#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rte h GLU 14 N 0.00 0.08 -0.71 0.00 -0.00 -1.91 -0.94 114.58 111.11 2rte h GLU 14 Ca 0.00 -0.01 -0.02 0.00 -0.00 0.00 0.00 59.36 59.33 2rte h GLU 14 Cb 0.00 -0.02 -0.03 0.00 -0.00 0.00 0.00 28.75 28.70 2rte h GLU 14 CO 0.00 0.06 0.35 0.00 -0.00 0.00 0.00 179.01 179.42 2rte h ALA 15 N 1.30 1.28 -0.39 1.06 0.00 -1.93 0.40 119.26 120.99 2rte h ALA 15 Ca 0.16 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 2rte h ALA 15 Cb 0.23 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2rte h ALA 15 CO -0.28 0.56 -0.25 0.78 0.00 0.00 0.00 179.25 180.06 2rte h GLY 16 N 1.06 0.86 1.02 0.00 0.00 -1.86 -3.23 103.07 100.91 2rte h GLY 16 Ca 0.25 -0.75 -0.23 0.00 0.00 0.00 0.00 47.33 46.60 2rte h GLY 16 CO -0.03 0.69 -0.90 -2.22 0.00 0.00 0.00 176.54 174.07 2rte h ILE 17 N 0.68 1.35 -2.23 2.60 2.04 -0.69 -3.45 117.51 117.81 2rte h ILE 17 Ca 0.09 -2.25 -0.60 0.00 1.00 0.00 0.00 64.86 63.10 2rte h ILE 17 Cb 0.77 2.59 0.06 0.00 -0.74 0.00 0.00 36.82 39.50 2rte h ILE 17 CO 0.06 0.67 0.68 0.41 0.00 0.00 0.00 178.15 179.98 2rte n THR 18 N -4.00 0.20 -1.92 -0.27 -1.04 0.09 -4.81 114.28 102.53 2rte n THR 18 Ca -0.12 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 2rte n THR 18 Cb 0.82 -1.37 0.00 0.00 -1.82 0.00 0.00 70.33 67.96 2rte n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2rte n GLY 19 N 2.97 -0.02 3.53 3.41 0.00 -0.87 -4.95 105.19 109.26 2rte n GLY 19 Ca 0.16 -1.56 -0.34 0.00 0.00 0.00 0.00 46.02 44.28 2rte n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rte s THR 20 N -2.64 3.71 0.08 2.61 2.01 -1.26 -1.81 115.64 118.34 2rte s THR 20 Ca 0.00 -0.45 0.04 0.00 0.31 0.00 0.00 61.69 61.59 2rte s THR 20 Cb 0.00 -2.56 -0.03 0.00 0.01 0.00 0.00 72.50 69.92 2rte s THR 20 CO 0.00 0.56 -0.12 0.26 -0.69 0.00 0.00 174.62 174.63 2rte s TRP 21 N -0.29 1.09 0.07 4.92 0.52 0.25 -1.59 118.94 123.90 2rte s TRP 21 Ca 0.04 -0.55 0.03 0.00 0.02 0.00 0.00 56.10 55.65 2rte s TRP 21 Cb -0.13 -0.61 -0.03 0.00 -1.15 0.00 0.00 33.47 31.56 2rte s TRP 21 CO 0.02 0.02 -0.10 0.71 0.02 0.00 0.00 176.95 177.63 2rte s TYR 22 N -1.80 0.93 0.47 -1.98 2.02 -0.72 -1.45 117.35 114.82 2rte s TYR 22 Ca 0.00 -0.58 0.03 0.00 -0.37 0.00 0.00 57.07 56.16 2rte s TYR 22 Cb -0.07 -0.53 -0.04 0.00 -0.40 0.00 0.00 41.96 40.93 2rte s TYR 22 CO 0.01 -0.03 0.01 0.54 -1.57 0.00 0.00 175.55 174.51 2rte s ASN 23 N -2.03 4.00 0.47 2.29 2.20 -1.11 -0.19 114.94 120.57 2rte s ASN 23 Ca -0.01 -1.55 0.26 0.00 -0.94 0.00 0.00 52.86 50.61 2rte s ASN 23 Cb -0.06 0.19 1.41 0.00 -2.00 0.00 0.00 41.25 40.79 2rte s ASN 23 CO 0.00 -0.71 1.77 0.06 -2.94 0.00 0.00 177.10 175.28 2rte h GLN 24 N 1.51 0.00 0.00 3.55 -0.00 -1.92 -1.10 115.11 117.15 2rte h GLN 24 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.21 2rte h GLN 24 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.77 2rte h GLN 24 CO 0.76 0.00 -0.88 1.28 -0.00 0.00 0.00 178.83 179.99 2rte n LEU 25 N -2.51 0.68 0.00 0.06 4.77 -1.26 -4.95 117.00 113.79 2rte n LEU 25 Ca -0.02 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2rte n LEU 25 Cb 0.19 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2rte n LEU 25 CO 0.12 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.74 2rte n GLY 26 N 1.32 0.97 3.87 -0.72 0.00 -0.42 -4.78 105.19 105.42 2rte n GLY 26 Ca 0.02 -0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 2rte n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rte s SER 27 N -2.04 6.51 -0.10 1.61 0.01 -1.26 -4.58 113.70 113.84 2rte s SER 27 Ca 0.00 1.25 -0.01 0.00 1.31 0.00 0.00 55.95 58.50 2rte s SER 27 Cb 0.00 -2.37 -0.03 0.00 0.21 0.00 0.00 66.02 63.83 2rte s SER 27 CO 0.00 -0.49 -0.07 -0.89 0.41 0.00 0.00 173.24 172.20 2rte s THR 28 N -2.52 3.65 -0.16 1.44 2.01 0.33 -2.73 115.64 117.66 2rte s THR 28 Ca 0.53 -0.48 -0.01 0.00 0.31 0.00 0.00 61.69 62.04 2rte s THR 28 Cb -0.10 -2.53 0.04 0.00 0.01 0.00 0.00 72.50 69.92 2rte s THR 28 CO 0.34 0.56 -0.02 0.12 -0.69 0.00 0.00 174.62 174.92 2rte s PHE 29 N -0.31 1.44 -0.21 4.92 5.36 -0.53 -0.97 117.98 127.68 2rte s PHE 29 Ca 0.04 -0.94 -0.03 0.00 -0.96 0.00 0.00 56.93 55.05 2rte s PHE 29 Cb -0.13 -1.19 -0.00 0.00 -0.34 0.00 0.00 43.02 41.36 2rte s PHE 29 CO 0.02 -0.58 -0.08 0.42 -1.46 0.00 0.00 175.22 173.54 2rte s ILE 30 N 1.72 3.12 0.05 3.12 1.01 -0.84 -0.59 121.20 128.79 2rte s ILE 30 Ca 0.01 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 60.07 2rte s ILE 30 Cb -0.15 -2.40 -0.03 0.00 0.01 0.00 0.00 42.46 39.89 2rte s ILE 30 CO -0.07 0.45 -0.04 0.54 0.00 0.00 0.00 174.94 175.82 2rte s VAL 31 N 1.35 0.30 -0.06 2.92 0.11 -0.75 -2.10 120.40 122.17 2rte s VAL 31 Ca 0.04 -1.49 0.02 0.00 -2.93 0.00 0.00 61.98 57.63 2rte s VAL 31 Cb -0.14 -1.08 0.01 0.00 -1.53 0.00 0.00 36.38 33.64 2rte s VAL 31 CO -0.04 -0.77 -0.13 -0.89 -3.33 0.00 0.00 175.10 169.94 2rte s THR 32 N -2.88 1.20 -0.20 5.04 2.01 -0.23 -2.06 115.64 118.53 2rte s THR 32 Ca -0.01 -0.52 -0.06 0.00 0.31 0.00 0.00 61.69 61.41 2rte s THR 32 Cb 0.00 -1.09 -0.03 0.00 0.01 0.00 0.00 72.50 71.39 2rte s THR 32 CO -0.05 0.37 0.03 0.00 -0.69 0.00 0.00 174.62 174.28 2rte s ALA 33 N 0.59 3.19 0.33 7.40 0.00 -1.26 -1.71 121.76 130.30 2rte s ALA 33 Ca -0.14 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 50.95 2rte s ALA 33 Cb -0.15 -1.85 -0.02 0.00 0.00 0.00 0.00 23.12 21.09 2rte s ALA 33 CO 0.04 -0.03 0.49 0.20 0.00 0.00 0.00 175.76 176.46 2rte s GLY 34 N 0.78 1.38 0.55 0.00 0.00 0.83 -4.80 107.32 106.06 2rte s GLY 34 Ca 0.02 -1.14 0.27 0.00 0.00 0.00 0.00 44.72 43.87 2rte s GLY 34 CO 0.02 -1.08 1.99 0.00 0.00 0.00 0.00 173.10 174.03 2rte h ALA 35 N 0.85 2.34 -0.18 3.20 0.00 -1.99 -2.20 119.26 121.29 2rte h ALA 35 Ca -0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2rte h ALA 35 Cb 1.24 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2rte h ALA 35 CO 0.59 -0.63 0.00 -0.40 0.00 0.00 0.00 179.25 178.81 2rte n ASP 36 N -4.14 0.99 0.00 0.00 5.68 -1.26 -4.86 116.55 112.96 2rte n ASP 36 Ca 0.09 -1.97 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 2rte n ASP 36 Cb 0.59 -0.12 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 2rte n ASP 36 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rte n GLY 37 N 0.81 0.79 3.88 6.12 0.00 -0.83 -4.99 105.19 110.96 2rte n GLY 37 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 2rte n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rte s ALA 38 N -2.19 3.46 -0.05 4.61 0.00 -1.23 -1.05 121.76 125.31 2rte s ALA 38 Ca 0.00 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.71 2rte s ALA 38 Cb 0.00 -2.56 0.02 0.00 0.00 0.00 0.00 23.12 20.58 2rte s ALA 38 CO 0.00 0.22 -0.08 -0.51 0.00 0.00 0.00 175.76 175.39 2rte s LEU 39 N -3.41 1.45 0.02 0.00 1.43 -0.77 -0.12 118.68 117.28 2rte s LEU 39 Ca 0.49 -0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 53.38 2rte s LEU 39 Cb -0.11 -0.61 -0.02 0.00 0.03 0.00 0.00 46.19 45.48 2rte s LEU 39 CO 0.26 -0.02 -0.00 0.28 0.23 0.00 0.00 176.35 177.10 2rte s THR 40 N 0.83 0.13 -2.84 5.49 -1.32 -0.69 -1.62 115.64 115.61 2rte s THR 40 Ca -0.12 -1.04 0.00 0.00 -1.21 0.00 0.00 61.69 59.32 2rte s THR 40 Cb -0.15 -0.52 0.00 0.00 -1.51 0.00 0.00 72.50 70.32 2rte s THR 40 CO 0.01 -0.57 0.00 0.61 -2.21 0.00 0.00 174.62 172.46 2rte n GLY 41 N 1.29 -0.55 3.15 6.08 0.00 -0.87 -1.07 105.19 113.20 2rte n GLY 41 Ca -0.22 -0.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.88 2rte n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rte s THR 42 N -3.30 0.78 0.01 2.61 -4.23 -0.89 -1.25 115.64 109.36 2rte s THR 42 Ca 0.00 -1.61 0.02 0.00 -1.18 0.00 0.00 61.69 58.92 2rte s THR 42 Cb 0.00 -1.30 -0.01 0.00 1.34 0.00 0.00 72.50 72.54 2rte s THR 42 CO 0.00 -0.62 -0.06 -0.47 -0.54 0.00 0.00 174.62 172.93 2rte s TYR 43 N -2.57 0.57 -0.10 3.99 6.14 0.19 -1.98 117.35 123.59 2rte s TYR 43 Ca 0.04 -0.18 0.01 0.00 0.64 0.00 0.00 57.07 57.58 2rte s TYR 43 Cb -0.02 -0.36 0.02 0.00 0.42 0.00 0.00 41.96 42.02 2rte s TYR 43 CO -0.01 -0.02 -0.10 -2.00 0.64 0.00 0.00 175.55 174.05 2rte s GLU 44 N -0.43 1.69 -0.09 4.97 2.12 -0.14 -1.67 118.70 125.15 2rte s GLU 44 Ca 0.00 -0.36 -0.03 0.00 0.36 0.00 0.00 54.97 54.94 2rte s GLU 44 Cb -0.04 -1.56 -0.04 0.00 0.26 0.00 0.00 34.13 32.75 2rte s GLU 44 CO -0.00 -0.13 0.06 0.45 -0.54 0.00 0.00 175.26 175.09 2rte s SER 45 N 1.21 5.66 0.19 -1.70 0.15 -1.26 -0.52 113.70 117.44 2rte s SER 45 Ca -0.04 0.25 0.25 0.00 0.70 0.00 0.00 55.95 57.11 2rte s SER 45 Cb -0.14 -1.68 0.57 0.00 -1.71 0.00 0.00 66.02 63.05 2rte s SER 45 CO -0.03 0.38 1.56 0.00 1.20 0.00 0.00 173.24 176.35 2rte h ALA 46 N 4.97 0.82 -2.25 5.45 0.00 -1.86 -3.46 119.26 122.93 2rte h ALA 46 Ca -0.52 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.05 2rte h ALA 46 Cb 1.20 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.85 2rte h ALA 46 CO 0.56 0.00 -0.65 0.14 0.00 0.00 0.00 179.25 179.30 2rte s VAL 47 N -3.14 0.83 0.00 0.00 -7.23 -1.26 -5.03 120.40 104.56 2rte s VAL 47 Ca 0.08 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 2rte s VAL 47 Cb 0.12 -2.33 0.00 0.00 0.56 0.00 0.00 36.38 34.73 2rte s VAL 47 CO 0.66 -0.31 0.00 0.61 -0.31 0.00 0.00 175.10 175.75 2rte n GLY 48 N -0.37 -2.90 3.19 2.32 0.00 -1.26 -4.58 105.19 101.59 2rte n GLY 48 Ca -0.05 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.67 2rte n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rte n ASN 49 N -0.07 4.96 -3.72 1.61 5.15 -1.26 -4.87 115.26 117.06 2rte n ASN 49 Ca 0.00 -3.00 -0.13 0.00 -0.60 0.00 0.00 54.58 50.85 2rte n ASN 49 Cb 0.00 -1.58 -0.08 0.00 -0.53 0.00 0.00 39.78 37.60 2rte n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2rte s ALA 50 N 1.79 -0.88 -0.27 5.20 0.00 -1.26 -4.64 121.76 121.69 2rte s ALA 50 Ca 0.44 0.31 -0.21 0.00 0.00 0.00 0.00 51.96 52.50 2rte s ALA 50 Cb 0.05 0.20 0.07 0.00 0.00 0.00 0.00 23.12 23.44 2rte s ALA 50 CO 0.00 -0.35 0.70 -1.83 0.00 0.00 0.00 175.76 174.28 2rte s GLU 51 N -1.90 0.78 1.80 0.00 -1.05 -1.26 -4.99 118.70 112.08 2rte s GLU 51 Ca -0.09 1.07 0.00 0.00 -0.15 0.00 0.00 54.97 55.80 2rte s GLU 51 Cb -0.03 0.30 0.00 0.00 -0.44 0.00 0.00 34.13 33.96 2rte s GLU 51 CO 0.01 -0.12 0.00 0.45 0.95 0.00 0.00 175.26 176.55 2rte n SER 52 N 3.33 -0.81 -4.94 0.83 2.88 -1.26 -4.78 113.62 108.87 2rte n SER 52 Ca -0.16 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.12 2rte n SER 52 Cb 0.57 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.00 2rte n SER 52 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2rte s ARG 53 N 0.00 3.48 0.04 -1.46 0.52 -1.26 -4.60 118.95 115.67 2rte s ARG 53 Ca 0.00 -0.49 0.05 0.00 -0.52 0.00 0.00 55.73 54.76 2rte s ARG 53 Cb 0.00 -2.86 -0.02 0.00 0.52 0.00 0.00 34.95 32.59 2rte s ARG 53 CO 0.00 0.40 -0.14 0.71 0.02 0.00 0.00 175.30 176.30 2rte s TYR 54 N -1.92 1.20 0.42 -0.53 1.51 -0.67 -4.89 117.35 112.46 2rte s TYR 54 Ca 0.37 -0.36 -0.23 0.00 -1.01 0.00 0.00 57.07 55.84 2rte s TYR 54 Cb -0.10 -0.71 -0.09 0.00 -0.11 0.00 0.00 41.96 40.94 2rte s TYR 54 CO 0.30 0.03 1.01 0.08 -1.11 0.00 0.00 175.55 175.85 2rte s VAL 55 N -0.88 3.98 0.03 0.71 1.01 -1.26 -0.64 120.40 123.35 2rte s VAL 55 Ca 0.01 1.38 0.01 0.00 0.00 0.00 0.00 61.98 63.39 2rte s VAL 55 Cb -0.08 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 2rte s VAL 55 CO 0.01 -0.12 -0.06 -1.48 0.00 0.00 0.00 175.10 173.46 2rte s LEU 56 N -2.91 2.23 0.01 3.92 0.05 -0.38 -4.47 118.68 117.12 2rte s LEU 56 Ca 0.60 -0.49 -0.01 0.00 0.05 0.00 0.00 54.13 54.28 2rte s LEU 56 Cb -0.17 -0.06 -0.01 0.00 -2.05 0.00 0.00 46.19 43.90 2rte s LEU 56 CO 0.21 -0.22 0.00 0.28 -0.55 0.00 0.00 176.35 176.07 2rte s THR 57 N -1.30 0.09 0.01 5.48 -1.32 -1.13 -2.06 115.64 115.41 2rte s THR 57 Ca -0.11 -0.76 -0.01 0.00 -1.21 0.00 0.00 61.69 59.60 2rte s THR 57 Cb -0.09 -0.26 0.00 0.00 -1.51 0.00 0.00 72.50 70.64 2rte s THR 57 CO -0.00 -0.42 0.03 0.61 -2.21 0.00 0.00 174.62 172.63 2rte n GLY 58 N 1.77 1.33 3.14 6.08 0.00 -0.64 -1.44 105.19 115.42 2rte n GLY 58 Ca -0.22 -0.93 -0.08 0.00 0.00 0.00 0.00 46.02 44.78 2rte n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rte s ARG 59 N -2.00 0.69 0.21 1.61 1.81 -0.76 -1.85 118.95 118.65 2rte s ARG 59 Ca 0.01 -0.97 -0.02 0.00 -1.72 0.00 0.00 55.73 53.02 2rte s ARG 59 Cb -0.00 0.27 -0.04 0.00 -0.45 0.00 0.00 34.95 34.73 2rte s ARG 59 CO 0.00 -0.18 0.17 1.52 -0.68 0.00 0.00 175.30 176.14 2rte s TYR 60 N -3.48 1.06 -0.50 -0.53 1.13 -0.22 -2.23 117.35 112.58 2rte s TYR 60 Ca 0.02 -1.30 -0.21 0.00 -1.41 0.00 0.00 57.07 54.18 2rte s TYR 60 Cb 0.04 -0.46 0.04 0.00 -1.10 0.00 0.00 41.96 40.48 2rte s TYR 60 CO -0.09 -0.69 0.73 0.34 -2.51 0.00 0.00 175.55 173.34 2rte s ASP 61 N -3.14 6.29 0.41 -0.18 3.68 -0.96 -4.71 116.67 118.05 2rte s ASP 61 Ca 0.37 -0.60 0.16 0.00 2.13 0.00 0.00 52.55 54.61 2rte s ASP 61 Cb 0.06 -2.34 0.87 0.00 -1.45 0.00 0.00 42.92 40.05 2rte s ASP 61 CO 0.12 -0.97 1.88 0.77 0.13 0.00 0.00 175.17 177.10 2rte h SER 62 N 9.06 0.00 -3.67 -0.34 4.64 -1.92 -3.29 113.55 118.05 2rte h SER 62 Ca -0.27 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.40 2rte h SER 62 Cb 1.09 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.79 2rte h SER 62 CO 0.99 0.30 -0.44 0.00 -0.87 0.00 0.00 176.83 176.81 2rte s ALA 63 N -4.22 3.75 0.92 5.18 0.00 -1.26 -4.91 121.76 121.22 2rte s ALA 63 Ca -0.03 -3.60 0.00 0.00 0.00 0.00 0.00 51.96 48.33 2rte s ALA 63 Cb 0.14 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.86 2rte s ALA 63 CO 0.70 -2.09 0.00 -0.35 0.00 0.00 0.00 175.76 174.01 2rte n PRO 64 N 2.60 1.18 -4.28 0.00 -0.04 -1.24 -5.04 135.00 128.17 2rte n PRO 64 Ca 0.14 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.29 2rte n PRO 64 Cb 0.35 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.72 2rte n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rte s ALA 65 N -2.08 3.18 -1.33 0.55 0.00 -1.26 -5.02 121.76 115.80 2rte s ALA 65 Ca 0.00 -1.05 -0.16 0.00 0.00 0.00 0.00 51.96 50.75 2rte s ALA 65 Cb 0.00 -1.19 0.08 0.00 0.00 0.00 0.00 23.12 22.01 2rte s ALA 65 CO 0.00 0.65 1.83 0.25 0.00 0.00 0.00 175.76 178.50 2rte n THR 66 N 1.13 3.89 -2.95 0.00 -2.24 -1.26 -4.69 114.28 108.16 2rte n THR 66 Ca -0.14 -3.94 0.00 0.00 -2.27 0.00 0.00 64.05 57.71 2rte n THR 66 Cb 0.52 -2.43 0.00 0.00 -2.10 0.00 0.00 70.33 66.32 2rte n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2rte n ASP 67 N 7.08 0.00 -3.43 3.42 5.68 -1.26 -5.01 116.55 123.03 2rte n ASP 67 Ca 0.47 -0.91 -0.39 0.00 -0.50 0.00 0.00 54.79 53.46 2rte n ASP 67 Cb 0.43 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.41 2rte n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rte n GLY 68 N 0.00 5.55 3.71 6.12 0.00 -1.26 -4.90 105.19 114.41 2rte n GLY 68 Ca 0.00 -2.28 -0.23 0.00 0.00 0.00 0.00 46.02 43.51 2rte n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rte s SER 69 N -0.42 4.74 0.51 1.61 0.01 -1.26 -5.13 113.70 113.77 2rte s SER 69 Ca 0.48 -0.64 0.02 0.00 1.31 0.00 0.00 55.95 57.12 2rte s SER 69 Cb 0.22 -0.88 0.02 0.00 0.21 0.00 0.00 66.02 65.60 2rte s SER 69 CO -0.14 -0.13 0.72 -0.83 0.41 0.00 0.00 173.24 173.28 2rte s GLY 70 N -3.77 1.80 -0.26 3.44 0.00 -1.26 -4.92 107.32 102.35 2rte s GLY 70 Ca 0.34 -1.34 -0.11 0.00 0.00 0.00 0.00 44.72 43.61 2rte s GLY 70 CO 0.22 -1.09 0.19 -1.59 0.00 0.00 0.00 173.10 170.83 2rte s THR 71 N -2.66 5.32 0.39 0.90 2.01 -0.15 -4.78 115.64 116.66 2rte s THR 71 Ca 0.55 0.21 -0.22 0.00 0.31 0.00 0.00 61.69 62.55 2rte s THR 71 Cb -0.10 -3.53 -0.11 0.00 0.01 0.00 0.00 72.50 68.77 2rte s THR 71 CO 0.37 0.28 0.94 0.00 -0.69 0.00 0.00 174.62 175.52 2rte s ALA 72 N 1.47 3.11 0.31 7.40 0.00 -1.26 -0.47 121.76 132.32 2rte s ALA 72 Ca 0.08 0.42 -0.19 0.00 0.00 0.00 0.00 51.96 52.27 2rte s ALA 72 Cb -0.15 -3.14 0.03 0.00 0.00 0.00 0.00 23.12 19.86 2rte s ALA 72 CO 0.08 0.16 0.73 -0.48 0.00 0.00 0.00 175.76 176.25 2rte s LEU 73 N -2.78 -0.17 0.01 0.00 2.34 -0.80 -2.27 118.68 115.00 2rte s LEU 73 Ca 0.58 -0.76 -0.28 0.00 0.06 0.00 0.00 54.13 53.73 2rte s LEU 73 Cb -0.12 2.73 0.09 0.00 -0.56 0.00 0.00 46.19 48.32 2rte s LEU 73 CO 0.17 -1.43 0.78 -0.83 -1.06 0.00 0.00 176.35 173.98 2rte s GLY 74 N -2.96 -0.50 0.15 -3.48 0.00 -0.95 -1.96 107.32 97.62 2rte s GLY 74 Ca 0.13 1.10 -0.19 0.00 0.00 0.00 0.00 44.72 45.76 2rte s GLY 74 CO 0.08 0.54 0.49 0.66 0.00 0.00 0.00 173.10 174.87 2rte s TRP 75 N -2.55 -0.32 0.06 1.90 -2.14 -0.96 -1.82 118.94 113.11 2rte s TRP 75 Ca -0.01 0.03 0.06 0.00 2.66 0.00 0.00 56.10 58.85 2rte s TRP 75 Cb -0.01 0.39 -0.03 0.00 -3.10 0.00 0.00 33.47 30.72 2rte s TRP 75 CO -0.04 -0.78 -0.18 0.99 -2.66 0.00 0.00 176.95 174.28 2rte s THR 76 N -3.79 1.41 -0.05 0.66 2.01 -0.52 -1.52 115.64 113.84 2rte s THR 76 Ca 0.03 -1.23 0.00 0.00 0.31 0.00 0.00 61.69 60.80 2rte s THR 76 Cb 0.00 -1.28 0.02 0.00 0.01 0.00 0.00 72.50 71.26 2rte s THR 76 CO -0.11 0.01 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.11 2rte s VAL 77 N -0.97 0.44 -0.20 3.82 1.01 -1.01 -2.84 120.40 120.64 2rte s VAL 77 Ca 0.04 -0.03 -0.07 0.00 0.00 0.00 0.00 61.98 61.92 2rte s VAL 77 Cb -0.09 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 2rte s VAL 77 CO 0.02 0.22 0.06 0.00 0.00 0.00 0.00 175.10 175.40 2rte s ALA 78 N 1.19 3.32 -1.51 5.51 0.00 -1.26 -1.41 121.76 127.60 2rte s ALA 78 Ca -0.07 -0.86 -0.09 0.00 0.00 0.00 0.00 51.96 50.94 2rte s ALA 78 Cb -0.14 -1.96 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 2rte s ALA 78 CO -0.02 -0.01 2.83 0.91 0.00 0.00 0.00 175.76 179.48 2rte n TRP 79 N 3.94 2.41 -4.16 0.00 7.02 -0.37 -4.82 117.44 121.45 2rte n TRP 79 Ca -0.16 -2.99 -0.18 0.00 -1.02 0.00 0.00 57.50 53.14 2rte n TRP 79 Cb 0.52 -2.30 -0.16 0.00 -2.42 0.00 0.00 31.31 26.95 2rte n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 2rte s LYS 80 N 1.27 0.67 0.00 -0.99 2.20 -1.26 -1.36 119.74 120.27 2rte s LYS 80 Ca 0.66 -0.13 0.00 0.00 -0.36 0.00 0.00 55.97 56.14 2rte s LYS 80 Cb 0.19 -0.69 0.00 0.00 -1.51 0.00 0.00 37.83 35.82 2rte s LYS 80 CO -0.07 -0.01 0.00 0.27 -0.36 0.00 0.00 175.35 175.18 2rte n ASN 81 N 3.68 0.00 0.05 1.43 0.23 -0.26 -4.85 115.26 115.53 2rte n ASN 81 Ca -0.22 -0.87 0.09 0.00 -0.53 0.00 0.00 54.58 53.05 2rte n ASN 81 Cb 0.53 0.00 0.40 0.00 -2.08 0.00 0.00 39.78 38.63 2rte n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2rte n ASN 82 N -1.66 0.27 -0.09 0.53 5.03 -1.26 -3.66 115.26 114.41 2rte n ASN 82 Ca 0.00 0.56 -0.13 0.00 0.87 0.00 0.00 54.58 55.88 2rte n ASN 82 Cb 0.00 -0.62 -0.09 0.00 -1.02 0.00 0.00 39.78 38.05 2rte n ASN 82 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2rte n TYR 83 N -1.79 0.00 -4.11 3.10 4.01 -1.26 -5.06 117.16 112.05 2rte n TYR 83 Ca 0.03 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.68 2rte n TYR 83 Cb 0.21 -0.73 -0.10 0.00 -0.31 0.00 0.00 39.34 38.41 2rte n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2rte s ARG 84 N -2.38 0.66 -0.24 -0.72 0.52 -1.24 -5.08 118.95 110.47 2rte s ARG 84 Ca -0.25 -1.12 -0.03 0.00 -0.52 0.00 0.00 55.73 53.81 2rte s ARG 84 Cb 0.06 -0.06 0.08 0.00 0.52 0.00 0.00 34.95 35.56 2rte s ARG 84 CO 0.45 -0.04 0.09 1.21 0.02 0.00 0.00 175.30 177.03 2rte s ASN 85 N -2.58 3.13 0.00 0.23 3.84 -1.26 -1.10 114.94 117.19 2rte s ASN 85 Ca 0.04 -1.04 0.23 0.00 0.21 0.00 0.00 52.86 52.30 2rte s ASN 85 Cb 0.02 -0.47 0.21 0.00 -0.55 0.00 0.00 41.25 40.46 2rte s ASN 85 CO -0.05 -0.38 1.21 0.00 -2.79 0.00 0.00 177.10 175.10 2rte n ALA 86 N 5.14 3.93 -3.44 1.71 0.00 -0.46 -4.98 120.51 122.40 2rte n ALA 86 Ca -0.06 -0.48 -0.18 0.00 0.00 0.00 0.00 53.44 52.72 2rte n ALA 86 Cb 0.45 -0.96 0.08 0.00 0.00 0.00 0.00 19.45 19.02 2rte n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2rte n HIS 87 N -1.22 -2.20 -3.90 0.00 -0.00 -1.26 -4.89 115.22 101.75 2rte n HIS 87 Ca 0.06 0.90 -0.09 0.00 -0.00 0.00 0.00 57.72 58.59 2rte n HIS 87 Cb 0.35 -4.76 -0.05 0.00 -0.00 0.00 0.00 29.99 25.53 2rte n HIS 87 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 2rte s SER 88 N -4.15 -0.11 -0.12 0.41 0.01 -1.26 -1.45 113.70 107.02 2rte s SER 88 Ca 0.10 -0.76 -0.14 0.00 1.31 0.00 0.00 55.95 56.46 2rte s SER 88 Cb -0.02 0.55 0.04 0.00 0.21 0.00 0.00 66.02 66.80 2rte s SER 88 CO 0.75 -1.05 0.39 0.00 0.41 0.00 0.00 173.24 173.73 2rte s ALA 89 N -3.96 -0.97 0.03 1.44 0.00 -0.71 -1.24 121.76 116.35 2rte s ALA 89 Ca 0.16 0.98 0.09 0.00 0.00 0.00 0.00 51.96 53.19 2rte s ALA 89 Cb 0.00 -0.50 -0.03 0.00 0.00 0.00 0.00 23.12 22.59 2rte s ALA 89 CO 0.03 -0.21 -0.25 0.99 0.00 0.00 0.00 175.76 176.32 2rte s THR 90 N -0.10 2.03 -0.00 0.00 2.01 -0.50 -1.42 115.64 117.65 2rte s THR 90 Ca -0.03 -1.27 0.06 0.00 0.31 0.00 0.00 61.69 60.76 2rte s THR 90 Cb -0.03 -1.72 -0.02 0.00 0.01 0.00 0.00 72.50 70.74 2rte s THR 90 CO 0.01 0.40 -0.19 0.42 -0.69 0.00 0.00 174.62 174.58 2rte s THR 91 N -0.74 1.51 -0.10 -0.82 -4.23 -0.29 -2.41 115.64 108.57 2rte s THR 91 Ca 0.11 -0.88 0.03 0.00 -1.18 0.00 0.00 61.69 59.77 2rte s THR 91 Cb -0.10 -1.27 -0.01 0.00 1.34 0.00 0.00 72.50 72.46 2rte s THR 91 CO 0.01 0.38 -0.18 0.26 -0.54 0.00 0.00 174.62 174.55 2rte s TRP 92 N -0.51 2.67 -0.06 3.99 0.51 -0.58 -1.72 118.94 123.24 2rte s TRP 92 Ca 0.07 -0.69 0.04 0.00 -2.12 0.00 0.00 56.10 53.40 2rte s TRP 92 Cb -0.08 -1.74 0.00 0.00 -0.81 0.00 0.00 33.47 30.85 2rte s TRP 92 CO -0.00 -0.21 -0.17 0.45 -0.51 0.00 0.00 176.95 176.51 2rte s SER 93 N 0.11 2.23 0.00 2.95 0.15 -0.36 -2.27 113.70 116.50 2rte s SER 93 Ca -0.09 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.19 2rte s SER 93 Cb -0.15 -0.78 0.00 0.00 -1.71 0.00 0.00 66.02 63.37 2rte s SER 93 CO 0.05 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.23 2rte n GLY 94 N 3.36 1.28 3.01 9.45 0.00 -0.83 -1.83 105.19 119.63 2rte n GLY 94 Ca -0.19 -0.61 -0.11 0.00 0.00 0.00 0.00 46.02 45.11 2rte n GLY 94 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rte s GLN 95 N 1.07 0.39 -0.18 1.61 -0.21 -0.62 -1.91 119.66 119.81 2rte s GLN 95 Ca 0.00 -0.65 -0.08 0.00 0.02 0.00 0.00 55.36 54.65 2rte s GLN 95 Cb 0.00 -0.05 -0.04 0.00 1.00 0.00 0.00 33.01 33.91 2rte s GLN 95 CO 0.00 -0.01 0.09 -0.47 -2.12 0.00 0.00 175.29 172.78 2rte s TYR 96 N -1.39 3.32 -0.21 0.91 5.04 0.38 -1.52 117.35 123.89 2rte s TYR 96 Ca -0.13 0.19 0.01 0.00 -2.44 0.00 0.00 57.07 54.70 2rte s TYR 96 Cb -0.10 -2.09 0.05 0.00 0.35 0.00 0.00 41.96 40.16 2rte s TYR 96 CO -0.00 0.24 -0.10 0.08 -1.34 0.00 0.00 175.55 174.42 2rte s VAL 97 N 0.27 1.69 0.34 3.14 1.01 -0.31 -0.98 120.40 125.57 2rte s VAL 97 Ca 0.06 -1.10 -0.00 0.00 0.00 0.00 0.00 61.98 60.93 2rte s VAL 97 Cb -0.12 -1.79 0.07 0.00 0.00 0.00 0.00 36.38 34.54 2rte s VAL 97 CO -0.00 0.13 0.47 0.61 0.00 0.00 0.00 175.10 176.30 2rte n GLY 98 N 4.65 0.63 0.00 4.51 0.00 -1.26 -0.97 105.19 112.75 2rte n GLY 98 Ca -0.14 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 43.90 2rte n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rte n GLY 99 N 1.41 0.81 0.15 -0.02 0.00 -1.26 -4.72 105.19 101.56 2rte n GLY 99 Ca 0.08 -1.88 -0.13 0.00 0.00 0.00 0.00 46.02 44.09 2rte n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rte h ALA 100 N 0.00 0.38 -3.30 4.61 0.00 -2.06 -3.36 119.26 115.53 2rte h ALA 100 Ca 0.00 -0.71 -0.66 0.00 0.00 0.00 0.00 54.91 53.54 2rte h ALA 100 Cb 0.00 -0.02 -0.39 0.00 0.00 0.00 0.00 17.79 17.38 2rte h ALA 100 CO 0.00 0.83 -0.53 -1.21 0.00 0.00 0.00 179.25 178.34 2rte s GLU 101 N -3.26 2.21 0.22 0.00 2.02 -1.26 -5.07 118.70 113.56 2rte s GLU 101 Ca -0.05 -2.61 -0.24 0.00 0.02 0.00 0.00 54.97 52.08 2rte s GLU 101 Cb 0.09 -3.47 -0.09 0.00 0.10 0.00 0.00 34.13 30.76 2rte s GLU 101 CO 0.86 -1.14 0.81 0.00 0.02 0.00 0.00 175.26 175.82 2rte s ALA 102 N -0.24 3.38 0.06 5.21 0.00 -1.26 -4.87 121.76 124.04 2rte s ALA 102 Ca 0.17 0.37 -0.00 0.00 0.00 0.00 0.00 51.96 52.50 2rte s ALA 102 Cb -0.24 -2.99 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 2rte s ALA 102 CO -0.01 0.27 -0.04 1.03 0.00 0.00 0.00 175.76 177.01 2rte s ARG 103 N -1.56 0.64 -0.15 0.00 1.81 -0.14 -3.42 118.95 116.14 2rte s ARG 103 Ca 0.41 -1.17 -0.00 0.00 -1.72 0.00 0.00 55.73 53.24 2rte s ARG 103 Cb -0.21 0.07 0.03 0.00 -0.45 0.00 0.00 34.95 34.40 2rte s ARG 103 CO 0.25 -0.07 -0.07 0.42 -0.68 0.00 0.00 175.30 175.15 2rte s ILE 104 N -3.50 1.12 -0.19 1.52 1.01 -1.01 -1.16 121.20 118.99 2rte s ILE 104 Ca 0.05 -0.52 -0.07 0.00 0.00 0.00 0.00 60.65 60.12 2rte s ILE 104 Cb 0.05 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 2rte s ILE 104 CO -0.07 0.24 0.06 0.20 0.00 0.00 0.00 174.94 175.36 2rte s ASN 105 N 1.65 5.45 0.18 3.58 0.01 -0.57 -1.19 114.94 124.04 2rte s ASN 105 Ca 0.02 0.00 -0.01 0.00 -0.71 0.00 0.00 52.86 52.17 2rte s ASN 105 Cb -0.14 -1.94 -0.04 0.00 0.41 0.00 0.00 41.25 39.54 2rte s ASN 105 CO -0.08 0.13 0.09 0.42 -1.51 0.00 0.00 177.10 176.15 2rte s THR 106 N 0.64 0.12 0.01 1.60 -4.23 -0.38 -1.59 115.64 111.82 2rte s THR 106 Ca 0.03 -1.97 0.03 0.00 -1.18 0.00 0.00 61.69 58.60 2rte s THR 106 Cb -0.13 -2.33 -0.01 0.00 1.34 0.00 0.00 72.50 71.37 2rte s THR 106 CO 0.02 -0.20 -0.10 -1.10 -0.54 0.00 0.00 174.62 172.70 2rte s GLN 107 N -4.10 0.76 0.10 3.99 -0.21 -0.76 -1.85 119.66 117.59 2rte s GLN 107 Ca 0.33 -0.51 0.03 0.00 0.02 0.00 0.00 55.36 55.22 2rte s GLN 107 Cb 0.07 -0.71 -0.04 0.00 1.00 0.00 0.00 33.01 33.33 2rte s GLN 107 CO 0.08 0.18 -0.08 1.67 -2.12 0.00 0.00 175.29 175.03 2rte s TRP 108 N -0.57 0.97 -0.10 0.91 1.48 -0.09 -1.22 118.94 120.32 2rte s TRP 108 Ca 0.01 -0.82 0.02 0.00 -1.06 0.00 0.00 56.10 54.24 2rte s TRP 108 Cb -0.06 -0.54 0.02 0.00 -1.16 0.00 0.00 33.47 31.73 2rte s TRP 108 CO 0.00 -0.08 -0.13 -0.51 -4.06 0.00 0.00 176.95 172.17 2rte s LEU 109 N -2.89 1.63 -0.32 -4.66 1.43 -0.70 -2.10 118.68 111.06 2rte s LEU 109 Ca 0.10 -0.38 -0.01 0.00 -1.03 0.00 0.00 54.13 52.82 2rte s LEU 109 Cb 0.03 -0.99 0.07 0.00 0.03 0.00 0.00 46.19 45.33 2rte s LEU 109 CO -0.03 0.00 0.04 -0.22 0.23 0.00 0.00 176.35 176.37 2rte s LEU 110 N 1.00 4.26 -0.16 1.79 0.20 -0.52 -1.13 118.68 124.12 2rte s LEU 110 Ca -0.07 -1.58 -0.06 0.00 0.69 0.00 0.00 54.13 53.11 2rte s LEU 110 Cb -0.15 -1.71 -0.04 0.00 -0.43 0.00 0.00 46.19 43.87 2rte s LEU 110 CO -0.01 -0.33 0.06 -0.89 -0.29 0.00 0.00 176.35 174.89 2rte s THR 111 N 1.16 4.76 0.05 3.68 2.01 -0.51 -1.47 115.64 125.32 2rte s THR 111 Ca -0.01 -0.05 0.02 0.00 0.31 0.00 0.00 61.69 61.96 2rte s THR 111 Cb -0.20 -3.11 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 2rte s THR 111 CO -0.03 0.51 0.07 -0.44 -0.69 0.00 0.00 174.62 174.03 2rte s SER 112 N -0.04 5.49 0.13 3.53 0.01 -0.54 -1.74 113.70 120.55 2rte s SER 112 Ca 0.06 0.03 -0.30 0.00 1.31 0.00 0.00 55.95 57.05 2rte s SER 112 Cb -0.12 -1.49 -0.07 0.00 0.21 0.00 0.00 66.02 64.55 2rte s SER 112 CO 0.01 0.22 1.12 -0.83 0.41 0.00 0.00 173.24 174.16 2rte s GLY 113 N -2.09 2.74 0.36 3.44 0.00 -0.53 -4.85 107.32 106.40 2rte s GLY 113 Ca 0.26 0.80 0.06 0.00 0.00 0.00 0.00 44.72 45.84 2rte s GLY 113 CO 0.18 1.76 0.21 -1.30 0.00 0.00 0.00 173.10 173.94 2rte n THR 114 N 2.88 0.00 -2.26 0.90 -2.24 -1.26 -5.05 114.28 107.26 2rte n THR 114 Ca 0.05 -2.34 -0.26 0.00 -2.27 0.00 0.00 64.05 59.23 2rte n THR 114 Cb 0.47 1.00 0.05 0.00 -2.10 0.00 0.00 70.33 69.75 2rte n THR 114 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2rte s THR 115 N -3.18 2.84 0.27 4.28 -4.23 -1.26 -4.91 115.64 109.45 2rte s THR 115 Ca 0.29 -0.13 -0.02 0.00 -1.18 0.00 0.00 61.69 60.65 2rte s THR 115 Cb 0.01 -3.19 0.16 0.00 1.34 0.00 0.00 72.50 70.82 2rte s THR 115 CO 0.21 -0.20 1.82 -0.08 -0.54 0.00 0.00 174.62 175.82 2rte h GLU 116 N -0.44 0.90 -0.98 3.99 4.81 -2.01 -2.72 114.58 118.13 2rte h GLU 116 Ca -0.45 -0.18 0.05 0.00 -0.13 0.00 0.00 59.36 58.66 2rte h GLU 116 Cb 1.29 -0.14 -0.06 0.00 0.63 0.00 0.00 28.75 30.47 2rte h GLU 116 CO 0.61 0.79 0.64 0.00 -0.73 0.00 0.00 179.01 180.31 2rte h ALA 117 N 1.32 1.40 -0.54 2.92 0.00 -2.06 -2.80 119.26 119.50 2rte h ALA 117 Ca 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2rte h ALA 117 Cb 0.27 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2rte h ALA 117 CO -0.01 0.47 0.00 0.09 0.00 0.00 0.00 179.25 179.80 2rte n ASN 118 N -4.47 4.89 0.25 0.00 3.02 -1.05 -4.47 115.26 113.42 2rte n ASN 118 Ca 0.14 -2.70 0.09 0.00 -0.03 0.00 0.00 54.58 52.07 2rte n ASN 118 Cb 0.15 -0.59 0.64 0.00 -0.61 0.00 0.00 39.78 39.36 2rte n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2rte h ALA 119 N 3.55 1.67 -0.17 5.41 0.00 -1.21 -2.40 119.26 126.11 2rte h ALA 119 Ca 0.00 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.87 2rte h ALA 119 Cb 1.61 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 2rte h ALA 119 CO 0.32 0.13 0.18 0.11 0.00 0.00 0.00 179.25 179.98 2rte h TRP 120 N 0.00 0.00 -0.68 0.00 5.08 -1.81 -2.13 115.95 116.40 2rte h TRP 120 Ca -0.00 0.00 -0.47 0.00 1.08 0.00 0.00 58.89 59.49 2rte h TRP 120 Cb 0.20 0.00 -0.31 0.00 -3.00 0.00 0.00 29.16 26.05 2rte h TRP 120 CO 0.00 0.00 -0.29 0.36 -1.28 0.00 0.00 178.44 177.23 2rte n LYS 121 N -3.87 2.95 0.06 0.12 2.85 -0.90 -4.72 118.16 114.64 2rte n LYS 121 Ca 0.01 -3.74 0.05 0.00 -1.05 0.00 0.00 58.31 53.58 2rte n LYS 121 Cb 0.30 -2.15 -0.05 0.00 -0.65 0.00 0.00 35.03 32.48 2rte n LYS 121 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2rte n SER 122 N -0.86 0.86 -4.37 -5.58 3.41 -0.80 -4.92 113.62 101.35 2rte n SER 122 Ca 0.45 0.36 -0.33 0.00 -0.26 0.00 0.00 58.87 59.08 2rte n SER 122 Cb 0.90 0.28 -0.14 0.00 -0.26 0.00 0.00 64.21 64.99 2rte n SER 122 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2rte s THR 123 N -3.12 3.14 0.08 6.66 2.01 -1.26 -1.47 115.64 121.68 2rte s THR 123 Ca -0.02 -0.62 0.02 0.00 0.31 0.00 0.00 61.69 61.38 2rte s THR 123 Cb 0.09 -2.34 -0.04 0.00 0.01 0.00 0.00 72.50 70.22 2rte s THR 123 CO 0.80 0.51 0.13 -0.76 -0.69 0.00 0.00 174.62 174.62 2rte s LEU 124 N 0.48 4.01 0.04 4.42 1.43 -0.54 -4.94 118.68 123.58 2rte s LEU 124 Ca -0.08 0.09 0.05 0.00 -1.03 0.00 0.00 54.13 53.16 2rte s LEU 124 Cb -0.16 -2.66 -0.02 0.00 0.03 0.00 0.00 46.19 43.38 2rte s LEU 124 CO 0.04 0.16 -0.14 0.54 0.23 0.00 0.00 176.35 177.18 2rte s VAL 125 N -1.46 1.15 0.10 -1.59 0.11 -1.26 -1.44 120.40 116.01 2rte s VAL 125 Ca 0.31 -1.01 -0.06 0.00 -2.93 0.00 0.00 61.98 58.29 2rte s VAL 125 Cb -0.12 -1.04 0.02 0.00 -1.53 0.00 0.00 36.38 33.71 2rte s VAL 125 CO 0.24 0.02 0.30 0.61 -3.33 0.00 0.00 175.10 172.94 2rte n GLY 126 N 1.90 1.38 3.04 6.54 0.00 -0.89 -5.00 105.19 112.14 2rte n GLY 126 Ca -0.18 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.67 2rte n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2rte s HIS 127 N -5.79 -0.12 0.04 1.61 -3.43 -1.26 -0.91 115.29 105.42 2rte s HIS 127 Ca 0.06 0.30 0.03 0.00 -0.80 0.00 0.00 55.06 54.65 2rte s HIS 127 Cb -0.01 0.03 -0.02 0.00 -1.43 0.00 0.00 32.58 31.15 2rte s HIS 127 CO 0.03 -0.11 -0.09 -0.51 -2.00 0.00 0.00 174.74 172.05 2rte s ASP 128 N -0.17 1.08 -0.11 7.38 1.01 -0.77 -4.97 116.67 120.11 2rte s ASP 128 Ca -0.02 -0.45 0.03 0.00 0.71 0.00 0.00 52.55 52.82 2rte s ASP 128 Cb -0.02 -0.02 0.01 0.00 1.01 0.00 0.00 42.92 43.89 2rte s ASP 128 CO 0.00 -0.09 -0.21 -0.89 0.21 0.00 0.00 175.17 174.20 2rte s THR 129 N -1.01 1.90 -0.03 -1.27 2.01 -1.26 -1.25 115.64 114.73 2rte s THR 129 Ca -0.04 -0.90 0.01 0.00 0.31 0.00 0.00 61.69 61.06 2rte s THR 129 Cb -0.08 -1.67 -0.03 0.00 0.01 0.00 0.00 72.50 70.73 2rte s THR 129 CO 0.01 0.52 -0.03 -0.36 -0.69 0.00 0.00 174.62 174.07 2rte s PHE 130 N 0.64 3.03 -0.10 4.92 0.40 -0.34 -3.46 117.98 123.08 2rte s PHE 130 Ca -0.12 0.07 0.03 0.00 -0.60 0.00 0.00 56.93 56.31 2rte s PHE 130 Cb -0.16 -1.69 -0.01 0.00 0.51 0.00 0.00 43.02 41.66 2rte s PHE 130 CO 0.03 0.42 -0.19 0.99 0.70 0.00 0.00 175.22 177.17 2rte s THR 131 N -0.96 2.59 0.21 0.64 2.01 0.74 -2.40 115.64 118.46 2rte s THR 131 Ca 0.16 -0.85 -0.27 0.00 0.31 0.00 0.00 61.69 61.05 2rte s THR 131 Cb -0.11 -2.03 -0.09 0.00 0.01 0.00 0.00 72.50 70.28 2rte s THR 131 CO 0.06 0.55 0.84 -0.75 -0.69 0.00 0.00 174.62 174.64 2rte s LYS 132 N 0.12 4.65 -0.50 4.92 2.20 -1.22 -1.75 119.74 128.16 2rte s LYS 132 Ca -0.09 1.27 -0.14 0.00 -0.36 0.00 0.00 55.97 56.65 2rte s LYS 132 Cb -0.15 -3.21 0.11 0.00 -1.51 0.00 0.00 37.83 33.07 2rte s LYS 132 CO 0.06 0.52 0.43 0.08 -0.36 0.00 0.00 175.35 176.08 2rte s VAL 133 N -1.22 5.01 -0.05 4.02 1.01 -0.62 -4.93 120.40 123.62 2rte s VAL 133 Ca 0.39 -1.40 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 2rte s VAL 133 Cb -0.23 -4.15 0.03 0.00 0.00 0.00 0.00 36.38 32.03 2rte s VAL 133 CO 0.28 -0.75 0.02 -1.59 0.00 0.00 0.00 175.10 173.07 2rte s LYS 134 N 1.57 0.31 0.00 2.72 -2.85 -1.26 -4.48 119.74 115.75 2rte s LYS 134 Ca 0.04 0.21 0.30 0.00 -1.00 0.00 0.00 55.97 55.52 2rte s LYS 134 Cb -0.27 -0.74 1.55 0.00 -2.06 0.00 0.00 37.83 36.30 2rte s LYS 134 CO 0.04 -0.29 2.02 -0.35 0.10 0.00 0.00 175.35 176.87