0.03 -1.89 -0.05 0.00 -1.71 0.00 0.00 66.02 62.34 2bda s SER 32 CO 0.12 0.04 0.21 -0.22 1.20 0.00 0.00 173.24 174.59 2bda s LEU 33 N 1.16 4.09 0.16 3.45 2.96 0.37 -0.46 118.68 130.42 2bda s LEU 33 Ca 0.04 0.13 0.08 0.00 -0.22 0.00 0.00 54.13 54.16 2bda s LEU 33 Cb -0.14 -2.17 -0.04 0.00 0.50 0.00 0.00 46.19 44.33 2bda s LEU 33 CO 0.03 0.01 -0.17 -1.10 -1.32 0.00 0.00 176.35 173.79 2bda s GLN 34 N 1.33 1.24 0.20 1.98 -0.21 0.11 -1.15 119.66 123.15 2bda s GLN 34 Ca 0.09 -1.40 0.10 0.00 0.02 0.00 0.00 55.36 54.17 2bda s GLN 34 Cb -0.14 -1.23 -0.04 0.00 1.00 0.00 0.00 33.01 32.59 2bda s GLN 34 CO 0.07 0.24 -0.20 1.52 -2.12 0.00 0.00 175.29 174.80 2bda s TYR 35 N -2.18 2.08 0.01 0.91 -0.85 0.16 -0.61 117.35 116.87 2bda s TYR 35 Ca 0.15 -0.41 -0.23 0.00 -0.52 0.00 0.00 57.07 56.06 2bda s TYR 35 Cb -0.05 -0.99 -0.05 0.00 0.38 0.00 0.00 41.96 41.25 2bda s TYR 35 CO 0.06 0.48 0.68 0.50 -1.52 0.00 0.00 175.55 175.75 2bda s ARG 36 N -3.00 4.41 -0.18 -3.49 3.00 -0.53 -0.22 118.95 118.94 2bda s ARG 36 Ca 0.21 0.90 -0.04 0.00 -1.00 0.00 0.00 55.73 55.80 2bda s ARG 36 Cb -0.06 -3.37 0.06 0.00 0.00 0.00 0.00 34.95 31.58 2bda s ARG 36 CO 0.10 0.29 0.07 0.45 0.00 0.00 0.00 175.30 176.20 2bda s SER 36 N 0.01 2.53 1.90 -2.12 0.15 0.28 -4.74 113.70 111.72 2bda s SER 36 Ca 0.35 -0.68 0.00 0.00 0.70 0.00 0.00 55.95 56.32 2bda s SER 36 Cb -0.19 -0.37 0.00 0.00 -1.71 0.00 0.00 66.02 63.75 2bda s SER 36 CO 0.20 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.91 2bda n GLY 36 N 5.20 4.08 1.09 9.45 0.00 -1.26 -1.00 105.19 122.75 2bda n GLY 36 Ca -0.08 0.11 0.10 0.00 0.00 0.00 0.00 46.02 46.15 2bda n GLY 36 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2bda n SER 36 N 9.12 3.48 -4.11 1.61 3.41 -1.26 -4.99 113.62 120.87 2bda n SER 36 Ca 0.00 -1.97 -0.27 0.00 -0.26 0.00 0.00 58.87 56.38 2bda n SER 36 Cb 0.00 -0.33 -0.06 0.00 -0.26 0.00 0.00 64.21 63.56 2bda n SER 36 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2bda n SER 37 N 1.31 2.52 -4.19 4.04 3.41 -0.17 -5.15 113.62 115.39 2bda n SER 37 Ca 0.19 -2.97 -0.24 0.00 -0.26 0.00 0.00 58.87 55.59 2bda n SER 37 Cb 0.56 0.54 -0.15 0.00 -0.26 0.00 0.00 64.21 64.90 2bda n SER 37 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 2bda s TRP 38 N -2.74 1.58 -0.07 7.33 0.52 -1.26 -0.56 118.94 123.74 2bda s TRP 38 Ca 0.07 -0.33 0.03 0.00 0.02 0.00 0.00 56.10 55.89 2bda s TRP 38 Cb 0.00 -0.98 0.01 0.00 -1.15 0.00 0.00 33.47 31.35 2bda s TRP 38 CO 0.05 0.02 -0.15 0.00 0.02 0.00 0.00 176.95 176.89 2bda s ALA 39 N -0.61 1.43 0.23 0.98 0.00 0.69 -4.92 121.76 119.57 2bda s ALA 39 Ca 0.06 -0.53 -0.31 0.00 0.00 0.00 0.00 51.96 51.18 2bda s ALA 39 Cb -0.08 -0.60 -0.11 0.00 0.00 0.00 0.00 23.12 22.34 2bda s ALA 39 CO 0.00 0.16 1.58 -1.58 0.00 0.00 0.00 175.76 175.92 2bda s HIS 40 N 0.54 2.93 0.00 0.00 2.46 -1.26 -0.66 115.29 119.29 2bda s HIS 40 Ca -0.14 0.71 0.00 0.00 0.47 0.00 0.00 55.06 56.10 2bda s HIS 40 Cb -0.16 -3.99 0.00 0.00 -0.13 0.00 0.00 32.58 28.30 2bda s HIS 40 CO 0.04 -3.48 0.00 -2.37 -2.47 0.00 0.00 174.74 166.46 2bda n THR 41 N 3.05 0.00 -3.91 0.89 5.66 -0.30 -4.91 114.28 114.76 2bda n THR 41 Ca 0.11 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 61.02 2bda n THR 41 Cb 0.38 -0.82 -0.05 0.00 -1.55 0.00 0.00 70.33 68.29 2bda n THR 41 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bda s GLY 43 N -2.96 1.80 0.21 0.00 0.00 0.05 -0.48 107.32 105.94 2bda s GLY 43 Ca 0.17 -1.84 -0.19 0.00 0.00 0.00 0.00 44.72 42.85 2bda s GLY 43 CO 0.05 -1.44 0.93 0.61 0.00 0.00 0.00 173.10 173.25 2bda n GLY 44 N -2.32 0.71 3.05 0.20 0.00 -1.06 -3.47 105.19 102.30 2bda n GLY 44 Ca 0.13 -1.15 -0.28 0.00 0.00 0.00 0.00 46.02 44.71 2bda n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bda s THR 45 N -2.10 1.45 -0.09 2.61 2.01 0.10 -1.41 115.64 118.21 2bda s THR 45 Ca 0.20 -0.62 -0.30 0.00 0.31 0.00 0.00 61.69 61.29 2bda s THR 45 Cb -0.03 -1.33 -0.03 0.00 0.01 0.00 0.00 72.50 71.11 2bda s THR 45 CO 0.06 0.43 1.37 -0.22 -0.69 0.00 0.00 174.62 175.57 2bda s LEU 46 N 1.00 4.25 -0.03 4.42 2.96 -0.08 -0.48 118.68 130.72 2bda s LEU 46 Ca -0.07 1.92 0.07 0.00 -0.22 0.00 0.00 54.13 55.83 2bda s LEU 46 Cb -0.15 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 42.90 2bda s LEU 46 CO -0.02 -0.76 0.11 2.30 -1.32 0.00 0.00 176.35 176.66 2bda n ILE 47 N 5.14 0.15 -4.20 6.68 -5.35 -0.47 0.31 119.36 121.62 2bda n ILE 47 Ca 0.14 -0.20 -0.12 0.00 -0.27 0.00 0.00 62.75 62.30 2bda n ILE 47 Cb 0.44 -0.05 -0.10 0.00 -1.74 0.00 0.00 39.64 38.20 2bda n ILE 47 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2bda s ARG 48 N -2.38 1.07 0.62 6.28 1.81 -0.99 -4.70 118.95 120.65 2bda s ARG 48 Ca -0.03 -1.53 0.32 0.00 -1.72 0.00 0.00 55.73 52.77 2bda s ARG 48 Cb 0.04 0.08 1.78 0.00 -0.45 0.00 0.00 34.95 36.40 2bda s ARG 48 CO 0.28 -0.26 2.10 1.96 -0.68 0.00 0.00 175.30 178.71 2bda h GLN 49 N 2.73 0.00 0.00 3.54 4.20 -1.96 -2.53 115.11 121.09 2bda h GLN 49 Ca -0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.35 2bda h GLN 49 Cb 1.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.99 2bda h GLN 49 CO 0.59 0.00 -0.21 0.27 -0.67 0.00 0.00 178.83 178.81 2bda n ASN 50 N -3.48 1.22 -3.97 1.46 6.94 -1.26 -0.95 115.26 115.22 2bda n ASN 50 Ca 0.00 -2.44 -0.17 0.00 -0.02 0.00 0.00 54.58 51.95 2bda n ASN 50 Cb 0.31 -0.28 -0.15 0.00 -2.36 0.00 0.00 39.78 37.30 2bda n ASN 50 CO 0.00 0.00 0.00 0.26 -1.03 0.00 0.00 177.26 176.49 2bda s TRP 51 N -1.39 0.56 -0.05 -2.53 0.52 -0.95 -0.53 118.94 114.56 2bda s TRP 51 Ca 0.15 -0.11 0.07 0.00 0.02 0.00 0.00 56.10 56.22 2bda s TRP 51 Cb 0.13 -0.38 -0.01 0.00 -1.15 0.00 0.00 33.47 32.06 2bda s TRP 51 CO 0.01 -0.02 -0.25 0.08 0.02 0.00 0.00 176.95 176.79 2bda s VAL 52 N -0.05 2.04 -0.20 4.03 1.01 -0.09 -1.37 120.40 125.78 2bda s VAL 52 Ca 0.01 -1.07 -0.11 0.00 0.00 0.00 0.00 61.98 60.80 2bda s VAL 52 Cb -0.04 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 2bda s VAL 52 CO -0.00 0.57 0.18 -0.32 0.00 0.00 0.00 175.10 175.53 2bda s MET 53 N -0.28 4.19 0.00 2.72 1.75 0.37 -0.30 119.30 127.75 2bda s MET 53 Ca 0.00 -0.14 0.00 0.00 -1.25 0.00 0.00 55.69 54.30 2bda s MET 53 Cb -0.13 -3.44 0.00 0.00 2.84 0.00 0.00 34.83 34.10 2bda s MET 53 CO 0.02 0.23 0.00 -2.37 -0.65 0.00 0.00 175.02 172.26 2bda n THR 54 N 3.69 0.00 -3.37 10.11 5.66 -0.01 -0.72 114.28 129.64 2bda n THR 54 Ca -0.15 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.49 2bda n THR 54 Cb 0.52 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.24 2bda n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bda s ALA 55 N -1.90 3.61 0.36 1.79 0.00 -1.26 -0.54 121.76 123.82 2bda s ALA 55 Ca 0.00 -0.10 0.05 0.00 0.00 0.00 0.00 51.96 51.90 2bda s ALA 55 Cb 0.00 -2.52 0.71 0.00 0.00 0.00 0.00 23.12 21.30 2bda s ALA 55 CO 0.00 0.45 1.97 0.00 0.00 0.00 0.00 175.76 178.18 2bda h ALA 56 N 4.12 1.65 0.00 0.00 0.00 -1.70 -1.76 119.26 121.57 2bda h ALA 56 Ca -0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2bda h ALA 56 Cb 1.21 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2bda h ALA 56 CO 0.64 0.26 0.00 1.12 0.00 0.00 0.00 179.25 181.27 2bda h HIS 57 N 0.79 0.00 0.00 0.00 2.07 -1.93 -2.05 115.15 114.04 2bda h HIS 57 Ca 0.29 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.81 2bda h HIS 57 Cb 0.15 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.13 2bda h HIS 57 CO -0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 2bda n VAL 59 N -3.07 1.47 -0.05 0.00 0.24 -0.78 -4.66 118.33 111.48 2bda n VAL 59 Ca 0.01 -2.19 -0.06 0.00 -2.04 0.00 0.00 64.34 60.07 2bda n VAL 59 Cb 0.34 0.07 0.14 0.00 -1.47 0.00 0.00 33.84 32.93 2bda n VAL 59 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2bda h ASP 60 N 0.60 0.65 -3.92 -1.34 3.32 -1.53 -3.45 116.42 110.75 2bda h ASP 60 Ca -0.04 -0.22 -0.48 0.00 0.02 0.00 0.00 57.03 56.31 2bda h ASP 60 Cb 1.21 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.57 2bda h ASP 60 CO 0.02 0.86 0.23 -0.13 -1.72 0.00 0.00 179.24 178.50 2bda s ARG 61 N -4.60 3.97 -1.50 3.56 3.00 -1.26 -4.96 118.95 117.16 2bda s ARG 61 Ca -0.08 0.79 -0.09 0.00 0.00 0.00 0.00 55.73 56.34 2bda s ARG 61 Cb 0.13 -2.28 0.00 0.00 0.00 0.00 0.00 34.95 32.81 2bda s ARG 61 CO 0.81 -0.06 2.63 -1.91 0.00 0.00 0.00 175.30 176.77 2bda n GLU 62 N -1.05 3.81 -4.01 3.54 4.07 -1.26 -4.93 120.64 120.81 2bda n GLU 62 Ca 0.05 -2.68 -0.22 0.00 -0.06 0.00 0.00 57.16 54.24 2bda n GLU 62 Cb 0.54 -2.84 -0.05 0.00 -0.06 0.00 0.00 31.44 29.03 2bda n GLU 62 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2bda s LEU 63 N -0.15 3.49 -0.23 4.31 1.43 -1.26 -5.09 118.68 121.18 2bda s LEU 63 Ca 0.60 -0.55 -0.21 0.00 -1.03 0.00 0.00 54.13 52.94 2bda s LEU 63 Cb 0.17 -2.04 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 2bda s LEU 63 CO -0.07 -0.24 0.67 -0.89 0.23 0.00 0.00 176.35 176.05 2bda s THR 64 N -2.31 4.97 0.09 5.49 2.01 -1.26 -5.02 115.64 119.60 2bda s THR 64 Ca 0.37 1.23 0.07 0.00 0.31 0.00 0.00 61.69 63.68 2bda s THR 64 Cb -0.05 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 2bda s THR 64 CO 0.24 0.03 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.73 2bda s PHE 65 N 2.39 2.70 0.19 4.92 0.40 -1.26 -1.46 117.98 125.86 2bda s PHE 65 Ca 0.29 -0.17 0.04 0.00 -0.60 0.00 0.00 56.93 56.48 2bda s PHE 65 Cb -0.16 -1.44 -0.05 0.00 0.51 0.00 0.00 43.02 41.88 2bda s PHE 65 CO 0.09 0.39 -0.04 -0.98 0.70 0.00 0.00 175.22 175.38 2bda s ARG 65 N -2.00 1.18 -0.07 0.44 1.70 0.22 -3.36 118.95 117.06 2bda s ARG 65 Ca 0.19 -1.56 0.03 0.00 -0.47 0.00 0.00 55.73 53.93 2bda s ARG 65 Cb -0.11 -0.54 -0.02 0.00 -0.57 0.00 0.00 34.95 33.71 2bda s ARG 65 CO 0.11 -0.04 -0.16 0.08 -1.08 0.00 0.00 175.30 174.22 2bda s VAL 66 N -3.43 2.91 -0.21 4.99 1.01 -0.13 -0.71 120.40 124.82 2bda s VAL 66 Ca 0.23 -0.76 -0.03 0.00 0.00 0.00 0.00 61.98 61.41 2bda s VAL 66 Cb 0.05 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 2bda s VAL 66 CO 0.04 0.57 -0.06 -0.69 0.00 0.00 0.00 175.10 174.97 2bda s VAL 67 N -0.39 3.27 0.19 2.92 1.01 0.40 -1.29 120.40 126.51 2bda s VAL 67 Ca 0.04 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 61.53 2bda s VAL 67 Cb -0.12 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 2bda s VAL 67 CO 0.02 0.44 0.25 0.68 0.00 0.00 0.00 175.10 176.49 2bda s VAL 68 N 1.42 4.98 -1.11 2.92 -7.23 -0.67 -1.53 120.40 119.17 2bda s VAL 68 Ca 0.05 -0.96 0.00 0.00 -1.81 0.00 0.00 61.98 59.26 2bda s VAL 68 Cb -0.14 -3.61 0.00 0.00 0.56 0.00 0.00 36.38 33.19 2bda s VAL 68 CO -0.04 -0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.17 2bda n GLY 69 N -0.80 0.15 3.83 2.32 0.00 -1.25 -0.93 105.19 108.51 2bda n GLY 69 Ca -0.08 -0.38 -0.38 0.00 0.00 0.00 0.00 46.02 45.18 2bda n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2bda s GLU 70 N -4.31 4.01 0.01 1.61 2.56 -1.26 -3.34 118.70 117.98 2bda s GLU 70 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 54.97 55.48 2bda s GLU 70 Cb 0.00 -3.23 0.00 0.00 2.00 0.00 0.00 34.13 32.90 2bda s GLU 70 CO 0.00 0.68 0.00 1.58 -0.56 0.00 0.00 175.26 176.96 2bda n HIS 71 N 1.79 -0.06 -3.98 5.30 -0.00 -1.26 -4.95 115.22 112.06 2bda n HIS 71 Ca -0.13 0.01 -0.34 0.00 -0.00 0.00 0.00 57.72 57.26 2bda n HIS 71 Cb 0.52 0.13 -0.15 0.00 -0.00 0.00 0.00 29.99 30.49 2bda n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2bda s ASN 72 N -5.07 3.98 0.54 0.26 3.84 -1.26 -1.92 114.94 115.31 2bda s ASN 72 Ca 0.00 -0.59 0.32 0.00 0.21 0.00 0.00 52.86 52.80 2bda s ASN 72 Cb 0.00 -1.65 1.51 0.00 -0.55 0.00 0.00 41.25 40.56 2bda s ASN 72 CO 0.00 -0.04 2.06 -0.07 -2.79 0.00 0.00 177.10 176.26 2bda h LEU 73 N 8.04 0.00 -2.05 3.21 3.38 -1.20 -3.11 115.31 123.58 2bda h LEU 73 Ca -0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2bda h LEU 73 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2bda h LEU 73 CO 0.61 0.08 0.00 0.59 0.09 0.00 0.00 178.44 179.81 2bda n ASN 74 N -3.35 2.66 -3.83 -0.43 3.02 -1.26 -5.00 115.26 107.06 2bda n ASN 74 Ca -0.01 -1.77 -0.09 0.00 -0.03 0.00 0.00 54.58 52.67 2bda n ASN 74 Cb 0.26 -0.12 -0.06 0.00 -0.61 0.00 0.00 39.78 39.25 2bda n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bda s GLN 75 N -1.18 1.00 -0.20 3.52 -2.07 -1.17 -5.12 119.66 114.43 2bda s GLN 75 Ca 0.23 -0.95 -0.29 0.00 -1.82 0.00 0.00 55.36 52.53 2bda s GLN 75 Cb 0.14 0.39 0.00 0.00 -1.09 0.00 0.00 33.01 32.45 2bda s GLN 75 CO 0.20 -0.36 1.06 1.21 -1.32 0.00 0.00 175.29 176.09 2bda s ASN 76 N -2.87 7.11 0.08 12.60 2.47 -1.26 -4.61 114.94 128.46 2bda s ASN 76 Ca 0.08 1.45 0.23 0.00 0.42 0.00 0.00 52.86 55.04 2bda s ASN 76 Cb 0.03 -2.54 0.12 0.00 -1.45 0.00 0.00 41.25 37.41 2bda s ASN 76 CO -0.08 -0.64 1.10 0.59 -3.72 0.00 0.00 177.10 174.35 2bda n ASN 77 N 6.09 0.64 -0.13 -4.21 3.02 -1.26 -4.96 115.26 114.45 2bda n ASN 77 Ca 0.12 -0.05 -0.02 0.00 -0.03 0.00 0.00 54.58 54.60 2bda n ASN 77 Cb 0.46 0.60 -0.01 0.00 -0.61 0.00 0.00 39.78 40.23 2bda n ASN 77 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bda n GLY 78 N 1.34 0.53 0.00 7.41 0.00 -1.26 -4.88 105.19 108.33 2bda n GLY 78 Ca 0.02 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2bda n GLY 78 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bda n THR 79 N -2.85 0.00 -2.75 2.61 -2.24 -1.26 -5.10 114.28 102.69 2bda n THR 79 Ca -0.02 -0.15 -0.35 0.00 -2.27 0.00 0.00 64.05 61.26 2bda n THR 79 Cb 0.11 1.40 -0.06 0.00 -2.10 0.00 0.00 70.33 69.68 2bda n THR 79 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2bda s GLU 80 N -0.13 4.32 -0.03 -0.78 8.01 -1.21 -4.46 118.70 124.42 2bda s GLU 80 Ca 0.00 1.26 0.04 0.00 0.01 0.00 0.00 54.97 56.28 2bda s GLU 80 Cb 0.00 -2.44 -0.01 0.00 -4.31 0.00 0.00 34.13 27.37 2bda s GLU 80 CO 0.00 0.04 -0.16 -0.65 0.01 0.00 0.00 175.26 174.50 2bda s GLN 81 N -2.69 1.46 -0.12 1.61 -0.21 -0.10 -4.99 119.66 114.61 2bda s GLN 81 Ca 0.58 -0.55 0.01 0.00 0.02 0.00 0.00 55.36 55.41 2bda s GLN 81 Cb -0.15 -1.34 -0.01 0.00 1.00 0.00 0.00 33.01 32.52 2bda s GLN 81 CO 0.19 0.27 -0.15 0.71 -2.12 0.00 0.00 175.29 174.20 2bda s TYR 82 N -0.13 2.76 -0.05 0.91 1.51 -1.26 -1.67 117.35 119.42 2bda s TYR 82 Ca 0.01 -0.70 -0.06 0.00 -1.01 0.00 0.00 57.07 55.32 2bda s TYR 82 Cb -0.09 -1.81 0.01 0.00 -0.11 0.00 0.00 41.96 39.96 2bda s TYR 82 CO 0.01 -0.23 0.15 0.54 -1.11 0.00 0.00 175.55 174.91 2bda s VAL 83 N 0.31 0.01 0.77 0.71 0.11 -0.41 -5.00 120.40 116.91 2bda s VAL 83 Ca -0.12 -0.10 -0.12 0.00 -2.93 0.00 0.00 61.98 58.72 2bda s VAL 83 Cb -0.16 -0.25 0.05 0.00 -1.53 0.00 0.00 36.38 34.49 2bda s VAL 83 CO 0.06 -0.05 1.13 -0.83 -3.33 0.00 0.00 175.10 172.07 2bda s GLY 84 N -0.12 1.61 -0.27 6.54 0.00 -1.26 -0.95 107.32 112.87 2bda s GLY 84 Ca -0.02 -0.43 -0.10 0.00 0.00 0.00 0.00 44.72 44.17 2bda s GLY 84 CO 0.00 0.01 0.17 0.14 0.00 0.00 0.00 173.10 173.42 2bda s VAL 85 N -3.38 5.20 -0.08 1.40 1.01 -1.21 -1.18 120.40 122.16 2bda s VAL 85 Ca 0.60 0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.70 2bda s VAL 85 Cb -0.12 -3.46 -0.26 0.00 0.00 0.00 0.00 36.38 32.54 2bda s VAL 85 CO 0.52 0.28 0.52 -0.61 0.00 0.00 0.00 175.10 175.81 2bda h GLN 86 N 8.20 0.20 -2.92 2.72 4.15 -0.41 -3.45 115.11 123.60 2bda h GLN 86 Ca -0.36 -0.35 -0.15 0.00 0.77 0.00 0.00 58.65 58.57 2bda h GLN 86 Cb 1.18 0.13 -0.26 0.00 0.21 0.00 0.00 27.48 28.75 2bda h GLN 86 CO 0.57 1.02 -0.35 0.21 -1.93 0.00 0.00 178.83 178.35 2bda s LYS 87 N -2.58 0.36 -0.27 1.69 2.20 -1.03 -4.98 119.74 115.12 2bda s LYS 87 Ca -0.16 0.51 -0.02 0.00 -0.36 0.00 0.00 55.97 55.95 2bda s LYS 87 Cb 0.07 0.11 0.04 0.00 -1.51 0.00 0.00 37.83 36.53 2bda s LYS 87 CO 0.80 -0.08 -0.04 0.42 -0.36 0.00 0.00 175.35 176.09 2bda s ILE 88 N 0.52 2.91 -0.41 5.43 1.01 -1.26 -0.83 121.20 128.56 2bda s ILE 88 Ca -0.03 -1.18 -0.08 0.00 0.00 0.00 0.00 60.65 59.36 2bda s ILE 88 Cb -0.04 -2.56 0.08 0.00 0.01 0.00 0.00 42.46 39.94 2bda s ILE 88 CO -0.03 0.07 0.24 -0.69 0.00 0.00 0.00 174.94 174.53 2bda s VAL 89 N 1.29 4.10 0.22 2.92 1.01 0.27 -5.00 120.40 125.22 2bda s VAL 89 Ca -0.02 -1.41 -0.13 0.00 0.00 0.00 0.00 61.98 60.41 2bda s VAL 89 Cb -0.18 -3.51 -0.08 0.00 0.00 0.00 0.00 36.38 32.62 2bda s VAL 89 CO -0.03 -0.48 0.61 -0.69 0.00 0.00 0.00 175.10 174.51 2bda s VAL 90 N 1.40 4.81 0.11 2.92 1.01 -1.26 -0.69 120.40 128.70 2bda s VAL 90 Ca 0.03 0.79 -0.33 0.00 0.00 0.00 0.00 61.98 62.46 2bda s VAL 90 Cb -0.23 -3.69 -0.13 0.00 0.00 0.00 0.00 36.38 32.34 2bda s VAL 90 CO 0.02 0.05 1.70 1.57 0.00 0.00 0.00 175.10 178.44 2bda n HIS 91 N 0.24 2.39 0.26 5.22 -0.00 -0.56 -4.82 115.22 117.96 2bda n HIS 91 Ca -0.01 0.12 0.12 0.00 0.46 0.00 0.00 57.72 58.40 2bda n HIS 91 Cb 0.52 -2.61 0.58 0.00 -0.12 0.00 0.00 29.99 28.35 2bda n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2bda h PRO 92 N 7.16 0.00 -0.02 1.57 0.13 -1.93 -0.33 132.00 138.59 2bda h PRO 92 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2bda h PRO 92 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2bda h PRO 92 CO 0.92 0.00 -0.06 0.66 -0.23 0.00 0.00 178.00 179.29 2bda n TYR 93 N -2.31 0.00 -1.78 1.56 0.53 -1.26 -4.95 117.16 108.95 2bda n TYR 93 Ca -0.00 0.00 -0.42 0.00 -1.02 0.00 0.00 57.90 56.46 2bda n TYR 93 Cb 0.12 -0.02 -0.02 0.00 -1.03 0.00 0.00 39.34 38.39 2bda n TYR 93 CO 0.00 0.00 0.00 -0.46 -1.02 0.00 0.00 176.86 175.38 2bda s TRP 94 N -2.10 2.80 -0.20 -0.72 -0.11 -0.14 -4.92 118.94 113.56 2bda s TRP 94 Ca 0.34 0.70 -0.00 0.00 1.22 0.00 0.00 56.10 58.36 2bda s TRP 94 Cb 0.20 -4.07 0.05 0.00 -1.50 0.00 0.00 33.47 28.16 2bda s TRP 94 CO 0.37 -3.69 -0.04 1.21 -4.62 0.00 0.00 176.95 170.18 2bda s ASN 95 N 0.64 3.23 0.52 5.86 3.84 -1.26 -5.04 114.94 122.73 2bda s ASN 95 Ca 0.65 -0.88 0.21 0.00 0.21 0.00 0.00 52.86 53.05 2bda s ASN 95 Cb -0.48 -0.95 1.33 0.00 -0.55 0.00 0.00 41.25 40.60 2bda s ASN 95 CO 0.44 -0.23 2.06 0.74 -2.79 0.00 0.00 177.10 177.32 2bda h THR 96 N 6.51 0.85 0.00 -5.21 2.02 -1.97 -1.58 112.91 113.53 2bda h THR 96 Ca -0.20 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 66.97 2bda h THR 96 Cb 1.10 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 2bda h THR 96 CO 0.39 0.00 0.00 0.47 0.37 0.00 0.00 175.52 176.76 2bda n ASP 97 N -4.45 0.00 -3.05 4.18 8.00 -1.26 -4.30 116.55 115.68 2bda n ASP 97 Ca 0.05 -0.96 -0.18 0.00 0.71 0.00 0.00 54.79 54.41 2bda n ASP 97 Cb 0.39 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.47 2bda n ASP 97 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2bda n ASP 98 N -0.99 -0.66 -2.08 -2.24 -0.08 -0.59 -5.07 116.55 104.85 2bda n ASP 98 Ca 0.22 -2.99 -0.00 0.00 -1.51 0.00 0.00 54.79 50.51 2bda n ASP 98 Cb 0.10 0.18 -0.00 0.00 2.34 0.00 0.00 41.12 43.73 2bda n ASP 98 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 2bda n VAL 99 N 1.17 0.21 0.00 5.18 0.31 -1.26 -4.08 118.33 119.86 2bda n VAL 99 Ca 0.18 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 2bda n VAL 99 Cb 0.59 -1.17 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 2bda n VAL 99 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2bda n ALA 99 N 2.20 0.00 0.00 3.52 0.00 -1.26 -4.82 120.51 120.16 2bda n ALA 99 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2bda n ALA 99 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.51 2bda n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bda n GLY 100 N 0.00 -0.99 2.44 0.00 0.00 -1.26 -4.99 105.19 100.39 2bda n GLY 100 Ca 0.00 -1.52 -0.17 0.00 0.00 0.00 0.00 46.02 44.33 2bda n GLY 100 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bda n TYR 101 N 0.00 -0.31 -2.48 1.61 4.02 -1.26 -4.63 117.16 114.11 2bda n TYR 101 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.46 2bda n TYR 101 Cb 0.00 -3.18 0.00 0.00 -0.02 0.00 0.00 39.34 36.14 2bda n TYR 101 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2bda n ASP 102 N -1.02 4.81 -3.65 7.72 2.03 -1.26 -4.38 116.55 120.81 2bda n ASP 102 Ca -0.19 -2.93 -0.15 0.00 0.52 0.00 0.00 54.79 52.05 2bda n ASP 102 Cb 0.61 -1.68 -0.08 0.00 -0.72 0.00 0.00 41.12 39.24 2bda n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2bda s ILE 103 N 3.30 0.01 -0.00 5.18 2.07 -1.26 -3.91 121.20 126.59 2bda s ILE 103 Ca 0.50 -0.11 -0.16 0.00 -1.41 0.00 0.00 60.65 59.47 2bda s ILE 103 Cb 0.05 -0.81 0.03 0.00 0.13 0.00 0.00 42.46 41.86 2bda s ILE 103 CO 0.03 -0.06 0.33 0.00 -1.91 0.00 0.00 174.94 173.33 2bda s ALA 104 N -0.53 -0.82 -0.08 1.50 0.00 0.29 -1.50 121.76 120.63 2bda s ALA 104 Ca -0.06 0.31 0.03 0.00 0.00 0.00 0.00 51.96 52.24 2bda s ALA 104 Cb -0.03 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.20 2bda s ALA 104 CO 0.04 -0.30 -0.17 -0.51 0.00 0.00 0.00 175.76 174.82 2bda s LEU 105 N -1.48 2.54 -0.22 0.00 1.43 0.14 -0.83 118.68 120.26 2bda s LEU 105 Ca -0.12 -0.33 -0.05 0.00 -1.03 0.00 0.00 54.13 52.61 2bda s LEU 105 Cb -0.04 -1.52 -0.02 0.00 0.03 0.00 0.00 46.19 44.64 2bda s LEU 105 CO 0.03 0.26 -0.00 -0.76 0.23 0.00 0.00 176.35 176.10 2bda s LEU 106 N -0.22 3.14 -0.16 1.79 1.43 0.59 -0.56 118.68 124.69 2bda s LEU 106 Ca -0.00 -0.28 -0.26 0.00 -1.03 0.00 0.00 54.13 52.56 2bda s LEU 106 Cb -0.13 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.26 2bda s LEU 106 CO 0.03 0.01 0.85 -0.60 0.23 0.00 0.00 176.35 176.87 2bda s ARG 107 N 1.32 4.31 0.45 1.70 3.52 -0.01 -0.91 118.95 129.33 2bda s ARG 107 Ca 0.04 1.05 -0.15 0.00 -0.13 0.00 0.00 55.73 56.54 2bda s ARG 107 Cb -0.15 -3.57 -0.08 0.00 -1.56 0.00 0.00 34.95 29.60 2bda s ARG 107 CO 0.00 -0.32 0.89 -0.51 -0.81 0.00 0.00 175.30 174.55 2bda s LEU 108 N 2.11 3.76 0.44 -0.88 1.43 0.31 0.28 118.68 126.13 2bda s LEU 108 Ca 0.39 1.41 0.24 0.00 -1.03 0.00 0.00 54.13 55.15 2bda s LEU 108 Cb -0.17 -4.31 0.87 0.00 0.03 0.00 0.00 46.19 42.61 2bda s LEU 108 CO 0.13 -0.47 1.80 0.00 0.23 0.00 0.00 176.35 178.05 2bda h ALA 109 N 1.26 0.99 -3.30 4.21 0.00 -1.46 -3.41 119.26 117.55 2bda h ALA 109 Ca -0.47 -0.19 -0.32 0.00 0.00 0.00 0.00 54.91 53.92 2bda h ALA 109 Cb 1.18 -0.03 -0.22 0.00 0.00 0.00 0.00 17.79 18.72 2bda h ALA 109 CO 0.63 0.26 -0.75 -0.65 0.00 0.00 0.00 179.25 178.74 2bda s GLN 110 N -3.58 0.63 0.08 0.00 1.11 -1.26 -5.02 119.66 111.61 2bda s GLN 110 Ca 0.01 -0.79 -0.31 0.00 0.01 0.00 0.00 55.36 54.29 2bda s GLN 110 Cb 0.10 -0.48 -0.06 0.00 -1.01 0.00 0.00 33.01 31.55 2bda s GLN 110 CO 0.64 0.10 1.23 -1.12 0.01 0.00 0.00 175.29 176.14 2bda s SER 111 N -1.54 7.04 0.58 5.90 0.01 -1.26 -4.72 113.70 119.71 2bda s SER 111 Ca -0.07 2.08 -0.13 0.00 1.31 0.00 0.00 55.95 59.15 2bda s SER 111 Cb -0.10 -2.58 -0.05 0.00 0.21 0.00 0.00 66.02 63.50 2bda s SER 111 CO 0.01 -0.49 1.01 0.68 0.41 0.00 0.00 173.24 174.86 2bda s VAL 112 N 0.97 4.65 -0.07 3.43 -7.23 -0.12 -4.98 120.40 117.04 2bda s VAL 112 Ca 0.59 0.99 -0.19 0.00 -1.81 0.00 0.00 61.98 61.56 2bda s VAL 112 Cb -0.31 -3.82 -0.05 0.00 0.56 0.00 0.00 36.38 32.77 2bda s VAL 112 CO 0.30 -0.98 0.53 -0.89 -0.31 0.00 0.00 175.10 173.76 2bda s THR 113 N -2.97 5.08 0.18 5.32 2.01 -1.26 -4.86 115.64 119.14 2bda s THR 113 Ca 0.56 1.09 -0.18 0.00 0.31 0.00 0.00 61.69 63.47 2bda s THR 113 Cb -0.11 -3.87 -0.08 0.00 0.01 0.00 0.00 72.50 68.46 2bda s THR 113 CO 0.46 0.36 0.66 -0.76 -0.69 0.00 0.00 174.62 174.64 2bda s LEU 114 N 0.30 4.38 0.00 4.42 1.43 -1.26 -4.79 118.68 123.16 2bda s LEU 114 Ca 0.29 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.70 2bda s LEU 114 Cb -0.16 -3.40 0.00 0.00 0.03 0.00 0.00 46.19 42.66 2bda s LEU 114 CO 0.13 0.09 0.00 -0.46 0.23 0.00 0.00 176.35 176.35 2bda n ASN 115 N 0.91 0.00 -0.33 2.29 0.23 -0.24 -4.95 115.26 113.18 2bda n ASN 115 Ca -0.04 -0.76 0.28 0.00 -0.53 0.00 0.00 54.58 53.52 2bda n ASN 115 Cb 0.51 0.00 0.60 0.00 -2.08 0.00 0.00 39.78 38.81 2bda n ASN 115 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2bda h SER 116 N 0.00 0.29 -0.00 0.53 0.02 -1.99 -2.65 113.55 109.74 2bda h SER 116 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2bda h SER 116 Cb 0.00 0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.56 2bda h SER 116 CO 0.00 0.04 -0.91 -1.22 -1.14 0.00 0.00 176.83 173.60 2bda n TYR 117 N -4.49 0.00 -3.66 3.45 4.02 -1.26 -4.72 117.16 110.50 2bda n TYR 117 Ca 0.26 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.87 2bda n TYR 117 Cb 1.03 -0.00 -0.16 0.00 -0.02 0.00 0.00 39.34 40.19 2bda n TYR 117 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2bda s VAL 118 N -2.91 0.33 0.07 -0.72 1.01 -1.00 -3.75 120.40 113.43 2bda s VAL 118 Ca 0.10 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.40 2bda s VAL 118 Cb 0.16 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 35.46 2bda s VAL 118 CO 0.82 -0.44 -0.07 -1.10 0.00 0.00 0.00 175.10 174.30 2bda s GLN 119 N 1.93 0.70 0.34 2.72 -1.52 -0.80 -1.08 119.66 121.94 2bda s GLN 119 Ca 0.04 -1.07 -0.28 0.00 -1.95 0.00 0.00 55.36 52.10 2bda s GLN 119 Cb -0.17 -0.26 -0.09 0.00 -0.22 0.00 0.00 33.01 32.27 2bda s GLN 119 CO -0.19 0.02 1.20 -0.51 -0.25 0.00 0.00 175.29 175.56 2bda s LEU 120 N -2.37 4.40 0.28 2.90 1.43 -1.26 -3.31 118.68 120.75 2bda s LEU 120 Ca 0.02 2.45 -0.29 0.00 -1.03 0.00 0.00 54.13 55.28 2bda s LEU 120 Cb -0.02 -3.76 -0.09 0.00 0.03 0.00 0.00 46.19 42.35 2bda s LEU 120 CO -0.02 -0.45 1.04 -0.83 0.23 0.00 0.00 176.35 176.32 2bda s GLY 121 N -0.81 3.05 0.06 -3.19 0.00 0.15 -4.80 107.32 101.77 2bda s GLY 121 Ca 0.50 0.79 -0.30 0.00 0.00 0.00 0.00 44.72 45.70 2bda s GLY 121 CO 0.45 1.36 1.10 0.14 0.00 0.00 0.00 173.10 176.15 2bda s VAL 122 N -1.22 4.32 0.06 1.40 1.01 -1.26 -4.83 120.40 119.88 2bda s VAL 122 Ca 0.45 1.71 0.05 0.00 0.00 0.00 0.00 61.98 64.18 2bda s VAL 122 Cb -0.29 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 2bda s VAL 122 CO 0.37 0.16 -0.04 -0.76 0.00 0.00 0.00 175.10 174.83 2bda s LEU 123 N 0.82 3.30 0.75 3.92 1.43 -1.26 -0.06 118.68 127.59 2bda s LEU 123 Ca 0.55 -0.20 -0.12 0.00 -1.03 0.00 0.00 54.13 53.33 2bda s LEU 123 Cb -0.26 -2.00 0.05 0.00 0.03 0.00 0.00 46.19 44.00 2bda s LEU 123 CO 0.29 0.21 1.12 -2.16 0.23 0.00 0.00 176.35 176.04 2bda s PRO 124 N -1.99 2.24 0.62 1.29 0.04 -1.26 -4.90 135.00 131.04 2bda s PRO 124 Ca 0.22 1.35 -0.18 0.00 0.04 0.00 0.00 61.00 62.43 2bda s PRO 124 Cb -0.11 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 2bda s PRO 124 CO 0.14 -1.68 1.22 -0.98 0.04 0.00 0.00 177.00 175.74 2bda s ARG 125 N -4.52 2.79 0.33 4.56 3.03 -1.26 -4.80 118.95 119.09 2bda s ARG 125 Ca 0.65 1.85 -0.28 0.00 2.03 0.00 0.00 55.73 59.97 2bda s ARG 125 Cb -0.20 -1.90 -0.12 0.00 -1.03 0.00 0.00 34.95 31.69 2bda s ARG 125 CO 0.51 -1.35 1.35 0.00 -1.13 0.00 0.00 175.30 174.68 2bda n ALA 126 N -1.81 1.50 0.00 7.88 0.00 -1.26 -2.34 120.51 124.48 2bda n ALA 126 Ca 0.14 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.94 2bda n ALA 126 Cb 0.49 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.65 2bda n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bda n GLY 127 N 0.97 2.42 3.72 0.00 0.00 -0.37 -5.00 105.19 106.93 2bda n GLY 127 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2bda n GLY 127 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bda s THR 128 N -2.77 2.28 -0.04 2.61 2.01 -0.99 -5.00 115.64 113.74 2bda s THR 128 Ca 0.00 0.20 0.06 0.00 0.31 0.00 0.00 61.69 62.26 2bda s THR 128 Cb 0.00 -3.13 -0.01 0.00 0.01 0.00 0.00 72.50 69.37 2bda s THR 128 CO 0.00 0.02 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.10 2bda s ILE 129 N 1.15 1.73 0.25 1.82 -1.09 -1.26 -4.76 121.20 119.03 2bda s ILE 129 Ca 0.73 -0.90 -0.27 0.00 -2.23 0.00 0.00 60.65 57.98 2bda s ILE 129 Cb -0.47 -1.46 -0.09 0.00 -1.58 0.00 0.00 42.46 38.86 2bda s ILE 129 CO 0.32 0.49 0.88 -0.76 -1.23 0.00 0.00 174.94 174.64 2bda s LEU 130 N -0.22 4.51 0.85 2.97 1.43 -1.26 -5.05 118.68 121.90 2bda s LEU 130 Ca 0.01 1.79 -0.12 0.00 -1.03 0.00 0.00 54.13 54.78 2bda s LEU 130 Cb -0.11 -3.66 0.11 0.00 0.03 0.00 0.00 46.19 42.56 2bda s LEU 130 CO 0.02 0.09 1.18 0.00 0.23 0.00 0.00 176.35 177.86 2bda s ALA 131 N -1.35 1.69 0.60 4.21 0.00 -1.26 -4.89 121.76 120.76 2bda s ALA 131 Ca 0.43 0.71 -0.19 0.00 0.00 0.00 0.00 51.96 52.91 2bda s ALA 131 Cb -0.22 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 2bda s ALA 131 CO 0.27 -2.48 1.16 -1.71 0.00 0.00 0.00 175.76 173.00 2bda n ASN 132 N -3.71 1.62 -2.33 0.00 5.15 -1.26 -2.21 115.26 112.51 2bda n ASN 132 Ca 0.13 0.86 -0.19 0.00 -0.60 0.00 0.00 54.58 54.78 2bda n ASN 132 Cb 0.51 -1.48 -0.02 0.00 -0.53 0.00 0.00 39.78 38.27 2bda n ASN 132 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2bda n ASN 133 N -1.13 -5.42 -4.76 1.20 5.15 0.17 -4.95 115.26 105.52 2bda n ASN 133 Ca 0.14 0.07 -0.40 0.00 -0.60 0.00 0.00 54.58 53.78 2bda n ASN 133 Cb 0.47 -4.55 -0.03 0.00 -0.53 0.00 0.00 39.78 35.13 2bda n ASN 133 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2bda s SER 134 N -2.09 7.04 -0.04 1.20 0.01 -0.94 -4.67 113.70 114.21 2bda s SER 134 Ca 0.00 2.45 -0.30 0.00 1.31 0.00 0.00 55.95 59.41 2bda s SER 134 Cb 0.00 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 2bda s SER 134 CO 0.00 -0.32 1.31 -2.16 0.41 0.00 0.00 173.24 172.47 2bda s PRO 135 N -1.62 4.30 0.04 12.44 0.04 -1.26 -1.05 135.00 147.90 2bda s PRO 135 Ca 0.47 1.81 -0.04 0.00 0.04 0.00 0.00 61.00 63.28 2bda s PRO 135 Cb -0.35 -3.60 -0.02 0.00 0.04 0.00 0.00 34.50 30.57 2bda s PRO 135 CO 0.46 -0.54 0.05 0.00 0.04 0.00 0.00 177.00 177.01 2bda s TYR 137 N -2.85 2.36 0.17 0.00 1.51 0.64 -0.53 117.35 118.65 2bda s TYR 137 Ca -0.03 -0.85 -0.18 0.00 -1.01 0.00 0.00 57.07 55.01 2bda s TYR 137 Cb 0.00 -1.58 -0.07 0.00 -0.11 0.00 0.00 41.96 40.20 2bda s TYR 137 CO -0.06 -0.31 0.63 -1.50 -1.11 0.00 0.00 175.55 173.20 2bda s ILE 138 N 0.15 4.70 0.08 2.71 2.07 -0.22 -0.94 121.20 129.76 2bda s ILE 138 Ca -0.12 1.11 0.05 0.00 -1.41 0.00 0.00 60.65 60.28 2bda s ILE 138 Cb -0.16 -3.83 -0.03 0.00 0.13 0.00 0.00 42.46 38.57 2bda s ILE 138 CO 0.06 0.29 -0.14 0.42 -1.91 0.00 0.00 174.94 173.66 2bda s THR 139 N -1.42 1.12 0.00 4.00 -4.23 -1.20 -1.32 115.64 112.59 2bda s THR 139 Ca 0.38 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.49 2bda s THR 139 Cb -0.17 -1.17 0.00 0.00 1.34 0.00 0.00 72.50 72.51 2bda s THR 139 CO 0.20 -0.30 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 2bda n GLY 140 N 1.08 0.02 1.27 3.99 0.00 -0.59 -4.51 105.19 106.46 2bda n GLY 140 Ca -0.20 -1.15 0.08 0.00 0.00 0.00 0.00 46.02 44.75 2bda n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2bda n TRP 141 N -0.72 1.31 -0.79 1.61 8.01 -1.26 -1.30 117.44 124.30 2bda n TRP 141 Ca 0.00 -0.75 -0.29 0.00 -1.31 0.00 0.00 57.50 55.15 2bda n TRP 141 Cb 0.00 -0.33 0.24 0.00 -2.01 0.00 0.00 31.31 29.21 2bda n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 2bda s GLY 142 N -1.34 1.53 0.47 6.99 0.00 -1.26 -1.35 107.32 112.35 2bda s GLY 142 Ca 0.45 -0.55 -0.23 0.00 0.00 0.00 0.00 44.72 44.40 2bda s GLY 142 CO 0.14 0.26 1.07 1.04 0.00 0.00 0.00 173.10 175.61 2bda n LEU 143 N -4.87 3.30 -0.21 0.66 4.77 0.46 -2.30 117.00 118.82 2bda n LEU 143 Ca 0.08 0.99 0.12 0.00 -0.03 0.00 0.00 56.01 57.17 2bda n LEU 143 Cb 0.58 -1.40 0.23 0.00 -2.33 0.00 0.00 43.42 40.49 2bda n LEU 143 CO 0.52 -1.35 0.48 0.35 -1.33 0.00 0.00 177.39 176.05 2bda n THR 144 N -0.75 0.00 -3.77 -5.08 -2.24 -0.67 -0.23 114.28 101.53 2bda n THR 144 Ca 0.10 -0.11 -0.11 0.00 -2.27 0.00 0.00 64.05 61.66 2bda n THR 144 Cb 0.41 0.57 -0.08 0.00 -2.10 0.00 0.00 70.33 69.14 2bda n THR 144 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2bda s ARG 145 N -2.66 0.79 0.22 -0.78 0.52 -1.26 -4.19 118.95 111.58 2bda s ARG 145 Ca 0.19 -0.54 -0.31 0.00 -0.52 0.00 0.00 55.73 54.55 2bda s ARG 145 Cb 0.18 0.34 -0.14 0.00 0.52 0.00 0.00 34.95 35.85 2bda s ARG 145 CO 0.61 -0.25 1.28 2.41 0.02 0.00 0.00 175.30 179.37 2bda n THR 147 N 0.59 1.06 -2.66 0.02 -1.04 -1.26 -0.43 114.28 110.56 2bda n THR 147 Ca -0.19 -0.26 -0.13 0.00 -2.04 0.00 0.00 64.05 61.43 2bda n THR 147 Cb 0.59 -1.21 -0.00 0.00 -1.82 0.00 0.00 70.33 67.89 2bda n THR 147 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2bda n ASN 148 N 1.97 -3.44 0.00 8.00 3.02 -1.26 -4.95 115.26 118.60 2bda n ASN 148 Ca 0.12 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.78 2bda n ASN 148 Cb 0.29 -2.93 0.00 0.00 -0.61 0.00 0.00 39.78 36.53 2bda n ASN 148 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bda n GLY 149 N -0.84 2.05 3.28 7.41 0.00 0.43 -5.12 105.19 112.39 2bda n GLY 149 Ca -0.10 -1.78 -0.15 0.00 0.00 0.00 0.00 46.02 43.99 2bda n GLY 149 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2bda s GLN 150 N 4.73 1.16 0.69 1.61 -2.07 -1.26 -4.89 119.66 119.63 2bda s GLN 150 Ca 0.00 -1.53 -0.16 0.00 -1.82 0.00 0.00 55.36 51.85 2bda s GLN 150 Cb 0.00 -0.60 0.02 0.00 -1.09 0.00 0.00 33.01 31.34 2bda s GLN 150 CO 0.00 0.01 1.20 -0.51 -1.32 0.00 0.00 175.29 174.66 2bda s LEU 151 N -3.21 3.41 0.37 2.60 1.43 -1.26 -1.67 118.68 120.34 2bda s LEU 151 Ca 0.21 2.32 -0.25 0.00 -1.03 0.00 0.00 54.13 55.38 2bda s LEU 151 Cb 0.04 -4.59 -0.10 0.00 0.03 0.00 0.00 46.19 41.58 2bda s LEU 151 CO 0.03 -2.01 1.00 0.00 0.23 0.00 0.00 176.35 175.60 2bda s ALA 152 N -1.93 3.13 0.03 4.21 0.00 -0.46 -4.82 121.76 121.92 2bda s ALA 152 Ca 0.74 0.60 -0.16 0.00 0.00 0.00 0.00 51.96 53.14 2bda s ALA 152 Cb -0.28 -3.22 -0.33 0.00 0.00 0.00 0.00 23.12 19.29 2bda s ALA 152 CO 0.42 -0.02 1.03 1.96 0.00 0.00 0.00 175.76 179.15 2bda h GLN 153 N 2.71 0.56 -6.19 0.00 4.20 -1.94 -3.45 115.11 111.01 2bda h GLN 153 Ca -0.48 -0.86 -0.65 0.00 0.06 0.00 0.00 58.65 56.72 2bda h GLN 153 Cb 1.20 0.31 -0.11 0.00 0.30 0.00 0.00 27.48 29.18 2bda h GLN 153 CO 0.63 1.40 -0.62 0.95 -0.67 0.00 0.00 178.83 180.53 2bda s THR 154 N -2.75 4.38 0.11 -0.54 -4.23 -1.26 -0.66 115.64 110.69 2bda s THR 154 Ca -0.10 -0.73 -0.35 0.00 -1.18 0.00 0.00 61.69 59.33 2bda s THR 154 Cb 0.04 -3.06 -0.15 0.00 1.34 0.00 0.00 72.50 70.67 2bda s THR 154 CO 0.93 0.20 1.49 -0.11 -0.54 0.00 0.00 174.62 176.60 2bda n LEU 155 N 0.76 2.48 -4.71 4.79 7.94 -0.81 -4.83 117.00 122.61 2bda n LEU 155 Ca -0.11 1.09 -0.27 0.00 -1.11 0.00 0.00 56.01 55.62 2bda n LEU 155 Cb 0.52 -1.32 -0.07 0.00 0.53 0.00 0.00 43.42 43.08 2bda n LEU 155 CO 0.40 -0.61 -0.29 -1.10 -1.11 0.00 0.00 177.39 174.69 2bda s GLN 156 N 0.88 2.59 0.06 1.96 -1.52 -0.42 -0.64 119.66 122.57 2bda s GLN 156 Ca 0.82 -1.01 0.04 0.00 -1.95 0.00 0.00 55.36 53.27 2bda s GLN 156 Cb -0.80 -2.47 -0.03 0.00 -0.22 0.00 0.00 33.01 29.49 2bda s GLN 156 CO 0.43 0.47 -0.13 1.14 -0.25 0.00 0.00 175.29 176.95 2bda s GLN 157 N -2.96 0.75 -0.02 2.91 -2.07 -0.06 -1.53 119.66 116.68 2bda s GLN 157 Ca 0.29 -0.91 -0.00 0.00 -1.82 0.00 0.00 55.36 52.91 2bda s GLN 157 Cb -0.10 -0.70 0.02 0.00 -1.09 0.00 0.00 33.01 31.14 2bda s GLN 157 CO 0.20 0.15 0.03 0.00 -1.32 0.00 0.00 175.29 174.36 2bda s ALA 158 N -1.31 -0.01 -0.20 2.60 0.00 -0.43 -0.57 121.76 121.85 2bda s ALA 158 Ca -0.04 0.20 -0.29 0.00 0.00 0.00 0.00 51.96 51.83 2bda s ALA 158 Cb -0.10 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.85 2bda s ALA 158 CO 0.02 -0.06 1.39 -0.47 0.00 0.00 0.00 175.76 176.64 2bda s TYR 159 N 0.55 2.54 -0.39 0.00 5.04 -1.26 -1.05 117.35 122.77 2bda s TYR 159 Ca -0.04 0.77 0.01 0.00 -2.44 0.00 0.00 57.07 55.37 2bda s TYR 159 Cb -0.06 -3.77 0.13 0.00 0.35 0.00 0.00 41.96 38.61 2bda s TYR 159 CO -0.02 -2.23 0.21 -0.51 -1.34 0.00 0.00 175.55 171.66 2bda s LEU 160 N 4.16 2.13 0.43 6.97 1.43 0.31 -4.95 118.68 129.17 2bda s LEU 160 Ca 0.61 -2.35 -0.25 0.00 -1.03 0.00 0.00 54.13 51.11 2bda s LEU 160 Cb -0.22 -0.83 -0.08 0.00 0.03 0.00 0.00 46.19 45.09 2bda s LEU 160 CO 0.22 -0.30 1.27 -2.84 0.23 0.00 0.00 176.35 174.92 2bda s PRO 161 N 0.75 3.84 0.88 1.29 0.02 -1.26 -3.86 135.00 136.67 2bda s PRO 161 Ca 0.16 2.06 -0.10 0.00 0.02 0.00 0.00 61.00 63.14 2bda s PRO 161 Cb -0.23 -2.63 0.12 0.00 0.02 0.00 0.00 34.50 31.79 2bda s PRO 161 CO -0.03 -0.56 1.14 0.95 -0.33 0.00 0.00 177.00 178.16 2bda s THR 162 N -1.33 2.29 -0.18 0.99 -4.23 -0.22 -1.18 115.64 111.78 2bda s THR 162 Ca 0.60 0.10 0.01 0.00 -1.18 0.00 0.00 61.69 61.21 2bda s THR 162 Cb -0.36 -2.23 0.04 0.00 1.34 0.00 0.00 72.50 71.29 2bda s THR 162 CO 0.45 -0.12 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.61 2bda s VAL 163 N -2.65 1.56 0.98 2.29 1.01 -0.21 -0.66 120.40 122.71 2bda s VAL 163 Ca 0.66 -0.86 -0.11 0.00 0.00 0.00 0.00 61.98 61.67 2bda s VAL 163 Cb -0.22 -1.60 0.18 0.00 0.00 0.00 0.00 36.38 34.74 2bda s VAL 163 CO 0.57 0.25 1.10 1.51 0.00 0.00 0.00 175.10 178.52 2bda s ASP 164 N 1.45 2.51 0.23 3.32 1.47 -1.26 -4.17 116.67 120.21 2bda s ASP 164 Ca 0.01 1.85 -0.08 0.00 1.18 0.00 0.00 52.55 55.51 2bda s ASP 164 Cb -0.15 -2.42 0.19 0.00 -0.34 0.00 0.00 42.92 40.20 2bda s ASP 164 CO -0.09 -3.30 1.85 0.22 0.68 0.00 0.00 175.17 174.53 2bda h TYR 165 N -2.01 1.18 -0.94 2.11 3.20 -1.94 0.40 116.97 118.98 2bda h TYR 165 Ca -0.50 -0.03 0.10 0.00 3.14 0.00 0.00 58.73 61.44 2bda h TYR 165 Cb 1.29 -0.38 -0.07 0.00 1.54 0.00 0.00 36.73 39.11 2bda h TYR 165 CO 0.42 0.82 0.60 0.00 -1.64 0.00 0.00 178.16 178.36 2bda h ALA 166 N 1.26 1.57 0.07 1.82 0.00 -1.96 0.44 119.26 122.45 2bda h ALA 166 Ca 0.31 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 55.03 2bda h ALA 166 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2bda h ALA 166 CO -0.05 0.23 -0.93 0.82 0.00 0.00 0.00 179.25 179.32 2bda h ILE 167 N 0.96 1.27 -0.86 0.00 2.04 -1.70 -3.36 117.51 115.87 2bda h ILE 167 Ca 0.44 -2.36 -0.03 0.00 1.00 0.00 0.00 64.86 63.91 2bda h ILE 167 Cb 0.39 2.86 -0.04 0.00 -0.74 0.00 0.00 36.82 39.29 2bda h ILE 167 CO -0.20 0.60 0.42 0.00 0.00 0.00 0.00 178.15 178.97 2bda n SER 169 N -4.31 6.43 0.00 0.00 3.41 0.15 -0.47 113.62 118.82 2bda n SER 169 Ca 0.09 -2.95 0.00 0.00 -0.26 0.00 0.00 58.87 55.75 2bda n SER 169 Cb 0.13 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 62.58 2bda n SER 169 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2bda n SER 170 N 3.68 0.00 0.00 4.04 3.41 -1.26 -3.59 113.62 119.90 2bda n SER 170 Ca 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 2bda n SER 170 Cb 0.31 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2bda n SER 170 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2bda n TYR 171 N 0.00 0.00 0.83 7.33 4.02 -1.26 -4.84 117.16 123.25 2bda n TYR 171 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.99 2bda n TYR 171 Cb 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.38 2bda n TYR 171 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 2bda n TRP 172 N 0.00 0.00 -3.49 -0.72 7.02 0.38 -4.83 117.44 115.80 2bda n TRP 172 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2bda n TRP 172 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 2bda n TRP 172 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2bda n GLY 173 N 1.17 2.11 0.00 6.99 0.00 -1.22 -1.87 105.19 112.37 2bda n GLY 173 Ca 0.10 -0.40 0.10 0.00 0.00 0.00 0.00 46.02 45.82 2bda n GLY 173 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2bda n SER 174 N -0.74 0.00 -0.04 1.61 3.41 -1.26 -3.09 113.62 113.51 2bda n SER 174 Ca 0.00 -0.17 0.01 0.00 -0.26 0.00 0.00 58.87 58.45 2bda n SER 174 Cb 0.00 -0.21 0.31 0.00 -0.26 0.00 0.00 64.21 64.05 2bda n SER 174 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2bda h THR 175 N 0.00 1.17 -3.28 6.66 2.02 -1.74 -3.42 112.91 114.33 2bda h THR 175 Ca 0.00 -0.58 -0.57 0.00 0.77 0.00 0.00 66.41 66.03 2bda h THR 175 Cb 0.14 0.69 -0.05 0.00 -1.74 0.00 0.00 68.15 67.19 2bda h THR 175 CO 0.00 0.22 -0.02 -0.69 0.37 0.00 0.00 175.52 175.40 2bda s VAL 176 N -5.24 4.85 0.35 3.16 1.01 -1.18 -4.78 120.40 118.57 2bda s VAL 176 Ca -0.08 1.23 0.08 0.00 0.00 0.00 0.00 61.98 63.21 2bda s VAL 176 Cb 0.16 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 2bda s VAL 176 CO 0.76 0.47 0.18 -0.54 0.00 0.00 0.00 175.10 175.97 2bda s LYS 177 N -0.51 2.41 0.00 2.72 -0.14 -1.26 -4.87 119.74 118.09 2bda s LYS 177 Ca 0.30 -1.55 0.16 0.00 -1.36 0.00 0.00 55.97 53.52 2bda s LYS 177 Cb -0.19 -2.20 0.73 0.00 -1.68 0.00 0.00 37.83 34.49 2bda s LYS 177 CO 0.18 0.06 1.50 -1.71 -0.76 0.00 0.00 175.35 174.62 2bda n ASN 178 N -1.21 0.00 -0.45 2.83 5.15 -1.26 -1.89 115.26 118.43 2bda n ASN 178 Ca -0.02 0.35 0.05 0.00 -0.60 0.00 0.00 54.58 54.35 2bda n ASN 178 Cb 0.61 -0.43 0.15 0.00 -0.53 0.00 0.00 39.78 39.59 2bda n ASN 178 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2bda n SER 179 N -1.43 1.31 -4.42 1.20 3.41 -1.26 -4.87 113.62 107.56 2bda n SER 179 Ca 0.05 -1.95 -0.24 0.00 -0.26 0.00 0.00 58.87 56.48 2bda n SER 179 Cb 0.17 -0.15 -0.11 0.00 -0.26 0.00 0.00 64.21 63.86 2bda n SER 179 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2bda s MET 180 N -1.69 1.54 -0.10 4.33 -1.94 -0.79 -0.89 119.30 119.77 2bda s MET 180 Ca 0.19 -1.65 0.03 0.00 -1.71 0.00 0.00 55.69 52.55 2bda s MET 180 Cb 0.10 -1.64 -0.01 0.00 2.01 0.00 0.00 34.83 35.29 2bda s MET 180 CO 0.13 0.32 -0.18 0.08 -0.01 0.00 0.00 175.02 175.35 2bda s VAL 181 N -2.34 2.61 -0.01 -6.03 1.01 0.32 -4.70 120.40 111.26 2bda s VAL 181 Ca 0.25 -0.84 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 2bda s VAL 181 Cb -0.05 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 2bda s VAL 181 CO 0.12 0.55 0.08 0.00 0.00 0.00 0.00 175.10 175.85 2bda s ALA 183 N -1.17 -0.91 0.00 0.00 0.00 -0.39 -1.05 121.76 118.23 2bda s ALA 183 Ca 0.22 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.06 2bda s ALA 183 Cb -0.12 -0.42 0.00 0.00 0.00 0.00 0.00 23.12 22.58 2bda s ALA 183 CO 0.13 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.10 2bda n GLY 184 N 2.40 1.04 2.01 0.00 0.00 -0.32 -1.45 105.19 108.87 2bda n GLY 184 Ca -0.15 -0.89 -0.00 0.00 0.00 0.00 0.00 46.02 44.98 2bda n GLY 184 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bda n GLY 185 N 0.00 0.40 0.18 -0.02 0.00 -1.26 -4.65 105.19 99.84 2bda n GLY 185 Ca 0.00 -1.08 0.14 0.00 0.00 0.00 0.00 46.02 45.08 2bda n GLY 185 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2bda n ASP 186 N 1.97 0.57 0.00 1.61 3.85 -1.26 -1.49 116.55 121.80 2bda n ASP 186 Ca -0.00 -1.24 0.00 0.00 -0.71 0.00 0.00 54.79 52.84 2bda n ASP 186 Cb 0.02 -0.01 0.00 0.00 -1.35 0.00 0.00 41.12 39.78 2bda n ASP 186 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2bda n GLY 187 N 1.04 0.78 0.79 6.12 0.00 -1.26 -4.80 105.19 107.86 2bda n GLY 187 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2bda n GLY 187 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2bda n VAL 188 N -2.09 0.00 -4.61 1.61 0.31 -1.26 -4.61 118.33 107.67 2bda n VAL 188 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.01 2bda n VAL 188 Cb 0.01 -1.11 -0.12 0.00 -0.91 0.00 0.00 33.84 31.72 2bda n VAL 188 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2bda s ARG 188 N -1.97 2.38 -0.04 5.55 0.52 -1.26 -3.80 118.95 120.34 2bda s ARG 188 Ca 0.00 -0.80 -0.31 0.00 -0.52 0.00 0.00 55.73 54.10 2bda s ARG 188 Cb 0.00 -2.37 0.11 0.00 0.52 0.00 0.00 34.95 33.21 2bda s ARG 188 CO 0.00 0.59 1.13 -1.54 0.02 0.00 0.00 175.30 175.50 2bda s SER 189 N -1.28 -0.16 0.98 0.23 1.04 -0.97 -4.35 113.70 109.18 2bda s SER 189 Ca 0.15 -0.11 -0.13 0.00 0.48 0.00 0.00 55.95 56.34 2bda s SER 189 Cb -0.11 0.25 0.18 0.00 0.10 0.00 0.00 66.02 66.44 2bda s SER 189 CO 0.05 -0.44 1.12 -0.83 0.98 0.00 0.00 173.24 174.12 2bda s GLY 190 N -2.61 1.57 0.30 7.32 0.00 -1.26 -1.37 107.32 111.26 2bda s GLY 190 Ca 0.11 -0.51 -0.19 0.00 0.00 0.00 0.00 44.72 44.12 2bda s GLY 190 CO -0.04 0.11 0.72 0.00 0.00 0.00 0.00 173.10 173.89 2bda n GLN 192 N -0.47 1.95 0.00 0.00 3.00 -1.26 -1.48 117.38 119.12 2bda n GLN 192 Ca -0.05 0.69 0.00 0.00 -0.01 0.00 0.00 57.00 57.63 2bda n GLN 192 Cb 0.59 -2.29 0.00 0.00 0.00 0.00 0.00 30.24 28.54 2bda n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2bda n GLY 193 N 1.68 2.12 0.15 1.08 0.00 -1.26 -0.40 105.19 108.56 2bda n GLY 193 Ca 0.10 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.19 2bda n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2bda h ASP 194 N 0.00 0.00 -1.58 1.61 3.32 -1.53 -3.28 116.42 114.96 2bda h ASP 194 Ca 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 2bda h ASP 194 Cb 0.00 0.00 0.12 0.00 0.22 0.00 0.00 39.33 39.67 2bda h ASP 194 CO 0.00 0.22 -0.38 -1.20 -1.72 0.00 0.00 179.24 176.16 2bda n SER 195 N -2.96 -0.68 0.00 6.45 7.64 -1.26 -1.13 113.62 121.68 2bda n SER 195 Ca -0.00 1.09 0.00 0.00 1.01 0.00 0.00 58.87 60.97 2bda n SER 195 Cb 0.64 -1.05 0.00 0.00 -1.01 0.00 0.00 64.21 62.79 2bda n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bda n GLY 196 N 1.80 3.10 3.95 0.23 0.00 0.47 -0.77 105.19 113.98 2bda n GLY 196 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 2bda n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bda s GLY 197 N -1.69 1.78 0.42 -0.02 0.00 -0.29 -3.41 107.32 104.11 2bda s GLY 197 Ca 0.00 -1.33 -0.19 0.00 0.00 0.00 0.00 44.72 43.20 2bda s GLY 197 CO 0.00 -0.60 0.90 2.56 0.00 0.00 0.00 173.10 175.96 2bda s PRO 198 N -5.72 4.13 -0.24 2.90 0.04 -1.26 -0.49 135.00 134.35 2bda s PRO 198 Ca 0.72 0.98 -0.04 0.00 0.04 0.00 0.00 61.00 62.70 2bda s PRO 198 Cb -0.04 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.27 2bda s PRO 198 CO 0.51 -0.03 -0.02 -1.17 0.04 0.00 0.00 177.00 176.33 2bda s LEU 199 N -3.29 3.14 -0.27 -3.56 2.96 -0.50 -3.27 118.68 113.89 2bda s LEU 199 Ca 0.60 -0.57 -0.11 0.00 -0.22 0.00 0.00 54.13 53.82 2bda s LEU 199 Cb -0.09 -1.75 -0.05 0.00 0.50 0.00 0.00 46.19 44.80 2bda s LEU 199 CO 0.17 -0.08 0.21 -1.00 -1.32 0.00 0.00 176.35 174.33 2bda s HIS 200 N 1.45 3.24 0.04 5.38 3.76 -0.11 -0.81 115.29 128.23 2bda s HIS 200 Ca 0.04 0.17 0.09 0.00 -0.15 0.00 0.00 55.06 55.21 2bda s HIS 200 Cb -0.15 -2.39 -0.03 0.00 1.11 0.00 0.00 32.58 31.12 2bda s HIS 200 CO -0.03 -0.14 -0.25 0.00 -0.85 0.00 0.00 174.74 173.48 2bda s LEU 202 N -1.17 4.12 -0.04 0.00 2.96 -0.63 -1.26 118.68 122.66 2bda s LEU 202 Ca 0.10 0.51 -0.01 0.00 -0.22 0.00 0.00 54.13 54.52 2bda s LEU 202 Cb -0.10 -2.85 0.03 0.00 0.50 0.00 0.00 46.19 43.78 2bda s LEU 202 CO 0.02 -0.47 0.02 -0.69 -1.32 0.00 0.00 176.35 173.91 2bda s VAL 203 N 2.61 0.09 -1.51 1.68 1.01 -0.52 -4.73 120.40 119.03 2bda s VAL 203 Ca 0.26 0.21 -0.06 0.00 0.00 0.00 0.00 61.98 62.39 2bda s VAL 203 Cb -0.15 -0.25 0.05 0.00 0.00 0.00 0.00 36.38 36.03 2bda s VAL 203 CO 0.11 0.17 0.52 0.59 0.00 0.00 0.00 175.10 176.48 2bda n ASN 204 N 4.65 -1.26 0.00 3.32 5.03 -1.26 -1.97 115.26 123.77 2bda n ASN 204 Ca -0.17 -1.02 0.00 0.00 0.87 0.00 0.00 54.58 54.26 2bda n ASN 204 Cb 0.50 -2.87 0.00 0.00 -1.02 0.00 0.00 39.78 36.39 2bda n ASN 204 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2bda n GLY 205 N -1.84 2.13 3.15 7.41 0.00 -1.26 -5.00 105.19 109.78 2bda n GLY 205 Ca -0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 2bda n GLY 205 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2bda s GLN 206 N -0.24 2.72 0.14 1.61 0.74 -0.83 -5.11 119.66 118.69 2bda s GLN 206 Ca 0.00 -0.76 -0.30 0.00 0.05 0.00 0.00 55.36 54.35 2bda s GLN 206 Cb 0.00 -2.16 -0.07 0.00 1.10 0.00 0.00 33.01 31.88 2bda s GLN 206 CO 0.00 0.06 1.24 0.71 -0.55 0.00 0.00 175.29 176.74 2bda s TYR 207 N 0.65 3.39 0.11 1.67 1.51 -1.26 -1.44 117.35 121.98 2bda s TYR 207 Ca -0.12 1.30 0.05 0.00 -1.01 0.00 0.00 57.07 57.28 2bda s TYR 207 Cb -0.16 -3.48 -0.04 0.00 -0.11 0.00 0.00 41.96 38.17 2bda s TYR 207 CO 0.03 -1.46 -0.12 0.00 -1.11 0.00 0.00 175.55 172.89 2bda s ALA 208 N 0.47 1.30 -0.72 3.71 0.00 -0.39 -4.68 121.76 121.46 2bda s ALA 208 Ca 0.57 -1.25 -0.23 0.00 0.00 0.00 0.00 51.96 51.05 2bda s ALA 208 Cb -0.33 -0.02 0.07 0.00 0.00 0.00 0.00 23.12 22.85 2bda s ALA 208 CO 0.33 0.02 1.04 0.08 0.00 0.00 0.00 175.76 177.24 2bda s VAL 209 N -2.34 4.29 -0.70 0.00 1.01 0.92 -0.71 120.40 122.87 2bda s VAL 209 Ca 0.07 -0.45 0.24 0.00 0.00 0.00 0.00 61.98 61.85 2bda s VAL 209 Cb -0.04 -4.74 0.03 0.00 0.00 0.00 0.00 36.38 31.64 2bda s VAL 209 CO 0.01 -1.53 1.32 1.41 0.00 0.00 0.00 175.10 176.32 2bda n HIS 210 N 7.79 0.45 -3.96 5.22 8.25 0.01 -4.28 115.22 128.69 2bda n HIS 210 Ca 0.02 0.13 -0.10 0.00 -0.26 0.00 0.00 57.72 57.51 2bda n HIS 210 Cb 0.46 -0.58 -0.12 0.00 1.12 0.00 0.00 29.99 30.88 2bda n HIS 210 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2bda s GLY 211 N -3.55 0.20 -0.23 -1.41 0.00 -1.15 -1.33 107.32 99.85 2bda s GLY 211 Ca 0.07 -0.47 -0.03 0.00 0.00 0.00 0.00 44.72 44.29 2bda s GLY 211 CO 0.72 -0.53 -0.06 0.14 0.00 0.00 0.00 173.10 173.37 2bda s VAL 212 N -1.15 3.05 0.09 1.40 1.01 -0.61 -1.40 120.40 122.79 2bda s VAL 212 Ca -0.12 -0.76 -0.33 0.00 0.00 0.00 0.00 61.98 60.77 2bda s VAL 212 Cb -0.08 -2.45 -0.12 0.00 0.00 0.00 0.00 36.38 33.73 2bda s VAL 212 CO -0.01 0.34 1.75 0.41 0.00 0.00 0.00 175.10 177.59 2bda n THR 213 N 4.73 0.27 0.00 3.92 -1.04 0.35 -0.42 114.28 122.10 2bda n THR 213 Ca -0.18 -0.05 -0.03 0.00 -2.04 0.00 0.00 64.05 61.75 2bda n THR 213 Cb 0.49 -1.86 -0.01 0.00 -1.82 0.00 0.00 70.33 67.14 2bda n THR 213 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2bda n SER 214 N 5.01 0.99 -3.55 8.00 2.88 0.14 -0.39 113.62 126.69 2bda n SER 214 Ca 0.19 0.14 -0.11 0.00 -1.33 0.00 0.00 58.87 57.76 2bda n SER 214 Cb 0.32 -0.34 -0.03 0.00 -0.75 0.00 0.00 64.21 63.42 2bda n SER 214 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2bda s PHE 215 N -2.16 -0.36 0.42 0.66 -0.71 -0.72 -4.94 117.98 110.17 2bda s PHE 215 Ca -0.07 0.09 0.04 0.00 -1.04 0.00 0.00 56.93 55.95 2bda s PHE 215 Cb 0.02 0.46 -0.02 0.00 -1.21 0.00 0.00 43.02 42.26 2bda s PHE 215 CO 0.09 -0.84 0.12 0.14 -1.34 0.00 0.00 175.22 173.40 2bda s VAL 216 N -3.79 0.62 0.65 -2.49 -7.23 -1.26 -1.03 120.40 105.87 2bda s VAL 216 Ca 0.03 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.02 2bda s VAL 216 Cb -0.00 -2.33 -0.01 0.00 0.56 0.00 0.00 36.38 34.60 2bda s VAL 216 CO -0.10 0.00 1.28 -0.24 -0.31 0.00 0.00 175.10 175.73 2bda n SER 217 N -1.32 2.00 0.28 4.85 2.88 -1.22 -4.91 113.62 116.19 2bda n SER 217 Ca -0.07 0.82 0.17 0.00 -1.33 0.00 0.00 58.87 58.47 2bda n SER 217 Cb 0.65 -1.55 0.75 0.00 -0.75 0.00 0.00 64.21 63.31 2bda n SER 217 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2bda h ARG 217 N 0.47 0.00 0.00 -1.46 3.08 -2.00 -2.72 114.38 111.75 2bda h ARG 217 Ca -0.51 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.46 2bda h ARG 217 Cb 1.34 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.38 2bda h ARG 217 CO 0.53 0.02 -0.39 1.25 -1.07 0.00 0.00 179.97 180.31 2bda h LEU 218 N 0.00 0.00 0.00 3.04 6.46 -2.04 -3.49 115.31 119.28 2bda h LEU 218 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2bda h LEU 218 Cb 0.44 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.37 2bda h LEU 218 CO 0.00 0.39 0.00 0.61 -0.62 0.00 0.00 178.44 178.82 2bda n GLY 219 N 0.08 -1.24 0.06 3.75 0.00 -1.03 -5.03 105.19 101.78 2bda n GLY 219 Ca -0.01 -1.54 -0.02 0.00 0.00 0.00 0.00 46.02 44.45 2bda n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bda s ASN 221 N -5.67 6.76 -0.10 0.00 4.22 -1.26 -4.70 114.94 114.20 2bda s ASN 221 Ca -0.05 -2.58 0.04 0.00 -2.14 0.00 0.00 52.86 48.12 2bda s ASN 221 Cb 0.00 -2.26 0.00 0.00 1.28 0.00 0.00 41.25 40.28 2bda s ASN 221 CO 0.11 -0.68 -0.23 -0.69 -2.04 0.00 0.00 177.10 173.57 2bda s VAL 221 N 0.72 1.97 0.21 3.54 1.01 -1.26 -4.58 120.40 122.00 2bda s VAL 221 Ca 0.22 -0.96 -0.32 0.00 0.00 0.00 0.00 61.98 60.92 2bda s VAL 221 Cb -0.09 -1.71 -0.12 0.00 0.00 0.00 0.00 36.38 34.46 2bda s VAL 221 CO -0.09 0.54 1.68 0.41 0.00 0.00 0.00 175.10 177.64 2bda n THR 222 N 3.61 0.12 -1.18 3.92 -1.04 -1.26 -1.35 114.28 117.09 2bda n THR 222 Ca -0.19 -0.03 -0.06 0.00 -2.04 0.00 0.00 64.05 61.72 2bda n THR 222 Cb 0.53 -1.90 -0.03 0.00 -1.82 0.00 0.00 70.33 67.11 2bda n THR 222 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2bda n ARG 223 N 3.67 -1.02 -3.49 -2.82 1.74 -0.55 -4.92 116.66 109.26 2bda n ARG 223 Ca 0.15 0.62 -0.28 0.00 -0.77 0.00 0.00 57.85 57.58 2bda n ARG 223 Cb 0.34 -4.58 -0.08 0.00 -1.02 0.00 0.00 32.46 27.12 2bda n ARG 223 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2bda n LYS 224 N -1.65 2.49 -1.43 5.56 4.76 -0.46 -4.25 118.16 123.18 2bda n LYS 224 Ca -0.06 -4.64 -0.36 0.00 -2.87 0.00 0.00 58.31 50.37 2bda n LYS 224 Cb 0.35 -2.27 0.07 0.00 -1.84 0.00 0.00 35.03 31.34 2bda n LYS 224 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2bda n PRO 225 N 1.05 0.60 -1.78 1.97 -0.04 -1.26 -4.50 135.00 131.04 2bda n PRO 225 Ca 0.28 0.25 -0.40 0.00 -0.04 0.00 0.00 63.50 63.59 2bda n PRO 225 Cb 0.40 -2.16 0.01 0.00 -0.04 0.00 0.00 33.50 31.71 2bda n PRO 225 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2bda s THR 226 N -1.73 2.02 -0.06 0.52 2.01 -0.53 -4.74 115.64 113.14 2bda s THR 226 Ca 0.73 0.02 0.02 0.00 0.31 0.00 0.00 61.69 62.77 2bda s THR 226 Cb -0.37 -3.01 -0.03 0.00 0.01 0.00 0.00 72.50 69.10 2bda s THR 226 CO 0.50 0.00 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.64 2bda s VAL 227 N -1.16 3.39 0.08 3.82 1.01 -0.20 -1.26 120.40 126.07 2bda s VAL 227 Ca 0.58 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 62.01 2bda s VAL 227 Cb -0.45 -2.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 2bda s VAL 227 CO 0.60 0.59 -0.16 -0.36 0.00 0.00 0.00 175.10 175.77 2bda s PHE 228 N -0.78 1.35 0.15 5.22 0.08 0.17 -0.68 117.98 123.50 2bda s PHE 228 Ca 0.12 -0.45 -0.31 0.00 0.12 0.00 0.00 56.93 56.41 2bda s PHE 228 Cb -0.11 -0.75 -0.08 0.00 -0.57 0.00 0.00 43.02 41.51 2bda s PHE 228 CO 0.01 0.09 1.32 0.99 -0.10 0.00 0.00 175.22 177.53 2bda s THR 229 N -1.27 3.37 -0.49 0.64 2.01 0.44 -0.52 115.64 119.81 2bda s THR 229 Ca 0.00 1.05 -0.29 0.00 0.31 0.00 0.00 61.69 62.77 2bda s THR 229 Cb -0.10 -3.67 0.02 0.00 0.01 0.00 0.00 72.50 68.76 2bda s THR 229 CO 0.03 0.12 1.25 -0.60 -0.69 0.00 0.00 174.62 174.73 2bda s ARG 230 N 0.48 3.59 0.26 4.92 3.52 -0.07 -1.57 118.95 130.09 2bda s ARG 230 Ca 0.60 0.58 -0.02 0.00 -0.13 0.00 0.00 55.73 56.75 2bda s ARG 230 Cb -0.35 -3.98 0.45 0.00 -1.56 0.00 0.00 34.95 29.50 2bda s ARG 230 CO 0.34 -1.56 1.83 0.28 -0.81 0.00 0.00 175.30 175.38 2bda h VAL 231 N 6.30 0.94 0.00 7.11 2.07 -1.51 -1.75 116.25 129.41 2bda h VAL 231 Ca -0.25 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2bda h VAL 231 Cb 1.07 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2bda h VAL 231 CO 1.14 0.17 0.00 -1.54 0.02 0.00 0.00 177.57 177.36 2bda n SER 232 N -4.66 0.16 0.06 0.57 3.41 -1.26 -1.02 113.62 110.88 2bda n SER 232 Ca 0.16 0.55 0.13 0.00 -0.26 0.00 0.00 58.87 59.45 2bda n SER 232 Cb 0.29 -0.58 0.46 0.00 -0.26 0.00 0.00 64.21 64.11 2bda n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bda n ALA 233 N -1.57 2.40 -0.19 7.33 0.00 -0.66 -1.24 120.51 126.58 2bda n ALA 233 Ca 0.02 -0.08 0.03 0.00 0.00 0.00 0.00 53.44 53.41 2bda n ALA 233 Cb 0.14 -1.43 0.07 0.00 0.00 0.00 0.00 19.45 18.23 2bda n ALA 233 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2bda n TYR 234 N -1.96 0.20 0.03 0.00 4.02 -0.19 -4.81 117.16 114.45 2bda n TYR 234 Ca 0.06 -0.56 -0.11 0.00 -0.01 0.00 0.00 57.90 57.28 2bda n TYR 234 Cb 0.40 -0.06 -0.06 0.00 -0.02 0.00 0.00 39.34 39.59 2bda n TYR 234 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 2bda h ILE 235 N 0.76 0.94 -0.51 -0.72 1.08 -1.71 0.40 117.51 117.76 2bda h ILE 235 Ca 0.00 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.51 2bda h ILE 235 Cb 0.66 0.94 -0.04 0.00 -3.07 0.00 0.00 36.82 35.32 2bda h ILE 235 CO 0.01 0.00 0.27 0.28 -0.69 0.00 0.00 178.15 178.02 2bda h SER 236 N -0.01 0.41 -0.28 1.72 0.02 -1.91 0.45 113.55 113.94 2bda h SER 236 Ca 0.02 0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.03 2bda h SER 236 Cb 0.04 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.48 2bda h SER 236 CO -0.05 0.29 0.03 -0.25 -1.14 0.00 0.00 176.83 175.71 2bda h TRP 237 N 0.54 0.05 0.37 3.45 7.01 -1.78 0.42 115.95 126.01 2bda h TRP 237 Ca 0.22 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.22 2bda h TRP 237 Cb 0.09 0.02 0.00 0.00 -2.10 0.00 0.00 29.16 27.18 2bda h TRP 237 CO -0.09 -0.01 -0.18 0.82 -2.79 0.00 0.00 178.44 176.20 2bda h ILE 238 N 0.13 0.64 -0.82 2.65 2.04 -0.63 -0.66 117.51 120.86 2bda h ILE 238 Ca 0.13 -0.03 0.11 0.00 1.00 0.00 0.00 64.86 66.07 2bda h ILE 238 Cb 0.16 0.66 -0.08 0.00 -0.74 0.00 0.00 36.82 36.82 2bda h ILE 238 CO -0.20 0.01 0.45 0.78 0.00 0.00 0.00 178.15 179.19 2bda h ASN 239 N -0.51 0.62 -0.66 1.72 2.35 -0.79 -1.59 115.58 116.73 2bda h ASN 239 Ca -0.05 0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 2bda h ASN 239 Cb 0.39 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.67 2bda h ASN 239 CO 0.08 0.33 0.32 0.78 -1.65 0.00 0.00 177.43 177.30 2bda h ASN 240 N 0.73 0.86 -0.11 5.81 2.35 -0.30 0.31 115.58 125.23 2bda h ASN 240 Ca 0.41 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 56.02 2bda h ASN 240 Cb 0.44 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 2bda h ASN 240 CO -0.28 0.75 0.02 0.58 -1.65 0.00 0.00 177.43 176.86 2bda h VAL 241 N 0.91 1.21 -0.53 2.81 2.07 -0.78 -2.68 116.25 119.26 2bda h VAL 241 Ca 0.23 -0.65 -0.09 0.00 0.82 0.00 0.00 66.70 67.00 2bda h VAL 241 Cb 0.12 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 2bda h VAL 241 CO -0.03 0.19 -0.03 0.40 0.02 0.00 0.00 177.57 178.12 2bda h ILE 242 N -0.03 1.27 -0.05 4.57 2.04 -1.07 -1.43 117.51 122.80 2bda h ILE 242 Ca 0.04 -1.16 0.02 0.00 1.00 0.00 0.00 64.86 64.76 2bda h ILE 242 Cb 0.27 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2bda h ILE 242 CO 0.00 0.41 0.12 0.00 0.00 0.00 0.00 178.15 178.68 2bda h ALA 243 N 0.94 1.39 0.00 1.87 0.00 -0.94 -3.21 119.26 119.30 2bda h ALA 243 Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2bda h ALA 243 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2bda h ALA 243 CO 0.03 -0.15 0.00 -1.13 0.00 0.00 0.00 179.25 178.01 2bda n SER 244 N -3.39 1.45 0.00 0.00 3.41 -0.78 -5.08 113.62 109.23 2bda n SER 244 Ca -0.01 -1.53 0.00 0.00 -0.26 0.00 0.00 58.87 57.06 2bda n SER 244 Cb 0.20 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 2bda n SER 244 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47