#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rth h GLU 14 N 0.00 0.02 -0.79 0.00 -0.00 -1.91 -3.07 114.58 108.84 2rth h GLU 14 Ca 0.00 -0.01 0.13 0.00 -0.00 0.00 0.00 59.36 59.48 2rth h GLU 14 Cb 0.00 -0.00 -0.09 0.00 -0.00 0.00 0.00 28.75 28.66 2rth h GLU 14 CO 0.00 0.39 0.38 0.00 -0.00 0.00 0.00 179.01 179.78 2rth h ALA 15 N 0.63 1.14 -0.55 1.06 0.00 -1.92 0.71 119.26 120.32 2rth h ALA 15 Ca 0.00 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2rth h ALA 15 Cb 0.39 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2rth h ALA 15 CO 0.00 -0.10 -0.01 0.78 0.00 0.00 0.00 179.25 179.92 2rth h GLY 16 N 0.58 1.02 1.27 0.00 0.00 -2.00 -3.19 103.07 100.75 2rth h GLY 16 Ca 0.42 -0.73 -0.29 0.00 0.00 0.00 0.00 47.33 46.73 2rth h GLY 16 CO -0.34 0.67 -1.20 -2.22 0.00 0.00 0.00 176.54 173.45 2rth h ILE 17 N 0.87 1.30 -3.70 2.60 2.04 -1.28 -3.45 117.51 115.89 2rth h ILE 17 Ca 0.16 -2.45 -0.55 0.00 1.00 0.00 0.00 64.86 63.02 2rth h ILE 17 Cb 0.53 2.63 0.11 0.00 -0.74 0.00 0.00 36.82 39.35 2rth h ILE 17 CO 0.03 0.75 0.68 0.41 0.00 0.00 0.00 178.15 180.02 2rth n THR 18 N -3.79 1.99 -0.17 -0.27 -1.04 0.18 -4.78 114.28 106.41 2rth n THR 18 Ca -0.13 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.39 2rth n THR 18 Cb 0.96 -1.84 0.00 0.00 -1.82 0.00 0.00 70.33 67.64 2rth n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2rth n GLY 19 N 0.57 0.90 3.66 3.41 0.00 -0.70 -4.47 105.19 108.56 2rth n GLY 19 Ca 0.02 -1.88 -0.35 0.00 0.00 0.00 0.00 46.02 43.82 2rth n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rth s THR 20 N -2.04 4.61 0.05 2.61 2.01 0.81 -1.92 115.64 121.77 2rth s THR 20 Ca 0.00 -0.11 0.04 0.00 0.31 0.00 0.00 61.69 61.93 2rth s THR 20 Cb 0.00 -3.02 -0.02 0.00 0.01 0.00 0.00 72.50 69.47 2rth s THR 20 CO 0.00 0.53 -0.12 0.26 -0.69 0.00 0.00 174.62 174.60 2rth s TRP 21 N -0.21 1.03 0.07 4.92 0.52 -0.02 -1.14 118.94 124.11 2rth s TRP 21 Ca 0.07 -0.43 0.03 0.00 0.02 0.00 0.00 56.10 55.79 2rth s TRP 21 Cb -0.12 -0.60 -0.03 0.00 -1.15 0.00 0.00 33.47 31.57 2rth s TRP 21 CO 0.02 0.01 -0.09 1.52 0.02 0.00 0.00 176.95 178.43 2rth s TYR 22 N -1.14 0.89 0.51 -1.98 -0.85 -0.63 -0.34 117.35 113.81 2rth s TYR 22 Ca -0.03 -0.61 0.01 0.00 -0.52 0.00 0.00 57.07 55.92 2rth s TYR 22 Cb -0.09 -0.51 0.01 0.00 0.38 0.00 0.00 41.96 41.75 2rth s TYR 22 CO 0.01 -0.05 0.08 0.27 -1.52 0.00 0.00 175.55 174.35 2rth n ASN 23 N 0.94 3.26 0.33 -0.18 0.23 -1.10 -1.01 115.26 117.73 2rth n ASN 23 Ca -0.19 -3.14 0.21 0.00 -0.53 0.00 0.00 54.58 50.93 2rth n ASN 23 Cb 0.56 0.27 1.11 0.00 -2.08 0.00 0.00 39.78 39.64 2rth n ASN 23 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 2rth h GLN 24 N 0.00 0.00 0.00 -3.83 -0.00 -1.91 -1.48 115.11 107.88 2rth h GLN 24 Ca -0.40 0.00 -0.05 0.00 -0.00 0.00 0.00 58.65 58.20 2rth h GLN 24 Cb 1.27 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.74 2rth h GLN 24 CO 0.66 0.00 -0.54 -0.07 -0.00 0.00 0.00 178.83 178.88 2rth h LEU 25 N 0.00 0.00 0.00 0.06 3.38 -1.95 -3.47 115.31 113.33 2rth h LEU 25 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2rth h LEU 25 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2rth h LEU 25 CO -0.00 0.20 0.00 0.61 0.09 0.00 0.00 178.44 179.34 2rth n GLY 26 N 1.19 1.21 3.87 0.83 0.00 -0.56 -4.82 105.19 106.91 2rth n GLY 26 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2rth n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rth s SER 27 N -2.00 6.44 -0.09 1.61 0.01 -1.26 -4.61 113.70 113.80 2rth s SER 27 Ca 0.00 1.35 0.00 0.00 1.31 0.00 0.00 55.95 58.62 2rth s SER 27 Cb 0.00 -2.42 -0.02 0.00 0.21 0.00 0.00 66.02 63.78 2rth s SER 27 CO 0.00 -0.63 -0.09 -0.89 0.41 0.00 0.00 173.24 172.04 2rth s THR 28 N -2.74 3.45 -0.10 1.44 2.01 0.12 -2.72 115.64 117.10 2rth s THR 28 Ca 0.55 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 62.01 2rth s THR 28 Cb -0.10 -2.43 0.01 0.00 0.01 0.00 0.00 72.50 70.00 2rth s THR 28 CO 0.39 0.56 -0.14 0.12 -0.69 0.00 0.00 174.62 174.87 2rth s PHE 29 N -0.31 1.79 -0.16 4.92 5.36 0.54 -0.67 117.98 129.45 2rth s PHE 29 Ca 0.04 -0.79 0.01 0.00 -0.96 0.00 0.00 56.93 55.22 2rth s PHE 29 Cb -0.13 -1.31 0.01 0.00 -0.34 0.00 0.00 43.02 41.25 2rth s PHE 29 CO 0.02 -0.42 -0.18 0.42 -1.46 0.00 0.00 175.22 173.60 2rth s ILE 30 N 0.95 2.31 0.04 3.12 -1.09 0.13 -0.84 121.20 125.81 2rth s ILE 30 Ca -0.08 -0.88 -0.01 0.00 -2.23 0.00 0.00 60.65 57.45 2rth s ILE 30 Cb -0.15 -1.96 -0.03 0.00 -1.58 0.00 0.00 42.46 38.74 2rth s ILE 30 CO -0.00 0.53 -0.02 0.54 -1.23 0.00 0.00 174.94 174.76 2rth s VAL 31 N 1.00 0.16 -0.05 2.92 0.11 -0.81 -1.27 120.40 122.46 2rth s VAL 31 Ca -0.02 -1.34 0.03 0.00 -2.93 0.00 0.00 61.98 57.72 2rth s VAL 31 Cb -0.15 -0.90 0.00 0.00 -1.53 0.00 0.00 36.38 33.81 2rth s VAL 31 CO -0.05 -0.74 -0.14 -0.89 -3.33 0.00 0.00 175.10 169.95 2rth s THR 32 N -2.70 1.24 -0.34 5.04 2.01 -0.32 -1.73 115.64 118.84 2rth s THR 32 Ca -0.04 -0.59 -0.11 0.00 0.31 0.00 0.00 61.69 61.26 2rth s THR 32 Cb -0.01 -1.09 0.01 0.00 0.01 0.00 0.00 72.50 71.42 2rth s THR 32 CO -0.05 0.37 0.19 0.00 -0.69 0.00 0.00 174.62 174.43 2rth s ALA 33 N 0.26 3.30 0.58 7.40 0.00 -1.26 -2.62 121.76 129.41 2rth s ALA 33 Ca -0.07 -1.53 -0.14 0.00 0.00 0.00 0.00 51.96 50.22 2rth s ALA 33 Cb -0.12 -2.51 -0.05 0.00 0.00 0.00 0.00 23.12 20.44 2rth s ALA 33 CO 0.02 -1.12 1.02 0.20 0.00 0.00 0.00 175.76 175.88 2rth s GLY 34 N 1.60 1.87 0.31 0.00 0.00 0.13 -4.77 107.32 106.45 2rth s GLY 34 Ca 0.04 0.08 0.25 0.00 0.00 0.00 0.00 44.72 45.08 2rth s GLY 34 CO 0.07 0.36 1.74 0.00 0.00 0.00 0.00 173.10 175.27 2rth h ALA 35 N 0.23 1.00 -0.06 3.20 0.00 -1.98 -1.88 119.26 119.77 2rth h ALA 35 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2rth h ALA 35 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2rth h ALA 35 CO 0.61 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.46 2rth n ASP 36 N -2.34 0.74 0.00 0.00 5.75 -1.26 -4.83 116.55 114.60 2rth n ASP 36 Ca 0.01 -1.48 0.00 0.00 -0.01 0.00 0.00 54.79 53.32 2rth n ASP 36 Cb 0.20 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 2rth n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2rth n GLY 37 N 0.98 0.96 3.92 6.12 0.00 -0.71 -4.95 105.19 111.50 2rth n GLY 37 Ca 0.16 -0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 2rth n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rth s ALA 38 N -2.00 3.79 -0.00 4.61 0.00 -1.22 -1.15 121.76 125.79 2rth s ALA 38 Ca 0.00 -0.75 0.04 0.00 0.00 0.00 0.00 51.96 51.26 2rth s ALA 38 Cb 0.00 -2.07 -0.01 0.00 0.00 0.00 0.00 23.12 21.04 2rth s ALA 38 CO 0.00 0.44 -0.13 -0.51 0.00 0.00 0.00 175.76 175.55 2rth s LEU 39 N -3.27 2.05 0.05 0.00 1.43 -0.81 0.19 118.68 118.33 2rth s LEU 39 Ca 0.40 -0.28 -0.11 0.00 -1.03 0.00 0.00 54.13 53.11 2rth s LEU 39 Cb -0.11 -0.66 0.01 0.00 0.03 0.00 0.00 46.19 45.46 2rth s LEU 39 CO 0.29 0.14 0.24 0.42 0.23 0.00 0.00 176.35 177.66 2rth s THR 40 N -0.40 0.10 -4.84 5.49 -4.23 -1.08 -1.59 115.64 109.09 2rth s THR 40 Ca 0.04 -0.86 0.00 0.00 -1.18 0.00 0.00 61.69 59.69 2rth s THR 40 Cb -0.06 -1.01 0.00 0.00 1.34 0.00 0.00 72.50 72.77 2rth s THR 40 CO -0.00 -0.48 0.00 0.61 -0.54 0.00 0.00 174.62 174.21 2rth n GLY 41 N 0.47 -0.49 3.16 3.99 0.00 -1.18 -1.17 105.19 109.97 2rth n GLY 41 Ca -0.18 -1.07 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 2rth n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rth s THR 42 N -3.09 0.77 -0.03 2.61 -4.23 -0.40 -2.41 115.64 108.86 2rth s THR 42 Ca 0.00 -1.73 0.03 0.00 -1.18 0.00 0.00 61.69 58.81 2rth s THR 42 Cb 0.00 -1.43 0.00 0.00 1.34 0.00 0.00 72.50 72.41 2rth s THR 42 CO 0.00 -0.70 -0.11 -0.47 -0.54 0.00 0.00 174.62 172.80 2rth s TYR 43 N -2.92 1.10 -0.18 3.99 6.14 0.11 -0.69 117.35 124.89 2rth s TYR 43 Ca 0.07 -0.28 0.01 0.00 0.64 0.00 0.00 57.07 57.51 2rth s TYR 43 Cb 0.00 -0.77 0.03 0.00 0.42 0.00 0.00 41.96 41.64 2rth s TYR 43 CO -0.02 -0.11 -0.15 -2.00 0.64 0.00 0.00 175.55 173.90 2rth s GLU 44 N 0.17 2.51 0.08 4.97 2.12 0.16 -1.36 118.70 127.35 2rth s GLU 44 Ca -0.03 -0.82 -0.02 0.00 0.36 0.00 0.00 54.97 54.46 2rth s GLU 44 Cb -0.09 -2.45 -0.05 0.00 0.26 0.00 0.00 34.13 31.81 2rth s GLU 44 CO 0.01 -0.30 0.27 0.45 -0.54 0.00 0.00 175.26 175.14 2rth s SER 45 N 1.34 6.41 0.00 -1.70 0.15 -1.26 -0.70 113.70 117.95 2rth s SER 45 Ca 0.02 0.40 0.24 0.00 0.70 0.00 0.00 55.95 57.31 2rth s SER 45 Cb -0.14 -2.01 0.31 0.00 -1.71 0.00 0.00 66.02 62.46 2rth s SER 45 CO -0.10 0.14 1.27 0.00 1.20 0.00 0.00 173.24 175.75 2rth n ALA 46 N 0.29 3.72 -2.27 5.45 0.00 -1.26 -4.89 120.51 121.55 2rth n ALA 46 Ca -0.05 -0.48 -0.15 0.00 0.00 0.00 0.00 53.44 52.77 2rth n ALA 46 Cb 0.51 -0.98 -0.10 0.00 0.00 0.00 0.00 19.45 18.88 2rth n ALA 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2rth s VAL 47 N -2.77 0.82 0.00 0.00 -7.23 -1.26 -5.03 120.40 104.94 2rth s VAL 47 Ca 0.15 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.32 2rth s VAL 47 Cb 0.18 -2.15 0.00 0.00 0.56 0.00 0.00 36.38 34.97 2rth s VAL 47 CO 0.67 -0.46 0.00 0.61 -0.31 0.00 0.00 175.10 175.61 2rth n GLY 48 N -0.28 -2.97 2.87 2.32 0.00 -1.26 -4.51 105.19 101.35 2rth n GLY 48 Ca -0.06 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 2rth n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rth n ASN 49 N -0.05 5.70 -3.88 1.61 5.15 -1.26 -4.88 115.26 117.65 2rth n ASN 49 Ca 0.00 -3.21 -0.15 0.00 -0.60 0.00 0.00 54.58 50.62 2rth n ASN 49 Cb 0.00 -1.41 -0.15 0.00 -0.53 0.00 0.00 39.78 37.70 2rth n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2rth s ALA 50 N -0.70 0.22 -0.09 5.20 0.00 -1.26 -4.51 121.76 120.62 2rth s ALA 50 Ca 0.38 -0.01 -0.04 0.00 0.00 0.00 0.00 51.96 52.29 2rth s ALA 50 Cb 0.09 -0.13 0.05 0.00 0.00 0.00 0.00 23.12 23.13 2rth s ALA 50 CO 0.02 0.01 0.18 -1.83 0.00 0.00 0.00 175.76 174.15 2rth s GLU 51 N 0.27 0.08 1.50 0.00 -1.05 -1.26 -4.94 118.70 113.30 2rth s GLU 51 Ca -0.02 0.55 0.00 0.00 -0.15 0.00 0.00 54.97 55.34 2rth s GLU 51 Cb -0.05 -0.19 0.00 0.00 -0.44 0.00 0.00 34.13 33.45 2rth s GLU 51 CO -0.01 -0.26 0.00 0.45 0.95 0.00 0.00 175.26 176.40 2rth n SER 52 N 4.95 0.00 -4.91 0.83 2.88 -1.26 -4.68 113.62 111.42 2rth n SER 52 Ca -0.12 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.12 2rth n SER 52 Cb 0.51 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.93 2rth n SER 52 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2rth s ARG 53 N 0.00 3.55 0.06 -1.46 0.52 -1.26 -4.50 118.95 115.86 2rth s ARG 53 Ca 0.00 -0.24 0.06 0.00 -0.52 0.00 0.00 55.73 55.04 2rth s ARG 53 Cb 0.00 -2.88 -0.03 0.00 0.52 0.00 0.00 34.95 32.56 2rth s ARG 53 CO 0.00 0.47 -0.18 0.71 0.02 0.00 0.00 175.30 176.32 2rth s TYR 54 N -1.71 1.54 0.28 -0.53 1.51 -0.47 -4.87 117.35 113.10 2rth s TYR 54 Ca 0.39 -0.39 -0.28 0.00 -1.01 0.00 0.00 57.07 55.78 2rth s TYR 54 Cb -0.12 -0.89 -0.09 0.00 -0.11 0.00 0.00 41.96 40.75 2rth s TYR 54 CO 0.27 0.10 0.96 0.08 -1.11 0.00 0.00 175.55 175.85 2rth s VAL 55 N -0.97 4.04 0.10 0.71 1.01 -1.26 -0.71 120.40 123.30 2rth s VAL 55 Ca 0.04 1.89 0.06 0.00 0.00 0.00 0.00 61.98 63.97 2rth s VAL 55 Cb -0.09 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 2rth s VAL 55 CO 0.02 0.33 -0.16 -1.48 0.00 0.00 0.00 175.10 173.81 2rth s LEU 56 N -1.60 2.32 -0.06 3.92 0.05 -1.01 -4.33 118.68 117.97 2rth s LEU 56 Ca 0.46 -0.70 -0.06 0.00 0.05 0.00 0.00 54.13 53.88 2rth s LEU 56 Cb -0.24 -0.63 0.02 0.00 -2.05 0.00 0.00 46.19 43.29 2rth s LEU 56 CO 0.30 -0.06 0.16 0.28 -0.55 0.00 0.00 176.35 176.48 2rth s THR 57 N -1.52 -0.00 0.00 5.48 -1.32 -0.99 -3.13 115.64 114.16 2rth s THR 57 Ca 0.04 0.01 0.00 0.00 -1.21 0.00 0.00 61.69 60.53 2rth s THR 57 Cb -0.08 -0.24 0.00 0.00 -1.51 0.00 0.00 72.50 70.67 2rth s THR 57 CO 0.03 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.05 2rth n GLY 58 N 3.06 2.54 3.20 6.08 0.00 -0.62 -1.31 105.19 118.14 2rth n GLY 58 Ca -0.13 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 2rth n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rth s ARG 59 N -1.32 0.68 0.15 1.61 1.81 -0.96 -1.93 118.95 118.99 2rth s ARG 59 Ca 0.00 -0.42 -0.04 0.00 -1.72 0.00 0.00 55.73 53.55 2rth s ARG 59 Cb 0.00 0.29 -0.03 0.00 -0.45 0.00 0.00 34.95 34.76 2rth s ARG 59 CO 0.00 -0.19 0.16 1.52 -0.68 0.00 0.00 175.30 176.10 2rth s TYR 60 N -1.96 0.69 -0.62 -0.53 1.13 -0.30 -1.84 117.35 113.92 2rth s TYR 60 Ca -0.09 -1.05 -0.28 0.00 -1.41 0.00 0.00 57.07 54.24 2rth s TYR 60 Cb -0.03 -0.31 0.03 0.00 -1.10 0.00 0.00 41.96 40.55 2rth s TYR 60 CO -0.00 -0.61 1.19 0.34 -2.51 0.00 0.00 175.55 173.96 2rth s ASP 61 N -3.02 6.37 0.20 -0.18 3.68 -0.51 -4.67 116.67 118.55 2rth s ASP 61 Ca 0.22 -0.07 0.21 0.00 2.13 0.00 0.00 52.55 55.04 2rth s ASP 61 Cb 0.06 -2.54 0.89 0.00 -1.45 0.00 0.00 42.92 39.88 2rth s ASP 61 CO 0.02 -1.54 1.64 -1.54 0.13 0.00 0.00 175.17 173.87 2rth n SER 62 N 8.57 0.50 -3.48 -0.34 3.41 -1.26 -3.70 113.62 117.33 2rth n SER 62 Ca 0.07 0.63 -0.27 0.00 -0.26 0.00 0.00 58.87 59.04 2rth n SER 62 Cb 0.49 -0.74 -0.09 0.00 -0.26 0.00 0.00 64.21 63.61 2rth n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rth n ALA 63 N -1.71 3.30 -0.74 7.33 0.00 -1.26 -4.74 120.51 122.69 2rth n ALA 63 Ca 0.02 -4.09 -0.30 0.00 0.00 0.00 0.00 53.44 49.08 2rth n ALA 63 Cb 0.20 -0.88 0.26 0.00 0.00 0.00 0.00 19.45 19.02 2rth n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2rth s PRO 64 N -1.47 -1.79 0.21 0.00 0.04 -1.24 -5.01 135.00 125.74 2rth s PRO 64 Ca 0.34 0.16 -0.20 0.00 0.04 0.00 0.00 61.00 61.34 2rth s PRO 64 Cb 0.09 -1.51 -0.08 0.00 0.04 0.00 0.00 34.50 33.04 2rth s PRO 64 CO -0.11 -4.13 0.71 0.00 0.04 0.00 0.00 177.00 173.52 2rth s ALA 65 N -2.65 3.43 -0.86 8.56 0.00 -1.26 -4.95 121.76 124.03 2rth s ALA 65 Ca 0.69 0.15 -0.12 0.00 0.00 0.00 0.00 51.96 52.68 2rth s ALA 65 Cb -0.14 -2.80 -0.09 0.00 0.00 0.00 0.00 23.12 20.09 2rth s ALA 65 CO 0.58 0.34 2.02 0.25 0.00 0.00 0.00 175.76 178.95 2rth n THR 66 N 0.77 2.18 -2.59 0.00 -2.24 -1.26 -4.52 114.28 106.62 2rth n THR 66 Ca -0.03 -1.53 0.00 0.00 -2.27 0.00 0.00 64.05 60.23 2rth n THR 66 Cb 0.51 -2.21 0.00 0.00 -2.10 0.00 0.00 70.33 66.53 2rth n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2rth n ASP 67 N 5.58 0.00 -3.04 3.42 5.68 -1.26 -5.02 116.55 121.91 2rth n ASP 67 Ca 0.46 -0.54 -0.34 0.00 -0.50 0.00 0.00 54.79 53.87 2rth n ASP 67 Cb 0.25 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.19 2rth n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rth n GLY 68 N 0.00 4.79 3.86 6.12 0.00 -1.26 -4.90 105.19 113.79 2rth n GLY 68 Ca 0.00 -1.95 -0.26 0.00 0.00 0.00 0.00 46.02 43.81 2rth n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rth s SER 69 N 0.45 5.84 0.59 1.61 0.01 -1.26 -5.10 113.70 115.85 2rth s SER 69 Ca 0.57 -0.02 -0.05 0.00 1.31 0.00 0.00 55.95 57.76 2rth s SER 69 Cb 0.27 -1.62 0.02 0.00 0.21 0.00 0.00 66.02 64.89 2rth s SER 69 CO -0.14 0.06 0.89 -0.83 0.41 0.00 0.00 173.24 173.62 2rth s GLY 70 N -3.20 1.63 -0.24 3.44 0.00 -1.26 -4.88 107.32 102.81 2rth s GLY 70 Ca 0.32 -0.81 -0.10 0.00 0.00 0.00 0.00 44.72 44.13 2rth s GLY 70 CO 0.25 -0.52 0.15 -1.59 0.00 0.00 0.00 173.10 171.39 2rth s THR 71 N -2.97 5.27 0.39 0.90 2.01 0.50 -4.80 115.64 116.95 2rth s THR 71 Ca 0.54 0.15 -0.24 0.00 0.31 0.00 0.00 61.69 62.46 2rth s THR 71 Cb -0.10 -3.46 -0.10 0.00 0.01 0.00 0.00 72.50 68.85 2rth s THR 71 CO 0.44 0.35 0.99 0.00 -0.69 0.00 0.00 174.62 175.71 2rth s ALA 72 N 1.05 3.10 0.14 7.40 0.00 -1.26 -0.15 121.76 132.03 2rth s ALA 72 Ca 0.07 0.56 -0.25 0.00 0.00 0.00 0.00 51.96 52.35 2rth s ALA 72 Cb -0.14 -3.21 0.06 0.00 0.00 0.00 0.00 23.12 19.84 2rth s ALA 72 CO 0.04 -0.01 0.88 -0.48 0.00 0.00 0.00 175.76 176.19 2rth s LEU 73 N -2.64 -0.26 0.18 0.00 -0.00 -1.09 -1.42 118.68 113.46 2rth s LEU 73 Ca 0.57 -0.32 -0.21 0.00 -0.00 0.00 0.00 54.13 54.16 2rth s LEU 73 Cb -0.17 2.26 0.05 0.00 -0.00 0.00 0.00 46.19 48.33 2rth s LEU 73 CO 0.22 -0.92 0.59 -0.83 -0.00 0.00 0.00 176.35 175.41 2rth s GLY 74 N -2.83 -0.42 0.20 -3.48 0.00 -0.77 -2.23 107.32 97.79 2rth s GLY 74 Ca 0.10 0.20 -0.20 0.00 0.00 0.00 0.00 44.72 44.82 2rth s GLY 74 CO -0.00 0.02 0.59 0.66 0.00 0.00 0.00 173.10 174.36 2rth s TRP 75 N -3.80 -0.27 0.01 1.90 -2.14 -0.47 -2.26 118.94 111.91 2rth s TRP 75 Ca 0.04 -0.06 0.03 0.00 2.66 0.00 0.00 56.10 58.77 2rth s TRP 75 Cb -0.02 0.51 -0.01 0.00 -3.10 0.00 0.00 33.47 30.85 2rth s TRP 75 CO -0.08 -0.96 -0.11 0.99 -2.66 0.00 0.00 176.95 174.14 2rth s THR 76 N -3.84 0.82 -0.07 0.66 2.01 -0.43 -0.92 115.64 113.88 2rth s THR 76 Ca 0.07 -0.58 0.01 0.00 0.31 0.00 0.00 61.69 61.49 2rth s THR 76 Cb -0.02 -0.72 0.02 0.00 0.01 0.00 0.00 72.50 71.80 2rth s THR 76 CO -0.04 0.13 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.27 2rth s VAL 77 N -0.44 0.72 -0.20 3.82 1.01 -0.75 -2.35 120.40 122.21 2rth s VAL 77 Ca 0.02 -0.18 -0.10 0.00 0.00 0.00 0.00 61.98 61.73 2rth s VAL 77 Cb -0.05 -0.75 -0.05 0.00 0.00 0.00 0.00 36.38 35.54 2rth s VAL 77 CO 0.00 0.29 0.13 0.00 0.00 0.00 0.00 175.10 175.51 2rth s ALA 78 N 1.24 3.64 -1.08 5.51 0.00 -1.26 -0.82 121.76 128.98 2rth s ALA 78 Ca -0.05 -0.73 -0.08 0.00 0.00 0.00 0.00 51.96 51.09 2rth s ALA 78 Cb -0.14 -2.16 -0.11 0.00 0.00 0.00 0.00 23.12 20.71 2rth s ALA 78 CO -0.02 0.10 3.09 0.91 0.00 0.00 0.00 175.76 179.84 2rth n TRP 79 N 3.66 1.72 -4.23 0.00 7.02 0.40 -4.77 117.44 121.24 2rth n TRP 79 Ca -0.16 -2.56 -0.20 0.00 -1.02 0.00 0.00 57.50 53.56 2rth n TRP 79 Cb 0.52 -2.12 -0.16 0.00 -2.42 0.00 0.00 31.31 27.12 2rth n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 2rth s LYS 80 N 1.31 0.88 0.00 -0.99 2.20 -1.26 -0.20 119.74 121.69 2rth s LYS 80 Ca 0.67 -0.16 0.00 0.00 -0.36 0.00 0.00 55.97 56.12 2rth s LYS 80 Cb 0.23 -0.85 0.00 0.00 -1.51 0.00 0.00 37.83 35.70 2rth s LYS 80 CO -0.05 -0.03 0.00 0.27 -0.36 0.00 0.00 175.35 175.17 2rth n ASN 81 N 3.85 0.00 0.02 1.43 0.23 0.40 -4.79 115.26 116.41 2rth n ASN 81 Ca -0.24 0.00 0.14 0.00 -0.53 0.00 0.00 54.58 53.95 2rth n ASN 81 Cb 0.52 0.00 0.54 0.00 -2.08 0.00 0.00 39.78 38.76 2rth n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2rth n ASN 82 N 0.00 0.22 -0.06 0.53 5.03 -1.26 -3.95 115.26 115.78 2rth n ASN 82 Ca 0.00 0.46 -0.05 0.00 0.87 0.00 0.00 54.58 55.86 2rth n ASN 82 Cb 0.00 -0.50 -0.10 0.00 -1.02 0.00 0.00 39.78 38.16 2rth n ASN 82 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2rth n TYR 83 N -1.67 0.00 -3.94 3.10 4.01 -1.26 -5.03 117.16 112.36 2rth n TYR 83 Ca 0.07 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.72 2rth n TYR 83 Cb 0.36 -0.58 -0.08 0.00 -0.31 0.00 0.00 39.34 38.73 2rth n TYR 83 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2rth s ARG 84 N -2.34 0.80 -0.13 -0.72 6.06 -1.25 -5.03 118.95 116.33 2rth s ARG 84 Ca -0.06 -1.06 -0.04 0.00 -2.50 0.00 0.00 55.73 52.07 2rth s ARG 84 Cb 0.04 0.30 0.05 0.00 0.06 0.00 0.00 34.95 35.41 2rth s ARG 84 CO 0.51 -0.23 0.10 1.21 -2.50 0.00 0.00 175.30 174.39 2rth s ASN 85 N -2.89 1.73 0.00 -2.12 3.84 -1.26 -0.45 114.94 113.79 2rth s ASN 85 Ca 0.07 -0.28 0.17 0.00 0.21 0.00 0.00 52.86 53.03 2rth s ASN 85 Cb 0.06 -0.09 0.28 0.00 -0.55 0.00 0.00 41.25 40.95 2rth s ASN 85 CO -0.10 -0.31 1.19 0.00 -2.79 0.00 0.00 177.10 175.10 2rth n ALA 86 N 5.29 2.38 -3.91 1.71 0.00 0.72 -4.98 120.51 121.73 2rth n ALA 86 Ca -0.05 -0.89 -0.25 0.00 0.00 0.00 0.00 53.44 52.25 2rth n ALA 86 Cb 0.49 -0.62 -0.01 0.00 0.00 0.00 0.00 19.45 19.32 2rth n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2rth n HIS 87 N 1.01 -1.73 -3.83 0.00 -0.00 -1.26 -4.88 115.22 104.53 2rth n HIS 87 Ca 0.13 0.77 -0.09 0.00 -0.00 0.00 0.00 57.72 58.53 2rth n HIS 87 Cb 0.47 -3.86 -0.05 0.00 -0.00 0.00 0.00 29.99 26.55 2rth n HIS 87 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2rth s SER 88 N -4.29 -0.15 -0.04 0.41 1.04 -1.26 -1.39 113.70 108.02 2rth s SER 88 Ca 0.05 -0.63 -0.11 0.00 0.48 0.00 0.00 55.95 55.75 2rth s SER 88 Cb -0.03 0.54 0.02 0.00 0.10 0.00 0.00 66.02 66.64 2rth s SER 88 CO 0.87 -1.01 0.24 0.00 0.98 0.00 0.00 173.24 174.32 2rth s ALA 89 N -3.91 -0.60 0.03 5.32 0.00 -0.76 -0.45 121.76 121.38 2rth s ALA 89 Ca 0.12 0.32 0.07 0.00 0.00 0.00 0.00 51.96 52.48 2rth s ALA 89 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.02 2rth s ALA 89 CO -0.01 -0.20 -0.21 0.99 0.00 0.00 0.00 175.76 176.33 2rth s THR 90 N -0.87 1.66 -0.05 0.00 2.01 0.00 -1.02 115.64 117.38 2rth s THR 90 Ca -0.09 -1.13 0.04 0.00 0.31 0.00 0.00 61.69 60.82 2rth s THR 90 Cb -0.05 -1.43 -0.00 0.00 0.01 0.00 0.00 72.50 71.03 2rth s THR 90 CO 0.02 0.26 -0.18 0.42 -0.69 0.00 0.00 174.62 174.46 2rth s THR 91 N -0.73 1.49 -0.10 -0.82 -4.23 -0.74 -1.81 115.64 108.70 2rth s THR 91 Ca 0.08 -0.74 -0.01 0.00 -1.18 0.00 0.00 61.69 59.83 2rth s THR 91 Cb -0.09 -1.29 -0.03 0.00 1.34 0.00 0.00 72.50 72.44 2rth s THR 91 CO 0.01 0.43 -0.06 0.26 -0.54 0.00 0.00 174.62 174.72 2rth s TRP 92 N 0.09 2.97 -0.08 3.99 0.51 -0.09 -2.10 118.94 124.22 2rth s TRP 92 Ca -0.05 -0.13 0.01 0.00 -2.12 0.00 0.00 56.10 53.80 2rth s TRP 92 Cb -0.12 -1.81 0.02 0.00 -0.81 0.00 0.00 33.47 30.75 2rth s TRP 92 CO 0.03 0.17 -0.10 0.45 -0.51 0.00 0.00 176.95 176.99 2rth s SER 93 N -0.33 1.83 0.00 2.95 0.15 -0.22 -1.36 113.70 116.72 2rth s SER 93 Ca 0.05 -0.28 0.00 0.00 0.70 0.00 0.00 55.95 56.41 2rth s SER 93 Cb -0.12 -0.80 0.00 0.00 -1.71 0.00 0.00 66.02 63.39 2rth s SER 93 CO 0.02 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.05 2rth n GLY 94 N 4.21 2.27 3.05 9.45 0.00 -0.95 -1.41 105.19 121.81 2rth n GLY 94 Ca -0.20 -0.59 -0.12 0.00 0.00 0.00 0.00 46.02 45.12 2rth n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rth s GLN 95 N 1.35 0.31 -0.09 1.61 -2.07 -0.57 -2.66 119.66 117.54 2rth s GLN 95 Ca 0.00 -0.13 -0.12 0.00 -1.82 0.00 0.00 55.36 53.29 2rth s GLN 95 Cb 0.00 0.13 -0.05 0.00 -1.09 0.00 0.00 33.01 32.00 2rth s GLN 95 CO 0.00 -0.06 0.28 -0.47 -1.32 0.00 0.00 175.29 173.72 2rth s TYR 96 N -0.69 3.59 -0.18 9.60 5.04 0.78 -1.63 117.35 133.87 2rth s TYR 96 Ca -0.08 0.71 0.00 0.00 -2.44 0.00 0.00 57.07 55.26 2rth s TYR 96 Cb -0.05 -2.20 0.04 0.00 0.35 0.00 0.00 41.96 40.10 2rth s TYR 96 CO 0.01 0.53 -0.08 0.08 -1.34 0.00 0.00 175.55 174.74 2rth s VAL 97 N -0.51 1.38 0.63 3.14 1.01 -0.09 -0.37 120.40 125.59 2rth s VAL 97 Ca 0.18 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.33 2rth s VAL 97 Cb -0.14 -1.49 0.13 0.00 0.00 0.00 0.00 36.38 34.88 2rth s VAL 97 CO 0.07 0.17 0.86 0.61 0.00 0.00 0.00 175.10 176.80 2rth n GLY 98 N 4.78 0.11 0.00 4.51 0.00 -1.26 -1.09 105.19 112.24 2rth n GLY 98 Ca -0.13 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 43.95 2rth n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rth n GLY 99 N -1.25 0.85 0.21 -0.02 0.00 -1.26 -4.72 105.19 99.00 2rth n GLY 99 Ca 0.13 -1.86 -0.18 0.00 0.00 0.00 0.00 46.02 44.11 2rth n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rth h ALA 100 N 0.00 0.24 -3.15 4.61 0.00 -2.06 -3.36 119.26 115.54 2rth h ALA 100 Ca 0.00 -0.62 -0.69 0.00 0.00 0.00 0.00 54.91 53.60 2rth h ALA 100 Cb 0.00 0.01 -0.35 0.00 0.00 0.00 0.00 17.79 17.45 2rth h ALA 100 CO 0.00 0.65 -0.44 -1.21 0.00 0.00 0.00 179.25 178.25 2rth s GLU 101 N -3.62 2.34 0.08 0.00 2.02 -1.26 -5.06 118.70 113.20 2rth s GLU 101 Ca -0.11 -2.26 -0.22 0.00 0.02 0.00 0.00 54.97 52.40 2rth s GLU 101 Cb 0.08 -3.67 -0.07 0.00 0.10 0.00 0.00 34.13 30.57 2rth s GLU 101 CO 0.90 -1.14 0.66 0.00 0.02 0.00 0.00 175.26 175.70 2rth s ALA 102 N 0.39 3.50 0.15 5.21 0.00 -1.26 -4.86 121.76 124.89 2rth s ALA 102 Ca 0.14 0.16 0.05 0.00 0.00 0.00 0.00 51.96 52.30 2rth s ALA 102 Cb -0.21 -2.79 -0.04 0.00 0.00 0.00 0.00 23.12 20.07 2rth s ALA 102 CO -0.04 0.28 -0.10 1.03 0.00 0.00 0.00 175.76 176.93 2rth s ARG 103 N -0.79 1.06 -0.15 0.00 1.81 -0.25 -3.19 118.95 117.44 2rth s ARG 103 Ca 0.33 -1.44 -0.00 0.00 -1.72 0.00 0.00 55.73 52.89 2rth s ARG 103 Cb -0.20 -0.65 0.04 0.00 -0.45 0.00 0.00 34.95 33.68 2rth s ARG 103 CO 0.21 0.08 -0.06 0.42 -0.68 0.00 0.00 175.30 175.28 2rth s ILE 104 N -3.24 1.08 -0.20 1.52 1.01 -0.67 -0.91 121.20 119.79 2rth s ILE 104 Ca 0.16 -0.54 -0.07 0.00 0.00 0.00 0.00 60.65 60.20 2rth s ILE 104 Cb 0.02 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.23 2rth s ILE 104 CO 0.01 0.19 0.06 0.20 0.00 0.00 0.00 174.94 175.40 2rth s ASN 105 N 1.66 5.49 0.25 3.58 0.01 -0.65 -1.27 114.94 124.01 2rth s ASN 105 Ca 0.02 0.00 0.01 0.00 -0.71 0.00 0.00 52.86 52.18 2rth s ASN 105 Cb -0.15 -1.95 -0.04 0.00 0.41 0.00 0.00 41.25 39.52 2rth s ASN 105 CO -0.08 0.12 0.15 0.42 -1.51 0.00 0.00 177.10 176.20 2rth s THR 106 N 0.71 0.20 0.02 1.60 -4.23 -0.46 -1.51 115.64 111.97 2rth s THR 106 Ca 0.03 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.58 2rth s THR 106 Cb -0.13 -2.53 -0.02 0.00 1.34 0.00 0.00 72.50 71.16 2rth s THR 106 CO 0.02 0.00 -0.11 -1.10 -0.54 0.00 0.00 174.62 172.89 2rth s GLN 107 N -3.97 0.78 0.13 3.99 -0.21 -0.50 -2.14 119.66 117.74 2rth s GLN 107 Ca 0.38 -0.56 0.03 0.00 0.02 0.00 0.00 55.36 55.23 2rth s GLN 107 Cb 0.06 -0.73 -0.04 0.00 1.00 0.00 0.00 33.01 33.29 2rth s GLN 107 CO 0.15 0.19 -0.07 1.67 -2.12 0.00 0.00 175.29 175.11 2rth s TRP 108 N -0.64 1.07 -0.09 0.91 1.48 -0.22 -1.05 118.94 120.41 2rth s TRP 108 Ca 0.01 -0.87 0.01 0.00 -1.06 0.00 0.00 56.10 54.19 2rth s TRP 108 Cb -0.06 -0.59 0.02 0.00 -1.16 0.00 0.00 33.47 31.68 2rth s TRP 108 CO 0.00 -0.07 -0.11 -0.51 -4.06 0.00 0.00 176.95 172.21 2rth s LEU 109 N -3.11 1.49 -0.28 -4.66 1.43 -0.89 -1.64 118.68 111.02 2rth s LEU 109 Ca 0.15 -0.31 -0.03 0.00 -1.03 0.00 0.00 54.13 52.91 2rth s LEU 109 Cb 0.04 -0.85 0.03 0.00 0.03 0.00 0.00 46.19 45.45 2rth s LEU 109 CO -0.02 -0.02 0.01 -0.22 0.23 0.00 0.00 176.35 176.33 2rth s LEU 110 N 1.05 3.66 -0.13 1.79 0.20 0.03 -1.79 118.68 123.50 2rth s LEU 110 Ca -0.07 -0.97 -0.02 0.00 0.69 0.00 0.00 54.13 53.75 2rth s LEU 110 Cb -0.15 -1.75 -0.03 0.00 -0.43 0.00 0.00 46.19 43.84 2rth s LEU 110 CO -0.01 -0.20 -0.05 -0.89 -0.29 0.00 0.00 176.35 174.91 2rth s THR 111 N 1.36 3.80 0.14 3.68 2.01 -0.19 -1.11 115.64 125.32 2rth s THR 111 Ca -0.01 -0.40 0.03 0.00 0.31 0.00 0.00 61.69 61.62 2rth s THR 111 Cb -0.18 -2.63 -0.04 0.00 0.01 0.00 0.00 72.50 69.66 2rth s THR 111 CO -0.01 0.53 0.23 -0.44 -0.69 0.00 0.00 174.62 174.24 2rth s SER 112 N 0.03 6.11 0.21 3.53 0.01 -0.35 -1.82 113.70 121.41 2rth s SER 112 Ca -0.00 0.10 -0.28 0.00 1.31 0.00 0.00 55.95 57.08 2rth s SER 112 Cb -0.13 -1.78 -0.09 0.00 0.21 0.00 0.00 66.02 64.23 2rth s SER 112 CO 0.03 0.07 0.86 -0.83 0.41 0.00 0.00 173.24 173.78 2rth s GLY 113 N -3.12 3.01 0.34 3.44 0.00 -0.49 -4.87 107.32 105.63 2rth s GLY 113 Ca 0.33 0.49 0.05 0.00 0.00 0.00 0.00 44.72 45.60 2rth s GLY 113 CO 0.27 1.02 0.34 -1.30 0.00 0.00 0.00 173.10 173.43 2rth n THR 114 N 1.50 0.00 -2.47 0.90 -2.24 -1.26 -5.02 114.28 105.69 2rth n THR 114 Ca -0.04 -2.28 -0.30 0.00 -2.27 0.00 0.00 64.05 59.16 2rth n THR 114 Cb 0.48 1.20 -0.02 0.00 -2.10 0.00 0.00 70.33 69.89 2rth n THR 114 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2rth s THR 115 N -3.22 4.73 0.52 4.28 -4.23 -1.26 -4.92 115.64 111.55 2rth s THR 115 Ca 0.37 0.75 0.24 0.00 -1.18 0.00 0.00 61.69 61.87 2rth s THR 115 Cb 0.01 -3.79 0.39 0.00 1.34 0.00 0.00 72.50 70.45 2rth s THR 115 CO 0.27 -0.77 2.00 -0.08 -0.54 0.00 0.00 174.62 175.50 2rth h GLU 116 N 0.61 0.02 -0.31 3.99 4.81 -2.01 -1.92 114.58 119.78 2rth h GLU 116 Ca -0.46 -0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.68 2rth h GLU 116 Cb 1.19 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 2rth h GLU 116 CO 0.62 0.02 -0.13 0.00 -0.73 0.00 0.00 179.01 178.79 2rth h ALA 117 N 1.75 0.44 -0.48 2.92 0.00 -2.06 -3.16 119.26 118.67 2rth h ALA 117 Ca 0.24 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2rth h ALA 117 Cb 0.93 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2rth h ALA 117 CO -0.01 0.31 0.00 0.09 0.00 0.00 0.00 179.25 179.64 2rth n ASN 118 N -4.41 4.09 -0.09 0.00 3.02 -0.74 -4.29 115.26 112.83 2rth n ASN 118 Ca -0.03 -2.48 -0.01 0.00 -0.03 0.00 0.00 54.58 52.03 2rth n ASN 118 Cb 0.36 -0.56 0.26 0.00 -0.61 0.00 0.00 39.78 39.23 2rth n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2rth h ALA 119 N 3.68 1.36 -0.87 5.41 0.00 -1.46 -2.46 119.26 124.93 2rth h ALA 119 Ca 0.00 -0.16 0.23 0.00 0.00 0.00 0.00 54.91 54.99 2rth h ALA 119 Cb 1.35 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 2rth h ALA 119 CO 0.26 0.47 0.61 0.11 0.00 0.00 0.00 179.25 180.70 2rth h TRP 120 N 0.73 0.17 -0.83 0.00 5.08 -1.82 -0.81 115.95 118.47 2rth h TRP 120 Ca 0.17 0.01 -0.58 0.00 1.08 0.00 0.00 58.89 59.57 2rth h TRP 120 Cb 0.19 -0.05 -0.35 0.00 -3.00 0.00 0.00 29.16 25.95 2rth h TRP 120 CO 0.01 0.04 -0.02 0.36 -1.28 0.00 0.00 178.44 177.55 2rth n LYS 121 N -4.36 3.07 0.11 0.12 2.85 -0.93 -4.72 118.16 114.31 2rth n LYS 121 Ca 0.18 -3.71 0.11 0.00 -1.05 0.00 0.00 58.31 53.84 2rth n LYS 121 Cb 0.85 -2.25 0.01 0.00 -0.65 0.00 0.00 35.03 32.99 2rth n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2rth h SER 122 N 2.00 0.00 -3.67 -5.58 4.64 -1.18 -3.47 113.55 106.29 2rth h SER 122 Ca 0.47 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 61.11 2rth h SER 122 Cb 1.26 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 63.09 2rth h SER 122 CO 1.09 0.03 -0.77 -0.89 -0.87 0.00 0.00 176.83 175.42 2rth s THR 123 N -3.33 3.00 0.07 2.95 2.01 -1.26 -1.21 115.64 117.86 2rth s THR 123 Ca 0.00 -0.71 0.04 0.00 0.31 0.00 0.00 61.69 61.33 2rth s THR 123 Cb 0.09 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.35 2rth s THR 123 CO 0.78 0.56 -0.00 -0.76 -0.69 0.00 0.00 174.62 174.50 2rth s LEU 124 N -0.16 3.46 0.05 4.42 1.43 -0.27 -4.92 118.68 122.68 2rth s LEU 124 Ca -0.01 -0.14 0.08 0.00 -1.03 0.00 0.00 54.13 53.03 2rth s LEU 124 Cb -0.13 -2.14 -0.03 0.00 0.03 0.00 0.00 46.19 43.92 2rth s LEU 124 CO 0.03 0.20 -0.22 0.54 0.23 0.00 0.00 176.35 177.13 2rth s VAL 125 N -1.24 1.82 0.14 -1.59 0.11 -1.26 -0.79 120.40 117.58 2rth s VAL 125 Ca 0.24 -1.27 -0.05 0.00 -2.93 0.00 0.00 61.98 57.97 2rth s VAL 125 Cb -0.12 -1.57 0.02 0.00 -1.53 0.00 0.00 36.38 33.18 2rth s VAL 125 CO 0.16 0.25 0.27 0.61 -3.33 0.00 0.00 175.10 173.06 2rth n GLY 126 N 1.80 1.72 3.17 6.54 0.00 -0.65 -4.99 105.19 112.78 2rth n GLY 126 Ca -0.17 -1.13 -0.13 0.00 0.00 0.00 0.00 46.02 44.60 2rth n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2rth s HIS 127 N -6.41 -0.33 0.09 1.61 -3.43 -1.26 -1.05 115.29 104.51 2rth s HIS 127 Ca 0.06 0.81 0.04 0.00 -0.80 0.00 0.00 55.06 55.17 2rth s HIS 127 Cb -0.02 0.11 -0.03 0.00 -1.43 0.00 0.00 32.58 31.21 2rth s HIS 127 CO 0.04 -0.17 -0.12 -0.51 -2.00 0.00 0.00 174.74 171.99 2rth s ASP 128 N 0.32 1.58 -0.07 7.38 1.01 -0.91 -4.97 116.67 121.01 2rth s ASP 128 Ca -0.01 -0.73 0.05 0.00 0.71 0.00 0.00 52.55 52.56 2rth s ASP 128 Cb -0.03 -0.02 -0.00 0.00 1.01 0.00 0.00 42.92 43.87 2rth s ASP 128 CO -0.01 -0.18 -0.21 -0.89 0.21 0.00 0.00 175.17 174.09 2rth s THR 129 N -1.93 1.80 -0.09 -1.27 2.01 -1.26 -1.35 115.64 113.55 2rth s THR 129 Ca 0.02 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 61.14 2rth s THR 129 Cb -0.06 -1.55 -0.02 0.00 0.01 0.00 0.00 72.50 70.88 2rth s THR 129 CO 0.01 0.51 -0.14 -0.36 -0.69 0.00 0.00 174.62 173.95 2rth s PHE 130 N 0.12 2.74 -0.09 4.92 0.08 -0.39 -3.24 117.98 122.12 2rth s PHE 130 Ca -0.09 -0.42 0.00 0.00 0.12 0.00 0.00 56.93 56.54 2rth s PHE 130 Cb -0.15 -1.73 -0.03 0.00 -0.57 0.00 0.00 43.02 40.54 2rth s PHE 130 CO 0.05 -0.03 -0.09 0.99 -0.10 0.00 0.00 175.22 176.04 2rth s THR 131 N -0.17 3.47 0.24 0.64 2.01 -0.18 -1.68 115.64 119.98 2rth s THR 131 Ca -0.00 -0.54 -0.11 0.00 0.31 0.00 0.00 61.69 61.35 2rth s THR 131 Cb -0.13 -2.44 -0.07 0.00 0.01 0.00 0.00 72.50 69.86 2rth s THR 131 CO 0.03 0.56 0.58 -0.75 -0.69 0.00 0.00 174.62 174.35 2rth s LYS 132 N -0.33 3.84 0.00 4.92 2.20 -1.19 -1.61 119.74 127.57 2rth s LYS 132 Ca 0.04 0.35 0.00 0.00 -0.36 0.00 0.00 55.97 56.00 2rth s LYS 132 Cb -0.13 -2.62 0.00 0.00 -1.51 0.00 0.00 37.83 33.57 2rth s LYS 132 CO 0.02 0.30 0.00 1.55 -0.36 0.00 0.00 175.35 176.86 2rth n VAL 133 N -0.14 0.00 -4.06 4.02 3.14 -0.29 -4.92 118.33 116.08 2rth n VAL 133 Ca 0.01 0.00 -0.22 0.00 -2.96 0.00 0.00 64.34 61.17 2rth n VAL 133 Cb 0.52 -0.98 -0.05 0.00 -1.06 0.00 0.00 33.84 32.27 2rth n VAL 133 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2rth s LYS 134 N -0.96 2.66 0.00 1.45 1.02 -1.22 -4.95 119.74 117.73 2rth s LYS 134 Ca 0.00 -1.28 0.31 0.00 0.02 0.00 0.00 55.97 55.02 2rth s LYS 134 Cb 0.00 -2.40 1.63 0.00 -0.52 0.00 0.00 37.83 36.55 2rth s LYS 134 CO 0.00 0.25 2.07 -0.35 -0.92 0.00 0.00 175.35 176.41