#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2onk h PHE 2 N 0.00 0.19 -3.18 2.03 3.57 -1.45 -3.41 116.94 114.69 2onk h PHE 2 Ca 0.00 0.02 -0.61 0.00 3.53 0.00 0.00 57.97 60.91 2onk h PHE 2 Cb 0.00 -0.02 -0.35 0.00 2.79 0.00 0.00 35.95 38.36 2onk h PHE 2 CO 0.00 0.05 -0.84 -1.17 -2.23 0.00 0.00 178.31 174.12 2onk s LEU 3 N -10.38 1.80 -0.04 0.59 2.96 -1.12 -0.27 118.68 112.23 2onk s LEU 3 Ca -0.13 -0.50 0.06 0.00 -0.22 0.00 0.00 54.13 53.35 2onk s LEU 3 Cb 0.13 -1.21 -0.02 0.00 0.50 0.00 0.00 46.19 45.59 2onk s LEU 3 CO 0.72 -0.01 -0.23 -0.54 -1.32 0.00 0.00 176.35 174.97 2onk s LYS 4 N 1.19 2.33 -0.19 1.98 1.02 -0.06 -0.59 119.74 125.42 2onk s LYS 4 Ca -0.01 -0.87 -0.04 0.00 0.02 0.00 0.00 55.97 55.07 2onk s LYS 4 Cb -0.14 -2.15 0.09 0.00 -0.52 0.00 0.00 37.83 35.10 2onk s LYS 4 CO -0.06 0.52 0.20 0.08 -0.92 0.00 0.00 175.35 175.16 2onk s VAL 5 N -0.50 -0.28 -0.23 3.17 1.01 0.12 -0.95 120.40 122.74 2onk s VAL 5 Ca 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.94 2onk s VAL 5 Cb -0.11 -0.64 0.06 0.00 0.00 0.00 0.00 36.38 35.68 2onk s VAL 5 CO 0.01 -0.20 -0.04 -0.60 0.00 0.00 0.00 175.10 174.27 2onk s ARG 6 N 2.30 1.46 -0.05 2.72 3.52 -1.07 -0.01 118.95 127.81 2onk s ARG 6 Ca 0.06 -0.89 -0.29 0.00 -0.13 0.00 0.00 55.73 54.47 2onk s ARG 6 Cb -0.16 -2.51 0.10 0.00 -1.56 0.00 0.00 34.95 30.83 2onk s ARG 6 CO -0.11 -0.60 0.87 0.00 -0.81 0.00 0.00 175.30 174.65 2onk s ALA 7 N 1.47 -1.84 0.07 6.12 0.00 -0.61 -1.08 121.76 125.90 2onk s ALA 7 Ca -0.05 1.22 0.08 0.00 0.00 0.00 0.00 51.96 53.21 2onk s ALA 7 Cb -0.19 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 2onk s ALA 7 CO -0.06 -0.51 -0.19 -1.21 0.00 0.00 0.00 175.76 173.78 2onk s GLU 8 N -2.18 1.90 -0.16 0.00 2.02 -0.11 -0.66 118.70 119.52 2onk s GLU 8 Ca -0.00 -1.09 -0.09 0.00 0.02 0.00 0.00 54.97 53.81 2onk s GLU 8 Cb -0.01 -2.12 0.05 0.00 0.10 0.00 0.00 34.13 32.15 2onk s GLU 8 CO -0.03 0.51 0.38 0.21 0.02 0.00 0.00 175.26 176.36 2onk s LYS 9 N -1.71 0.38 -0.12 1.61 2.47 0.15 -1.15 119.74 121.36 2onk s LYS 9 Ca 0.15 0.71 -0.02 0.00 -1.56 0.00 0.00 55.97 55.25 2onk s LYS 9 Cb -0.10 0.00 -0.03 0.00 -1.46 0.00 0.00 37.83 36.24 2onk s LYS 9 CO 0.07 -0.14 -0.05 0.50 0.16 0.00 0.00 175.35 175.88 2onk s ARG 10 N 1.17 3.33 -0.37 4.03 3.52 -1.26 0.47 118.95 129.84 2onk s ARG 10 Ca -0.08 -0.54 0.04 0.00 -0.13 0.00 0.00 55.73 55.02 2onk s ARG 10 Cb -0.08 -2.78 0.16 0.00 -1.56 0.00 0.00 34.95 30.69 2onk s ARG 10 CO -0.10 0.40 0.41 -0.51 -0.81 0.00 0.00 175.30 174.69 2onk s LEU 11 N -0.07 -0.30 0.00 -0.88 1.43 0.45 -5.02 118.68 114.29 2onk s LEU 11 Ca 0.01 -1.37 0.00 0.00 -1.03 0.00 0.00 54.13 51.75 2onk s LEU 11 Cb -0.13 0.78 0.00 0.00 0.03 0.00 0.00 46.19 46.87 2onk s LEU 11 CO 0.03 -0.26 0.00 0.61 0.23 0.00 0.00 176.35 176.96 2onk n GLY 12 N 4.38 1.22 0.72 -3.19 0.00 -1.26 -1.84 105.19 105.22 2onk n GLY 12 Ca 0.10 -0.61 0.04 0.00 0.00 0.00 0.00 46.02 45.55 2onk n GLY 12 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2onk n ASN 13 N 5.22 2.04 -4.66 1.61 3.02 -1.26 -4.83 115.26 116.39 2onk n ASN 13 Ca 0.00 -2.11 -0.35 0.00 -0.03 0.00 0.00 54.58 52.09 2onk n ASN 13 Cb 0.00 -0.31 -0.09 0.00 -0.61 0.00 0.00 39.78 38.76 2onk n ASN 13 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2onk s PHE 14 N -1.63 3.25 -0.09 3.10 5.36 -0.77 -5.09 117.98 122.10 2onk s PHE 14 Ca 0.21 0.12 0.02 0.00 -0.96 0.00 0.00 56.93 56.32 2onk s PHE 14 Cb 0.13 -1.98 0.02 0.00 -0.34 0.00 0.00 43.02 40.84 2onk s PHE 14 CO 0.12 0.28 -0.13 1.03 -1.46 0.00 0.00 175.22 175.06 2onk s ARG 15 N -0.11 1.94 -0.41 10.12 0.52 -1.26 -0.41 118.95 129.34 2onk s ARG 15 Ca 0.06 -0.47 -0.02 0.00 -0.52 0.00 0.00 55.73 54.78 2onk s ARG 15 Cb -0.12 -1.67 0.11 0.00 0.52 0.00 0.00 34.95 33.79 2onk s ARG 15 CO 0.01 -0.05 0.20 -1.17 0.02 0.00 0.00 175.30 174.31 2onk s LEU 16 N 0.95 5.19 -0.28 2.53 0.20 0.18 -4.21 118.68 123.24 2onk s LEU 16 Ca -0.08 -2.10 0.03 0.00 0.69 0.00 0.00 54.13 52.67 2onk s LEU 16 Cb -0.15 -1.81 0.07 0.00 -0.43 0.00 0.00 46.19 43.88 2onk s LEU 16 CO -0.00 -0.52 -0.05 0.54 -0.29 0.00 0.00 176.35 176.04 2onk s ASN 17 N 1.65 4.46 0.19 3.68 6.03 -1.15 0.31 114.94 130.10 2onk s ASN 17 Ca 0.09 -1.61 0.10 0.00 -1.03 0.00 0.00 52.86 50.41 2onk s ASN 17 Cb -0.22 -1.51 -0.04 0.00 -3.03 0.00 0.00 41.25 36.45 2onk s ASN 17 CO -0.05 -0.26 -0.16 0.68 -2.03 0.00 0.00 177.10 175.29 2onk s VAL 18 N 1.09 2.83 -0.27 3.54 -7.23 0.17 -4.39 120.40 116.15 2onk s VAL 18 Ca -0.02 -1.83 -0.03 0.00 -1.81 0.00 0.00 61.98 58.30 2onk s VAL 18 Cb -0.19 -2.39 0.09 0.00 0.56 0.00 0.00 36.38 34.44 2onk s VAL 18 CO -0.07 -0.12 0.09 -0.62 -0.31 0.00 0.00 175.10 174.08 2onk s ASP 19 N -2.78 3.48 -0.05 4.85 -1.08 -1.23 -1.57 116.67 118.30 2onk s ASP 19 Ca 0.23 -1.26 -0.01 0.00 -0.52 0.00 0.00 52.55 51.00 2onk s ASP 19 Cb -0.08 -0.58 0.03 0.00 -1.46 0.00 0.00 42.92 40.82 2onk s ASP 19 CO 0.13 -0.39 0.01 0.12 0.52 0.00 0.00 175.17 175.56 2onk s PHE 20 N 1.87 0.44 0.10 -5.34 5.36 0.98 -4.89 117.98 116.50 2onk s PHE 20 Ca 0.06 -0.02 0.04 0.00 -0.96 0.00 0.00 56.93 56.06 2onk s PHE 20 Cb -0.17 -0.63 -0.04 0.00 -0.34 0.00 0.00 43.02 41.85 2onk s PHE 20 CO -0.24 -0.24 0.03 -1.21 -1.46 0.00 0.00 175.22 172.10 2onk s GLU 21 N 1.77 2.67 -0.05 10.12 2.02 -1.26 0.12 118.70 134.09 2onk s GLU 21 Ca 0.01 -0.81 -0.08 0.00 0.02 0.00 0.00 54.97 54.11 2onk s GLU 21 Cb -0.13 -2.60 0.02 0.00 0.10 0.00 0.00 34.13 31.52 2onk s GLU 21 CO -0.04 0.54 0.20 1.41 0.02 0.00 0.00 175.26 177.39 2onk s MET 22 N -2.43 0.36 0.00 1.61 -2.45 0.24 -4.98 119.30 111.66 2onk s MET 22 Ca 0.27 0.04 0.00 0.00 -1.25 0.00 0.00 55.69 54.75 2onk s MET 22 Cb -0.12 0.16 0.00 0.00 1.25 0.00 0.00 34.83 36.13 2onk s MET 22 CO 0.20 -0.07 0.00 0.41 1.05 0.00 0.00 175.02 176.61 2onk n GLY 23 N 2.34 -1.23 0.15 2.11 0.00 -1.26 -1.59 105.19 105.71 2onk n GLY 23 Ca -0.17 -1.41 0.09 0.00 0.00 0.00 0.00 46.02 44.53 2onk n GLY 23 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2onk n ARG 24 N 0.00 1.25 0.00 1.61 0.63 -1.26 -4.15 116.66 114.74 2onk n ARG 24 Ca 0.00 -2.59 0.00 0.00 -0.92 0.00 0.00 57.85 54.34 2onk n ARG 24 Cb 0.00 -1.46 0.00 0.00 0.45 0.00 0.00 32.46 31.45 2onk n ARG 24 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 2onk n ASP 25 N -1.34 0.00 -4.34 6.15 5.68 -1.26 -4.02 116.55 117.43 2onk n ASP 25 Ca 0.16 0.00 -0.46 0.00 -0.50 0.00 0.00 54.79 53.98 2onk n ASP 25 Cb 0.65 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.60 2onk n ASP 25 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2onk s TYR 26 N 2.69 3.50 0.43 2.11 6.04 -1.26 -0.97 117.35 129.88 2onk s TYR 26 Ca 0.00 -1.65 -0.05 0.00 0.04 0.00 0.00 57.07 55.41 2onk s TYR 26 Cb 0.00 -3.88 -0.04 0.00 -1.04 0.00 0.00 41.96 37.00 2onk s TYR 26 CO 0.00 -1.07 0.72 0.00 -1.54 0.00 0.00 175.55 173.66 2onk s VAL 28 N -2.56 -0.70 -0.22 0.00 1.01 -1.07 -2.40 120.40 114.47 2onk s VAL 28 Ca 0.47 0.06 -0.08 0.00 0.00 0.00 0.00 61.98 62.43 2onk s VAL 28 Cb -0.10 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 2onk s VAL 28 CO 0.40 -0.01 0.08 -1.48 0.00 0.00 0.00 175.10 174.09 2onk s LEU 29 N 2.64 3.66 0.26 3.92 2.34 -0.64 -1.33 118.68 129.54 2onk s LEU 29 Ca 0.05 -0.06 -0.16 0.00 0.06 0.00 0.00 54.13 54.02 2onk s LEU 29 Cb -0.13 -1.96 -0.08 0.00 -0.56 0.00 0.00 46.19 43.45 2onk s LEU 29 CO -0.15 0.06 0.69 -0.76 -1.06 0.00 0.00 176.35 175.13 2onk s LEU 30 N 1.07 4.19 0.00 1.48 1.43 -0.00 -2.56 118.68 124.28 2onk s LEU 30 Ca 0.05 1.26 0.00 0.00 -1.03 0.00 0.00 54.13 54.40 2onk s LEU 30 Cb -0.14 -3.80 0.00 0.00 0.03 0.00 0.00 46.19 42.28 2onk s LEU 30 CO 0.03 -0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.14 2onk n GLY 31 N 0.11 1.38 3.42 -3.19 0.00 -0.74 0.14 105.19 106.31 2onk n GLY 31 Ca 0.00 0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 2onk n GLY 31 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2onk s PRO 32 N -1.04 -1.77 0.14 1.61 0.02 -1.26 -3.85 135.00 128.86 2onk s PRO 32 Ca 0.00 0.51 -0.31 0.00 0.02 0.00 0.00 61.00 61.22 2onk s PRO 32 Cb 0.00 -1.48 -0.08 0.00 0.02 0.00 0.00 34.50 32.96 2onk s PRO 32 CO 0.00 -4.20 1.34 0.99 -0.33 0.00 0.00 177.00 174.80 2onk s THR 33 N -2.41 3.32 0.00 0.99 2.01 -1.26 -2.85 115.64 115.44 2onk s THR 33 Ca 0.69 1.00 0.00 0.00 0.31 0.00 0.00 61.69 63.68 2onk s THR 33 Cb -0.20 -3.64 0.00 0.00 0.01 0.00 0.00 72.50 68.67 2onk s THR 33 CO 0.62 0.11 0.00 0.61 -0.69 0.00 0.00 174.62 175.26 2onk n GLY 34 N 3.04 0.97 0.02 4.40 0.00 -1.26 -4.96 105.19 107.39 2onk n GLY 34 Ca 0.09 -0.55 0.11 0.00 0.00 0.00 0.00 46.02 45.67 2onk n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2onk n ALA 35 N -0.87 3.74 0.00 4.61 0.00 -1.13 -4.65 120.51 122.21 2onk n ALA 35 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.98 2onk n ALA 35 Cb 0.25 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.78 2onk n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2onk n GLY 36 N 1.41 1.07 0.17 0.00 0.00 -1.26 0.54 105.19 107.12 2onk n GLY 36 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.00 2onk n GLY 36 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2onk h LYS 37 N 2.78 0.23 -0.60 1.61 1.57 -1.92 -0.50 116.57 119.74 2onk h LYS 37 Ca 0.00 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 2onk h LYS 37 Cb 0.00 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 2onk h LYS 37 CO 0.00 0.15 0.00 0.77 -0.57 0.00 0.00 179.45 179.80 2onk h SER 38 N 0.24 1.03 -0.34 0.86 0.02 -1.99 -1.72 113.55 111.65 2onk h SER 38 Ca 0.19 -0.29 -0.16 0.00 -0.84 0.00 0.00 61.79 60.70 2onk h SER 38 Cb 0.22 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 2onk h SER 38 CO -0.24 1.08 -0.38 -0.37 -1.14 0.00 0.00 176.83 175.78 2onk h VAL 39 N 0.96 1.27 -0.49 2.27 -1.51 -1.95 -1.92 116.25 114.87 2onk h VAL 39 Ca 0.17 -1.56 0.10 0.00 -1.23 0.00 0.00 66.70 64.18 2onk h VAL 39 Cb 0.55 1.39 -0.10 0.00 -2.13 0.00 0.00 31.29 31.01 2onk h VAL 39 CO 0.03 0.52 -0.14 0.15 -1.23 0.00 0.00 177.57 176.90 2onk h PHE 40 N 0.73 -0.30 -0.68 5.19 3.57 -0.77 0.31 116.94 124.99 2onk h PHE 40 Ca 0.06 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.55 2onk h PHE 40 Cb 0.97 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.89 2onk h PHE 40 CO 0.06 -0.23 0.19 -0.07 -2.23 0.00 0.00 178.31 176.03 2onk h LEU 41 N -0.02 0.99 -1.75 0.59 3.38 -1.13 -1.63 115.31 115.74 2onk h LEU 41 Ca 0.24 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2onk h LEU 41 Cb 0.38 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2onk h LEU 41 CO -0.52 0.93 -0.16 -0.33 0.09 0.00 0.00 178.44 178.46 2onk h GLU 42 N 1.01 0.00 0.39 1.13 5.08 -0.19 0.46 114.58 122.46 2onk h GLU 42 Ca 0.22 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 2onk h GLU 42 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2onk h GLU 42 CO -0.00 0.16 -0.19 1.25 -1.00 0.00 0.00 179.01 179.23 2onk h LEU 43 N 0.00 -0.44 -0.19 1.33 6.46 0.41 0.35 115.31 123.23 2onk h LEU 43 Ca -0.00 -0.12 0.05 0.00 -0.12 0.00 0.00 57.88 57.69 2onk h LEU 43 Cb 0.40 0.11 -0.05 0.00 -0.73 0.00 0.00 40.66 40.40 2onk h LEU 43 CO 0.02 -0.01 -0.12 0.40 -0.62 0.00 0.00 178.44 178.10 2onk h ILE 44 N -0.99 0.63 -1.02 4.05 1.08 -0.99 -1.09 117.51 119.19 2onk h ILE 44 Ca -0.05 0.00 0.26 0.00 -0.39 0.00 0.00 64.86 64.67 2onk h ILE 44 Cb 0.53 0.63 -0.09 0.00 -3.07 0.00 0.00 36.82 34.83 2onk h ILE 44 CO 0.09 0.00 0.66 0.00 -0.69 0.00 0.00 178.15 178.21 2onk h ALA 45 N 1.03 2.26 -0.13 1.87 0.00 -0.04 -3.45 119.26 120.79 2onk h ALA 45 Ca 0.11 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2onk h ALA 45 Cb 0.28 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2onk h ALA 45 CO -0.27 -0.64 0.00 0.41 0.00 0.00 0.00 179.25 178.76 2onk n GLY 46 N -1.49 1.20 0.49 0.00 0.00 -0.00 -4.21 105.19 101.17 2onk n GLY 46 Ca 0.24 -0.36 0.05 0.00 0.00 0.00 0.00 46.02 45.95 2onk n GLY 46 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2onk n ILE 47 N -1.96 1.28 -3.51 -0.61 5.41 0.10 -3.34 119.36 116.73 2onk n ILE 47 Ca 0.00 -1.24 0.00 0.00 1.00 0.00 0.00 62.75 62.52 2onk n ILE 47 Cb 0.22 0.32 -0.04 0.00 -0.71 0.00 0.00 39.64 39.43 2onk n ILE 47 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2onk s VAL 48 N -1.44 -0.83 0.22 1.39 1.01 -1.13 -4.91 120.40 114.70 2onk s VAL 48 Ca 0.22 0.00 -0.23 0.00 0.00 0.00 0.00 61.98 61.96 2onk s VAL 48 Cb 0.14 -1.00 -0.08 0.00 0.00 0.00 0.00 36.38 35.44 2onk s VAL 48 CO 0.10 0.00 0.79 -0.54 0.00 0.00 0.00 175.10 175.45 2onk s LYS 49 N 2.76 4.46 0.51 2.72 1.02 -1.26 -4.46 119.74 125.50 2onk s LYS 49 Ca -0.02 1.09 -0.15 0.00 0.02 0.00 0.00 55.97 56.91 2onk s LYS 49 Cb -0.10 -3.03 -0.07 0.00 -0.52 0.00 0.00 37.83 34.10 2onk s LYS 49 CO -0.18 0.45 0.96 -1.25 -0.92 0.00 0.00 175.35 174.40 2onk s PRO 50 N -1.63 3.86 0.02 -1.68 0.04 -1.26 -4.98 135.00 129.38 2onk s PRO 50 Ca 0.41 0.84 -0.25 0.00 0.04 0.00 0.00 61.00 62.04 2onk s PRO 50 Cb -0.20 -2.17 -0.17 0.00 0.04 0.00 0.00 34.50 32.00 2onk s PRO 50 CO 0.24 -0.28 1.37 -0.44 0.04 0.00 0.00 177.00 177.93 2onk h ASP 51 N 0.77 -0.18 -4.46 6.66 3.32 -1.53 -3.45 116.42 117.55 2onk h ASP 51 Ca -0.46 -0.22 -0.31 0.00 0.02 0.00 0.00 57.03 56.06 2onk h ASP 51 Cb 1.19 0.05 -0.18 0.00 0.22 0.00 0.00 39.33 40.60 2onk h ASP 51 CO 0.62 0.13 -0.73 -0.60 -1.72 0.00 0.00 179.24 176.94 2onk s ARG 52 N -4.94 0.80 0.04 3.56 3.52 -1.13 -5.00 118.95 115.79 2onk s ARG 52 Ca -0.15 -1.12 0.00 0.00 -0.13 0.00 0.00 55.73 54.34 2onk s ARG 52 Cb 0.03 -0.48 0.00 0.00 -1.56 0.00 0.00 34.95 32.94 2onk s ARG 52 CO 0.61 0.07 0.00 0.41 -0.81 0.00 0.00 175.30 175.58 2onk n GLY 53 N 0.64 -3.09 3.38 8.12 0.00 -1.26 -0.94 105.19 112.04 2onk n GLY 53 Ca -0.17 -2.05 -0.10 0.00 0.00 0.00 0.00 46.02 43.71 2onk n GLY 53 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2onk s GLU 54 N -0.54 1.31 -0.30 1.61 -1.05 -0.24 -4.91 118.70 114.57 2onk s GLU 54 Ca 0.00 -1.35 0.02 0.00 -0.15 0.00 0.00 54.97 53.49 2onk s GLU 54 Cb 0.00 0.37 0.08 0.00 -0.44 0.00 0.00 34.13 34.15 2onk s GLU 54 CO 0.00 -0.49 0.01 0.08 0.95 0.00 0.00 175.26 175.81 2onk s VAL 55 N -4.05 1.91 -0.13 1.83 1.01 -1.26 -2.59 120.40 117.12 2onk s VAL 55 Ca 0.26 -1.86 -0.15 0.00 0.00 0.00 0.00 61.98 60.23 2onk s VAL 55 Cb 0.03 -2.29 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 2onk s VAL 55 CO 0.07 -0.41 0.36 -0.13 0.00 0.00 0.00 175.10 174.99 2onk s ARG 56 N 1.14 4.22 -0.22 2.72 0.52 -0.12 -0.62 118.95 126.58 2onk s ARG 56 Ca 0.04 0.24 -0.01 0.00 -0.52 0.00 0.00 55.73 55.47 2onk s ARG 56 Cb -0.19 -3.40 0.06 0.00 0.52 0.00 0.00 34.95 31.94 2onk s ARG 56 CO -0.10 0.28 0.01 -1.17 0.02 0.00 0.00 175.30 174.34 2onk s LEU 57 N 0.30 1.81 -0.21 2.53 2.96 -0.19 -0.88 118.68 124.99 2onk s LEU 57 Ca 0.20 -1.02 -0.00 0.00 -0.22 0.00 0.00 54.13 53.09 2onk s LEU 57 Cb -0.14 -0.84 0.00 0.00 0.50 0.00 0.00 46.19 45.71 2onk s LEU 57 CO 0.07 -0.29 0.01 -3.20 -1.32 0.00 0.00 176.35 171.62 2onk n ASN 58 N 4.89 -1.67 0.00 3.68 4.05 0.63 -3.11 115.26 123.73 2onk n ASN 58 Ca -0.10 -0.01 0.00 0.00 0.45 0.00 0.00 54.58 54.93 2onk n ASN 58 Cb 0.46 -1.04 0.00 0.00 1.23 0.00 0.00 39.78 40.43 2onk n ASN 58 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2onk n GLY 59 N -0.98 2.94 3.75 8.20 0.00 -1.26 -4.99 105.19 112.85 2onk n GLY 59 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 2onk n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2onk s ALA 60 N -1.13 3.37 -0.01 4.61 0.00 -1.18 -5.00 121.76 122.41 2onk s ALA 60 Ca 0.00 0.30 -0.30 0.00 0.00 0.00 0.00 51.96 51.96 2onk s ALA 60 Cb 0.00 -3.00 -0.05 0.00 0.00 0.00 0.00 23.12 20.06 2onk s ALA 60 CO 0.00 0.08 1.44 0.34 0.00 0.00 0.00 175.76 177.62 2onk s ASP 61 N -0.16 6.82 -0.03 0.00 -1.08 -1.26 -1.02 116.67 119.93 2onk s ASP 61 Ca 0.39 2.12 0.15 0.00 -0.52 0.00 0.00 52.55 54.68 2onk s ASP 61 Cb -0.21 -2.56 -0.23 0.00 -1.46 0.00 0.00 42.92 38.47 2onk s ASP 61 CO 0.24 -0.76 0.30 -0.38 0.52 0.00 0.00 175.17 175.09 2onk n ILE 62 N 4.81 0.11 -0.32 4.11 5.41 0.21 -4.73 119.36 128.96 2onk n ILE 62 Ca 0.14 -0.38 -0.00 0.00 1.00 0.00 0.00 62.75 63.51 2onk n ILE 62 Cb 0.43 0.06 0.04 0.00 -0.71 0.00 0.00 39.64 39.47 2onk n ILE 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 2onk n THR 63 N -2.09 -0.43 0.28 1.39 -1.04 -1.19 0.85 114.28 112.04 2onk n THR 63 Ca -0.05 1.96 0.16 0.00 -2.04 0.00 0.00 64.05 64.08 2onk n THR 63 Cb 0.46 -2.60 0.81 0.00 -1.82 0.00 0.00 70.33 67.18 2onk n THR 63 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2onk h PRO 64 N 0.00 0.00 -7.19 -2.82 0.13 -1.94 -3.44 132.00 116.74 2onk h PRO 64 Ca 0.30 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.95 2onk h PRO 64 Cb 0.51 0.00 0.05 0.00 0.13 0.00 0.00 31.00 31.69 2onk h PRO 64 CO -0.84 0.00 0.38 -0.51 -0.23 0.00 0.00 178.00 176.80 2onk s LEU 65 N -5.32 3.54 0.36 1.56 1.43 0.25 -5.06 118.68 115.44 2onk s LEU 65 Ca -0.02 1.76 -0.09 0.00 -1.03 0.00 0.00 54.13 54.74 2onk s LEU 65 Cb 0.09 -4.53 -0.06 0.00 0.03 0.00 0.00 46.19 41.72 2onk s LEU 65 CO 0.35 -1.00 0.71 -2.84 0.23 0.00 0.00 176.35 173.80 2onk s PRO 66 N -4.05 3.76 0.63 1.29 0.02 -1.26 -4.93 135.00 130.47 2onk s PRO 66 Ca 0.62 0.37 0.28 0.00 0.02 0.00 0.00 61.00 62.30 2onk s PRO 66 Cb -0.14 -2.46 1.55 0.00 0.02 0.00 0.00 34.50 33.46 2onk s PRO 66 CO 0.35 0.05 1.86 -1.00 -0.33 0.00 0.00 177.00 177.93 2onk h PRO 67 N 1.48 0.00 0.10 5.54 0.13 -1.72 0.67 132.00 138.19 2onk h PRO 67 Ca -0.47 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.38 2onk h PRO 67 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2onk h PRO 67 CO 0.65 0.00 -1.36 1.05 -0.23 0.00 0.00 178.00 178.11 2onk h GLU 68 N 0.00 0.20 -0.01 0.86 4.11 -1.90 -3.31 114.58 114.53 2onk h GLU 68 Ca 0.00 -0.35 0.00 0.00 0.07 0.00 0.00 59.36 59.08 2onk h GLU 68 Cb 0.65 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.03 2onk h GLU 68 CO 0.00 1.10 -0.30 0.54 0.07 0.00 0.00 179.01 180.41 2onk n ARG 69 N -3.44 0.87 -2.73 1.06 1.74 0.18 -4.83 116.66 109.51 2onk n ARG 69 Ca -0.11 -0.55 -0.30 0.00 -0.77 0.00 0.00 57.85 56.12 2onk n ARG 69 Cb 1.02 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.95 2onk n ARG 69 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2onk s ARG 70 N -2.51 3.74 0.03 5.56 0.52 -0.90 -4.93 118.95 120.45 2onk s ARG 70 Ca 0.23 0.47 0.25 0.00 -0.52 0.00 0.00 55.73 56.16 2onk s ARG 70 Cb 0.19 -2.35 0.47 0.00 0.52 0.00 0.00 34.95 33.78 2onk s ARG 70 CO 0.54 -0.11 1.39 0.41 0.02 0.00 0.00 175.30 177.54 2onk n GLY 71 N -1.58 -1.30 3.49 -3.53 0.00 -1.26 -4.97 105.19 96.04 2onk n GLY 71 Ca 0.03 -0.32 -0.46 0.00 0.00 0.00 0.00 46.02 45.26 2onk n GLY 71 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2onk n ILE 72 N -1.67 1.99 -3.65 -0.61 5.41 -1.26 -3.17 119.36 116.40 2onk n ILE 72 Ca 0.05 -0.50 -0.38 0.00 1.00 0.00 0.00 62.75 62.92 2onk n ILE 72 Cb 0.37 -0.47 -0.12 0.00 -0.71 0.00 0.00 39.64 38.71 2onk n ILE 72 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2onk s GLY 73 N -0.80 1.87 -0.08 7.39 0.00 -1.02 -4.90 107.32 109.79 2onk s GLY 73 Ca 0.61 -1.28 -0.03 0.00 0.00 0.00 0.00 44.72 44.03 2onk s GLY 73 CO 0.58 0.67 0.05 -0.12 0.00 0.00 0.00 173.10 174.27 2onk s PHE 74 N 1.65 3.28 -0.19 1.90 5.36 -1.26 -0.22 117.98 128.50 2onk s PHE 74 Ca 0.06 0.27 -0.04 0.00 -0.96 0.00 0.00 56.93 56.25 2onk s PHE 74 Cb -0.17 -1.81 0.09 0.00 -0.34 0.00 0.00 43.02 40.79 2onk s PHE 74 CO 0.07 0.54 0.21 0.08 -1.46 0.00 0.00 175.22 174.66 2onk s VAL 75 N -0.98 -0.31 0.13 3.12 1.01 -0.96 -4.94 120.40 117.48 2onk s VAL 75 Ca 0.16 -0.06 -0.20 0.00 0.00 0.00 0.00 61.98 61.87 2onk s VAL 75 Cb -0.12 -0.63 -0.07 0.00 0.00 0.00 0.00 36.38 35.56 2onk s VAL 75 CO 0.05 -0.17 0.64 -2.16 0.00 0.00 0.00 175.10 173.47 2onk s PRO 76 N 2.31 4.27 -0.17 2.72 0.04 -1.26 -3.01 135.00 139.90 2onk s PRO 76 Ca 0.06 0.83 -0.22 0.00 0.04 0.00 0.00 61.00 61.71 2onk s PRO 76 Cb -0.15 -3.14 -0.10 0.00 0.04 0.00 0.00 34.50 31.15 2onk s PRO 76 CO -0.11 0.56 0.70 0.94 0.04 0.00 0.00 177.00 179.13 2onk n GLN 77 N 1.39 0.00 -2.87 4.56 7.27 -1.24 -1.54 117.38 124.96 2onk n GLN 77 Ca -0.07 0.00 -0.09 0.00 0.07 0.00 0.00 57.00 56.91 2onk n GLN 77 Cb 0.50 -0.72 0.01 0.00 2.41 0.00 0.00 30.24 32.44 2onk n GLN 77 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2onk n ASP 78 N 1.57 -7.88 -2.67 1.69 9.92 -1.26 -4.78 116.55 113.14 2onk n ASP 78 Ca 0.13 0.55 -0.27 0.00 -0.53 0.00 0.00 54.79 54.67 2onk n ASP 78 Cb -0.01 -5.26 -0.01 0.00 -0.64 0.00 0.00 41.12 35.20 2onk n ASP 78 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2onk n TYR 79 N -0.26 -1.09 -2.07 1.24 4.02 -0.59 -4.85 117.16 113.56 2onk n TYR 79 Ca 0.11 0.43 -0.41 0.00 -0.01 0.00 0.00 57.90 58.02 2onk n TYR 79 Cb 0.45 -1.12 -0.00 0.00 -0.02 0.00 0.00 39.34 38.65 2onk n TYR 79 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2onk n ALA 80 N -0.50 6.49 -2.53 -0.72 0.00 -1.26 -4.96 120.51 117.03 2onk n ALA 80 Ca 0.08 -4.14 -0.42 0.00 0.00 0.00 0.00 53.44 48.96 2onk n ALA 80 Cb 0.23 -2.82 -0.03 0.00 0.00 0.00 0.00 19.45 16.83 2onk n ALA 80 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2onk s LEU 81 N -1.69 4.35 -0.41 0.00 1.43 -1.26 -4.92 118.68 116.18 2onk s LEU 81 Ca 0.51 1.85 -0.27 0.00 -1.03 0.00 0.00 54.13 55.19 2onk s LEU 81 Cb 0.16 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.76 2onk s LEU 81 CO -0.07 -0.41 2.27 -0.36 0.23 0.00 0.00 176.35 178.01 2onk s PHE 82 N 1.25 1.19 0.55 0.29 2.99 -1.26 -4.83 117.98 118.16 2onk s PHE 82 Ca 0.56 1.15 0.40 0.00 0.00 0.00 0.00 56.93 59.03 2onk s PHE 82 Cb -0.25 -3.76 2.13 0.00 0.00 0.00 0.00 43.02 41.14 2onk s PHE 82 CO 0.27 -3.00 2.28 -1.00 -0.00 0.00 0.00 175.22 173.77 2onk h PRO 83 N 17.50 0.00 -0.55 0.24 0.13 -2.00 -1.73 132.00 145.59 2onk h PRO 83 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2onk h PRO 83 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2onk h PRO 83 CO 1.10 0.01 0.00 -2.39 -0.23 0.00 0.00 178.00 176.49 2onk n HIS 84 N -3.23 0.78 -4.46 1.56 1.44 -1.26 -4.66 115.22 105.40 2onk n HIS 84 Ca -0.02 -0.37 -0.20 0.00 -2.01 0.00 0.00 57.72 55.11 2onk n HIS 84 Cb 0.12 -0.03 -0.14 0.00 0.12 0.00 0.00 29.99 30.06 2onk n HIS 84 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2onk s LEU 85 N -1.08 2.08 0.69 2.39 1.43 -0.65 -5.11 118.68 118.43 2onk s LEU 85 Ca 0.36 -0.31 -0.14 0.00 -1.03 0.00 0.00 54.13 53.01 2onk s LEU 85 Cb 0.20 -0.61 0.01 0.00 0.03 0.00 0.00 46.19 45.83 2onk s LEU 85 CO 0.24 0.10 1.11 -0.94 0.23 0.00 0.00 176.35 177.08 2onk s SER 86 N -0.63 4.94 0.25 2.29 1.04 -1.26 -4.24 113.70 116.08 2onk s SER 86 Ca 0.03 1.98 -0.11 0.00 0.48 0.00 0.00 55.95 58.33 2onk s SER 86 Cb -0.06 -2.55 0.35 0.00 0.10 0.00 0.00 66.02 63.86 2onk s SER 86 CO 0.00 -1.75 1.59 0.58 0.98 0.00 0.00 173.24 174.64 2onk h VAL 87 N -0.23 0.16 0.31 5.02 2.07 -0.95 0.43 116.25 123.05 2onk h VAL 87 Ca -0.46 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.05 2onk h VAL 87 Cb 1.24 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 2onk h VAL 87 CO 0.53 0.00 -0.43 0.22 0.02 0.00 0.00 177.57 177.91 2onk h TYR 88 N -0.01 -1.22 -0.25 1.57 3.20 -1.54 -0.11 116.97 118.62 2onk h TYR 88 Ca 0.39 0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.35 2onk h TYR 88 Cb 0.61 0.49 -0.01 0.00 1.54 0.00 0.00 36.73 39.36 2onk h TYR 88 CO -0.66 -0.54 0.20 0.00 -1.64 0.00 0.00 178.16 175.51 2onk h ARG 89 N -0.77 0.00 0.39 1.82 3.08 -1.38 0.27 114.38 117.79 2onk h ARG 89 Ca -0.04 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 2onk h ARG 89 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.76 2onk h ARG 89 CO -0.12 0.00 -0.19 -0.91 -1.07 0.00 0.00 179.97 177.68 2onk h ASN 90 N 0.00 -0.45 -0.79 7.04 2.35 0.42 -1.41 115.58 122.74 2onk h ASN 90 Ca 0.12 -0.12 0.03 0.00 -0.55 0.00 0.00 56.30 55.78 2onk h ASN 90 Cb 0.51 0.12 -0.05 0.00 0.05 0.00 0.00 38.32 38.95 2onk h ASN 90 CO -0.00 -0.10 0.51 0.40 -1.65 0.00 0.00 177.43 176.59 2onk h ILE 91 N -0.84 1.12 -0.16 2.81 2.04 0.31 -2.30 117.51 120.49 2onk h ILE 91 Ca -0.05 -0.34 -0.03 0.00 1.00 0.00 0.00 64.86 65.44 2onk h ILE 91 Cb 0.54 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 2onk h ILE 91 CO 0.09 0.18 -0.05 0.00 0.00 0.00 0.00 178.15 178.37 2onk h ALA 92 N 1.33 1.62 -2.50 1.87 0.00 -0.48 -3.43 119.26 117.68 2onk h ALA 92 Ca 0.32 -0.14 -0.55 0.00 0.00 0.00 0.00 54.91 54.53 2onk h ALA 92 Cb 0.01 -0.08 0.06 0.00 0.00 0.00 0.00 17.79 17.78 2onk h ALA 92 CO -0.11 0.28 0.90 0.98 0.00 0.00 0.00 179.25 181.30 2onk n TYR 93 N -4.35 2.55 0.00 0.00 9.36 -0.54 -1.05 117.16 123.13 2onk n TYR 93 Ca -0.01 0.16 0.00 0.00 3.32 0.00 0.00 57.90 61.38 2onk n TYR 93 Cb 0.21 -2.61 0.00 0.00 -0.63 0.00 0.00 39.34 36.31 2onk n TYR 93 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2onk n GLY 94 N 3.51 0.70 0.00 2.98 0.00 -1.26 -4.91 105.19 106.22 2onk n GLY 94 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2onk n GLY 94 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2onk n LEU 95 N 0.00 1.68 0.09 0.99 4.77 -0.21 -4.68 117.00 119.64 2onk n LEU 95 Ca 0.00 -1.68 0.04 0.00 -0.03 0.00 0.00 56.01 54.34 2onk n LEU 95 Cb 0.00 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.33 2onk n LEU 95 CO 0.00 0.42 0.67 -1.14 -1.33 0.00 0.00 177.39 176.01 2onk n ARG 96 N -0.38 0.06 -0.13 3.23 3.00 -1.26 0.10 116.66 121.28 2onk n ARG 96 Ca 0.00 0.49 0.10 0.00 -0.00 0.00 0.00 57.85 58.44 2onk n ARG 96 Cb 0.23 -1.88 0.31 0.00 0.00 0.00 0.00 32.46 31.12 2onk n ARG 96 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2onk n ASN 97 N -1.78 2.22 -4.51 6.15 5.15 -1.26 -4.91 115.26 116.32 2onk n ASN 97 Ca -0.01 -1.82 -0.29 0.00 -0.60 0.00 0.00 54.58 51.86 2onk n ASN 97 Cb 0.20 -0.17 -0.11 0.00 -0.53 0.00 0.00 39.78 39.17 2onk n ASN 97 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2onk s VAL 98 N -1.67 2.94 0.58 3.44 1.01 0.28 -5.10 120.40 121.88 2onk s VAL 98 Ca 0.33 -1.50 -0.19 0.00 0.00 0.00 0.00 61.98 60.62 2onk s VAL 98 Cb 0.18 -2.36 -0.06 0.00 0.00 0.00 0.00 36.38 34.14 2onk s VAL 98 CO 0.27 0.07 0.84 1.21 0.00 0.00 0.00 175.10 177.49 2onk n GLU 99 N 0.69 0.80 0.00 2.72 0.00 -1.26 -4.72 120.64 118.87 2onk n GLU 99 Ca -0.15 0.31 0.00 0.00 0.00 0.00 0.00 57.16 57.32 2onk n GLU 99 Cb 0.53 -2.02 0.00 0.00 0.00 0.00 0.00 31.44 29.95 2onk n GLU 99 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 2onk n ARG 100 N -0.68 0.00 -0.26 5.31 0.63 -1.26 -0.45 116.66 119.94 2onk n ARG 100 Ca 0.13 0.64 0.12 0.00 -0.92 0.00 0.00 57.85 57.82 2onk n ARG 100 Cb 0.47 -1.50 0.38 0.00 0.45 0.00 0.00 32.46 32.26 2onk n ARG 100 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2onk h VAL 101 N 0.00 0.85 -0.49 5.15 2.07 -1.99 0.85 116.25 122.69 2onk h VAL 101 Ca 0.00 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 2onk h VAL 101 Cb 0.00 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 2onk h VAL 101 CO 0.00 0.13 0.22 -0.08 0.02 0.00 0.00 177.57 177.85 2onk h GLU 102 N 0.70 0.71 0.07 1.57 4.57 -1.91 -0.05 114.58 120.23 2onk h GLU 102 Ca 0.44 -0.12 0.01 0.00 -1.18 0.00 0.00 59.36 58.51 2onk h GLU 102 Cb 0.69 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.14 2onk h GLU 102 CO -0.20 0.62 -0.12 0.00 -1.18 0.00 0.00 179.01 178.13 2onk h ARG 103 N 0.64 -0.23 -0.88 1.92 3.08 0.15 0.18 114.38 119.25 2onk h ARG 103 Ca 0.16 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.31 2onk h ARG 103 Cb 0.15 0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.20 2onk h ARG 103 CO -0.02 -0.15 0.57 0.22 -1.07 0.00 0.00 179.97 179.52 2onk h ASP 104 N -0.24 0.84 0.24 7.04 1.82 -0.87 0.13 116.42 125.39 2onk h ASP 104 Ca 0.02 0.01 -0.01 0.00 -0.39 0.00 0.00 57.03 56.66 2onk h ASP 104 Cb 0.25 -0.17 0.00 0.00 0.68 0.00 0.00 39.33 40.10 2onk h ASP 104 CO -0.07 0.53 -0.11 -0.09 -1.61 0.00 0.00 179.24 177.88 2onk h ARG 105 N 0.95 -0.31 -0.96 0.28 2.43 -0.25 -1.65 114.38 114.86 2onk h ARG 105 Ca 0.39 0.02 0.30 0.00 -0.81 0.00 0.00 59.98 59.88 2onk h ARG 105 Cb 0.28 0.07 -0.15 0.00 -0.42 0.00 0.00 29.97 29.75 2onk h ARG 105 CO -0.15 -0.21 0.43 0.00 -1.51 0.00 0.00 179.97 178.53 2onk h ARG 106 N -0.32 0.23 0.69 0.20 3.08 -0.59 0.32 114.38 117.98 2onk h ARG 106 Ca -0.03 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 2onk h ARG 106 Cb 0.25 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.25 2onk h ARG 106 CO 0.05 0.15 -0.33 0.28 -1.07 0.00 0.00 179.97 179.06 2onk h VAL 107 N 0.24 0.00 -0.34 2.04 2.07 -0.64 -0.96 116.25 118.66 2onk h VAL 107 Ca 0.68 -0.07 0.01 0.00 0.82 0.00 0.00 66.70 68.14 2onk h VAL 107 Cb 1.53 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 2onk h VAL 107 CO -0.66 0.00 0.22 0.03 0.02 0.00 0.00 177.57 177.19 2onk h ARG 108 N -1.00 0.40 0.20 1.57 3.08 -0.49 0.37 114.38 118.51 2onk h ARG 108 Ca -0.09 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 2onk h ARG 108 Cb 0.71 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 2onk h ARG 108 CO 0.16 0.27 -0.15 1.49 -1.07 0.00 0.00 179.97 180.66 2onk h GLU 109 N 0.41 -0.34 -0.03 0.04 4.81 -0.30 -0.13 114.58 119.04 2onk h GLU 109 Ca 0.13 0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.27 2onk h GLU 109 Cb 0.01 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2onk h GLU 109 CO -0.03 -0.23 -0.50 0.52 -0.73 0.00 0.00 179.01 178.04 2onk h MET 110 N -0.36 0.08 -0.03 1.92 2.86 -0.35 -0.12 114.93 118.94 2onk h MET 110 Ca -0.01 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.53 2onk h MET 110 Cb 0.32 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 2onk h MET 110 CO -0.01 0.56 -0.23 0.00 1.06 0.00 0.00 176.91 178.29 2onk h ALA 111 N 1.43 1.56 0.15 6.32 0.00 0.14 -2.36 119.26 126.50 2onk h ALA 111 Ca -0.00 -0.23 -0.28 0.00 0.00 0.00 0.00 54.91 54.40 2onk h ALA 111 Cb 0.91 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.65 2onk h ALA 111 CO 0.07 0.33 -1.38 1.49 0.00 0.00 0.00 179.25 179.76 2onk h GLU 112 N 0.05 0.32 0.00 0.00 4.81 -0.65 0.10 114.58 119.21 2onk h GLU 112 Ca 0.01 -0.54 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 2onk h GLU 112 Cb 0.44 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.02 2onk h GLU 112 CO 0.03 1.26 0.01 1.63 -0.73 0.00 0.00 179.01 181.21 2onk n LYS 113 N -3.87 0.00 0.00 1.92 5.02 -0.09 -1.34 118.16 119.79 2onk n LYS 113 Ca -0.22 0.33 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 2onk n LYS 113 Cb 0.94 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 34.45 2onk n LYS 113 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2onk n LEU 114 N -1.33 0.98 -3.47 -0.35 4.77 -0.92 -5.04 117.00 111.64 2onk n LEU 114 Ca 0.00 -0.98 -0.19 0.00 -0.03 0.00 0.00 56.01 54.81 2onk n LEU 114 Cb 0.01 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.16 2onk n LEU 114 CO 0.00 0.25 0.03 0.61 -1.33 0.00 0.00 177.39 176.94 2onk n GLY 115 N -0.23 -0.61 0.00 -0.72 0.00 -0.45 -4.90 105.19 98.28 2onk n GLY 115 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2onk n GLY 115 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2onk n ILE 116 N -3.93 0.00 0.00 -0.61 -5.35 0.17 -4.86 119.36 104.78 2onk n ILE 116 Ca -0.22 -0.01 0.00 0.00 -0.27 0.00 0.00 62.75 62.26 2onk n ILE 116 Cb 0.65 1.66 0.00 0.00 -1.74 0.00 0.00 39.64 40.22 2onk n ILE 116 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2onk n ALA 117 N -0.00 0.51 0.02 -1.28 0.00 -0.18 0.11 120.51 119.69 2onk n ALA 117 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 2onk n ALA 117 Cb 0.17 -0.47 -0.12 0.00 0.00 0.00 0.00 19.45 19.02 2onk n ALA 117 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2onk n HIS 118 N -1.17 0.29 1.44 0.00 1.44 -1.26 -4.02 115.22 111.94 2onk n HIS 118 Ca 0.00 0.08 0.14 0.00 -2.01 0.00 0.00 57.72 55.93 2onk n HIS 118 Cb 0.23 -0.64 0.47 0.00 0.12 0.00 0.00 29.99 30.17 2onk n HIS 118 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2onk n LEU 119 N -2.39 1.64 -0.38 2.39 4.77 0.30 -4.47 117.00 118.86 2onk n LEU 119 Ca -0.03 -0.55 0.37 0.00 -0.03 0.00 0.00 56.01 55.77 2onk n LEU 119 Cb 0.57 -0.00 0.59 0.00 -2.33 0.00 0.00 43.42 42.24 2onk n LEU 119 CO 0.44 0.27 1.34 -0.07 -1.33 0.00 0.00 177.39 178.05 2onk h LEU 120 N 2.57 0.00 0.00 2.23 3.38 -1.68 0.53 115.31 122.34 2onk h LEU 120 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2onk h LEU 120 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2onk h LEU 120 CO 0.00 0.00 -2.03 0.47 0.09 0.00 0.00 178.44 176.97 2onk n ASP 121 N -3.52 0.02 -4.67 -0.43 8.00 -1.26 -1.53 116.55 113.16 2onk n ASP 121 Ca 0.30 0.01 -0.29 0.00 0.71 0.00 0.00 54.79 55.53 2onk n ASP 121 Cb 1.68 1.82 0.18 0.00 -0.02 0.00 0.00 41.12 44.78 2onk n ASP 121 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2onk s ARG 122 N -3.37 0.33 0.09 -1.24 0.52 0.18 -4.66 118.95 110.80 2onk s ARG 122 Ca -0.08 0.52 0.10 0.00 -0.52 0.00 0.00 55.73 55.74 2onk s ARG 122 Cb 0.13 -1.73 -0.04 0.00 0.52 0.00 0.00 34.95 33.84 2onk s ARG 122 CO 0.90 -2.80 -0.24 0.15 0.02 0.00 0.00 175.30 173.33 2onk s LYS 123 N -4.94 1.69 0.00 3.54 1.02 -1.26 -0.62 119.74 119.17 2onk s LYS 123 Ca 0.66 -1.19 0.00 0.00 0.02 0.00 0.00 55.97 55.45 2onk s LYS 123 Cb -0.19 -2.01 0.00 0.00 -0.52 0.00 0.00 37.83 35.11 2onk s LYS 123 CO 0.58 0.49 0.00 -0.35 -0.92 0.00 0.00 175.35 175.15 2onk n PRO 124 N 1.23 0.00 -0.22 -1.68 -0.04 -1.26 -1.07 135.00 131.95 2onk n PRO 124 Ca -0.17 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.25 2onk n PRO 124 Cb 0.52 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.05 2onk n PRO 124 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2onk h ALA 125 N 0.00 0.82 0.00 0.55 0.00 -1.96 -1.70 119.26 116.97 2onk h ALA 125 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2onk h ALA 125 Cb 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2onk h ALA 125 CO 0.00 0.15 0.00 0.54 0.00 0.00 0.00 179.25 179.94 2onk n ARG 126 N -4.70 0.00 -3.13 0.00 1.74 -0.24 -4.73 116.66 105.61 2onk n ARG 126 Ca 0.06 0.43 -0.36 0.00 -0.77 0.00 0.00 57.85 57.22 2onk n ARG 126 Cb 0.07 -1.51 -0.06 0.00 -1.02 0.00 0.00 32.46 29.94 2onk n ARG 126 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2onk s LEU 127 N -3.05 4.31 0.59 0.55 1.43 -0.64 -5.03 118.68 116.85 2onk s LEU 127 Ca 0.02 1.37 -0.08 0.00 -1.03 0.00 0.00 54.13 54.41 2onk s LEU 127 Cb 0.03 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.63 2onk s LEU 127 CO 0.08 0.01 0.94 -0.94 0.23 0.00 0.00 176.35 176.67 2onk s SER 128 N -1.73 5.85 0.18 2.29 1.04 -1.26 -4.81 113.70 115.26 2onk s SER 128 Ca 0.44 0.99 -0.23 0.00 0.48 0.00 0.00 55.95 57.63 2onk s SER 128 Cb -0.16 -2.03 0.10 0.00 0.10 0.00 0.00 66.02 64.03 2onk s SER 128 CO 0.20 -0.97 1.57 1.23 0.98 0.00 0.00 173.24 176.25 2onk h GLY 129 N -0.21 -0.27 0.70 7.32 0.00 -1.97 0.14 103.07 108.78 2onk h GLY 129 Ca -0.45 0.53 0.07 0.00 0.00 0.00 0.00 47.33 47.47 2onk h GLY 129 CO 0.62 -0.17 0.62 -1.33 0.00 0.00 0.00 176.54 176.27 2onk h GLY 130 N -0.16 1.48 1.18 4.60 0.00 -2.00 -1.81 103.07 106.36 2onk h GLY 130 Ca 0.22 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 2onk h GLY 130 CO -0.75 0.30 0.41 0.83 0.00 0.00 0.00 176.54 177.33 2onk h GLU 131 N 1.10 1.07 0.86 4.80 5.08 -1.13 -1.97 114.58 124.40 2onk h GLU 131 Ca 0.43 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.62 2onk h GLU 131 Cb 0.20 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 29.25 2onk h GLU 131 CO -0.18 0.80 -0.41 0.00 -1.00 0.00 0.00 179.01 178.21 2onk h ARG 132 N 1.08 -1.11 -0.96 2.33 3.08 -0.30 -1.15 114.38 117.35 2onk h ARG 132 Ca 0.27 0.08 0.30 0.00 0.07 0.00 0.00 59.98 60.70 2onk h ARG 132 Cb 0.04 0.25 -0.17 0.00 0.08 0.00 0.00 29.97 30.18 2onk h ARG 132 CO -0.04 -0.74 0.29 1.96 -1.07 0.00 0.00 179.97 180.36 2onk h GLN 133 N -1.17 0.10 0.23 0.04 4.20 -1.19 0.68 115.11 118.00 2onk h GLN 133 Ca -0.12 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 2onk h GLN 133 Cb 0.89 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.65 2onk h GLN 133 CO 0.19 0.07 -0.11 0.00 -0.67 0.00 0.00 178.83 178.31 2onk h ARG 134 N 0.11 -0.29 -0.59 1.46 3.08 -1.02 -1.04 114.38 116.08 2onk h ARG 134 Ca 0.66 0.02 0.10 0.00 0.07 0.00 0.00 59.98 60.83 2onk h ARG 134 Cb 1.50 0.07 -0.07 0.00 0.08 0.00 0.00 29.97 31.54 2onk h ARG 134 CO -0.76 0.06 0.18 0.28 -1.07 0.00 0.00 179.97 178.66 2onk h VAL 135 N -0.71 0.73 0.04 2.04 2.07 0.29 0.81 116.25 121.51 2onk h VAL 135 Ca -0.03 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.39 2onk h VAL 135 Cb 0.49 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 30.57 2onk h VAL 135 CO 0.05 0.06 -0.52 0.00 0.02 0.00 0.00 177.57 177.19 2onk h ALA 136 N 1.43 -0.95 -0.18 1.67 0.00 0.33 0.90 119.26 122.45 2onk h ALA 136 Ca 0.30 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.15 2onk h ALA 136 Cb 0.40 0.92 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 2onk h ALA 136 CO -0.33 -1.10 -0.03 -0.07 0.00 0.00 0.00 179.25 177.72 2onk h LEU 137 N -0.68 -0.13 -0.38 0.00 3.38 -0.20 -1.26 115.31 116.04 2onk h LEU 137 Ca 0.01 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.07 2onk h LEU 137 Cb 0.71 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.48 2onk h LEU 137 CO -0.32 -0.04 -0.55 0.00 0.09 0.00 0.00 178.44 177.62 2onk h ALA 138 N 1.17 -0.79 -0.25 1.53 0.00 0.12 0.70 119.26 121.74 2onk h ALA 138 Ca 0.09 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.02 2onk h ALA 138 Cb 0.12 1.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2onk h ALA 138 CO -0.17 -1.04 0.17 -0.09 0.00 0.00 0.00 179.25 178.12 2onk h ARG 139 N -0.41 0.18 -0.00 0.00 2.43 -0.57 -1.94 114.38 114.07 2onk h ARG 139 Ca 0.07 -0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 59.07 2onk h ARG 139 Cb 0.59 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 2onk h ARG 139 CO -0.57 0.12 -0.75 0.00 -1.51 0.00 0.00 179.97 177.26 2onk h ALA 140 N 1.86 0.75 0.18 2.80 0.00 0.18 -3.37 119.26 121.66 2onk h ALA 140 Ca 0.11 -0.67 -0.35 0.00 0.00 0.00 0.00 54.91 54.00 2onk h ALA 140 Cb 0.20 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.88 2onk h ALA 140 CO -0.02 0.91 -1.75 -0.07 0.00 0.00 0.00 179.25 178.32 2onk h LEU 141 N 0.03 0.58 -0.84 0.00 3.38 -0.20 -3.36 115.31 114.89 2onk h LEU 141 Ca -0.01 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.07 2onk h LEU 141 Cb 1.32 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2onk h LEU 141 CO 0.10 1.75 0.31 0.52 0.09 0.00 0.00 178.44 181.22 2onk n VAL 142 N -3.57 0.60 1.44 1.22 0.31 -0.90 0.11 118.33 117.55 2onk n VAL 142 Ca -0.24 0.74 0.14 0.00 -0.01 0.00 0.00 64.34 64.97 2onk n VAL 142 Cb 1.07 -1.74 0.61 0.00 -0.91 0.00 0.00 33.84 32.87 2onk n VAL 142 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2onk n ILE 143 N -2.04 0.00 -3.46 2.52 5.41 -1.26 -4.93 119.36 115.60 2onk n ILE 143 Ca -0.01 -0.07 -0.22 0.00 1.00 0.00 0.00 62.75 63.45 2onk n ILE 143 Cb 0.33 -0.06 0.05 0.00 -0.71 0.00 0.00 39.64 39.26 2onk n ILE 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2onk n GLN 144 N -0.86 -1.65 -1.74 0.38 6.02 0.30 -4.87 117.38 114.96 2onk n GLN 144 Ca 0.15 0.72 -0.42 0.00 -0.01 0.00 0.00 57.00 57.45 2onk n GLN 144 Cb 0.28 -4.89 -0.02 0.00 1.02 0.00 0.00 30.24 26.63 2onk n GLN 144 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 2onk n PRO 145 N -3.54 2.66 0.03 -1.09 -0.04 -1.26 -4.92 135.00 126.84 2onk n PRO 145 Ca -0.08 0.95 -0.01 0.00 -0.04 0.00 0.00 63.50 64.31 2onk n PRO 145 Cb 0.60 -2.73 0.27 0.00 -0.04 0.00 0.00 33.50 31.60 2onk n PRO 145 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2onk h ARG 146 N 4.88 0.44 -4.75 0.54 3.08 -1.88 -3.46 114.38 113.22 2onk h ARG 146 Ca -0.47 -0.13 -0.44 0.00 0.07 0.00 0.00 59.98 59.02 2onk h ARG 146 Cb 1.23 -0.04 -0.12 0.00 0.08 0.00 0.00 29.97 31.11 2onk h ARG 146 CO 0.80 0.59 -0.43 -1.17 -1.07 0.00 0.00 179.97 178.69 2onk s LEU 147 N -8.78 1.62 -0.24 3.04 2.96 -1.26 -4.60 118.68 111.42 2onk s LEU 147 Ca -0.07 -1.72 -0.02 0.00 -0.22 0.00 0.00 54.13 52.10 2onk s LEU 147 Cb 0.15 0.75 0.13 0.00 0.50 0.00 0.00 46.19 47.71 2onk s LEU 147 CO 0.77 -1.12 0.35 -0.22 -1.32 0.00 0.00 176.35 174.81 2onk s LEU 148 N -3.35 -0.52 -0.06 -0.68 2.96 -0.99 -2.43 118.68 113.60 2onk s LEU 148 Ca 0.39 0.01 -0.11 0.00 -0.22 0.00 0.00 54.13 54.19 2onk s LEU 148 Cb 0.02 0.94 -0.05 0.00 0.50 0.00 0.00 46.19 47.60 2onk s LEU 148 CO 0.27 -0.32 0.28 -0.76 -1.32 0.00 0.00 176.35 174.50 2onk s LEU 149 N 2.49 4.43 -0.02 -0.68 1.43 0.69 -0.17 118.68 126.85 2onk s LEU 149 Ca 0.11 0.72 -0.10 0.00 -1.03 0.00 0.00 54.13 53.84 2onk s LEU 149 Cb -0.15 -2.34 0.01 0.00 0.03 0.00 0.00 46.19 43.74 2onk s LEU 149 CO -0.18 0.36 0.20 -0.76 0.23 0.00 0.00 176.35 176.20 2onk s LEU 150 N -1.02 1.28 -0.10 1.79 1.43 -0.44 -2.26 118.68 119.35 2onk s LEU 150 Ca 0.19 0.00 -0.06 0.00 -1.03 0.00 0.00 54.13 53.24 2onk s LEU 150 Cb -0.14 0.86 0.04 0.00 0.03 0.00 0.00 46.19 46.98 2onk s LEU 150 CO 0.09 -0.34 0.25 1.51 0.23 0.00 0.00 176.35 178.09 2onk s ASP 151 N -1.08 -0.27 -1.36 2.29 -4.77 -1.16 -0.98 116.67 109.33 2onk s ASP 151 Ca -0.12 0.53 -0.12 0.00 -3.30 0.00 0.00 52.55 49.54 2onk s ASP 151 Cb -0.06 0.43 0.10 0.00 -1.09 0.00 0.00 42.92 42.30 2onk s ASP 151 CO 0.02 -0.16 0.56 -0.62 0.70 0.00 0.00 175.17 175.68 2onk n GLU 152 N 4.06 -3.23 0.00 2.11 -0.58 0.10 -3.59 120.64 119.51 2onk n GLU 152 Ca -0.24 0.41 0.05 0.00 -0.42 0.00 0.00 57.16 56.96 2onk n GLU 152 Cb 0.54 -5.11 0.25 0.00 -0.57 0.00 0.00 31.44 26.54 2onk n GLU 152 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 2onk n PRO 153 N -3.87 0.10 -0.02 3.49 -0.04 -1.26 -2.09 135.00 131.30 2onk n PRO 153 Ca 0.02 0.23 0.01 0.00 -0.04 0.00 0.00 63.50 63.72 2onk n PRO 153 Cb 0.52 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.50 2onk n PRO 153 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2onk n LEU 154 N -1.35 1.78 -4.78 1.53 4.77 -1.26 -4.97 117.00 112.72 2onk n LEU 154 Ca 0.04 -1.58 -0.31 0.00 -0.03 0.00 0.00 56.01 54.13 2onk n LEU 154 Cb 0.10 -0.03 0.09 0.00 -2.33 0.00 0.00 43.42 41.24 2onk n LEU 154 CO 0.09 0.44 0.70 -0.94 -1.33 0.00 0.00 177.39 176.34 2onk s SER 155 N -0.67 4.63 -1.26 -1.43 1.04 -0.89 -3.78 113.70 111.35 2onk s SER 155 Ca 0.04 1.71 -0.02 0.00 0.48 0.00 0.00 55.95 58.16 2onk s SER 155 Cb 0.02 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.69 2onk s SER 155 CO 0.03 -1.94 0.94 0.00 0.98 0.00 0.00 173.24 173.26 2onk n ALA 156 N -3.45 -1.91 -3.70 5.32 0.00 -1.26 -5.00 120.51 110.50 2onk n ALA 156 Ca 0.08 -0.03 -0.11 0.00 0.00 0.00 0.00 53.44 53.38 2onk n ALA 156 Cb 0.54 -2.70 -0.12 0.00 0.00 0.00 0.00 19.45 17.16 2onk n ALA 156 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2onk s VAL 157 N -3.44 -0.11 0.30 0.00 1.01 -1.25 -5.14 120.40 111.77 2onk s VAL 157 Ca 0.09 0.14 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 2onk s VAL 157 Cb -0.04 -0.50 -0.12 0.00 0.00 0.00 0.00 36.38 35.71 2onk s VAL 157 CO 0.76 0.06 1.43 -0.67 0.00 0.00 0.00 175.10 176.67 2onk n ASP 158 N 4.43 3.13 -0.38 3.32 2.03 -1.26 -4.68 116.55 123.13 2onk n ASP 158 Ca -0.22 1.17 -0.03 0.00 0.52 0.00 0.00 54.79 56.23 2onk n ASP 158 Cb 0.53 -1.50 0.01 0.00 -0.72 0.00 0.00 41.12 39.44 2onk n ASP 158 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2onk h LEU 159 N 3.73 -1.58 -0.74 -2.67 3.38 -1.99 0.69 115.31 116.13 2onk h LEU 159 Ca -0.46 0.31 0.09 0.00 0.09 0.00 0.00 57.88 57.91 2onk h LEU 159 Cb 1.26 0.79 -0.12 0.00 0.09 0.00 0.00 40.66 42.69 2onk h LEU 159 CO 0.71 -0.28 -0.49 0.50 0.09 0.00 0.00 178.44 178.98 2onk h LYS 160 N -0.01 -0.15 -0.61 1.13 1.63 -2.02 -0.65 116.57 115.88 2onk h LYS 160 Ca 0.30 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 60.09 2onk h LYS 160 Cb 0.56 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.19 2onk h LYS 160 CO -0.96 -0.10 0.31 1.15 -3.45 0.00 0.00 179.45 176.40 2onk h THR 161 N -0.16 1.21 -0.44 1.00 2.02 -1.33 -3.21 112.91 112.00 2onk h THR 161 Ca 0.18 -0.56 0.05 0.00 0.77 0.00 0.00 66.41 66.85 2onk h THR 161 Cb 0.53 0.45 -0.07 0.00 -1.74 0.00 0.00 68.15 67.32 2onk h THR 161 CO -0.79 0.23 -0.45 0.50 0.37 0.00 0.00 175.52 175.38 2onk h LYS 162 N 0.83 -0.23 -0.74 6.66 3.64 0.62 -1.17 116.57 126.18 2onk h LYS 162 Ca 0.21 0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.71 2onk h LYS 162 Cb 0.08 0.05 -0.12 0.00 -0.41 0.00 0.00 32.23 31.84 2onk h LYS 162 CO -0.03 -0.16 -0.45 0.78 -2.27 0.00 0.00 179.45 177.32 2onk h GLY 163 N -0.24 -0.40 0.42 5.01 0.00 -1.47 0.33 103.07 106.72 2onk h GLY 163 Ca 0.07 0.59 0.08 0.00 0.00 0.00 0.00 47.33 48.08 2onk h GLY 163 CO -0.54 -0.14 0.18 -0.39 0.00 0.00 0.00 176.54 175.65 2onk h VAL 164 N -0.14 0.78 -0.62 4.60 -1.51 -1.47 -1.67 116.25 116.22 2onk h VAL 164 Ca 0.21 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.57 2onk h VAL 164 Cb 0.55 0.40 -0.03 0.00 -2.13 0.00 0.00 31.29 30.08 2onk h VAL 164 CO -0.80 0.06 0.40 -0.07 -1.23 0.00 0.00 177.57 175.94 2onk h LEU 165 N 0.35 0.72 -0.36 4.19 3.38 0.54 -2.33 115.31 121.80 2onk h LEU 165 Ca 0.27 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.25 2onk h LEU 165 Cb 0.33 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2onk h LEU 165 CO -0.29 0.53 0.15 0.24 0.09 0.00 0.00 178.44 179.16 2onk h MET 166 N 0.84 0.30 -0.71 1.13 2.86 0.36 0.20 114.93 119.92 2onk h MET 166 Ca 0.23 -0.02 0.10 0.00 -2.06 0.00 0.00 59.70 57.95 2onk h MET 166 Cb -0.08 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.46 2onk h MET 166 CO -0.05 0.20 0.47 0.93 1.06 0.00 0.00 176.91 179.52 2onk h GLU 167 N 0.31 0.55 -0.27 1.72 5.08 -1.02 0.15 114.58 121.11 2onk h GLU 167 Ca 0.16 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.38 2onk h GLU 167 Cb 0.11 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2onk h GLU 167 CO -0.14 0.37 -0.27 0.93 -1.00 0.00 0.00 179.01 178.90 2onk h GLU 168 N 0.57 0.53 -0.02 2.33 5.08 -0.48 -1.39 114.58 121.20 2onk h GLU 168 Ca 0.33 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2onk h GLU 168 Cb 0.53 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 2onk h GLU 168 CO -0.11 0.75 -0.00 -0.07 -1.00 0.00 0.00 179.01 178.57 2onk h LEU 169 N 0.46 0.03 -0.24 1.33 3.38 0.57 0.11 115.31 120.95 2onk h LEU 169 Ca 0.06 -0.35 0.05 0.00 0.09 0.00 0.00 57.88 57.74 2onk h LEU 169 Cb 0.71 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.37 2onk h LEU 169 CO 0.05 0.37 -0.46 0.03 0.09 0.00 0.00 178.44 178.53 2onk h ARG 170 N -0.31 -0.43 -0.09 1.13 3.08 -1.08 0.14 114.38 116.83 2onk h ARG 170 Ca 0.00 0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.12 2onk h ARG 170 Cb 0.36 0.10 -0.06 0.00 0.08 0.00 0.00 29.97 30.44 2onk h ARG 170 CO 0.00 -0.29 -0.41 0.35 -1.07 0.00 0.00 179.97 178.55 2onk h PHE 171 N -0.45 -1.18 -0.98 3.04 3.57 -1.15 -0.07 116.94 119.73 2onk h PHE 171 Ca 0.09 0.04 0.19 0.00 3.53 0.00 0.00 57.97 61.83 2onk h PHE 171 Cb 0.62 0.53 -0.09 0.00 2.79 0.00 0.00 35.95 39.80 2onk h PHE 171 CO -0.57 -0.48 0.61 0.28 -2.23 0.00 0.00 178.31 175.93 2onk h VAL 172 N -0.51 0.70 -0.19 1.41 2.07 0.14 0.78 116.25 120.65 2onk h VAL 172 Ca 0.07 -0.22 -0.14 0.00 0.82 0.00 0.00 66.70 67.22 2onk h VAL 172 Cb 0.63 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 2onk h VAL 172 CO -0.37 0.12 -0.44 -0.61 0.02 0.00 0.00 177.57 176.29 2onk h GLN 173 N 0.65 0.63 -0.23 1.57 4.15 0.56 -0.97 115.11 121.47 2onk h GLN 173 Ca 0.54 -0.43 -0.10 0.00 0.77 0.00 0.00 58.65 59.43 2onk h GLN 173 Cb 0.99 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.73 2onk h GLN 173 CO -0.30 1.04 -0.29 0.00 -1.93 0.00 0.00 178.83 177.35 2onk h ARG 174 N 0.30 0.46 -0.24 1.69 3.08 0.30 0.39 114.38 120.36 2onk h ARG 174 Ca -0.00 -0.18 -0.19 0.00 0.07 0.00 0.00 59.98 59.68 2onk h ARG 174 Cb 1.05 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.08 2onk h ARG 174 CO 0.10 0.70 -0.58 1.49 -1.07 0.00 0.00 179.97 180.61 2onk h GLU 175 N 0.40 0.78 -0.25 0.04 4.57 0.58 -3.30 114.58 117.41 2onk h GLU 175 Ca 0.05 -0.52 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 2onk h GLU 175 Cb 0.71 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.37 2onk h GLU 175 CO 0.05 1.14 0.00 1.19 -1.18 0.00 0.00 179.01 180.22 2onk n PHE 176 N -3.98 0.33 -4.06 0.92 3.01 -0.37 -4.98 117.46 108.32 2onk n PHE 176 Ca -0.04 -0.30 -0.36 0.00 1.01 0.00 0.00 57.45 57.75 2onk n PHE 176 Cb 0.64 -0.01 -0.02 0.00 -0.01 0.00 0.00 39.48 40.07 2onk n PHE 176 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2onk n ASP 177 N 0.71 -1.91 -4.20 4.37 8.00 0.12 -4.90 116.55 118.74 2onk n ASP 177 Ca 0.11 -1.13 -0.35 0.00 0.71 0.00 0.00 54.79 54.13 2onk n ASP 177 Cb 0.40 -1.37 -0.14 0.00 -0.02 0.00 0.00 41.12 40.00 2onk n ASP 177 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2onk s VAL 178 N -3.90 3.02 0.58 2.53 1.01 -1.18 -5.07 120.40 117.38 2onk s VAL 178 Ca 0.27 -1.15 -0.19 0.00 0.00 0.00 0.00 61.98 60.91 2onk s VAL 178 Cb -0.15 -2.62 -0.06 0.00 0.00 0.00 0.00 36.38 33.54 2onk s VAL 178 CO 0.85 0.05 0.88 -0.81 0.00 0.00 0.00 175.10 176.08 2onk n PRO 179 N 4.67 0.86 -4.22 2.72 -0.04 -1.26 -4.81 135.00 132.92 2onk n PRO 179 Ca -0.15 0.33 -0.20 0.00 -0.04 0.00 0.00 63.50 63.45 2onk n PRO 179 Cb 0.45 -2.07 -0.16 0.00 -0.04 0.00 0.00 33.50 31.69 2onk n PRO 179 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2onk s ILE 180 N -1.53 0.57 -0.38 0.52 1.01 -0.14 -2.34 121.20 118.91 2onk s ILE 180 Ca 0.73 -0.18 -0.05 0.00 0.00 0.00 0.00 60.65 61.15 2onk s ILE 180 Cb -0.43 -0.57 0.08 0.00 0.01 0.00 0.00 42.46 41.55 2onk s ILE 180 CO 0.49 0.22 0.17 -0.22 0.00 0.00 0.00 174.94 175.60 2onk s LEU 181 N 0.66 4.85 -0.22 2.97 2.96 0.76 -0.47 118.68 130.19 2onk s LEU 181 Ca -0.09 -1.64 -0.08 0.00 -0.22 0.00 0.00 54.13 52.10 2onk s LEU 181 Cb -0.12 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 2onk s LEU 181 CO 0.00 -0.46 0.09 -2.28 -1.32 0.00 0.00 176.35 172.38 2onk s HIS 182 N 1.27 3.20 -0.17 5.38 5.65 -1.01 -1.33 115.29 128.28 2onk s HIS 182 Ca 0.03 -0.06 -0.02 0.00 0.25 0.00 0.00 55.06 55.26 2onk s HIS 182 Cb -0.22 -2.18 -0.01 0.00 -1.18 0.00 0.00 32.58 29.00 2onk s HIS 182 CO -0.01 -0.05 -0.10 0.08 -0.65 0.00 0.00 174.74 174.01 2onk s VAL 183 N 0.96 3.11 0.37 0.89 1.01 -0.15 -1.61 120.40 124.98 2onk s VAL 183 Ca 0.05 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.35 2onk s VAL 183 Cb -0.14 -2.35 0.02 0.00 0.00 0.00 0.00 36.38 33.91 2onk s VAL 183 CO 0.03 0.49 0.59 -0.89 0.00 0.00 0.00 175.10 175.32 2onk s THR 184 N 0.83 0.00 0.00 3.92 2.01 -1.06 0.00 115.64 121.34 2onk s THR 184 Ca -0.03 -1.41 0.00 0.00 0.31 0.00 0.00 61.69 60.56 2onk s THR 184 Cb -0.15 -2.77 0.00 0.00 0.01 0.00 0.00 72.50 69.59 2onk s THR 184 CO 0.01 0.00 0.66 0.00 -0.69 0.00 0.00 174.62 174.60 2onk n HIS 185 N -0.57 0.00 -3.68 4.92 1.44 -1.25 -1.80 115.22 114.27 2onk n HIS 185 Ca -0.02 -0.19 -0.37 0.00 -2.01 0.00 0.00 57.72 55.12 2onk n HIS 185 Cb 0.61 -0.02 -0.12 0.00 0.12 0.00 0.00 29.99 30.58 2onk n HIS 185 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 2onk s ASP 186 N -0.38 5.47 0.12 4.39 2.15 -1.26 -4.79 116.67 122.37 2onk s ASP 186 Ca 0.00 -0.26 -0.24 0.00 0.43 0.00 0.00 52.55 52.48 2onk s ASP 186 Cb 0.00 -1.99 -0.06 0.00 -0.30 0.00 0.00 42.92 40.56 2onk s ASP 186 CO 0.00 -0.09 1.66 -0.07 -0.17 0.00 0.00 175.17 176.50 2onk h LEU 187 N 8.30 -0.53 -1.30 -1.34 3.38 -1.98 -2.13 115.31 119.71 2onk h LEU 187 Ca -0.36 0.08 0.47 0.00 0.09 0.00 0.00 57.88 58.16 2onk h LEU 187 Cb 1.17 0.22 -0.15 0.00 0.09 0.00 0.00 40.66 41.99 2onk h LEU 187 CO 0.58 -0.25 0.82 -0.38 0.09 0.00 0.00 178.44 179.30 2onk n ILE 188 N -5.31 -0.28 0.06 1.22 5.41 -1.26 0.85 119.36 120.04 2onk n ILE 188 Ca -0.05 1.84 -0.21 0.00 1.00 0.00 0.00 62.75 65.33 2onk n ILE 188 Cb 0.23 -3.01 -0.12 0.00 -0.71 0.00 0.00 39.64 36.02 2onk n ILE 188 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2onk h GLU 189 N 0.00 0.56 0.53 0.38 5.08 -1.81 -1.98 114.58 117.34 2onk h GLU 189 Ca 0.87 -0.71 -0.03 0.00 -1.00 0.00 0.00 59.36 58.50 2onk h GLU 189 Cb 2.72 0.23 0.01 0.00 0.50 0.00 0.00 28.75 32.20 2onk h GLU 189 CO -0.52 1.30 -0.26 0.00 -1.00 0.00 0.00 179.01 178.53 2onk h ALA 190 N 0.28 -0.72 -0.68 3.43 0.00 0.66 -1.68 119.26 120.57 2onk h ALA 190 Ca -0.15 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 54.70 2onk h ALA 190 Cb 1.73 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 19.75 2onk h ALA 190 CO 0.20 -0.89 0.45 0.00 0.00 0.00 0.00 179.25 179.01 2onk h ALA 191 N -0.29 1.98 0.00 0.00 0.00 -0.48 -1.70 119.26 118.78 2onk h ALA 191 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2onk h ALA 191 Cb 0.56 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2onk h ALA 191 CO 0.12 -0.14 -0.57 0.52 0.00 0.00 0.00 179.25 179.18 2onk h MET 192 N 0.48 0.00 0.00 0.00 2.07 -1.09 -3.43 114.93 112.96 2onk h MET 192 Ca 0.32 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.95 2onk h MET 192 Cb 0.59 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.32 2onk h MET 192 CO -0.10 0.00 -0.76 1.28 1.07 0.00 0.00 176.91 178.40 2onk n LEU 193 N -2.85 2.11 -4.74 1.22 4.77 -0.65 -4.99 117.00 111.87 2onk n LEU 193 Ca 0.02 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.59 2onk n LEU 193 Cb 0.54 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.64 2onk n LEU 193 CO 0.37 0.35 1.00 0.00 -1.33 0.00 0.00 177.39 177.79 2onk n ALA 194 N -2.21 1.78 -0.05 -1.18 0.00 -0.67 -4.87 120.51 113.31 2onk n ALA 194 Ca 0.00 0.29 0.01 0.00 0.00 0.00 0.00 53.44 53.74 2onk n ALA 194 Cb 0.38 -2.34 -0.16 0.00 0.00 0.00 0.00 19.45 17.33 2onk n ALA 194 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2onk n ASP 195 N 0.20 0.24 -3.99 0.00 8.00 0.33 -4.93 116.55 116.41 2onk n ASP 195 Ca 0.05 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.46 2onk n ASP 195 Cb 0.40 1.48 -0.10 0.00 -0.02 0.00 0.00 41.12 42.87 2onk n ASP 195 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2onk s GLU 196 N -2.97 0.56 -0.03 -1.24 2.02 -1.22 -4.81 118.70 111.01 2onk s GLU 196 Ca -0.09 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.02 2onk s GLU 196 Cb 0.10 0.21 0.03 0.00 0.10 0.00 0.00 34.13 34.56 2onk s GLU 196 CO 0.83 -0.12 0.01 0.08 0.02 0.00 0.00 175.26 176.07 2onk s VAL 197 N -2.88 0.13 0.39 2.63 1.01 0.32 -2.59 120.40 119.41 2onk s VAL 197 Ca -0.03 0.13 0.08 0.00 0.00 0.00 0.00 61.98 62.16 2onk s VAL 197 Cb 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 36.38 36.12 2onk s VAL 197 CO -0.06 0.15 0.42 0.00 0.00 0.00 0.00 175.10 175.61 2onk s ALA 198 N 1.17 4.16 -0.19 5.51 0.00 -0.44 -0.83 121.76 131.13 2onk s ALA 198 Ca -0.08 -1.71 -0.04 0.00 0.00 0.00 0.00 51.96 50.13 2onk s ALA 198 Cb -0.13 -1.31 0.09 0.00 0.00 0.00 0.00 23.12 21.76 2onk s ALA 198 CO -0.02 -0.15 0.21 0.08 0.00 0.00 0.00 175.76 175.88 2onk s VAL 199 N -2.36 -0.32 -0.04 0.00 1.01 -0.37 -0.82 120.40 117.51 2onk s VAL 199 Ca 0.48 -0.08 -0.10 0.00 0.00 0.00 0.00 61.98 62.28 2onk s VAL 199 Cb -0.07 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.62 2onk s VAL 199 CO 0.29 -0.18 0.28 -0.32 0.00 0.00 0.00 175.10 175.17 2onk s MET 200 N 2.32 3.66 -0.26 2.72 1.75 0.12 -1.45 119.30 128.16 2onk s MET 200 Ca 0.06 0.09 -0.01 0.00 -1.25 0.00 0.00 55.69 54.58 2onk s MET 200 Cb -0.15 -3.16 0.15 0.00 2.84 0.00 0.00 34.83 34.50 2onk s MET 200 CO -0.12 0.71 0.40 -0.51 -0.65 0.00 0.00 175.02 174.85 2onk s LEU 201 N -1.27 -0.71 -0.72 4.11 1.43 0.21 -4.25 118.68 117.48 2onk s LEU 201 Ca 0.22 -0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 53.30 2onk s LEU 201 Cb -0.14 1.13 0.00 0.00 0.03 0.00 0.00 46.19 47.21 2onk s LEU 201 CO 0.11 -0.32 0.61 0.59 0.23 0.00 0.00 176.35 177.56 2onk n ASN 202 N 5.36 -2.63 0.00 2.29 3.02 -1.24 -3.16 115.26 118.90 2onk n ASN 202 Ca -0.02 -0.35 0.00 0.00 -0.03 0.00 0.00 54.58 54.18 2onk n ASN 202 Cb 0.50 -3.18 0.00 0.00 -0.61 0.00 0.00 39.78 36.49 2onk n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2onk n GLY 203 N -1.15 2.59 3.70 7.41 0.00 0.19 -4.80 105.19 113.13 2onk n GLY 203 Ca -0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 2onk n GLY 203 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2onk s ARG 204 N 0.00 3.34 -1.03 1.61 3.52 -1.19 -2.93 118.95 122.27 2onk s ARG 204 Ca 0.00 -0.35 -0.17 0.00 -0.13 0.00 0.00 55.73 55.09 2onk s ARG 204 Cb 0.00 -2.97 0.15 0.00 -1.56 0.00 0.00 34.95 30.57 2onk s ARG 204 CO 0.00 0.59 1.23 0.42 -0.81 0.00 0.00 175.30 176.73 2onk s ILE 205 N -0.55 4.86 0.13 4.11 1.01 -1.26 -0.62 121.20 128.87 2onk s ILE 205 Ca 0.10 -1.99 -0.32 0.00 0.00 0.00 0.00 60.65 58.44 2onk s ILE 205 Cb -0.12 -4.82 -0.11 0.00 0.01 0.00 0.00 42.46 37.42 2onk s ILE 205 CO 0.02 -1.54 1.53 0.58 0.00 0.00 0.00 174.94 175.53 2onk h VAL 206 N 5.38 0.00 -2.93 2.92 2.07 -1.58 -3.45 116.25 118.65 2onk h VAL 206 Ca 0.21 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.62 2onk h VAL 206 Cb 0.97 0.00 -0.21 0.00 -1.52 0.00 0.00 31.29 30.53 2onk h VAL 206 CO 1.15 0.00 -0.25 -1.61 0.02 0.00 0.00 177.57 176.88 2onk s GLU 207 N -5.57 0.63 0.16 1.57 2.02 -1.23 -5.01 118.70 111.26 2onk s GLU 207 Ca -0.14 -0.00 0.07 0.00 0.02 0.00 0.00 54.97 54.91 2onk s GLU 207 Cb 0.08 0.29 -0.04 0.00 0.10 0.00 0.00 34.13 34.56 2onk s GLU 207 CO 0.60 -0.16 -0.15 0.21 0.02 0.00 0.00 175.26 175.78 2onk s LYS 208 N -0.96 1.16 0.00 1.61 2.20 -1.26 -1.23 119.74 121.26 2onk s LYS 208 Ca -0.10 -1.39 0.00 0.00 -0.36 0.00 0.00 55.97 54.12 2onk s LYS 208 Cb -0.04 -1.03 0.00 0.00 -1.51 0.00 0.00 37.83 35.25 2onk s LYS 208 CO 0.04 0.19 0.00 0.41 -0.36 0.00 0.00 175.35 175.63 2onk n GLY 209 N 0.17 -0.34 3.37 5.54 0.00 -0.01 -4.96 105.19 108.96 2onk n GLY 209 Ca -0.12 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.15 2onk n GLY 209 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2onk s LYS 210 N -1.15 1.94 0.14 1.61 1.02 -1.26 0.12 119.74 122.15 2onk s LYS 210 Ca 0.00 -1.03 -0.30 0.00 0.02 0.00 0.00 55.97 54.65 2onk s LYS 210 Cb 0.00 -2.05 -0.09 0.00 -0.52 0.00 0.00 37.83 35.17 2onk s LYS 210 CO 0.00 0.53 1.52 -0.07 -0.92 0.00 0.00 175.35 176.41 2onk h LEU 211 N 4.90 -1.91 -0.75 3.17 3.38 -1.93 -0.23 115.31 121.94 2onk h LEU 211 Ca -0.46 0.27 0.13 0.00 0.09 0.00 0.00 57.88 57.92 2onk h LEU 211 Cb 1.14 0.82 -0.14 0.00 0.09 0.00 0.00 40.66 42.57 2onk h LEU 211 CO 0.45 -0.30 -0.30 0.11 0.09 0.00 0.00 178.44 178.49 2onk h LYS 212 N -0.19 -0.07 -0.58 1.13 1.57 -2.00 0.35 116.57 116.77 2onk h LYS 212 Ca 0.11 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.95 2onk h LYS 212 Cb 0.48 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.75 2onk h LYS 212 CO -0.72 -0.05 0.30 0.93 -0.57 0.00 0.00 179.45 179.34 2onk h GLU 213 N -0.07 0.55 -0.14 3.15 5.08 -1.60 -2.30 114.58 119.25 2onk h GLU 213 Ca 0.31 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.67 2onk h GLU 213 Cb 0.57 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2onk h GLU 213 CO -0.80 0.36 0.10 -0.07 -1.00 0.00 0.00 179.01 177.61 2onk h LEU 214 N 0.57 0.03 0.00 1.33 3.38 0.13 -2.49 115.31 118.26 2onk h LEU 214 Ca 0.26 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2onk h LEU 214 Cb 0.18 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2onk h LEU 214 CO -0.18 0.02 0.00 0.49 0.09 0.00 0.00 178.44 178.86 2onk n PHE 215 N -4.50 0.00 -0.31 1.13 3.01 -0.61 -4.18 117.46 112.00 2onk n PHE 215 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.41 2onk n PHE 215 Cb 0.20 -0.31 -0.03 0.00 -0.01 0.00 0.00 39.48 39.33 2onk n PHE 215 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2onk n SER 216 N -1.44 -0.66 -3.32 4.37 3.41 -1.16 -1.63 113.62 113.19 2onk n SER 216 Ca 0.00 1.34 -0.29 0.00 -0.26 0.00 0.00 58.87 59.67 2onk n SER 216 Cb 0.00 -0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 63.69 2onk n SER 216 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2onk n ALA 217 N -3.51 4.30 -2.11 7.33 0.00 -0.94 -4.89 120.51 120.69 2onk n ALA 217 Ca 0.04 -2.40 -0.43 0.00 0.00 0.00 0.00 53.44 50.65 2onk n ALA 217 Cb 0.25 -3.19 -0.03 0.00 0.00 0.00 0.00 19.45 16.48 2onk n ALA 217 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2onk s LYS 218 N 3.87 3.97 -0.20 0.00 1.02 -0.65 -4.88 119.74 122.88 2onk s LYS 218 Ca 0.45 1.84 0.15 0.00 0.02 0.00 0.00 55.97 58.43 2onk s LYS 218 Cb 0.11 -3.99 0.54 0.00 -0.52 0.00 0.00 37.83 33.97 2onk s LYS 218 CO 0.01 -1.08 1.45 0.09 -0.92 0.00 0.00 175.35 174.90 2onk n ASN 219 N 7.81 3.70 0.00 2.83 3.02 -1.26 -4.97 115.26 126.39 2onk n ASN 219 Ca 0.18 -3.15 0.00 0.00 -0.03 0.00 0.00 54.58 51.58 2onk n ASN 219 Cb 0.44 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 2onk n ASN 219 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2onk n GLY 220 N -0.60 0.18 1.06 7.41 0.00 -1.26 -4.61 105.19 107.36 2onk n GLY 220 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2onk n GLY 220 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2onk n GLU 221 N -1.81 0.00 0.16 1.61 2.13 -1.26 -4.20 120.64 117.27 2onk n GLU 221 Ca 0.00 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.83 2onk n GLU 221 Cb 0.03 -0.49 0.23 0.00 0.27 0.00 0.00 31.44 31.48 2onk n GLU 221 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2onk h VAL 222 N 0.00 1.24 -0.07 6.31 2.07 -1.96 -2.19 116.25 121.64 2onk h VAL 222 Ca 0.00 -1.89 -0.01 0.00 0.82 0.00 0.00 66.70 65.62 2onk h VAL 222 Cb 0.09 2.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.91 2onk h VAL 222 CO 0.00 0.52 0.02 0.00 0.02 0.00 0.00 177.57 178.13 2onk h ALA 223 N 1.47 0.10 0.11 1.67 0.00 -1.84 0.12 119.26 120.89 2onk h ALA 223 Ca -0.01 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.80 2onk h ALA 223 Cb 1.02 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2onk h ALA 223 CO 0.07 -0.29 -0.19 1.49 0.00 0.00 0.00 179.25 180.33 2onk h GLU 224 N -0.08 -0.35 -0.16 0.00 4.81 -1.66 -1.59 114.58 115.54 2onk h GLU 224 Ca 0.02 0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 2onk h GLU 224 Cb 0.22 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 2onk h GLU 224 CO -0.00 -0.24 -0.06 0.35 -0.73 0.00 0.00 179.01 178.33 2onk h PHE 225 N -0.37 -0.14 0.00 0.92 3.57 -1.28 -1.65 116.94 118.00 2onk h PHE 225 Ca 0.02 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2onk h PHE 225 Cb 0.38 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.21 2onk h PHE 225 CO -0.18 -0.10 0.00 1.28 -2.23 0.00 0.00 178.31 177.08 2onk n LEU 226 N -5.20 0.00 0.00 0.59 4.77 0.02 -3.31 117.00 113.87 2onk n LEU 226 Ca -0.03 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.03 2onk n LEU 226 Cb 0.13 0.00 0.38 0.00 -2.33 0.00 0.00 43.42 41.60 2onk n LEU 226 CO 0.25 0.00 0.75 -1.54 -1.33 0.00 0.00 177.39 175.52 2onk n SER 227 N -0.87 0.00 0.00 -1.43 3.41 -0.61 -2.89 113.62 111.23 2onk n SER 227 Ca 0.13 0.31 0.02 0.00 -0.26 0.00 0.00 58.87 59.07 2onk n SER 227 Cb 0.06 -0.41 0.11 0.00 -0.26 0.00 0.00 64.21 63.71 2onk n SER 227 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2onk n ALA 228 N -1.41 1.27 -0.20 7.33 0.00 -1.21 -2.27 120.51 124.03 2onk n ALA 228 Ca 0.06 -0.02 0.09 0.00 0.00 0.00 0.00 53.44 53.56 2onk n ALA 228 Cb 0.17 -1.08 0.38 0.00 0.00 0.00 0.00 19.45 18.91 2onk n ALA 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2onk h ARG 229 N 0.00 0.68 -0.22 0.00 2.47 -1.85 -2.05 114.38 113.40 2onk h ARG 229 Ca 0.00 -0.04 0.04 0.00 -1.26 0.00 0.00 59.98 58.72 2onk h ARG 229 Cb 0.08 -0.15 -0.04 0.00 -1.65 0.00 0.00 29.97 28.20 2onk h ARG 229 CO 0.00 0.45 -0.05 -0.91 0.56 0.00 0.00 179.97 180.02 2onk h ASN 230 N 0.70 -0.20 -0.83 7.04 2.35 -1.76 0.49 115.58 123.38 2onk h ASN 230 Ca 0.35 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 56.16 2onk h ASN 230 Cb 0.42 0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.88 2onk h ASN 230 CO -0.13 -0.07 0.50 -0.07 -1.65 0.00 0.00 177.43 176.01 2onk h LEU 231 N 0.00 1.00 -0.88 1.61 3.38 -1.61 0.98 115.31 119.80 2onk h LEU 231 Ca 0.11 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 2onk h LEU 231 Cb 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2onk h LEU 231 CO -0.22 0.77 -0.27 -0.07 0.09 0.00 0.00 178.44 178.74 2onk h LEU 232 N 1.15 0.52 -0.03 1.67 3.38 -0.85 -0.93 115.31 120.22 2onk h LEU 232 Ca 0.30 -0.18 -0.16 0.00 0.09 0.00 0.00 57.88 57.92 2onk h LEU 232 Cb -0.04 -0.14 0.01 0.00 0.09 0.00 0.00 40.66 40.58 2onk h LEU 232 CO -0.06 0.78 -0.61 -0.07 0.09 0.00 0.00 178.44 178.57 2onk h LEU 233 N 0.45 0.58 -1.11 1.67 3.38 0.15 -2.47 115.31 117.97 2onk h LEU 233 Ca 0.06 -0.73 0.01 0.00 0.09 0.00 0.00 57.88 57.32 2onk h LEU 233 Cb 0.70 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.23 2onk h LEU 233 CO 0.05 1.23 0.60 0.11 0.09 0.00 0.00 178.44 180.53 2onk h LYS 234 N -0.02 1.18 -0.42 1.13 1.57 0.10 -1.68 116.57 118.44 2onk h LYS 234 Ca -0.07 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.57 2onk h LYS 234 Cb 1.30 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 2onk h LYS 234 CO 0.12 0.78 0.01 0.28 -0.57 0.00 0.00 179.45 180.07 2onk h VAL 235 N 1.22 1.26 -0.32 0.50 2.07 -1.18 -1.20 116.25 118.60 2onk h VAL 235 Ca 0.34 -1.02 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 2onk h VAL 235 Cb -0.11 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 2onk h VAL 235 CO -0.08 0.35 0.11 0.77 0.02 0.00 0.00 177.57 178.74 2onk h SER 236 N 0.58 0.41 0.24 0.57 4.64 -0.99 -1.56 113.55 117.45 2onk h SER 236 Ca 0.12 -0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 2onk h SER 236 Cb 0.48 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2onk h SER 236 CO 0.02 0.39 -0.12 0.11 -0.87 0.00 0.00 176.83 176.36 2onk h LYS 237 N 0.45 -0.31 0.00 4.77 1.57 -0.89 -3.08 116.57 119.09 2onk h LYS 237 Ca 0.11 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2onk h LYS 237 Cb 0.12 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.50 2onk h LYS 237 CO -0.01 0.03 0.00 0.82 -0.57 0.00 0.00 179.45 179.73 2onk h ILE 238 N -0.73 0.00 -4.33 1.86 2.04 -0.75 -3.41 117.51 112.19 2onk h ILE 238 Ca -0.03 0.00 -0.70 0.00 1.00 0.00 0.00 64.86 65.13 2onk h ILE 238 Cb 0.49 0.68 -0.27 0.00 -0.74 0.00 0.00 36.82 36.99 2onk h ILE 238 CO 0.05 0.00 -0.84 -0.76 0.00 0.00 0.00 178.15 176.60 2onk s LEU 239 N -5.16 2.35 0.00 1.44 1.43 -0.63 -5.09 118.68 113.02 2onk s LEU 239 Ca -0.03 -0.38 0.00 0.00 -1.03 0.00 0.00 54.13 52.68 2onk s LEU 239 Cb 0.09 -1.43 0.00 0.00 0.03 0.00 0.00 46.19 44.88 2onk s LEU 239 CO 0.28 0.32 0.00 0.47 0.23 0.00 0.00 176.35 177.65