#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rdl s ILE 17 N 0.00 5.22 -1.21 1.39 1.01 0.16 -4.22 121.20 123.57 2rdl s ILE 17 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.77 2rdl s ILE 17 Cb 0.00 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 39.08 2rdl s ILE 17 CO 0.00 0.43 0.00 0.61 0.00 0.00 0.00 174.94 175.98 2rdl n GLY 18 N 3.65 0.45 0.00 6.18 0.00 -1.26 -1.88 105.19 112.33 2rdl n GLY 18 Ca -0.16 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2rdl n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rdl n GLY 19 N -1.17 2.78 3.19 -0.02 0.00 -1.26 -4.79 105.19 103.92 2rdl n GLY 19 Ca -0.14 -1.97 -0.12 0.00 0.00 0.00 0.00 46.02 43.79 2rdl n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rdl s THR 20 N 2.25 0.84 0.28 2.61 -4.23 0.16 -4.92 115.64 112.63 2rdl s THR 20 Ca 0.00 -1.92 -0.29 0.00 -1.18 0.00 0.00 61.69 58.30 2rdl s THR 20 Cb 0.00 -1.67 -0.10 0.00 1.34 0.00 0.00 72.50 72.08 2rdl s THR 20 CO 0.00 -0.80 1.25 -0.70 -0.54 0.00 0.00 174.62 173.83 2rdl s GLU 21 N -3.65 4.44 0.60 3.99 2.12 -1.26 -0.17 118.70 124.76 2rdl s GLU 21 Ca 0.12 2.07 -0.13 0.00 0.36 0.00 0.00 54.97 57.39 2rdl s GLU 21 Cb 0.03 -3.14 -0.04 0.00 0.26 0.00 0.00 34.13 31.25 2rdl s GLU 21 CO -0.03 -0.10 1.02 0.00 -0.54 0.00 0.00 175.26 175.62 2rdl s ARG 23 N -4.78 4.34 -0.08 0.00 0.52 -1.26 -4.87 118.95 112.81 2rdl s ARG 23 Ca 0.57 1.98 -0.39 0.00 -0.52 0.00 0.00 55.73 57.37 2rdl s ARG 23 Cb -0.12 -3.35 -0.17 0.00 0.52 0.00 0.00 34.95 31.84 2rdl s ARG 23 CO 0.47 -0.43 1.44 -2.30 0.02 0.00 0.00 175.30 174.50 2rdl n PRO 24 N 4.28 0.87 -1.10 3.54 -0.02 -1.26 -0.67 135.00 140.65 2rdl n PRO 24 Ca 0.11 0.32 -0.03 0.00 -2.02 0.00 0.00 63.50 61.88 2rdl n PRO 24 Cb 0.44 -1.94 -0.01 0.00 -0.02 0.00 0.00 33.50 31.96 2rdl n PRO 24 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2rdl n HIS 25 N 3.33 0.00 0.45 6.00 8.25 -1.26 -4.87 115.22 127.12 2rdl n HIS 25 Ca 0.22 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.81 2rdl n HIS 25 Cb 0.13 -1.74 0.43 0.00 1.12 0.00 0.00 29.99 29.94 2rdl n HIS 25 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2rdl h ALA 26 N 0.00 1.00 -2.09 -1.41 0.00 -1.26 -3.31 119.26 112.19 2rdl h ALA 26 Ca -0.07 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.31 2rdl h ALA 26 Cb 0.80 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 18.18 2rdl h ALA 26 CO 0.10 0.00 -0.98 0.54 0.00 0.00 0.00 179.25 178.91 2rdl n ARG 27 N -2.48 1.67 0.00 0.00 1.74 -1.26 -4.98 116.66 111.35 2rdl n ARG 27 Ca 0.04 -3.87 0.00 0.00 -0.77 0.00 0.00 57.85 53.25 2rdl n ARG 27 Cb 0.37 -1.81 0.00 0.00 -1.02 0.00 0.00 32.46 29.99 2rdl n ARG 27 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2rdl n PRO 28 N 0.41 0.00 0.00 5.56 -0.04 -1.25 -1.86 135.00 137.82 2rdl n PRO 28 Ca 0.26 0.02 0.11 0.00 -0.04 0.00 0.00 63.50 63.85 2rdl n PRO 28 Cb 0.54 -1.51 -0.07 0.00 -0.04 0.00 0.00 33.50 32.42 2rdl n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2rdl n TYR 29 N -0.87 0.07 -1.74 0.54 0.18 -1.23 -0.95 117.16 113.16 2rdl n TYR 29 Ca 0.00 0.02 -0.42 0.00 1.88 0.00 0.00 57.90 59.38 2rdl n TYR 29 Cb 0.01 -0.23 -0.02 0.00 -0.38 0.00 0.00 39.34 38.72 2rdl n TYR 29 CO 0.00 0.00 0.00 -1.33 -2.08 0.00 0.00 176.86 173.45 2rdl n MET 30 N -1.78 2.65 -4.97 -3.48 2.81 -0.78 0.29 117.12 111.87 2rdl n MET 30 Ca 0.02 0.94 -0.27 0.00 -1.81 0.00 0.00 57.70 56.58 2rdl n MET 30 Cb 0.41 -2.71 -0.15 0.00 -0.71 0.00 0.00 33.22 30.05 2rdl n MET 30 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2rdl s ALA 31 N -0.06 1.70 -0.26 3.04 0.00 0.10 -4.40 121.76 121.87 2rdl s ALA 31 Ca 0.64 -0.90 -0.05 0.00 0.00 0.00 0.00 51.96 51.65 2rdl s ALA 31 Cb -0.51 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.20 2rdl s ALA 31 CO 0.49 0.41 0.02 -0.47 0.00 0.00 0.00 175.76 176.21 2rdl s TYR 32 N -0.51 3.08 -0.23 0.00 5.04 -0.67 -1.35 117.35 122.73 2rdl s TYR 32 Ca 0.08 -1.10 -0.10 0.00 -2.44 0.00 0.00 57.07 53.51 2rdl s TYR 32 Cb -0.08 -2.17 -0.05 0.00 0.35 0.00 0.00 41.96 40.02 2rdl s TYR 32 CO -0.01 -0.60 0.13 -0.51 -1.34 0.00 0.00 175.55 173.23 2rdl s LEU 33 N 1.45 4.03 -0.27 6.97 1.02 -0.35 -1.07 118.68 130.47 2rdl s LEU 33 Ca 0.03 0.10 -0.08 0.00 0.02 0.00 0.00 54.13 54.20 2rdl s LEU 33 Cb -0.16 -2.07 -0.02 0.00 0.02 0.00 0.00 46.19 43.96 2rdl s LEU 33 CO -0.01 0.09 0.09 -1.61 0.02 0.00 0.00 176.35 174.94 2rdl s GLU 34 N 0.91 3.49 0.06 1.70 2.02 -0.89 -1.61 118.70 124.37 2rdl s GLU 34 Ca 0.07 -0.60 0.07 0.00 0.02 0.00 0.00 54.97 54.53 2rdl s GLU 34 Cb -0.13 -3.40 -0.03 0.00 0.10 0.00 0.00 34.13 30.67 2rdl s GLU 34 CO 0.03 -0.29 -0.18 0.42 0.02 0.00 0.00 175.26 175.27 2rdl s ILE 34 N 1.60 2.82 -0.41 -1.63 1.01 0.78 -2.30 121.20 123.06 2rdl s ILE 34 Ca 0.05 -1.25 -0.04 0.00 0.00 0.00 0.00 60.65 59.42 2rdl s ILE 34 Cb -0.16 -2.21 0.11 0.00 0.01 0.00 0.00 42.46 40.21 2rdl s ILE 34 CO 0.04 0.28 0.21 -0.69 0.00 0.00 0.00 174.94 174.79 2rdl s VAL 34 N -0.98 3.40 0.79 2.92 1.01 -0.99 -0.20 120.40 126.35 2rdl s VAL 34 Ca 0.15 -1.99 -0.14 0.00 0.00 0.00 0.00 61.98 60.01 2rdl s VAL 34 Cb -0.11 -3.30 0.07 0.00 0.00 0.00 0.00 36.38 33.05 2rdl s VAL 34 CO 0.06 -0.67 1.22 0.42 0.00 0.00 0.00 175.10 176.13 2rdl s THR 34 N 1.17 2.05 0.55 3.92 -4.23 0.84 -0.54 115.64 119.40 2rdl s THR 34 Ca 0.07 0.02 0.30 0.00 -1.18 0.00 0.00 61.69 60.91 2rdl s THR 34 Cb -0.23 -2.50 0.45 0.00 1.34 0.00 0.00 72.50 71.56 2rdl s THR 34 CO -0.04 -0.01 1.90 1.55 -0.54 0.00 0.00 174.62 177.48 2rdl h PRO 35 N -0.71 0.00 -0.58 3.99 0.13 -1.87 0.95 132.00 133.90 2rdl h PRO 35 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2rdl h PRO 35 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2rdl h PRO 35 CO 0.47 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.39 2rdl n GLU 36 N -4.14 2.39 -2.67 0.86 0.28 -1.26 -4.90 120.64 111.20 2rdl n GLU 36 Ca 0.15 -1.42 -0.15 0.00 -0.16 0.00 0.00 57.16 55.57 2rdl n GLU 36 Cb 0.85 -1.58 0.02 0.00 1.43 0.00 0.00 31.44 32.16 2rdl n GLU 36 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2rdl n ASN 37 N 0.43 -4.62 -4.90 -1.84 5.15 0.33 -5.04 115.26 104.77 2rdl n ASN 37 Ca 0.13 -0.16 -0.21 0.00 -0.60 0.00 0.00 54.58 53.74 2rdl n ASN 37 Cb 0.51 -3.54 -0.03 0.00 -0.53 0.00 0.00 39.78 36.19 2rdl n ASN 37 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2rdl s HIS 38 N -2.92 3.11 -0.20 1.20 3.76 -1.23 -4.84 115.29 114.18 2rdl s HIS 38 Ca 0.16 -0.18 -0.08 0.00 -0.15 0.00 0.00 55.06 54.82 2rdl s HIS 38 Cb -0.07 -1.69 -0.04 0.00 1.11 0.00 0.00 32.58 31.88 2rdl s HIS 38 CO 0.20 0.28 0.08 -0.51 -0.85 0.00 0.00 174.74 173.94 2rdl s LEU 39 N -3.99 3.84 0.30 0.89 1.43 -1.26 -0.11 118.68 119.78 2rdl s LEU 39 Ca 0.38 0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.58 2rdl s LEU 39 Cb -0.08 -1.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 2rdl s LEU 39 CO 0.28 0.14 0.29 -0.55 0.23 0.00 0.00 176.35 176.74 2rdl s SER 40 N 0.56 1.06 0.03 2.29 0.15 0.72 -4.97 113.70 113.54 2rdl s SER 40 Ca 0.04 -1.58 -0.03 0.00 0.70 0.00 0.00 55.95 55.09 2rdl s SER 40 Cb -0.13 0.53 -0.02 0.00 -1.71 0.00 0.00 66.02 64.70 2rdl s SER 40 CO 0.01 -1.05 0.03 0.00 1.20 0.00 0.00 173.24 173.42 2rdl s ALA 41 N -3.58 0.09 0.30 5.45 0.00 -1.26 -0.16 121.76 122.60 2rdl s ALA 41 Ca 0.38 -0.65 -0.06 0.00 0.00 0.00 0.00 51.96 51.63 2rdl s ALA 41 Cb 0.03 0.20 -0.00 0.00 0.00 0.00 0.00 23.12 23.35 2rdl s ALA 41 CO 0.21 -0.25 0.45 0.00 0.00 0.00 0.00 175.76 176.17 2rdl s SER 43 N -3.15 4.48 -0.02 0.00 0.01 -0.02 -1.21 113.70 113.78 2rdl s SER 43 Ca 0.28 -1.16 -0.29 0.00 1.31 0.00 0.00 55.95 56.10 2rdl s SER 43 Cb 0.00 -0.19 0.10 0.00 0.21 0.00 0.00 66.02 66.14 2rdl s SER 43 CO 0.16 -0.70 1.29 -0.83 0.41 0.00 0.00 173.24 173.56 2rdl s GLY 44 N -4.00 -0.14 -0.05 3.44 0.00 -0.45 -3.91 107.32 102.21 2rdl s GLY 44 Ca 0.36 0.06 -0.08 0.00 0.00 0.00 0.00 44.72 45.06 2rdl s GLY 44 CO 0.20 5.56 0.19 -0.11 0.00 0.00 0.00 173.10 178.95 2rdl s PHE 45 N -2.03 -0.14 -0.24 1.90 -0.71 -0.96 0.01 117.98 115.81 2rdl s PHE 45 Ca 0.29 0.31 -0.29 0.00 -1.04 0.00 0.00 56.93 56.21 2rdl s PHE 45 Cb -0.00 0.04 -0.00 0.00 -1.21 0.00 0.00 43.02 41.84 2rdl s PHE 45 CO -0.01 -0.18 1.23 -1.17 -1.34 0.00 0.00 175.22 173.75 2rdl s LEU 46 N -0.44 4.03 0.00 -1.99 2.96 0.15 -1.33 118.68 122.05 2rdl s LEU 46 Ca -0.05 1.39 0.15 0.00 -0.22 0.00 0.00 54.13 55.39 2rdl s LEU 46 Cb -0.04 -3.54 -0.16 0.00 0.50 0.00 0.00 46.19 42.96 2rdl s LEU 46 CO 0.01 -0.89 0.63 2.30 -1.32 0.00 0.00 176.35 177.08 2rdl n ILE 47 N 5.75 0.00 -3.55 6.68 -5.35 -0.52 -0.71 119.36 121.66 2rdl n ILE 47 Ca 0.14 -0.15 -0.17 0.00 -0.27 0.00 0.00 62.75 62.30 2rdl n ILE 47 Cb 0.46 1.00 -0.06 0.00 -1.74 0.00 0.00 39.64 39.30 2rdl n ILE 47 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2rdl s ARG 48 N -2.38 0.98 0.51 6.28 3.52 -1.13 -4.60 118.95 122.12 2rdl s ARG 48 Ca 0.06 0.44 0.43 0.00 -0.13 0.00 0.00 55.73 56.52 2rdl s ARG 48 Cb 0.11 0.46 1.64 0.00 -1.56 0.00 0.00 34.95 35.61 2rdl s ARG 48 CO 0.60 -0.26 1.57 0.54 -0.81 0.00 0.00 175.30 176.94 2rdl n ARG 49 N 1.35 -0.02 -0.32 5.12 1.74 -1.26 -0.33 116.66 122.95 2rdl n ARG 49 Ca -0.17 1.16 0.08 0.00 -0.77 0.00 0.00 57.85 58.15 2rdl n ARG 49 Cb 0.57 -2.50 0.15 0.00 -1.02 0.00 0.00 32.46 29.65 2rdl n ARG 49 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2rdl n ASN 50 N -4.27 1.94 -3.77 0.55 2.04 -1.26 -0.00 115.26 110.49 2rdl n ASN 50 Ca 0.43 -3.24 -0.17 0.00 -0.44 0.00 0.00 54.58 51.16 2rdl n ASN 50 Cb 1.84 -0.44 -0.16 0.00 -2.53 0.00 0.00 39.78 38.48 2rdl n ASN 50 CO 0.00 0.00 0.00 -0.36 -0.44 0.00 0.00 177.26 176.46 2rdl s PHE 51 N -2.70 0.18 -0.05 -2.53 0.08 0.56 -1.48 117.98 112.03 2rdl s PHE 51 Ca 0.32 0.08 0.05 0.00 0.12 0.00 0.00 56.93 57.50 2rdl s PHE 51 Cb 0.29 -0.37 -0.02 0.00 -0.57 0.00 0.00 43.02 42.35 2rdl s PHE 51 CO -0.01 -0.13 -0.19 0.08 -0.10 0.00 0.00 175.22 174.87 2rdl s VAL 52 N 1.27 2.65 -0.11 -0.44 1.01 -0.11 -1.43 120.40 123.24 2rdl s VAL 52 Ca -0.06 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.02 2rdl s VAL 52 Cb -0.13 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.20 2rdl s VAL 52 CO -0.03 0.58 0.00 -0.32 0.00 0.00 0.00 175.10 175.33 2rdl s MET 53 N -0.47 3.26 0.00 2.72 1.75 -0.44 0.69 119.30 126.81 2rdl s MET 53 Ca 0.06 -0.42 0.00 0.00 -1.25 0.00 0.00 55.69 54.08 2rdl s MET 53 Cb -0.12 -2.88 0.00 0.00 2.84 0.00 0.00 34.83 34.67 2rdl s MET 53 CO 0.01 0.55 0.00 -2.37 -0.65 0.00 0.00 175.02 172.57 2rdl n THR 54 N 2.61 0.00 -3.30 10.11 5.66 0.85 -2.26 114.28 127.95 2rdl n THR 54 Ca -0.18 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.48 2rdl n THR 54 Cb 0.53 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.25 2rdl n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2rdl s ALA 55 N -1.28 3.51 0.34 1.79 0.00 -1.26 0.43 121.76 125.30 2rdl s ALA 55 Ca 0.00 -0.10 0.04 0.00 0.00 0.00 0.00 51.96 51.91 2rdl s ALA 55 Cb 0.00 -2.58 0.61 0.00 0.00 0.00 0.00 23.12 21.14 2rdl s ALA 55 CO 0.00 0.43 1.88 0.00 0.00 0.00 0.00 175.76 178.07 2rdl h ALA 56 N 3.11 1.37 0.00 0.00 0.00 -1.70 -2.46 119.26 119.58 2rdl h ALA 56 Ca -0.48 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2rdl h ALA 56 Cb 1.18 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2rdl h ALA 56 CO 0.66 0.44 0.00 -2.39 0.00 0.00 0.00 179.25 177.96 2rdl n HIS 57 N -4.28 0.00 0.52 0.00 1.44 -1.26 -1.93 115.22 109.70 2rdl n HIS 57 Ca 0.01 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.83 2rdl n HIS 57 Cb 0.24 0.00 0.26 0.00 0.12 0.00 0.00 29.99 30.62 2rdl n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2rdl s ALA 59 N -1.51 2.51 0.00 0.00 0.00 -0.81 -4.94 121.76 117.00 2rdl s ALA 59 Ca 0.37 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2rdl s ALA 59 Cb 0.21 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 20.00 2rdl s ALA 59 CO 0.29 -1.19 0.00 0.41 0.00 0.00 0.00 175.76 175.27 2rdl n GLY 61 N -0.38 1.52 0.13 0.00 0.00 -1.26 -4.52 105.19 100.68 2rdl n GLY 61 Ca 0.11 -0.90 -0.11 0.00 0.00 0.00 0.00 46.02 45.11 2rdl n GLY 61 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2rdl h ARG 62 N 0.00 0.33 -4.14 1.61 3.08 -1.02 -3.45 114.38 110.79 2rdl h ARG 62 Ca 0.00 -0.08 -0.12 0.00 0.07 0.00 0.00 59.98 59.85 2rdl h ARG 62 Cb 0.00 -0.04 -0.15 0.00 0.08 0.00 0.00 29.97 29.85 2rdl h ARG 62 CO 0.00 0.45 -0.63 -1.54 -1.07 0.00 0.00 179.97 177.18 2rdl s SER 63 N -5.71 0.40 -0.05 7.04 1.04 -1.22 -5.04 113.70 110.17 2rdl s SER 63 Ca -0.14 -0.89 -0.16 0.00 0.48 0.00 0.00 55.95 55.24 2rdl s SER 63 Cb 0.07 0.21 0.03 0.00 0.10 0.00 0.00 66.02 66.44 2rdl s SER 63 CO 0.72 -0.59 0.37 -0.63 0.98 0.00 0.00 173.24 174.08 2rdl s ILE 64 N -3.67 0.04 0.03 -1.02 1.01 -1.26 -2.34 121.20 113.99 2rdl s ILE 64 Ca 0.04 -0.32 0.03 0.00 0.00 0.00 0.00 60.65 60.41 2rdl s ILE 64 Cb 0.06 -0.64 -0.02 0.00 0.01 0.00 0.00 42.46 41.87 2rdl s ILE 64 CO -0.09 -0.17 -0.09 0.42 0.00 0.00 0.00 174.94 175.01 2rdl s THR 65 N -0.95 0.65 -0.06 2.92 -4.23 -0.98 -2.21 115.64 110.78 2rdl s THR 65 Ca -0.10 -0.81 0.05 0.00 -1.18 0.00 0.00 61.69 59.64 2rdl s THR 65 Cb -0.04 -0.63 -0.02 0.00 1.34 0.00 0.00 72.50 73.15 2rdl s THR 65 CO 0.04 -0.14 -0.20 -0.69 -0.54 0.00 0.00 174.62 173.09 2rdl s VAL 66 N -0.88 2.57 -0.22 2.29 1.01 0.13 -2.11 120.40 123.19 2rdl s VAL 66 Ca -0.04 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 2rdl s VAL 66 Cb -0.07 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.34 2rdl s VAL 66 CO 0.00 0.57 -0.09 -0.22 0.00 0.00 0.00 175.10 175.37 2rdl s LEU 67 N -0.36 2.85 0.18 3.92 2.96 -0.23 -0.80 118.68 127.19 2rdl s LEU 67 Ca 0.03 -0.65 0.10 0.00 -0.22 0.00 0.00 54.13 53.38 2rdl s LEU 67 Cb -0.12 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 44.87 2rdl s LEU 67 CO 0.02 -0.06 -0.14 -0.76 -1.32 0.00 0.00 176.35 174.09 2rdl s LEU 68 N 1.37 2.80 0.00 -0.68 1.43 -0.14 -1.66 118.68 121.81 2rdl s LEU 68 Ca 0.03 -0.66 0.00 0.00 -1.03 0.00 0.00 54.13 52.47 2rdl s LEU 68 Cb -0.15 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.56 2rdl s LEU 68 CO -0.06 0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.24 2rdl n GLY 69 N 0.14 0.39 3.62 -3.19 0.00 -1.23 -0.92 105.19 104.00 2rdl n GLY 69 Ca -0.11 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.51 2rdl n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rdl s ALA 70 N -2.00 3.08 -0.05 4.61 0.00 -1.26 -4.03 121.76 122.11 2rdl s ALA 70 Ca 0.00 -1.05 -0.08 0.00 0.00 0.00 0.00 51.96 50.83 2rdl s ALA 70 Cb 0.00 -1.14 -0.03 0.00 0.00 0.00 0.00 23.12 21.95 2rdl s ALA 70 CO 0.00 0.63 -0.17 1.58 0.00 0.00 0.00 175.76 177.81 2rdl n HIS 71 N 1.29 0.00 -3.70 0.00 -0.00 -1.26 -4.84 115.22 106.71 2rdl n HIS 71 Ca -0.14 0.00 -0.38 0.00 0.46 0.00 0.00 57.72 57.66 2rdl n HIS 71 Cb 0.52 -0.29 -0.12 0.00 -0.12 0.00 0.00 29.99 29.99 2rdl n HIS 71 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 2rdl s ASN 72 N -6.01 5.39 0.00 0.26 3.84 -1.26 -1.30 114.94 115.86 2rdl s ASN 72 Ca -0.15 -0.61 0.09 0.00 0.21 0.00 0.00 52.86 52.40 2rdl s ASN 72 Cb 0.03 -1.95 0.38 0.00 -0.55 0.00 0.00 41.25 39.15 2rdl s ASN 72 CO 0.21 -0.20 1.28 2.29 -2.79 0.00 0.00 177.10 177.89 2rdl n LYS 73 N 4.94 0.00 -0.21 0.43 2.85 0.14 -2.01 118.16 124.29 2rdl n LYS 73 Ca -0.14 0.35 0.10 0.00 -1.05 0.00 0.00 58.31 57.56 2rdl n LYS 73 Cb 0.49 -1.50 0.21 0.00 -0.65 0.00 0.00 35.03 33.58 2rdl n LYS 73 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2rdl n LYS 74 N -1.50 2.45 -3.89 -1.58 4.01 -1.26 -4.81 118.16 111.59 2rdl n LYS 74 Ca 0.02 -2.22 -0.30 0.00 -0.51 0.00 0.00 58.31 55.30 2rdl n LYS 74 Cb 0.10 -1.44 -0.15 0.00 -0.51 0.00 0.00 35.03 33.03 2rdl n LYS 74 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2rdl s VAL 75 N -1.19 1.50 0.35 -0.18 1.01 -0.85 -5.11 120.40 115.93 2rdl s VAL 75 Ca 0.35 -1.57 -0.28 0.00 0.00 0.00 0.00 61.98 60.48 2rdl s VAL 75 Cb 0.20 -1.98 -0.10 0.00 0.00 0.00 0.00 36.38 34.49 2rdl s VAL 75 CO 0.27 -0.42 1.37 -0.54 0.00 0.00 0.00 175.10 175.77 2rdl s LYS 76 N 1.34 4.23 0.10 2.72 1.02 -1.26 -4.71 119.74 123.19 2rdl s LYS 76 Ca 0.04 2.33 -0.00 0.00 0.02 0.00 0.00 55.97 58.36 2rdl s LYS 76 Cb -0.18 -3.01 -0.04 0.00 -0.52 0.00 0.00 37.83 34.08 2rdl s LYS 76 CO -0.13 -0.33 0.01 -1.21 -0.92 0.00 0.00 175.35 172.76 2rdl s GLU 77 N -1.94 0.83 0.24 1.68 2.02 -1.26 -5.03 118.70 115.24 2rdl s GLU 77 Ca 0.51 -1.36 0.21 0.00 0.02 0.00 0.00 54.97 54.35 2rdl s GLU 77 Cb -0.42 0.12 0.95 0.00 0.10 0.00 0.00 34.13 34.88 2rdl s GLU 77 CO 0.56 -0.17 1.64 -0.25 0.02 0.00 0.00 175.26 177.07 2rdl n ASP 78 N -0.04 0.55 -0.40 -0.19 8.00 -1.26 -1.76 116.55 121.45 2rdl n ASP 78 Ca -0.09 0.67 0.13 0.00 0.71 0.00 0.00 54.79 56.20 2rdl n ASP 78 Cb 0.62 -0.77 0.53 0.00 -0.02 0.00 0.00 41.12 41.49 2rdl n ASP 78 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2rdl n THR 79 N -2.14 0.07 -2.44 -3.53 -2.24 -1.26 -4.89 114.28 97.85 2rdl n THR 79 Ca 0.01 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 2rdl n THR 79 Cb 0.17 0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.62 2rdl n THR 79 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 2rdl s TRP 80 N -1.93 3.48 -0.16 4.78 0.52 -0.72 -4.01 118.94 120.90 2rdl s TRP 80 Ca 0.37 1.42 -0.03 0.00 0.02 0.00 0.00 56.10 57.87 2rdl s TRP 80 Cb 0.19 -3.38 0.05 0.00 -1.15 0.00 0.00 33.47 29.19 2rdl s TRP 80 CO 0.31 -1.05 0.05 -0.65 0.02 0.00 0.00 176.95 175.62 2rdl s GLN 81 N 0.38 0.45 -0.31 4.98 -0.21 -0.10 -4.99 119.66 119.86 2rdl s GLN 81 Ca 0.55 -0.20 -0.09 0.00 0.02 0.00 0.00 55.36 55.64 2rdl s GLN 81 Cb -0.30 -1.76 -0.00 0.00 1.00 0.00 0.00 33.01 31.95 2rdl s GLN 81 CO 0.32 -0.57 0.15 0.15 -2.12 0.00 0.00 175.29 173.22 2rdl s LYS 82 N 1.97 3.27 0.08 2.91 1.02 -1.26 -0.96 119.74 126.77 2rdl s LYS 82 Ca 0.01 -0.77 0.09 0.00 0.02 0.00 0.00 55.97 55.33 2rdl s LYS 82 Cb -0.16 -3.56 -0.03 0.00 -0.52 0.00 0.00 37.83 33.56 2rdl s LYS 82 CO -0.07 -0.44 -0.24 -0.51 -0.92 0.00 0.00 175.35 173.16 2rdl s LEU 83 N 1.60 2.25 0.33 3.17 1.02 0.02 -4.96 118.68 122.10 2rdl s LEU 83 Ca 0.04 -0.65 -0.11 0.00 0.02 0.00 0.00 54.13 53.44 2rdl s LEU 83 Cb -0.17 -1.10 -0.07 0.00 0.02 0.00 0.00 46.19 44.87 2rdl s LEU 83 CO 0.06 0.17 0.68 -1.61 0.02 0.00 0.00 176.35 175.67 2rdl s GLU 84 N -1.63 3.81 -0.17 1.70 2.02 -1.26 0.18 118.70 123.35 2rdl s GLU 84 Ca 0.10 0.41 -0.17 0.00 0.02 0.00 0.00 54.97 55.33 2rdl s GLU 84 Cb -0.10 -2.49 -0.04 0.00 0.10 0.00 0.00 34.13 31.60 2rdl s GLU 84 CO 0.04 0.12 0.43 0.08 0.02 0.00 0.00 175.26 175.94 2rdl s VAL 85 N -2.12 5.20 -0.13 2.63 1.01 -0.94 -1.55 120.40 124.49 2rdl s VAL 85 Ca 0.50 0.79 0.20 0.00 0.00 0.00 0.00 61.98 63.47 2rdl s VAL 85 Cb -0.10 -3.76 -0.20 0.00 0.00 0.00 0.00 36.38 32.31 2rdl s VAL 85 CO 0.26 0.28 0.61 -1.84 0.00 0.00 0.00 175.10 174.40 2rdl n GLU 86 N 4.19 0.64 -3.70 2.72 0.28 0.47 -4.76 120.64 120.48 2rdl n GLU 86 Ca -0.08 0.02 -0.11 0.00 -0.16 0.00 0.00 57.16 56.83 2rdl n GLU 86 Cb 0.51 -1.66 -0.11 0.00 1.43 0.00 0.00 31.44 31.61 2rdl n GLU 86 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 2rdl s LYS 87 N -3.13 0.33 -0.15 3.44 2.20 -1.05 -5.02 119.74 116.36 2rdl s LYS 87 Ca -0.06 0.73 -0.13 0.00 -0.36 0.00 0.00 55.97 56.15 2rdl s LYS 87 Cb 0.10 -0.03 -0.05 0.00 -1.51 0.00 0.00 37.83 36.34 2rdl s LYS 87 CO 0.84 -0.17 0.29 -0.65 -0.36 0.00 0.00 175.35 175.30 2rdl s GLN 88 N 1.47 4.18 -0.71 4.03 -0.21 -1.26 -1.23 119.66 125.93 2rdl s GLN 88 Ca -0.09 0.09 0.04 0.00 0.02 0.00 0.00 55.36 55.43 2rdl s GLN 88 Cb -0.09 -3.40 0.27 0.00 1.00 0.00 0.00 33.01 30.79 2rdl s GLN 88 CO -0.11 0.31 0.90 1.19 -2.12 0.00 0.00 175.29 175.46 2rdl n PHE 89 N 3.35 3.44 -2.01 0.91 3.72 0.50 -5.01 117.46 122.36 2rdl n PHE 89 Ca -0.13 -3.86 -0.40 0.00 -0.05 0.00 0.00 57.45 53.01 2rdl n PHE 89 Cb 0.52 -0.68 -0.01 0.00 -0.94 0.00 0.00 39.48 38.37 2rdl n PHE 89 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2rdl s PRO 90 N -2.65 4.09 0.40 -1.08 0.02 -1.26 -2.27 135.00 132.25 2rdl s PRO 90 Ca 0.39 2.27 -0.27 0.00 0.02 0.00 0.00 61.00 63.41 2rdl s PRO 90 Cb 0.14 -2.88 -0.11 0.00 0.02 0.00 0.00 34.50 31.67 2rdl s PRO 90 CO -0.00 -0.43 1.33 1.58 -0.33 0.00 0.00 177.00 179.15 2rdl n HIS 91 N 0.37 2.37 -0.15 6.54 -0.00 -0.90 -4.88 115.22 118.57 2rdl n HIS 91 Ca 0.02 0.50 -0.03 0.00 0.46 0.00 0.00 57.72 58.67 2rdl n HIS 91 Cb 0.42 -2.42 0.03 0.00 -0.12 0.00 0.00 29.99 27.90 2rdl n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2rdl h PRO 92 N 2.37 -0.00 -0.97 1.57 0.11 -1.92 -2.23 132.00 130.93 2rdl h PRO 92 Ca -0.48 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.29 2rdl h PRO 92 Cb 1.28 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.19 2rdl h PRO 92 CO 0.61 -0.00 0.42 1.63 -0.21 0.00 0.00 178.00 180.46 2rdl n LYS 93 N -5.35 2.05 -1.82 1.05 4.76 -1.26 -4.96 118.16 112.62 2rdl n LYS 93 Ca 0.04 -2.13 -0.42 0.00 -2.87 0.00 0.00 58.31 52.93 2rdl n LYS 93 Cb 0.26 -1.85 -0.03 0.00 -1.84 0.00 0.00 35.03 31.57 2rdl n LYS 93 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 2rdl s TYR 94 N -2.32 2.84 -0.56 2.13 5.04 -0.84 -4.66 117.35 118.98 2rdl s TYR 94 Ca 0.40 0.41 -0.04 0.00 -2.44 0.00 0.00 57.07 55.39 2rdl s TYR 94 Cb 0.33 -4.05 0.15 0.00 0.35 0.00 0.00 41.96 38.74 2rdl s TYR 94 CO 0.08 -4.01 0.39 0.34 -1.34 0.00 0.00 175.55 171.00 2rdl s ASP 95 N 1.43 5.39 0.17 4.32 -1.08 -0.35 -4.97 116.67 121.57 2rdl s ASP 95 Ca 0.74 -2.51 -0.28 0.00 -0.52 0.00 0.00 52.55 49.98 2rdl s ASP 95 Cb -0.46 -1.89 -0.00 0.00 -1.46 0.00 0.00 42.92 39.10 2rdl s ASP 95 CO 0.32 -0.47 1.55 -0.78 0.52 0.00 0.00 175.17 176.32 2rdl h ASP 96 N 7.52 -1.78 -0.64 -0.34 3.58 -1.92 0.65 116.42 123.50 2rdl h ASP 96 Ca -0.06 0.28 -0.01 0.00 0.42 0.00 0.00 57.03 57.66 2rdl h ASP 96 Cb 1.00 0.79 -0.03 0.00 1.72 0.00 0.00 39.33 42.81 2rdl h ASP 96 CO 0.73 -0.31 0.35 0.03 -2.88 0.00 0.00 179.24 177.16 2rdl h ARG 97 N -0.17 0.88 0.00 0.28 3.08 -1.98 -3.04 114.38 113.43 2rdl h ARG 97 Ca 0.17 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2rdl h ARG 97 Cb 0.53 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.40 2rdl h ARG 97 CO -0.78 0.66 -0.59 1.28 -1.07 0.00 0.00 179.97 179.47 2rdl n LEU 98 N -4.55 0.58 -3.33 3.04 4.77 -1.08 -4.98 117.00 111.45 2rdl n LEU 98 Ca 0.05 -0.07 -0.18 0.00 -0.03 0.00 0.00 56.01 55.78 2rdl n LEU 98 Cb 0.08 -0.21 0.07 0.00 -2.33 0.00 0.00 43.42 41.03 2rdl n LEU 98 CO 0.37 0.14 0.02 0.52 -1.33 0.00 0.00 177.39 177.11 2rdl n VAL 99 N -1.52 -8.43 -4.65 4.08 0.31 0.22 -4.86 118.33 103.48 2rdl n VAL 99 Ca 0.05 -1.22 -0.30 0.00 -0.01 0.00 0.00 64.34 62.85 2rdl n VAL 99 Cb 0.34 -6.08 -0.13 0.00 -0.91 0.00 0.00 33.84 27.06 2rdl n VAL 99 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2rdl s LEU 100 N -5.64 2.52 -1.35 7.52 1.43 -1.10 -4.62 118.68 117.44 2rdl s LEU 100 Ca 0.42 -0.49 -0.09 0.00 -1.03 0.00 0.00 54.13 52.95 2rdl s LEU 100 Cb -0.07 -1.46 0.01 0.00 0.03 0.00 0.00 46.19 44.70 2rdl s LEU 100 CO 0.76 0.24 1.18 0.59 0.23 0.00 0.00 176.35 179.35 2rdl n ASN 101 N 1.48 -6.18 -4.17 2.29 3.02 -1.26 -1.21 115.26 109.23 2rdl n ASN 101 Ca -0.16 -0.54 -0.43 0.00 -0.03 0.00 0.00 54.58 53.42 2rdl n ASN 101 Cb 0.52 -5.04 0.00 0.00 -0.61 0.00 0.00 39.78 34.65 2rdl n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2rdl n ASP 102 N -3.02 4.64 -3.86 6.41 2.03 -1.26 -4.35 116.55 117.13 2rdl n ASP 102 Ca -0.01 -2.93 -0.12 0.00 0.52 0.00 0.00 54.79 52.26 2rdl n ASP 102 Cb 0.57 -1.65 -0.12 0.00 -0.72 0.00 0.00 41.12 39.20 2rdl n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2rdl s ILE 103 N 2.89 0.04 -0.10 5.18 2.07 -1.26 -3.75 121.20 126.28 2rdl s ILE 103 Ca 0.48 -0.36 -0.13 0.00 -1.41 0.00 0.00 60.65 59.23 2rdl s ILE 103 Cb 0.07 -0.28 0.03 0.00 0.13 0.00 0.00 42.46 42.41 2rdl s ILE 103 CO -0.00 -0.20 0.35 -0.32 -1.91 0.00 0.00 174.94 172.86 2rdl s MET 104 N -0.63 0.49 -0.04 3.50 -2.45 0.17 -2.13 119.30 118.21 2rdl s MET 104 Ca -0.07 0.31 0.00 0.00 -1.25 0.00 0.00 55.69 54.68 2rdl s MET 104 Cb -0.04 0.23 -0.03 0.00 1.25 0.00 0.00 34.83 36.24 2rdl s MET 104 CO 0.01 -0.09 -0.02 -0.51 1.05 0.00 0.00 175.02 175.46 2rdl s LEU 105 N -0.23 3.43 -0.13 4.11 1.43 -0.96 -0.10 118.68 126.22 2rdl s LEU 105 Ca -0.04 0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.10 2rdl s LEU 105 Cb -0.03 -1.86 0.02 0.00 0.03 0.00 0.00 46.19 44.34 2rdl s LEU 105 CO 0.02 0.33 -0.15 -0.76 0.23 0.00 0.00 176.35 176.02 2rdl s LEU 106 N -1.17 1.72 -0.19 1.79 1.43 0.22 -0.37 118.68 122.10 2rdl s LEU 106 Ca 0.16 -0.46 -0.17 0.00 -1.03 0.00 0.00 54.13 52.62 2rdl s LEU 106 Cb -0.11 -1.15 -0.04 0.00 0.03 0.00 0.00 46.19 44.92 2rdl s LEU 106 CO 0.06 -0.02 0.46 -0.75 0.23 0.00 0.00 176.35 176.33 2rdl s LYS 107 N 1.21 4.21 0.41 1.70 2.20 -0.36 -0.94 119.74 128.17 2rdl s LYS 107 Ca -0.01 0.33 -0.13 0.00 -0.36 0.00 0.00 55.97 55.80 2rdl s LYS 107 Cb -0.14 -3.53 -0.08 0.00 -1.51 0.00 0.00 37.83 32.57 2rdl s LYS 107 CO -0.06 -0.06 0.81 -0.51 -0.36 0.00 0.00 175.35 175.17 2rdl s LEU 108 N 1.35 3.85 0.38 5.43 1.43 -0.55 -0.40 118.68 130.17 2rdl s LEU 108 Ca 0.22 1.28 0.08 0.00 -1.03 0.00 0.00 54.13 54.68 2rdl s LEU 108 Cb -0.15 -4.15 0.82 0.00 0.03 0.00 0.00 46.19 42.74 2rdl s LEU 108 CO 0.09 -0.38 1.95 0.11 0.23 0.00 0.00 176.35 178.35 2rdl h LYS 109 N 1.47 0.65 -4.09 1.70 1.57 -1.60 -3.42 116.57 112.85 2rdl h LYS 109 Ca -0.47 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.14 2rdl h LYS 109 Cb 1.18 -0.15 -0.16 0.00 0.08 0.00 0.00 32.23 33.19 2rdl h LYS 109 CO 0.64 0.43 -0.62 -1.83 -0.57 0.00 0.00 179.45 177.49 2rdl s GLU 110 N -5.61 0.60 0.46 3.15 1.03 -1.26 -5.02 118.70 112.04 2rdl s GLU 110 Ca -0.09 -1.04 -0.23 0.00 0.03 0.00 0.00 54.97 53.64 2rdl s GLU 110 Cb 0.20 0.22 -0.07 0.00 -0.80 0.00 0.00 34.13 33.67 2rdl s GLU 110 CO 0.77 -0.13 1.17 0.15 -1.33 0.00 0.00 175.26 175.89 2rdl s LYS 111 N -3.40 3.76 0.56 -4.83 1.02 -1.26 -4.76 119.74 110.83 2rdl s LYS 111 Ca 0.02 1.79 -0.15 0.00 0.02 0.00 0.00 55.97 57.65 2rdl s LYS 111 Cb 0.04 -2.42 -0.06 0.00 -0.52 0.00 0.00 37.83 34.87 2rdl s LYS 111 CO -0.08 -0.55 1.01 0.00 -0.92 0.00 0.00 175.35 174.81 2rdl s ALA 112 N -1.53 3.01 -0.15 5.17 0.00 0.99 -4.95 121.76 124.30 2rdl s ALA 112 Ca 0.63 0.13 -0.11 0.00 0.00 0.00 0.00 51.96 52.61 2rdl s ALA 112 Cb -0.29 -3.13 -0.05 0.00 0.00 0.00 0.00 23.12 19.66 2rdl s ALA 112 CO 0.35 -0.49 0.21 -0.80 0.00 0.00 0.00 175.76 175.03 2rdl s ASN 113 N -3.37 6.38 0.13 0.00 0.02 -1.26 -4.88 114.94 111.96 2rdl s ASN 113 Ca 0.58 0.45 -0.30 0.00 -1.02 0.00 0.00 52.86 52.57 2rdl s ASN 113 Cb -0.11 -2.13 -0.07 0.00 0.02 0.00 0.00 41.25 38.96 2rdl s ASN 113 CO 0.39 0.22 1.21 -0.76 0.02 0.00 0.00 177.10 178.19 2rdl s LEU 114 N -0.09 4.42 0.00 0.60 1.43 -1.26 -4.81 118.68 118.97 2rdl s LEU 114 Ca 0.14 2.15 -0.01 0.00 -1.03 0.00 0.00 54.13 55.38 2rdl s LEU 114 Cb -0.12 -3.59 0.01 0.00 0.03 0.00 0.00 46.19 42.51 2rdl s LEU 114 CO 0.03 -0.42 0.32 0.35 0.23 0.00 0.00 176.35 176.85 2rdl n THR 115 N 3.15 0.00 0.34 5.49 -2.24 -1.02 -4.98 114.28 115.01 2rdl n THR 115 Ca 0.07 -1.18 0.14 0.00 -2.27 0.00 0.00 64.05 60.81 2rdl n THR 115 Cb 0.45 0.72 0.60 0.00 -2.10 0.00 0.00 70.33 70.01 2rdl n THR 115 CO 0.00 0.00 0.00 0.17 -0.57 0.00 0.00 175.07 174.67 2rdl h LEU 116 N 0.00 0.00 -1.78 3.22 8.10 -1.99 -2.86 115.31 120.00 2rdl h LEU 116 Ca -0.18 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.81 2rdl h LEU 116 Cb 0.78 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.00 2rdl h LEU 116 CO 0.24 0.00 0.00 0.61 -4.11 0.00 0.00 178.44 175.18 2rdl n GLY 117 N -0.14 0.44 2.75 0.17 0.00 -1.26 -4.88 105.19 102.27 2rdl n GLY 117 Ca 0.01 -0.39 -0.19 0.00 0.00 0.00 0.00 46.02 45.45 2rdl n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rdl s VAL 118 N -1.08 -0.20 0.27 1.61 1.01 -1.08 -3.49 120.40 117.44 2rdl s VAL 118 Ca 0.18 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.41 2rdl s VAL 118 Cb 0.12 -0.34 -0.00 0.00 0.00 0.00 0.00 36.38 36.15 2rdl s VAL 118 CO 0.17 0.05 0.34 0.61 0.00 0.00 0.00 175.10 176.27 2rdl n GLY 119 N 5.31 2.59 3.88 4.51 0.00 -0.12 -2.44 105.19 118.91 2rdl n GLY 119 Ca -0.05 -1.66 -0.21 0.00 0.00 0.00 0.00 46.02 44.11 2rdl n GLY 119 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rdl s THR 120 N -2.85 3.05 -0.14 2.61 -4.23 -1.26 -3.54 115.64 109.29 2rdl s THR 120 Ca 0.26 -1.33 0.02 0.00 -1.18 0.00 0.00 61.69 59.46 2rdl s THR 120 Cb -0.00 -3.08 0.01 0.00 1.34 0.00 0.00 72.50 70.77 2rdl s THR 120 CO 0.18 -0.07 -0.19 -0.22 -0.54 0.00 0.00 174.62 173.79 2rdl s LEU 121 N -4.09 1.94 0.33 4.79 2.96 0.11 -4.83 118.68 119.89 2rdl s LEU 121 Ca 0.46 -0.54 -0.28 0.00 -0.22 0.00 0.00 54.13 53.54 2rdl s LEU 121 Cb -0.05 -1.31 -0.09 0.00 0.50 0.00 0.00 46.19 45.24 2rdl s LEU 121 CO 0.28 0.03 1.15 -2.16 -1.32 0.00 0.00 176.35 174.33 2rdl s PRO 122 N 1.01 4.41 0.31 0.98 0.04 -1.26 -4.62 135.00 135.87 2rdl s PRO 122 Ca -0.04 1.87 0.07 0.00 0.04 0.00 0.00 61.00 62.94 2rdl s PRO 122 Cb -0.15 -3.00 -0.02 0.00 0.04 0.00 0.00 34.50 31.37 2rdl s PRO 122 CO -0.04 -0.02 0.32 0.96 0.04 0.00 0.00 177.00 178.26 2rdl s ILE 123 N -1.25 4.00 0.61 0.56 -4.36 -1.26 -2.73 121.20 116.77 2rdl s ILE 123 Ca 0.49 -1.26 -0.18 0.00 -0.26 0.00 0.00 60.65 59.45 2rdl s ILE 123 Cb -0.32 -3.34 -0.03 0.00 1.25 0.00 0.00 42.46 40.02 2rdl s ILE 123 CO 0.42 -0.22 1.16 -0.55 0.24 0.00 0.00 174.94 175.99 2rdl s SER 124 N -4.00 5.21 0.06 4.36 0.15 -0.28 -4.84 113.70 114.36 2rdl s SER 124 Ca 0.40 2.24 0.06 0.00 0.70 0.00 0.00 55.95 59.34 2rdl s SER 124 Cb -0.07 -2.58 -0.04 0.00 -1.71 0.00 0.00 66.02 61.62 2rdl s SER 124 CO 0.27 -1.57 -0.12 0.00 1.20 0.00 0.00 173.24 173.02 2rdl s ALA 125 N -1.86 2.84 -0.20 5.45 0.00 -1.26 -4.38 121.76 122.36 2rdl s ALA 125 Ca 0.73 -1.19 -0.06 0.00 0.00 0.00 0.00 51.96 51.45 2rdl s ALA 125 Cb -0.26 -0.88 -0.05 0.00 0.00 0.00 0.00 23.12 21.93 2rdl s ALA 125 CO 0.34 0.61 1.17 0.36 0.00 0.00 0.00 175.76 178.25 2rdl n LYS 126 N 1.16 0.02 0.00 0.00 -0.00 -1.26 -1.62 118.16 116.46 2rdl n LYS 126 Ca -0.15 -0.33 0.00 0.00 -0.00 0.00 0.00 58.31 57.83 2rdl n LYS 126 Cb 0.52 -1.56 0.00 0.00 -0.00 0.00 0.00 35.03 33.99 2rdl n LYS 126 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2rdl n SER 127 N 7.31 0.00 0.07 -5.58 3.41 -1.26 -4.95 113.62 112.62 2rdl n SER 127 Ca 0.08 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.70 2rdl n SER 127 Cb 0.47 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.45 2rdl n SER 127 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2rdl n ASN 128 N 0.00 0.03 -3.31 4.04 2.85 -0.64 -4.68 115.26 113.55 2rdl n ASN 128 Ca 0.00 0.16 -0.42 0.00 -0.11 0.00 0.00 54.58 54.22 2rdl n ASN 128 Cb 0.00 -0.08 -0.05 0.00 1.24 0.00 0.00 39.78 40.89 2rdl n ASN 128 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2rdl n SER 129 N -1.37 -0.22 -4.75 1.20 2.88 -1.26 -4.85 113.62 105.26 2rdl n SER 129 Ca -0.00 0.85 -0.41 0.00 -1.33 0.00 0.00 58.87 57.99 2rdl n SER 129 Cb 0.53 -0.69 -0.05 0.00 -0.75 0.00 0.00 64.21 63.26 2rdl n SER 129 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 2rdl s ILE 130 N -0.17 3.93 0.47 2.46 1.10 -1.26 -5.05 121.20 122.67 2rdl s ILE 130 Ca 0.63 1.80 -0.16 0.00 -0.51 0.00 0.00 60.65 62.41 2rdl s ILE 130 Cb -0.88 -4.15 -0.08 0.00 0.15 0.00 0.00 42.46 37.50 2rdl s ILE 130 CO 0.42 0.37 0.92 -2.16 -2.11 0.00 0.00 174.94 172.39 2rdl s PRO 131 N -0.84 3.95 0.39 3.50 0.04 -1.26 -5.00 135.00 135.77 2rdl s PRO 131 Ca 0.45 0.86 -0.25 0.00 0.04 0.00 0.00 61.00 62.10 2rdl s PRO 131 Cb -0.28 -2.21 -0.12 0.00 0.04 0.00 0.00 34.50 31.93 2rdl s PRO 131 CO 0.35 -0.17 0.91 -2.30 0.04 0.00 0.00 177.00 175.83 2rdl n PRO 132 N -1.34 1.17 0.00 0.56 -0.02 -1.26 -2.38 135.00 131.74 2rdl n PRO 132 Ca 0.06 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2rdl n PRO 132 Cb 0.54 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2rdl n PRO 132 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rdl n GLY 133 N 1.32 2.84 3.72 -1.23 0.00 -0.52 -4.98 105.19 106.34 2rdl n GLY 133 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2rdl n GLY 133 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rdl s ARG 134 N -0.17 4.25 -0.27 1.61 1.81 -1.00 -4.70 118.95 120.49 2rdl s ARG 134 Ca 0.00 2.27 -0.19 0.00 -1.72 0.00 0.00 55.73 56.09 2rdl s ARG 134 Cb 0.00 -3.19 -0.02 0.00 -0.45 0.00 0.00 34.95 31.29 2rdl s ARG 134 CO 0.00 -0.55 0.58 0.08 -0.68 0.00 0.00 175.30 174.72 2rdl s VAL 135 N 1.15 5.02 0.48 3.52 1.01 -1.26 -1.88 120.40 128.44 2rdl s VAL 135 Ca 0.68 0.97 0.01 0.00 0.00 0.00 0.00 61.98 63.65 2rdl s VAL 135 Cb -0.41 -3.90 0.01 0.00 0.00 0.00 0.00 36.38 32.09 2rdl s VAL 135 CO 0.31 0.03 0.12 0.00 0.00 0.00 0.00 175.10 175.56 2rdl s ARG 137 N -3.80 1.92 -0.13 0.00 0.52 0.35 0.04 118.95 117.85 2rdl s ARG 137 Ca 0.09 -0.63 -0.07 0.00 -0.52 0.00 0.00 55.73 54.61 2rdl s ARG 137 Cb -0.01 -1.63 -0.04 0.00 0.52 0.00 0.00 34.95 33.79 2rdl s ARG 137 CO 0.06 0.23 0.12 0.00 0.02 0.00 0.00 175.30 175.72 2rdl s ALA 138 N 0.11 3.75 -0.07 2.13 0.00 0.00 -0.14 121.76 127.55 2rdl s ALA 138 Ca -0.06 -0.67 0.02 0.00 0.00 0.00 0.00 51.96 51.25 2rdl s ALA 138 Cb -0.13 -1.94 0.01 0.00 0.00 0.00 0.00 23.12 21.06 2rdl s ALA 138 CO 0.03 0.52 -0.12 0.08 0.00 0.00 0.00 175.76 176.26 2rdl s VAL 139 N -0.70 1.16 0.16 0.00 1.01 -0.79 -1.75 120.40 119.49 2rdl s VAL 139 Ca 0.13 -0.48 -0.24 0.00 0.00 0.00 0.00 61.98 61.39 2rdl s VAL 139 Cb -0.12 -1.08 0.07 0.00 0.00 0.00 0.00 36.38 35.26 2rdl s VAL 139 CO 0.03 0.37 1.03 -0.83 0.00 0.00 0.00 175.10 175.69 2rdl s GLY 140 N 0.80 -0.07 -0.17 4.51 0.00 -0.96 -3.59 107.32 107.83 2rdl s GLY 140 Ca -0.12 -0.07 0.16 0.00 0.00 0.00 0.00 44.72 44.69 2rdl s GLY 140 CO 0.02 1.24 1.52 0.79 0.00 0.00 0.00 173.10 176.67 2rdl n TRP 141 N -0.59 1.27 -1.10 1.90 8.01 -1.26 -2.19 117.44 123.48 2rdl n TRP 141 Ca -0.05 -0.78 -0.30 0.00 -1.31 0.00 0.00 57.50 55.06 2rdl n TRP 141 Cb 0.60 -0.34 0.25 0.00 -2.01 0.00 0.00 31.31 29.81 2rdl n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2rdl n GLY 142 N 0.05 -2.71 3.74 6.99 0.00 -1.24 -3.22 105.19 108.79 2rdl n GLY 142 Ca 0.23 -1.51 -0.39 0.00 0.00 0.00 0.00 46.02 44.35 2rdl n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rdl n ARG 143 N -4.81 1.88 0.00 1.61 1.74 -0.01 -1.78 116.66 115.29 2rdl n ARG 143 Ca 0.15 0.68 0.14 0.00 -0.77 0.00 0.00 57.85 58.05 2rdl n ARG 143 Cb 0.59 -2.55 0.53 0.00 -1.02 0.00 0.00 32.46 30.01 2rdl n ARG 143 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2rdl n THR 144 N -0.67 0.00 -3.56 0.55 -2.24 -1.18 -2.12 114.28 105.06 2rdl n THR 144 Ca 0.08 -0.02 -0.06 0.00 -2.27 0.00 0.00 64.05 61.79 2rdl n THR 144 Cb 0.43 -0.19 -0.02 0.00 -2.10 0.00 0.00 70.33 68.45 2rdl n THR 144 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2rdl s ASN 145 N -2.83 -0.22 0.32 3.42 3.04 -1.26 -4.14 114.94 113.27 2rdl s ASN 145 Ca 0.18 0.00 0.07 0.00 0.04 0.00 0.00 52.86 53.15 2rdl s ASN 145 Cb 0.19 0.23 0.89 0.00 -1.54 0.00 0.00 41.25 41.03 2rdl s ASN 145 CO 0.55 -0.38 1.61 0.58 -3.04 0.00 0.00 177.10 176.42 2rdl h VAL 147 N 2.00 0.14 -0.31 -5.21 2.07 -1.94 -0.47 116.25 112.53 2rdl h VAL 147 Ca -0.14 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.35 2rdl h VAL 147 Cb 1.19 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2rdl h VAL 147 CO 0.26 0.02 0.00 0.59 0.02 0.00 0.00 177.57 178.46 2rdl n ASN 148 N -5.32 4.05 -4.73 0.57 5.03 -1.26 -4.99 115.26 108.62 2rdl n ASN 148 Ca 0.26 -2.92 -0.29 0.00 0.87 0.00 0.00 54.58 52.50 2rdl n ASN 148 Cb 0.86 -0.54 -0.07 0.00 -1.02 0.00 0.00 39.78 39.02 2rdl n ASN 148 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2rdl s GLU 149 N -2.66 2.69 0.91 3.52 2.02 -0.19 -5.11 118.70 119.89 2rdl s GLU 149 Ca 0.42 -0.81 -0.11 0.00 0.02 0.00 0.00 54.97 54.49 2rdl s GLU 149 Cb 0.33 -2.60 0.14 0.00 0.10 0.00 0.00 34.13 32.10 2rdl s GLU 149 CO 0.11 0.53 1.10 -1.25 0.02 0.00 0.00 175.26 175.77 2rdl s PRO 150 N -2.49 1.14 0.46 0.39 0.04 -1.26 -4.22 135.00 129.06 2rdl s PRO 150 Ca 0.28 1.07 -0.25 0.00 0.04 0.00 0.00 61.00 62.14 2rdl s PRO 150 Cb -0.11 -1.78 -0.08 0.00 0.04 0.00 0.00 34.50 32.57 2rdl s PRO 150 CO 0.20 -2.39 1.42 -2.14 0.04 0.00 0.00 177.00 174.13 2rdl s PRO 151 N -4.80 3.64 0.27 0.56 0.02 -1.26 -3.11 135.00 130.32 2rdl s PRO 151 Ca 0.64 2.39 -0.29 0.00 0.02 0.00 0.00 61.00 63.76 2rdl s PRO 151 Cb -0.20 -2.62 -0.10 0.00 0.02 0.00 0.00 34.50 31.61 2rdl s PRO 151 CO 0.58 -0.84 1.30 0.45 -0.33 0.00 0.00 177.00 178.15 2rdl s SER 152 N -0.56 6.87 0.17 2.53 0.15 -0.73 -4.87 113.70 117.25 2rdl s SER 152 Ca 0.62 2.53 0.03 0.00 0.70 0.00 0.00 55.95 59.83 2rdl s SER 152 Cb -0.43 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.25 2rdl s SER 152 CO 0.55 -0.50 1.38 0.44 1.20 0.00 0.00 173.24 176.32 2rdl h ASP 153 N 4.35 0.22 -3.16 5.45 3.32 -1.90 -3.45 116.42 121.24 2rdl h ASP 153 Ca -0.47 -0.18 -0.65 0.00 0.02 0.00 0.00 57.03 55.75 2rdl h ASP 153 Cb 1.22 -0.07 -0.10 0.00 0.22 0.00 0.00 39.33 40.60 2rdl h ASP 153 CO 0.71 0.98 -0.59 0.42 -1.72 0.00 0.00 179.24 179.04 2rdl s THR 154 N -3.20 4.60 0.16 0.35 -4.23 -1.26 0.25 115.64 112.31 2rdl s THR 154 Ca -0.02 -0.51 -0.34 0.00 -1.18 0.00 0.00 61.69 59.64 2rdl s THR 154 Cb 0.10 -3.12 -0.14 0.00 1.34 0.00 0.00 72.50 70.68 2rdl s THR 154 CO 0.82 0.31 1.57 -0.11 -0.54 0.00 0.00 174.62 176.67 2rdl n LEU 155 N 1.07 3.05 -4.56 4.79 7.94 -0.42 -4.90 117.00 123.97 2rdl n LEU 155 Ca -0.12 1.08 -0.29 0.00 -1.11 0.00 0.00 56.01 55.57 2rdl n LEU 155 Cb 0.52 -1.42 -0.10 0.00 0.53 0.00 0.00 43.42 42.96 2rdl n LEU 155 CO 0.39 -0.31 -0.43 -1.10 -1.11 0.00 0.00 177.39 174.82 2rdl s GLN 156 N 0.90 2.04 0.00 1.96 -1.52 -0.93 -1.34 119.66 120.77 2rdl s GLN 156 Ca 0.79 -1.13 0.03 0.00 -1.95 0.00 0.00 55.36 53.10 2rdl s GLN 156 Cb -0.69 -2.23 -0.01 0.00 -0.22 0.00 0.00 33.01 29.87 2rdl s GLN 156 CO 0.38 0.48 -0.11 -2.00 -0.25 0.00 0.00 175.29 173.79 2rdl s GLU 157 N -2.40 0.83 -0.12 2.91 2.12 0.76 -2.27 118.70 120.52 2rdl s GLU 157 Ca 0.22 -0.44 -0.08 0.00 0.36 0.00 0.00 54.97 55.03 2rdl s GLU 157 Cb -0.10 -0.79 0.04 0.00 0.26 0.00 0.00 34.13 33.54 2rdl s GLU 157 CO 0.14 0.21 0.30 0.54 -0.54 0.00 0.00 175.26 175.91 2rdl s VAL 158 N -0.38 -0.02 0.15 3.70 0.11 -0.71 0.39 120.40 123.63 2rdl s VAL 158 Ca 0.03 0.08 -0.30 0.00 -2.93 0.00 0.00 61.98 58.86 2rdl s VAL 158 Cb -0.05 -0.44 -0.07 0.00 -1.53 0.00 0.00 36.38 34.29 2rdl s VAL 158 CO -0.00 0.03 1.00 -0.54 -3.33 0.00 0.00 175.10 172.26 2rdl s LYS 159 N 0.86 4.68 -0.06 1.54 1.02 -1.26 -0.82 119.74 125.71 2rdl s LYS 159 Ca -0.06 1.54 -0.08 0.00 0.02 0.00 0.00 55.97 57.39 2rdl s LYS 159 Cb -0.07 -3.33 0.02 0.00 -0.52 0.00 0.00 37.83 33.93 2rdl s LYS 159 CO -0.06 0.21 0.21 -1.64 -0.92 0.00 0.00 175.35 173.15 2rdl s MET 160 N -0.25 0.32 0.08 1.68 -1.94 0.11 -4.88 119.30 114.41 2rdl s MET 160 Ca 0.47 0.15 -0.05 0.00 -1.71 0.00 0.00 55.69 54.54 2rdl s MET 160 Cb -0.26 0.15 -0.05 0.00 2.01 0.00 0.00 34.83 36.68 2rdl s MET 160 CO 0.32 -0.06 0.32 0.50 -0.01 0.00 0.00 175.02 176.09 2rdl s ARG 161 N -0.24 3.59 0.13 2.03 3.52 -1.26 0.18 118.95 126.89 2rdl s ARG 161 Ca -0.03 -0.11 -0.30 0.00 -0.13 0.00 0.00 55.73 55.16 2rdl s ARG 161 Cb -0.03 -2.97 -0.06 0.00 -1.56 0.00 0.00 34.95 30.33 2rdl s ARG 161 CO 0.01 0.56 0.99 0.42 -0.81 0.00 0.00 175.30 176.46 2rdl s ILE 162 N -1.49 4.37 0.34 4.11 -1.09 -0.78 -1.25 121.20 125.41 2rdl s ILE 162 Ca 0.35 1.99 0.09 0.00 -2.23 0.00 0.00 60.65 60.84 2rdl s ILE 162 Cb -0.13 -4.27 -0.05 0.00 -1.58 0.00 0.00 42.46 36.43 2rdl s ILE 162 CO 0.22 0.31 0.01 -0.76 -1.23 0.00 0.00 174.94 173.49 2rdl s LEU 163 N -0.09 2.99 0.50 2.97 1.43 0.00 -1.44 118.68 125.05 2rdl s LEU 163 Ca 0.47 -0.98 -0.23 0.00 -1.03 0.00 0.00 54.13 52.37 2rdl s LEU 163 Cb -0.25 -1.37 -0.06 0.00 0.03 0.00 0.00 46.19 44.55 2rdl s LEU 163 CO 0.31 -0.23 1.34 -0.62 0.23 0.00 0.00 176.35 177.38 2rdl s ASP 164 N -3.71 5.59 0.17 2.29 2.15 -1.26 -4.53 116.67 117.37 2rdl s ASP 164 Ca 0.35 2.73 0.11 0.00 0.43 0.00 0.00 52.55 56.17 2rdl s ASP 164 Cb -0.00 -2.64 0.62 0.00 -0.30 0.00 0.00 42.92 40.61 2rdl s ASP 164 CO 0.19 -1.35 1.35 -0.81 -0.17 0.00 0.00 175.17 174.39 2rdl n PRO 165 N -0.69 0.07 0.16 4.34 -0.04 -1.26 -1.40 135.00 136.18 2rdl n PRO 165 Ca 0.08 0.57 0.02 0.00 -0.04 0.00 0.00 63.50 64.13 2rdl n PRO 165 Cb 0.45 -1.74 0.25 0.00 -0.04 0.00 0.00 33.50 32.41 2rdl n PRO 165 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2rdl h GLN 166 N 0.00 0.00 0.00 0.54 5.75 -2.00 -2.77 115.11 116.63 2rdl h GLN 166 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2rdl h GLN 166 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 2rdl h GLN 166 CO 0.00 0.50 0.00 0.00 -2.65 0.00 0.00 178.83 176.68 2rdl h ALA 167 N 1.50 1.00 -0.38 3.38 0.00 -1.58 -0.52 119.26 122.65 2rdl h ALA 167 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2rdl h ALA 167 Cb 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2rdl h ALA 167 CO 0.07 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.32 2rdl h LYS 169 N 2.58 0.31 0.00 0.00 2.10 -1.21 -0.26 116.57 120.09 2rdl h LYS 169 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2rdl h LYS 169 Cb 1.56 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.82 2rdl h LYS 169 CO 0.29 0.20 0.00 -2.39 -2.00 0.00 0.00 179.45 175.55 2rdl n HIS 170 N -4.46 0.00 -3.17 0.07 1.44 -1.26 -4.27 115.22 103.57 2rdl n HIS 170 Ca 0.08 0.00 -0.45 0.00 -2.01 0.00 0.00 57.72 55.34 2rdl n HIS 170 Cb 0.37 -0.41 -0.05 0.00 0.12 0.00 0.00 29.99 30.03 2rdl n HIS 170 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2rdl s PHE 171 N -2.81 3.07 0.21 -1.40 0.08 -0.11 -4.96 117.98 112.06 2rdl s PHE 171 Ca 0.06 -1.03 -0.08 0.00 0.12 0.00 0.00 56.93 56.00 2rdl s PHE 171 Cb 0.06 -3.93 0.32 0.00 -0.57 0.00 0.00 43.02 38.90 2rdl s PHE 171 CO 0.16 -1.21 1.22 0.39 -0.10 0.00 0.00 175.22 175.68 2rdl n GLU 172 N 6.03 -0.10 -1.18 0.44 -0.58 -1.26 -1.88 120.64 122.12 2rdl n GLU 172 Ca -0.11 1.22 -0.20 0.00 -0.42 0.00 0.00 57.16 57.65 2rdl n GLU 172 Cb 0.42 -1.82 0.16 0.00 -0.57 0.00 0.00 31.44 29.63 2rdl n GLU 172 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2rdl n ASP 173 N -5.25 4.19 -4.74 1.62 9.92 -1.26 -5.00 116.55 116.03 2rdl n ASP 173 Ca 0.12 -3.72 -0.40 0.00 -0.53 0.00 0.00 54.79 50.26 2rdl n ASP 173 Cb 0.37 -0.77 -0.05 0.00 -0.64 0.00 0.00 41.12 40.04 2rdl n ASP 173 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 2rdl s PHE 174 N -3.41 3.83 -0.10 1.24 5.36 -0.79 -4.97 117.98 119.14 2rdl s PHE 174 Ca 0.54 1.70 0.01 0.00 -0.96 0.00 0.00 56.93 58.22 2rdl s PHE 174 Cb 0.46 -2.94 0.02 0.00 -0.34 0.00 0.00 43.02 40.22 2rdl s PHE 174 CO 0.05 0.30 -0.09 -1.01 -1.46 0.00 0.00 175.22 173.00 2rdl s HIS 175 N -0.33 1.49 0.46 10.12 3.76 -1.26 -5.03 115.29 124.49 2rdl s HIS 175 Ca 0.42 -0.68 0.30 0.00 -0.15 0.00 0.00 55.06 54.95 2rdl s HIS 175 Cb -0.23 -1.18 1.61 0.00 1.11 0.00 0.00 32.58 33.90 2rdl s HIS 175 CO 0.28 -0.43 2.13 -0.56 -0.85 0.00 0.00 174.74 175.31 2rdl h GLN 177 N 7.74 0.00 0.06 1.40 3.07 -1.94 -1.35 115.11 124.10 2rdl h GLN 177 Ca -0.31 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.43 2rdl h GLN 177 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.71 2rdl h GLN 177 CO 0.44 0.08 -0.03 1.05 0.09 0.00 0.00 178.83 180.45 2rdl h GLU 178 N 0.00 -0.08 -0.00 0.06 9.09 -2.03 -3.35 114.58 118.26 2rdl h GLU 178 Ca -0.00 0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2rdl h GLU 178 Cb 0.24 0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.36 2rdl h GLU 178 CO 0.01 0.50 -0.54 -0.35 0.05 0.00 0.00 179.01 178.67 2rdl n PRO 179 N -4.82 0.19 -4.26 1.06 -0.04 -1.22 -4.79 135.00 121.11 2rdl n PRO 179 Ca -0.08 -0.12 -0.16 0.00 -0.04 0.00 0.00 63.50 63.10 2rdl n PRO 179 Cb 0.31 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.16 2rdl n PRO 179 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2rdl s GLN 180 N -2.90 1.09 0.03 0.54 -0.21 -0.51 -0.24 119.66 117.46 2rdl s GLN 180 Ca 0.13 -1.41 0.06 0.00 0.02 0.00 0.00 55.36 54.16 2rdl s GLN 180 Cb 0.18 -0.79 -0.03 0.00 1.00 0.00 0.00 33.01 33.37 2rdl s GLN 180 CO 0.69 0.12 -0.14 -0.51 -2.12 0.00 0.00 175.29 173.34 2rdl s LEU 181 N -2.98 2.82 -0.32 2.90 1.43 0.13 -4.39 118.68 118.27 2rdl s LEU 181 Ca 0.15 -0.32 -0.09 0.00 -1.03 0.00 0.00 54.13 52.84 2rdl s LEU 181 Cb -0.00 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.58 2rdl s LEU 181 CO 0.02 0.26 0.15 0.00 0.23 0.00 0.00 176.35 177.02 2rdl s VAL 183 N 1.58 0.92 0.00 0.00 1.01 -0.67 -0.82 120.40 122.43 2rdl s VAL 183 Ca 0.04 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.58 2rdl s VAL 183 Cb -0.17 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.39 2rdl s VAL 183 CO 0.06 0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.05 2rdl n GLY 184 N 3.27 2.09 3.68 4.51 0.00 -0.38 -0.29 105.19 118.06 2rdl n GLY 184 Ca -0.18 -0.96 -0.50 0.00 0.00 0.00 0.00 46.02 44.37 2rdl n GLY 184 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rdl n ASN 185 N 0.00 3.15 0.08 1.61 2.85 -1.26 -2.98 115.26 118.70 2rdl n ASN 185 Ca 0.00 0.95 0.09 0.00 -0.11 0.00 0.00 54.58 55.51 2rdl n ASN 185 Cb 0.00 -1.32 0.38 0.00 1.24 0.00 0.00 39.78 40.09 2rdl n ASN 185 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2rdl n PRO 185 N 6.52 0.10 0.00 1.20 -0.04 -1.26 -2.04 135.00 139.48 2rdl n PRO 185 Ca 0.25 0.42 0.15 0.00 -0.04 0.00 0.00 63.50 64.27 2rdl n PRO 185 Cb 0.26 -1.73 0.65 0.00 -0.04 0.00 0.00 33.50 32.64 2rdl n PRO 185 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2rdl n LYS 185 N -1.92 1.24 -4.62 0.54 4.76 -1.26 -4.89 118.16 112.00 2rdl n LYS 185 Ca 0.02 -0.53 -0.28 0.00 -2.87 0.00 0.00 58.31 54.65 2rdl n LYS 185 Cb 0.14 -1.49 -0.11 0.00 -1.84 0.00 0.00 35.03 31.74 2rdl n LYS 185 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2rdl s LYS 186 N -2.12 1.96 0.09 1.97 -0.14 -0.87 -5.04 119.74 115.60 2rdl s LYS 186 Ca 0.38 -2.12 0.20 0.00 -1.36 0.00 0.00 55.97 53.08 2rdl s LYS 186 Cb 0.21 -1.63 -0.12 0.00 -1.68 0.00 0.00 37.83 34.61 2rdl s LYS 186 CO 0.38 -0.06 0.81 0.44 -0.76 0.00 0.00 175.35 176.16 2rdl n ILE 187 N -0.98 0.76 -1.68 2.17 -5.35 -1.26 -4.91 119.36 108.12 2rdl n ILE 187 Ca -0.05 -0.61 -0.56 0.00 -0.27 0.00 0.00 62.75 61.26 2rdl n ILE 187 Cb 0.67 -0.43 -0.07 0.00 -1.74 0.00 0.00 39.64 38.07 2rdl n ILE 187 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2rdl n ARG 188 N -2.68 1.17 -3.76 6.28 1.74 -1.26 -4.64 116.66 113.51 2rdl n ARG 188 Ca -0.06 0.43 0.00 0.00 -0.77 0.00 0.00 57.85 57.45 2rdl n ARG 188 Cb 0.69 -2.10 0.00 0.00 -1.02 0.00 0.00 32.46 30.03 2rdl n ARG 188 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2rdl s ASN 189 N 2.65 -0.05 0.44 0.55 2.47 -0.79 -4.79 114.94 115.42 2rdl s ASN 189 Ca 0.94 -0.28 0.08 0.00 0.42 0.00 0.00 52.86 54.02 2rdl s ASN 189 Cb -1.03 0.27 0.01 0.00 -1.45 0.00 0.00 41.25 39.05 2rdl s ASN 189 CO 0.60 -0.51 0.53 0.68 -3.72 0.00 0.00 177.10 174.68 2rdl s VAL 190 N -2.44 2.78 0.04 -5.21 -7.23 -1.26 0.40 120.40 107.48 2rdl s VAL 190 Ca 0.18 -1.12 -0.03 0.00 -1.81 0.00 0.00 61.98 59.21 2rdl s VAL 190 Cb 0.02 -2.90 0.01 0.00 0.56 0.00 0.00 36.38 34.06 2rdl s VAL 190 CO -0.01 0.00 0.13 0.00 -0.31 0.00 0.00 175.10 174.91 2rdl n TYR 191 N -1.79 -0.89 -1.64 2.82 -0.00 -1.26 -4.75 117.16 109.65 2rdl n TYR 191 Ca 0.07 -0.21 -0.63 0.00 -0.00 0.00 0.00 57.90 57.13 2rdl n TYR 191 Cb 0.60 0.10 -0.09 0.00 -0.00 0.00 0.00 39.34 39.96 2rdl n TYR 191 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 2rdl n LYS 192 N -0.09 0.14 0.00 2.98 5.02 -1.26 0.04 118.16 124.99 2rdl n LYS 192 Ca -0.01 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2rdl n LYS 192 Cb 0.08 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 2rdl n LYS 192 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rdl n GLY 193 N 2.90 2.12 0.06 0.72 0.00 -1.26 -0.83 105.19 108.91 2rdl n GLY 193 Ca 0.25 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.40 2rdl n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2rdl n ASP 194 N 0.00 0.68 -4.50 1.61 8.00 0.11 -3.31 116.55 119.13 2rdl n ASP 194 Ca 0.00 0.16 -0.43 0.00 0.71 0.00 0.00 54.79 55.23 2rdl n ASP 194 Cb 0.00 0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.13 2rdl n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2rdl n SER 195 N -2.07 -0.13 0.00 -2.24 7.64 -1.26 -0.17 113.62 115.40 2rdl n SER 195 Ca 0.04 1.00 0.00 0.00 1.01 0.00 0.00 58.87 60.92 2rdl n SER 195 Cb 0.43 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.45 2rdl n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rdl n GLY 196 N 1.59 2.86 3.75 0.23 0.00 -0.56 -0.84 105.19 112.22 2rdl n GLY 196 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 2rdl n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2rdl s GLY 197 N -1.61 2.21 0.19 -0.02 0.00 0.76 -3.57 107.32 105.28 2rdl s GLY 197 Ca 0.00 0.68 -0.09 0.00 0.00 0.00 0.00 44.72 45.30 2rdl s GLY 197 CO 0.00 1.05 0.51 2.56 0.00 0.00 0.00 173.10 177.22 2rdl s PRO 198 N -4.05 3.79 -0.38 2.90 0.04 -1.24 -1.18 135.00 134.89 2rdl s PRO 198 Ca 0.70 0.23 -0.05 0.00 0.04 0.00 0.00 61.00 61.92 2rdl s PRO 198 Cb -0.24 -2.75 0.08 0.00 0.04 0.00 0.00 34.50 31.63 2rdl s PRO 198 CO 0.44 0.39 0.16 -1.17 0.04 0.00 0.00 177.00 176.86 2rdl s LEU 199 N -2.58 4.81 -0.16 -3.56 2.96 -0.38 -1.89 118.68 117.87 2rdl s LEU 199 Ca 0.44 -1.61 -0.10 0.00 -0.22 0.00 0.00 54.13 52.64 2rdl s LEU 199 Cb -0.12 -1.85 -0.05 0.00 0.50 0.00 0.00 46.19 44.67 2rdl s LEU 199 CO 0.21 -0.45 0.18 -0.76 -1.32 0.00 0.00 176.35 174.21 2rdl s LEU 200 N 1.28 4.29 -0.16 -0.68 1.02 0.80 -0.70 118.68 124.53 2rdl s LEU 200 Ca 0.03 0.40 0.00 0.00 0.02 0.00 0.00 54.13 54.58 2rdl s LEU 200 Cb -0.22 -2.17 0.02 0.00 0.02 0.00 0.00 46.19 43.84 2rdl s LEU 200 CO -0.01 0.24 -0.15 0.00 0.02 0.00 0.00 176.35 176.45 2rdl n ALA 204 N 4.74 -0.20 -0.37 0.00 0.00 -1.26 -1.37 120.51 122.06 2rdl n ALA 204 Ca -0.18 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2rdl n ALA 204 Cb 0.50 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 18.23 2rdl n ALA 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rdl n GLY 205 N -0.31 0.81 3.30 0.00 0.00 -1.26 -5.06 105.19 102.67 2rdl n GLY 205 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 2rdl n GLY 205 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2rdl s ILE 208 N -2.02 2.46 -0.28 -0.61 1.01 -0.47 -4.78 121.20 116.51 2rdl s ILE 208 Ca 0.00 -0.89 -0.29 0.00 0.00 0.00 0.00 60.65 59.48 2rdl s ILE 208 Cb 0.00 -1.97 -0.01 0.00 0.01 0.00 0.00 42.46 40.48 2rdl s ILE 208 CO 0.00 0.55 1.54 0.00 0.00 0.00 0.00 174.94 177.03 2rdl s ALA 209 N 0.19 3.21 -0.16 9.38 0.00 -1.10 -1.09 121.76 132.18 2rdl s ALA 209 Ca -0.12 0.27 0.18 0.00 0.00 0.00 0.00 51.96 52.30 2rdl s ALA 209 Cb -0.16 -3.87 -0.26 0.00 0.00 0.00 0.00 23.12 18.83 2rdl s ALA 209 CO 0.06 -2.05 0.14 1.04 0.00 0.00 0.00 175.76 174.95 2rdl n GLN 210 N 7.73 0.76 -4.04 0.00 1.13 0.13 -1.13 117.38 121.95 2rdl n GLN 210 Ca 0.18 -0.05 -0.13 0.00 -1.94 0.00 0.00 57.00 55.07 2rdl n GLN 210 Cb 0.46 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.27 2rdl n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2rdl s GLY 211 N -5.23 1.19 -0.08 1.08 0.00 -1.06 -1.72 107.32 101.50 2rdl s GLY 211 Ca -0.09 -1.32 0.01 0.00 0.00 0.00 0.00 44.72 43.32 2rdl s GLY 211 CO 0.82 -0.87 -0.09 -0.42 0.00 0.00 0.00 173.10 172.54 2rdl s ILE 212 N -3.19 1.01 0.07 0.90 1.01 -0.94 -1.25 121.20 118.82 2rdl s ILE 212 Ca 0.28 -0.36 -0.32 0.00 0.00 0.00 0.00 60.65 60.25 2rdl s ILE 212 Cb -0.01 -0.98 -0.12 0.00 0.01 0.00 0.00 42.46 41.37 2rdl s ILE 212 CO 0.17 0.34 1.80 0.00 0.00 0.00 0.00 174.94 177.25 2rdl n ALA 213 N 4.30 1.64 -0.00 9.38 0.00 -0.32 -0.77 120.51 134.74 2rdl n ALA 213 Ca -0.19 0.33 -0.00 0.00 0.00 0.00 0.00 53.44 53.58 2rdl n ALA 213 Cb 0.51 -2.52 -0.00 0.00 0.00 0.00 0.00 19.45 17.44 2rdl n ALA 213 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2rdl n SER 214 N 5.51 0.05 -3.99 0.00 2.88 -0.11 -1.49 113.62 116.47 2rdl n SER 214 Ca 0.19 0.01 -0.08 0.00 -1.33 0.00 0.00 58.87 57.66 2rdl n SER 214 Cb 0.34 -0.21 -0.09 0.00 -0.75 0.00 0.00 64.21 63.49 2rdl n SER 214 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 2rdl s TYR 215 N -1.04 0.33 0.36 0.66 -0.85 -0.88 -4.83 117.35 111.10 2rdl s TYR 215 Ca -0.00 -0.76 0.05 0.00 -0.52 0.00 0.00 57.07 55.83 2rdl s TYR 215 Cb 0.00 -0.24 -0.02 0.00 0.38 0.00 0.00 41.96 42.09 2rdl s TYR 215 CO 0.01 -0.39 0.17 1.33 -1.52 0.00 0.00 175.55 175.15 2rdl n VAL 216 N 0.40 0.00 -3.49 -3.49 0.24 -1.26 -1.19 118.33 109.54 2rdl n VAL 216 Ca -0.17 -2.24 -0.36 0.00 -2.04 0.00 0.00 64.34 59.54 2rdl n VAL 216 Cb 0.60 0.89 -0.06 0.00 -1.47 0.00 0.00 33.84 33.80 2rdl n VAL 216 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2rdl s LEU 217 N 0.00 4.39 0.42 1.34 2.96 -1.26 -4.97 118.68 121.56 2rdl s LEU 217 Ca 0.24 0.93 0.09 0.00 -0.22 0.00 0.00 54.13 55.17 2rdl s LEU 217 Cb 0.01 -2.92 0.91 0.00 0.50 0.00 0.00 46.19 44.69 2rdl s LEU 217 CO 0.17 0.21 2.04 0.03 -1.32 0.00 0.00 176.35 177.48 2rdl h ARG 218 N 4.01 0.49 -0.02 1.98 3.08 -2.01 -0.39 114.38 121.53 2rdl h ARG 218 Ca -0.50 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.52 2rdl h ARG 218 Cb 1.20 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.14 2rdl h ARG 218 CO 0.65 0.33 0.00 0.27 -1.07 0.00 0.00 179.97 180.14 2rdl n ASN 219 N -4.48 0.10 -0.48 7.04 0.23 -1.26 -4.89 115.26 111.53 2rdl n ASN 219 Ca 0.04 -1.76 -0.06 0.00 -0.53 0.00 0.00 54.58 52.27 2rdl n ASN 219 Cb 0.13 -0.01 -0.03 0.00 -2.08 0.00 0.00 39.78 37.79 2rdl n ASN 219 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2rdl n ALA 223 N -0.56 -0.10 -1.00 -2.53 0.00 -0.15 -5.00 120.51 111.17 2rdl n ALA 223 Ca 0.06 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.60 2rdl n ALA 223 Cb 0.04 -1.57 0.00 0.00 0.00 0.00 0.00 19.45 17.92 2rdl n ALA 223 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2rdl n LYS 224 N -0.30 -0.06 -0.50 0.00 4.81 -1.26 -4.91 118.16 115.94 2rdl n LYS 224 Ca -0.06 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.10 2rdl n LYS 224 Cb 0.52 0.00 0.22 0.00 0.02 0.00 0.00 35.03 35.79 2rdl n LYS 224 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2rdl n PRO 225 N -0.91 -2.67 -4.56 1.64 -0.04 -1.16 -4.58 135.00 122.72 2rdl n PRO 225 Ca 0.00 -0.77 -0.26 0.00 -0.04 0.00 0.00 63.50 62.42 2rdl n PRO 225 Cb 0.00 -1.81 -0.11 0.00 -0.04 0.00 0.00 33.50 31.54 2rdl n PRO 225 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2rdl s SER 226 N -2.24 3.65 -0.20 3.54 0.01 0.60 -4.77 113.70 114.29 2rdl s SER 226 Ca 0.57 -1.27 -0.06 0.00 1.31 0.00 0.00 55.95 56.50 2rdl s SER 226 Cb -0.14 -0.34 -0.03 0.00 0.21 0.00 0.00 66.02 65.71 2rdl s SER 226 CO 0.58 -0.33 0.04 -0.69 0.41 0.00 0.00 173.24 173.24 2rdl s VAL 227 N -2.71 4.37 0.06 3.43 1.01 -0.33 -1.67 120.40 124.56 2rdl s VAL 227 Ca 0.33 -0.17 0.08 0.00 0.00 0.00 0.00 61.98 62.22 2rdl s VAL 227 Cb 0.06 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 2rdl s VAL 227 CO 0.17 0.43 -0.19 -0.36 0.00 0.00 0.00 175.10 175.15 2rdl s PHE 228 N 0.77 2.52 -0.02 5.22 0.40 -0.76 -0.93 117.98 125.17 2rdl s PHE 228 Ca 0.02 -0.28 -0.30 0.00 -0.60 0.00 0.00 56.93 55.77 2rdl s PHE 228 Cb -0.14 -1.42 -0.03 0.00 0.51 0.00 0.00 43.02 41.94 2rdl s PHE 228 CO 0.02 0.27 1.03 0.99 0.70 0.00 0.00 175.22 178.24 2rdl s THR 229 N -0.97 4.68 -0.48 0.64 2.01 0.05 0.21 115.64 121.79 2rdl s THR 229 Ca 0.15 1.94 -0.29 0.00 0.31 0.00 0.00 61.69 63.80 2rdl s THR 229 Cb -0.10 -4.24 0.02 0.00 0.01 0.00 0.00 72.50 68.18 2rdl s THR 229 CO 0.06 0.10 1.35 -0.60 -0.69 0.00 0.00 174.62 174.84 2rdl s ARG 230 N 1.39 3.52 0.12 4.92 3.52 0.67 -2.22 118.95 130.87 2rdl s ARG 230 Ca 0.52 0.69 -0.26 0.00 -0.13 0.00 0.00 55.73 56.55 2rdl s ARG 230 Cb -0.22 -4.03 -0.05 0.00 -1.56 0.00 0.00 34.95 29.09 2rdl s ARG 230 CO 0.25 -1.64 1.63 0.82 -0.81 0.00 0.00 175.30 175.55 2rdl h ILE 231 N 6.38 0.40 -1.21 4.11 2.04 -1.64 -2.51 117.51 125.09 2rdl h ILE 231 Ca -0.26 0.00 0.36 0.00 1.00 0.00 0.00 64.86 65.96 2rdl h ILE 231 Cb 1.09 0.40 -0.11 0.00 -0.74 0.00 0.00 36.82 37.47 2rdl h ILE 231 CO 1.13 0.00 0.79 0.77 0.00 0.00 0.00 178.15 180.84 2rdl h SER 232 N -0.41 0.30 0.39 1.72 4.64 -1.76 0.37 113.55 118.80 2rdl h SER 232 Ca 0.06 0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.47 2rdl h SER 232 Cb 0.49 0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 2rdl h SER 232 CO -0.23 -0.05 -0.05 -0.74 -0.87 0.00 0.00 176.83 174.90 2rdl h HIS 233 N 0.20 0.00 -0.21 4.77 -0.00 -1.75 -2.83 115.15 115.33 2rdl h HIS 233 Ca 0.71 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 61.08 2rdl h HIS 233 Cb 2.14 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 29.55 2rdl h HIS 233 CO -0.00 0.05 0.00 0.66 -0.00 0.00 0.00 177.93 178.63 2rdl n TYR 234 N -3.34 0.28 -0.29 5.26 4.02 0.13 -4.74 117.16 118.48 2rdl n TYR 234 Ca -0.02 -0.37 0.07 0.00 -0.01 0.00 0.00 57.90 57.57 2rdl n TYR 234 Cb 0.19 -0.02 0.18 0.00 -0.02 0.00 0.00 39.34 39.67 2rdl n TYR 234 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 2rdl h ARG 235 N 1.65 0.06 -0.66 -0.72 9.65 -1.22 0.29 114.38 123.43 2rdl h ARG 235 Ca 0.00 -0.00 0.06 0.00 -1.10 0.00 0.00 59.98 58.94 2rdl h ARG 235 Cb 0.61 -0.01 -0.06 0.00 -1.39 0.00 0.00 29.97 29.12 2rdl h ARG 235 CO 0.00 0.04 0.36 -1.35 2.80 0.00 0.00 179.97 181.82 2rdl h PRO 236 N 0.06 0.64 -0.40 0.20 0.11 -1.85 0.11 132.00 130.87 2rdl h PRO 236 Ca 0.46 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.43 2rdl h PRO 236 Cb 0.84 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.79 2rdl h PRO 236 CO -0.77 0.42 -0.14 2.35 -0.21 0.00 0.00 178.00 179.65 2rdl h TRP 237 N 0.66 0.91 -0.19 0.65 7.01 -1.37 -2.10 115.95 121.51 2rdl h TRP 237 Ca 0.30 -0.21 0.01 0.00 2.11 0.00 0.00 58.89 61.10 2rdl h TRP 237 Cb 0.21 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.04 2rdl h TRP 237 CO -0.09 0.95 0.11 0.82 -2.79 0.00 0.00 178.44 177.44 2rdl h ILE 238 N 0.61 1.02 -0.88 2.65 2.04 -0.56 -2.16 117.51 120.24 2rdl h ILE 238 Ca 0.10 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 65.89 2rdl h ILE 238 Cb 0.68 0.77 -0.05 0.00 -0.74 0.00 0.00 36.82 37.48 2rdl h ILE 238 CO 0.05 0.04 0.58 0.78 0.00 0.00 0.00 178.15 179.60 2rdl h ASN 239 N 0.23 0.99 0.10 1.72 2.35 -0.73 -1.86 115.58 118.38 2rdl h ASN 239 Ca 0.07 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2rdl h ASN 239 Cb -0.00 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.13 2rdl h ASN 239 CO -0.04 0.70 -0.05 0.50 -1.65 0.00 0.00 177.43 176.90 2rdl h LYS 240 N 1.16 -0.13 -1.01 0.81 3.64 -1.05 -1.36 116.57 118.63 2rdl h LYS 240 Ca 0.33 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.77 2rdl h LYS 240 Cb -0.09 0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 31.69 2rdl h LYS 240 CO -0.08 -0.05 0.66 0.82 -2.27 0.00 0.00 179.45 178.52 2rdl h ILE 241 N -0.17 1.14 -0.12 2.00 1.08 -1.15 -1.90 117.51 118.39 2rdl h ILE 241 Ca -0.01 -0.42 -0.10 0.00 -0.39 0.00 0.00 64.86 63.93 2rdl h ILE 241 Cb 0.14 -0.21 -0.01 0.00 -3.07 0.00 0.00 36.82 33.67 2rdl h ILE 241 CO 0.02 0.23 -0.38 -0.07 -0.69 0.00 0.00 178.15 177.26 2rdl h LEU 242 N 1.24 0.26 -0.35 1.44 3.38 -1.09 -2.38 115.31 117.80 2rdl h LEU 242 Ca 0.41 -0.10 -0.19 0.00 0.09 0.00 0.00 57.88 58.10 2rdl h LEU 242 Cb 0.07 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2rdl h LEU 242 CO -0.14 0.62 -0.62 0.03 0.09 0.00 0.00 178.44 178.42 2rdl h ARG 243 N 0.21 0.72 -0.37 1.13 3.08 -0.58 -3.23 114.38 115.34 2rdl h ARG 243 Ca 0.02 -0.49 0.00 0.00 0.07 0.00 0.00 59.98 59.58 2rdl h ARG 243 Cb 0.77 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.89 2rdl h ARG 243 CO 0.06 1.11 0.00 0.39 -1.07 0.00 0.00 179.97 180.46 2rdl n GLU 244 N -3.96 1.98 0.00 0.04 1.02 -0.78 -5.11 120.64 113.83 2rdl n GLU 244 Ca -0.05 -1.52 0.00 0.00 -0.02 0.00 0.00 57.16 55.58 2rdl n GLU 244 Cb 0.65 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 2rdl n GLU 244 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40