#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dfy s ILE 4 N 0.00 3.63 -0.22 0.55 1.01 -0.20 -1.78 121.20 124.18 3dfy s ILE 4 Ca 0.00 1.25 0.08 0.00 0.00 0.00 0.00 60.65 61.98 3dfy s ILE 4 Cb 0.00 -3.80 -0.10 0.00 0.01 0.00 0.00 42.46 38.57 3dfy s ILE 4 CO 0.00 0.14 0.27 1.33 0.00 0.00 0.00 174.94 176.68 3dfy n VAL 5 N 3.29 0.00 -3.56 2.92 0.24 0.64 0.11 118.33 121.98 3dfy n VAL 5 Ca 0.08 -0.26 -0.12 0.00 -2.04 0.00 0.00 64.34 61.99 3dfy n VAL 5 Cb 0.44 0.72 -0.05 0.00 -1.47 0.00 0.00 33.84 33.49 3dfy n VAL 5 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3dfy s ASN 6 N -2.21 -0.44 -0.04 -1.34 2.47 -1.12 -4.94 114.94 107.32 3dfy s ASN 6 Ca 0.01 0.44 -0.02 0.00 0.42 0.00 0.00 52.86 53.71 3dfy s ASN 6 Cb 0.06 0.37 0.03 0.00 -1.45 0.00 0.00 41.25 40.26 3dfy s ASN 6 CO 0.32 -0.44 0.07 -0.69 -3.72 0.00 0.00 177.10 172.64 3dfy s VAL 7 N -1.33 -0.11 -0.01 -5.21 1.01 -1.26 -0.75 120.40 112.74 3dfy s VAL 7 Ca -0.03 0.34 0.03 0.00 0.00 0.00 0.00 61.98 62.32 3dfy s VAL 7 Cb -0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 36.38 36.22 3dfy s VAL 7 CO 0.03 0.14 -0.09 -1.59 0.00 0.00 0.00 175.10 173.59 3dfy s LYS 8 N 1.78 0.77 -0.04 2.72 -2.85 -0.66 -4.70 119.74 116.76 3dfy s LYS 8 Ca -0.00 -0.31 0.00 0.00 -1.00 0.00 0.00 55.97 54.66 3dfy s LYS 8 Cb -0.12 -0.74 -0.03 0.00 -2.06 0.00 0.00 37.83 34.87 3dfy s LYS 8 CO -0.03 0.17 -0.00 -0.51 0.10 0.00 0.00 175.35 175.07 3dfy s LEU 9 N -0.10 3.51 -0.06 2.77 1.02 -1.26 -1.41 118.68 123.14 3dfy s LEU 9 Ca 0.02 0.05 -0.05 0.00 0.02 0.00 0.00 54.13 54.16 3dfy s LEU 9 Cb -0.05 -1.92 0.02 0.00 0.02 0.00 0.00 46.19 44.26 3dfy s LEU 9 CO -0.00 0.32 0.16 -0.94 0.02 0.00 0.00 176.35 175.91 3dfy s SER 10 N -1.25 -0.17 0.28 2.29 1.04 -0.47 -4.96 113.70 110.47 3dfy s SER 10 Ca 0.17 0.33 -0.29 0.00 0.48 0.00 0.00 55.95 56.63 3dfy s SER 10 Cb -0.11 0.32 -0.09 0.00 0.10 0.00 0.00 66.02 66.24 3dfy s SER 10 CO 0.07 -0.07 1.07 -0.22 0.98 0.00 0.00 173.24 175.08 3dfy s LEU 11 N 0.19 4.54 -0.13 2.42 2.96 -1.26 -0.57 118.68 126.83 3dfy s LEU 11 Ca -0.01 2.21 -0.05 0.00 -0.22 0.00 0.00 54.13 56.06 3dfy s LEU 11 Cb -0.02 -3.66 0.06 0.00 0.50 0.00 0.00 46.19 43.07 3dfy s LEU 11 CO -0.00 -0.12 0.28 -0.54 -1.32 0.00 0.00 176.35 174.64 3dfy s LYS 12 N -1.48 0.19 -0.06 1.98 1.02 -0.23 -4.91 119.74 116.25 3dfy s LYS 12 Ca 0.45 0.71 -0.02 0.00 0.02 0.00 0.00 55.97 57.13 3dfy s LYS 12 Cb -0.31 -0.03 -0.04 0.00 -0.52 0.00 0.00 37.83 36.94 3dfy s LYS 12 CO 0.39 -0.24 0.05 -0.98 -0.92 0.00 0.00 175.35 173.64 3dfy s ARG 13 N 2.08 3.06 -0.07 1.68 3.03 -1.26 -1.07 118.95 126.39 3dfy s ARG 13 Ca -0.02 -0.41 0.02 0.00 2.03 0.00 0.00 55.73 57.35 3dfy s ARG 13 Cb -0.11 -2.86 0.01 0.00 -1.03 0.00 0.00 34.95 30.96 3dfy s ARG 13 CO -0.09 0.69 -0.13 0.71 -1.13 0.00 0.00 175.30 175.35 3dfy s TYR 14 N -1.02 1.52 -0.01 5.89 2.02 0.33 -4.94 117.35 121.13 3dfy s TYR 14 Ca 0.17 -0.58 -0.27 0.00 -0.37 0.00 0.00 57.07 56.02 3dfy s TYR 14 Cb -0.12 -1.11 -0.04 0.00 -0.40 0.00 0.00 41.96 40.29 3dfy s TYR 14 CO 0.07 -0.30 0.87 -2.00 -1.57 0.00 0.00 175.55 172.62 3dfy s GLU 15 N 0.70 4.52 0.06 -0.62 2.12 -1.26 0.84 118.70 125.06 3dfy s GLU 15 Ca -0.14 1.21 -0.30 0.00 0.36 0.00 0.00 54.97 56.10 3dfy s GLU 15 Cb -0.16 -3.44 -0.05 0.00 0.26 0.00 0.00 34.13 30.74 3dfy s GLU 15 CO 0.03 0.03 1.12 0.71 -0.54 0.00 0.00 175.26 176.61 3dfy s TYR 16 N 0.81 3.53 0.17 5.30 2.02 -1.26 -1.91 117.35 126.00 3dfy s TYR 16 Ca 0.46 1.46 -0.14 0.00 -0.37 0.00 0.00 57.07 58.47 3dfy s TYR 16 Cb -0.20 -3.31 0.10 0.00 -0.40 0.00 0.00 41.96 38.14 3dfy s TYR 16 CO 0.24 -0.82 1.80 1.49 -1.57 0.00 0.00 175.55 176.69 3dfy h GLU 17 N 6.55 0.53 -0.70 -0.62 4.57 -1.51 -3.45 114.58 119.95 3dfy h GLU 17 Ca -0.42 -0.03 -0.32 0.00 -1.18 0.00 0.00 59.36 57.41 3dfy h GLU 17 Cb 1.22 -0.12 -0.29 0.00 -0.16 0.00 0.00 28.75 29.40 3dfy h GLU 17 CO 0.78 0.35 -0.83 1.63 -1.18 0.00 0.00 179.01 179.76 3dfy n LYS 18 N -4.84 1.12 -3.40 1.92 4.76 -1.26 -5.14 118.16 111.31 3dfy n LYS 18 Ca 0.03 -2.64 -0.38 0.00 -2.87 0.00 0.00 58.31 52.46 3dfy n LYS 18 Cb 0.09 -0.90 -0.06 0.00 -1.84 0.00 0.00 35.03 32.32 3dfy n LYS 18 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 3dfy s GLU 29 N -1.50 4.06 -0.16 1.97 2.12 -1.26 -5.22 118.70 118.72 3dfy s GLU 29 Ca 0.27 0.53 0.00 0.00 0.36 0.00 0.00 54.97 56.14 3dfy s GLU 29 Cb 0.40 -3.25 0.00 0.00 0.26 0.00 0.00 34.13 31.54 3dfy s GLU 29 CO -0.03 0.62 -0.16 0.45 -0.54 0.00 0.00 175.26 175.60 3dfy s SER 30 N -0.92 3.58 -0.41 -1.70 0.15 0.25 -4.86 113.70 109.79 3dfy s SER 30 Ca 0.26 -0.49 -0.07 0.00 0.70 0.00 0.00 55.95 56.34 3dfy s SER 30 Cb -0.18 -1.55 0.08 0.00 -1.71 0.00 0.00 66.02 62.67 3dfy s SER 30 CO 0.15 0.07 0.23 -0.13 1.20 0.00 0.00 173.24 174.76 3dfy s ARG 31 N 0.87 2.48 0.36 5.44 0.52 -1.26 -0.51 118.95 126.85 3dfy s ARG 31 Ca -0.04 -1.51 0.08 0.00 -0.52 0.00 0.00 55.73 53.74 3dfy s ARG 31 Cb -0.15 -3.69 -0.04 0.00 0.52 0.00 0.00 34.95 31.59 3dfy s ARG 31 CO -0.01 -0.95 0.23 -0.80 0.02 0.00 0.00 175.30 173.79 3dfy s ASN 32 N 2.00 4.90 -0.24 0.23 0.01 -0.24 -4.62 114.94 116.98 3dfy s ASN 32 Ca 0.03 -0.71 -0.01 0.00 -0.71 0.00 0.00 52.86 51.46 3dfy s ASN 32 Cb -0.23 -0.76 0.03 0.00 0.41 0.00 0.00 41.25 40.70 3dfy s ASN 32 CO 0.01 -0.39 -0.09 -0.69 -1.51 0.00 0.00 177.10 174.43 3dfy s VAL 33 N -2.41 2.68 0.05 1.60 1.01 0.07 -1.07 120.40 122.33 3dfy s VAL 33 Ca 0.40 -1.04 -0.20 0.00 0.00 0.00 0.00 61.98 61.14 3dfy s VAL 33 Cb -0.03 -2.33 -0.06 0.00 0.00 0.00 0.00 36.38 33.95 3dfy s VAL 33 CO 0.25 0.25 0.60 -0.70 0.00 0.00 0.00 175.10 175.50 3dfy s GLU 34 N 1.30 4.29 -0.15 2.72 2.12 0.27 -0.02 118.70 129.23 3dfy s GLU 34 Ca 0.00 0.79 -0.00 0.00 0.36 0.00 0.00 54.97 56.12 3dfy s GLU 34 Cb -0.16 -3.28 -0.01 0.00 0.26 0.00 0.00 34.13 30.94 3dfy s GLU 34 CO -0.06 0.53 -0.14 0.08 -0.54 0.00 0.00 175.26 175.13 3dfy s VAL 35 N -0.77 2.86 -0.17 3.70 1.01 0.34 -1.37 120.40 126.01 3dfy s VAL 35 Ca 0.31 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.58 3dfy s VAL 35 Cb -0.19 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 33.99 3dfy s VAL 35 CO 0.19 0.51 -0.20 -0.70 0.00 0.00 0.00 175.10 174.91 3dfy s GLU 36 N 0.63 3.03 -0.21 2.72 2.12 -0.50 -1.17 118.70 125.31 3dfy s GLU 36 Ca -0.08 -0.83 -0.06 0.00 0.36 0.00 0.00 54.97 54.36 3dfy s GLU 36 Cb -0.16 -2.55 -0.03 0.00 0.26 0.00 0.00 34.13 31.66 3dfy s GLU 36 CO 0.03 -0.14 0.04 0.42 -0.54 0.00 0.00 175.26 175.07 3dfy s ILE 37 N 1.12 4.29 -0.21 -3.70 1.01 0.74 -1.66 121.20 122.80 3dfy s ILE 37 Ca 0.01 -0.19 -0.09 0.00 0.00 0.00 0.00 60.65 60.37 3dfy s ILE 37 Cb -0.14 -2.96 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 3dfy s ILE 37 CO -0.09 0.40 0.11 -0.69 0.00 0.00 0.00 174.94 174.68 3dfy s VAL 38 N 1.05 5.06 0.05 2.92 1.01 0.07 -0.94 120.40 129.61 3dfy s VAL 38 Ca 0.03 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.08 3dfy s VAL 38 Cb -0.14 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 3dfy s VAL 38 CO 0.02 0.41 0.16 -0.76 0.00 0.00 0.00 175.10 174.94 3dfy s LEU 39 N 0.67 4.18 0.56 3.92 1.02 -0.17 -0.26 118.68 128.61 3dfy s LEU 39 Ca 0.06 0.20 0.26 0.00 0.02 0.00 0.00 54.13 54.67 3dfy s LEU 39 Cb -0.13 -2.73 1.51 0.00 0.02 0.00 0.00 46.19 44.87 3dfy s LEU 39 CO 0.01 0.19 2.07 1.05 0.02 0.00 0.00 176.35 179.69 3dfy h GLU 40 N 3.34 0.00 0.00 1.70 4.11 -1.66 0.39 114.58 122.46 3dfy h GLU 40 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 3dfy h GLU 40 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3dfy h GLU 40 CO 0.71 0.00 0.00 0.66 0.07 0.00 0.00 179.01 180.45 3dfy h SER 41 N 0.00 0.00 0.00 3.06 4.64 -1.94 -3.46 113.55 115.85 3dfy h SER 41 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3dfy h SER 41 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 3dfy h SER 41 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3dfy n GLY 42 N 0.11 0.38 3.77 -0.77 0.00 0.14 -5.07 105.19 103.75 3dfy n GLY 42 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 3dfy n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dfy s VAL 43 N -2.00 3.05 -0.08 1.61 1.01 -1.25 -4.78 120.40 117.96 3dfy s VAL 43 Ca 0.00 0.94 0.03 0.00 0.00 0.00 0.00 61.98 62.95 3dfy s VAL 43 Cb 0.00 -3.56 0.01 0.00 0.00 0.00 0.00 36.38 32.83 3dfy s VAL 43 CO 0.00 0.14 -0.17 -0.54 0.00 0.00 0.00 175.10 174.53 3dfy s LYS 44 N -2.09 2.20 -0.06 2.72 1.02 -1.26 -1.00 119.74 121.27 3dfy s LYS 44 Ca 0.54 -0.60 0.01 0.00 0.02 0.00 0.00 55.97 55.94 3dfy s LYS 44 Cb -0.33 -1.74 -0.03 0.00 -0.52 0.00 0.00 37.83 35.20 3dfy s LYS 44 CO 0.43 0.10 -0.05 0.20 -0.92 0.00 0.00 175.35 175.10 3dfy s GLY 45 N 0.50 1.74 0.10 -3.33 0.00 -0.12 -4.67 107.32 101.54 3dfy s GLY 45 Ca -0.15 -0.90 0.10 0.00 0.00 0.00 0.00 44.72 43.77 3dfy s GLY 45 CO 0.06 -0.69 -0.25 -0.19 0.00 0.00 0.00 173.10 172.03 3dfy s TYR 46 N -0.87 2.16 0.17 1.90 2.02 -1.26 -0.19 117.35 121.29 3dfy s TYR 46 Ca 0.14 -0.39 -0.10 0.00 -0.37 0.00 0.00 57.07 56.34 3dfy s TYR 46 Cb -0.11 -1.20 -0.00 0.00 -0.40 0.00 0.00 41.96 40.24 3dfy s TYR 46 CO 0.03 0.26 0.33 0.20 -1.57 0.00 0.00 175.55 174.79 3dfy s GLY 47 N -1.82 0.37 -0.03 0.71 0.00 -0.31 -3.76 107.32 102.48 3dfy s GLY 47 Ca 0.12 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 44.08 3dfy s GLY 47 CO 0.05 -0.73 0.01 1.85 0.00 0.00 0.00 173.10 174.27 3dfy s GLU 48 N -3.95 0.21 -0.34 2.90 2.12 -1.26 -0.50 118.70 117.88 3dfy s GLU 48 Ca 0.16 0.09 -0.11 0.00 0.36 0.00 0.00 54.97 55.47 3dfy s GLU 48 Cb 0.02 -0.40 0.00 0.00 0.26 0.00 0.00 34.13 34.01 3dfy s GLU 48 CO -0.01 -0.13 0.20 0.00 -0.54 0.00 0.00 175.26 174.78 3dfy s ALA 49 N 0.96 3.35 -0.69 6.30 0.00 0.97 -4.45 121.76 128.18 3dfy s ALA 49 Ca -0.09 -1.49 -0.06 0.00 0.00 0.00 0.00 51.96 50.32 3dfy s ALA 49 Cb -0.13 -2.53 0.18 0.00 0.00 0.00 0.00 23.12 20.64 3dfy s ALA 49 CO -0.02 -1.07 0.54 0.45 0.00 0.00 0.00 175.76 175.66 3dfy s SER 50 N 1.63 5.67 0.78 0.00 0.15 -1.26 -0.76 113.70 119.92 3dfy s SER 50 Ca 0.04 -2.85 -0.13 0.00 0.70 0.00 0.00 55.95 53.71 3dfy s SER 50 Cb -0.18 -1.95 0.07 0.00 -1.71 0.00 0.00 66.02 62.25 3dfy s SER 50 CO 0.08 -0.42 1.17 -2.16 1.20 0.00 0.00 173.24 173.11 3dfy s PRO 51 N -0.06 1.88 -0.08 5.44 0.04 -1.26 -4.61 135.00 136.34 3dfy s PRO 51 Ca 0.18 1.59 -0.02 0.00 0.04 0.00 0.00 61.00 62.79 3dfy s PRO 51 Cb -0.17 -1.82 0.04 0.00 0.04 0.00 0.00 34.50 32.58 3dfy s PRO 51 CO -0.05 -2.00 0.04 0.45 0.04 0.00 0.00 177.00 175.49 3dfy s SER 52 N -2.44 1.59 0.05 6.66 0.15 -1.26 -4.87 113.70 113.58 3dfy s SER 52 Ca 0.70 -0.14 -0.17 0.00 0.70 0.00 0.00 55.95 57.04 3dfy s SER 52 Cb -0.25 -0.29 -0.17 0.00 -1.71 0.00 0.00 66.02 63.60 3dfy s SER 52 CO 0.50 -0.25 1.25 0.15 1.20 0.00 0.00 173.24 176.09 3dfy h PHE 53 N 8.39 0.75 -0.32 3.44 3.57 -1.87 -1.30 116.94 129.60 3dfy h PHE 53 Ca -0.15 -0.32 -0.03 0.00 3.53 0.00 0.00 57.97 60.99 3dfy h PHE 53 Cb 1.13 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.73 3dfy h PHE 53 CO 0.42 1.10 0.07 -0.09 -2.23 0.00 0.00 178.31 177.58 3dfy h ARG 54 N 0.19 0.52 0.00 1.11 2.43 -1.94 0.09 114.38 116.78 3dfy h ARG 54 Ca -0.03 -0.13 -0.14 0.00 -0.81 0.00 0.00 59.98 58.86 3dfy h ARG 54 Cb 1.15 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 3dfy h ARG 54 CO 0.11 0.60 -0.79 0.28 -1.51 0.00 0.00 179.97 178.66 3dfy h VAL 55 N 0.36 1.22 -0.00 0.20 2.07 -1.98 -3.40 116.25 114.71 3dfy h VAL 55 Ca 0.10 -2.22 0.00 0.00 0.82 0.00 0.00 66.70 65.40 3dfy h VAL 55 Cb 0.32 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 3dfy h VAL 55 CO 0.00 0.41 -0.89 0.59 0.02 0.00 0.00 177.57 177.70 3dfy n ASN 56 N -4.50 0.96 -0.19 0.57 3.02 -0.59 -4.97 115.26 109.56 3dfy n ASN 56 Ca -0.24 -0.98 -0.02 0.00 -0.03 0.00 0.00 54.58 53.31 3dfy n ASN 56 Cb 0.60 0.98 -0.01 0.00 -0.61 0.00 0.00 39.78 40.74 3dfy n ASN 56 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dfy n GLY 57 N 1.45 0.58 3.87 7.41 0.00 0.02 -4.95 105.19 113.56 3dfy n GLY 57 Ca 0.04 -0.47 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 3dfy n GLY 57 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dfy s GLU 58 N -1.50 3.84 -0.10 1.61 2.02 -0.88 -4.86 118.70 118.83 3dfy s GLU 58 Ca 0.00 0.56 0.02 0.00 0.02 0.00 0.00 54.97 55.57 3dfy s GLU 58 Cb 0.00 -2.37 0.01 0.00 0.10 0.00 0.00 34.13 31.87 3dfy s GLU 58 CO 0.00 -0.03 -0.16 1.03 0.02 0.00 0.00 175.26 176.13 3dfy s ARG 59 N -3.72 2.21 0.51 1.61 1.81 -1.26 -3.00 118.95 117.10 3dfy s ARG 59 Ca 0.53 -0.57 0.25 0.00 -1.72 0.00 0.00 55.73 54.22 3dfy s ARG 59 Cb -0.10 -1.84 1.35 0.00 -0.45 0.00 0.00 34.95 33.90 3dfy s ARG 59 CO 0.29 -0.02 1.93 -0.24 -0.68 0.00 0.00 175.30 176.58 3dfy h VAL 60 N 5.93 0.67 -0.25 3.52 3.04 -1.94 0.61 116.25 127.83 3dfy h VAL 60 Ca -0.30 -0.03 -0.12 0.00 -1.01 0.00 0.00 66.70 65.24 3dfy h VAL 60 Cb 1.18 0.56 -0.01 0.00 -2.01 0.00 0.00 31.29 31.02 3dfy h VAL 60 CO 0.48 0.02 -0.33 -0.33 -1.01 0.00 0.00 177.57 176.40 3dfy h GLU 61 N 0.10 0.53 -0.41 4.17 3.07 -1.98 -2.97 114.58 117.10 3dfy h GLU 61 Ca 0.35 -0.24 -0.14 0.00 -0.50 0.00 0.00 59.36 58.83 3dfy h GLU 61 Cb 1.25 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 29.13 3dfy h GLU 61 CO -0.04 0.80 -0.30 0.00 -1.40 0.00 0.00 179.01 178.07 3dfy h ALA 62 N 1.19 0.69 -0.49 3.43 0.00 -1.31 -2.41 119.26 120.36 3dfy h ALA 62 Ca 0.05 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3dfy h ALA 62 Cb 0.80 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3dfy h ALA 62 CO 0.07 0.67 0.32 -0.07 0.00 0.00 0.00 179.25 180.24 3dfy h LEU 63 N 0.75 0.56 -0.98 0.00 4.07 -1.36 -2.72 115.31 115.62 3dfy h LEU 63 Ca 0.08 -0.02 -0.06 0.00 0.08 0.00 0.00 57.88 57.96 3dfy h LEU 63 Cb 0.87 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.45 3dfy h LEU 63 CO 0.08 0.41 0.05 -0.07 -1.08 0.00 0.00 178.44 177.83 3dfy h LEU 64 N 0.66 0.74 -2.21 1.67 3.38 -1.45 -2.88 115.31 115.23 3dfy h LEU 64 Ca 0.18 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3dfy h LEU 64 Cb -0.07 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.48 3dfy h LEU 64 CO -0.04 0.78 0.00 0.00 0.09 0.00 0.00 178.44 179.27 3dfy h ALA 65 N 1.31 1.00 -0.49 1.53 0.00 -1.11 -2.86 119.26 118.65 3dfy h ALA 65 Ca 0.15 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 3dfy h ALA 65 Cb 0.38 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3dfy h ALA 65 CO 0.01 0.00 0.05 0.44 0.00 0.00 0.00 179.25 179.75 3dfy n ILE 66 N -2.98 2.63 -0.16 0.00 -5.35 -1.09 -4.63 119.36 107.78 3dfy n ILE 66 Ca -0.01 -1.68 -0.02 0.00 -0.27 0.00 0.00 62.75 60.76 3dfy n ILE 66 Cb 0.16 -0.29 0.06 0.00 -1.74 0.00 0.00 39.64 37.84 3dfy n ILE 66 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3dfy h GLU 67 N 2.85 0.15 -0.91 6.28 4.81 -1.63 -2.19 114.58 123.94 3dfy h GLU 67 Ca 0.06 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 3dfy h GLU 67 Cb 1.85 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 31.16 3dfy h GLU 67 CO 0.44 0.10 0.51 -0.97 -0.73 0.00 0.00 179.01 178.36 3dfy h ASN 68 N 0.16 1.12 -0.60 1.04 -0.73 -1.87 -1.34 115.58 113.36 3dfy h ASN 68 Ca 0.26 -0.10 -0.07 0.00 1.87 0.00 0.00 56.30 58.26 3dfy h ASN 68 Cb 0.38 -0.29 -0.03 0.00 0.27 0.00 0.00 38.32 38.65 3dfy h ASN 68 CO -0.39 0.89 0.11 0.00 -0.37 0.00 0.00 177.43 177.68 3dfy h ALA 69 N 1.28 1.02 -0.19 1.57 0.00 -1.77 -1.72 119.26 119.44 3dfy h ALA 69 Ca 0.32 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3dfy h ALA 69 Cb 0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3dfy h ALA 69 CO -0.05 0.63 0.03 0.28 0.00 0.00 0.00 179.25 180.14 3dfy h VAL 70 N 0.95 1.22 -0.56 0.00 2.07 -0.97 -0.94 116.25 118.03 3dfy h VAL 70 Ca 0.19 -0.72 -0.00 0.00 0.82 0.00 0.00 66.70 66.99 3dfy h VAL 70 Cb 0.39 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 3dfy h VAL 70 CO 0.01 0.22 0.34 -0.09 0.02 0.00 0.00 177.57 178.07 3dfy h ARG 71 N 0.11 0.75 -0.35 1.57 2.43 -1.15 -2.17 114.38 115.58 3dfy h ARG 71 Ca 0.06 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 3dfy h ARG 71 Cb 0.31 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 3dfy h ARG 71 CO 0.00 0.54 0.05 1.49 -1.51 0.00 0.00 179.97 180.55 3dfy h GLU 72 N 0.75 0.52 -0.39 0.20 4.22 -1.21 0.18 114.58 118.85 3dfy h GLU 72 Ca 0.20 -0.09 -0.06 0.00 0.08 0.00 0.00 59.36 59.49 3dfy h GLU 72 Cb -0.02 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 3dfy h GLU 72 CO -0.04 0.51 -0.01 0.52 -2.18 0.00 0.00 179.01 177.80 3dfy h MET 73 N 0.51 0.62 0.00 1.92 2.86 -0.51 -3.35 114.93 116.98 3dfy h MET 73 Ca 0.12 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 3dfy h MET 73 Cb 0.25 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.83 3dfy h MET 73 CO 0.00 0.65 0.00 0.44 1.06 0.00 0.00 176.91 179.06 3dfy n ILE 74 N -4.24 0.00 -1.74 -1.22 -5.35 -1.10 -5.02 119.36 100.69 3dfy n ILE 74 Ca 0.02 -0.44 -0.42 0.00 -0.27 0.00 0.00 62.75 61.64 3dfy n ILE 74 Cb 0.27 1.04 -0.01 0.00 -1.74 0.00 0.00 39.64 39.21 3dfy n ILE 74 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 3dfy n THR 75 N -0.55 1.46 0.00 7.28 -1.04 0.60 -1.97 114.28 120.07 3dfy n THR 75 Ca 0.00 -0.36 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 3dfy n THR 75 Cb 0.01 -1.87 0.00 0.00 -1.82 0.00 0.00 70.33 66.65 3dfy n THR 75 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dfy n GLY 76 N 1.42 3.26 3.75 3.41 0.00 0.12 -4.95 105.19 112.20 3dfy n GLY 76 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3dfy n GLY 76 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dfy s ILE 77 N -2.58 4.08 0.03 -0.61 1.01 -0.83 -4.49 121.20 117.81 3dfy s ILE 77 Ca 0.00 2.01 -0.30 0.00 0.00 0.00 0.00 60.65 62.37 3dfy s ILE 77 Cb 0.00 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.15 3dfy s ILE 77 CO 0.00 0.45 0.96 -0.62 0.00 0.00 0.00 174.94 175.72 3dfy s ASP 78 N -0.90 7.38 0.50 3.58 -1.08 -1.26 -1.03 116.67 123.85 3dfy s ASP 78 Ca 0.43 1.66 0.34 0.00 -0.52 0.00 0.00 52.55 54.46 3dfy s ASP 78 Cb -0.26 -2.56 1.81 0.00 -1.46 0.00 0.00 42.92 40.45 3dfy s ASP 78 CO 0.33 -0.20 2.03 -0.37 0.52 0.00 0.00 175.17 177.48 3dfy h VAL 79 N 4.59 0.00 0.00 1.11 -1.51 -1.93 -0.01 116.25 118.50 3dfy h VAL 79 Ca -0.42 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 3dfy h VAL 79 Cb 1.22 0.79 0.00 0.00 -2.13 0.00 0.00 31.29 31.16 3dfy h VAL 79 CO 0.74 0.00 0.00 0.08 -1.23 0.00 0.00 177.57 177.16 3dfy h ARG 80 N 0.00 0.00 -1.69 5.19 0.11 -1.95 -1.85 114.38 114.19 3dfy h ARG 80 Ca 0.00 0.00 -0.74 0.00 0.10 0.00 0.00 59.98 59.34 3dfy h ARG 80 Cb 0.03 0.00 -0.28 0.00 1.11 0.00 0.00 29.97 30.82 3dfy h ARG 80 CO 0.00 0.00 0.93 0.09 0.10 0.00 0.00 179.97 181.09 3dfy n ASN 81 N -2.97 7.45 0.14 0.08 3.02 -0.02 -4.78 115.26 118.19 3dfy n ASN 81 Ca 0.01 -3.82 0.15 0.00 -0.03 0.00 0.00 54.58 50.89 3dfy n ASN 81 Cb 0.30 -1.01 0.71 0.00 -0.61 0.00 0.00 39.78 39.16 3dfy n ASN 81 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 3dfy h TYR 82 N 2.69 0.00 0.00 3.10 -0.00 -1.48 -0.22 116.97 121.07 3dfy h TYR 82 Ca 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 59.29 3dfy h TYR 82 Cb 0.29 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.02 3dfy h TYR 82 CO 1.24 0.00 -0.05 0.00 -0.00 0.00 0.00 178.16 179.35 3dfy h ALA 83 N 1.84 1.17 -0.04 0.10 0.00 -1.88 -0.44 119.26 120.02 3dfy h ALA 83 Ca 0.12 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 3dfy h ALA 83 Cb 0.53 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.32 3dfy h ALA 83 CO -0.00 0.06 -0.48 0.00 0.00 0.00 0.00 179.25 178.83 3dfy h ARG 84 N 0.00 0.40 -0.43 0.00 3.08 -1.42 -2.05 114.38 113.95 3dfy h ARG 84 Ca -0.00 -0.37 -0.02 0.00 0.07 0.00 0.00 59.98 59.66 3dfy h ARG 84 Cb 0.23 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 3dfy h ARG 84 CO 0.01 1.03 0.18 0.82 -1.07 0.00 0.00 179.97 180.94 3dfy h ILE 85 N -0.11 1.16 -0.18 2.04 2.04 -1.33 -1.77 117.51 119.37 3dfy h ILE 85 Ca -0.05 -0.48 -0.05 0.00 1.00 0.00 0.00 64.86 65.29 3dfy h ILE 85 Cb 1.17 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 3dfy h ILE 85 CO 0.10 0.19 -0.06 -0.26 0.00 0.00 0.00 178.15 178.11 3dfy h PHE 86 N 0.60 0.41 -0.54 1.37 -1.00 -1.07 -1.39 116.94 115.32 3dfy h PHE 86 Ca 0.15 -0.10 -0.01 0.00 2.81 0.00 0.00 57.97 60.83 3dfy h PHE 86 Cb 0.11 -0.10 -0.03 0.00 3.61 0.00 0.00 35.95 39.54 3dfy h PHE 86 CO 0.01 0.65 0.31 1.49 -1.61 0.00 0.00 178.31 179.15 3dfy h GLU 87 N 0.06 0.74 -0.24 1.51 4.81 -1.09 -1.24 114.58 119.13 3dfy h GLU 87 Ca 0.04 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 3dfy h GLU 87 Cb 0.53 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 3dfy h GLU 87 CO 0.02 0.56 0.12 0.82 -0.73 0.00 0.00 179.01 179.80 3dfy h ILE 88 N 0.72 1.14 0.00 2.32 2.04 -1.29 -2.73 117.51 119.72 3dfy h ILE 88 Ca 0.19 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.67 3dfy h ILE 88 Cb 0.02 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 3dfy h ILE 88 CO -0.03 0.13 0.00 0.71 0.00 0.00 0.00 178.15 178.96 3dfy h THR 89 N 0.26 0.00 0.00 -0.27 1.35 -1.03 -2.07 112.91 111.15 3dfy h THR 89 Ca 0.08 -0.26 -0.00 0.00 -0.55 0.00 0.00 66.41 65.68 3dfy h THR 89 Cb 0.10 1.03 -0.00 0.00 -1.73 0.00 0.00 68.15 67.55 3dfy h THR 89 CO -0.01 0.00 -0.00 0.44 -0.25 0.00 0.00 175.52 175.70 3dfy h ASP 90 N 0.00 0.00 0.61 5.36 3.32 -0.89 -0.48 116.42 124.33 3dfy h ASP 90 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3dfy h ASP 90 Cb 0.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.94 3dfy h ASP 90 CO 0.00 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.06 3dfy n ARG 91 N -3.09 0.12 -1.14 3.56 1.74 -0.78 -3.03 116.66 114.03 3dfy n ARG 91 Ca -0.01 0.36 -0.22 0.00 -0.77 0.00 0.00 57.85 57.21 3dfy n ARG 91 Cb 0.19 -1.72 0.02 0.00 -1.02 0.00 0.00 32.46 29.92 3dfy n ARG 91 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3dfy n LEU 92 N -1.94 6.65 0.11 0.55 4.77 -0.19 -4.54 117.00 122.41 3dfy n LEU 92 Ca 0.02 -3.68 0.10 0.00 -0.03 0.00 0.00 56.01 52.43 3dfy n LEU 92 Cb 0.20 -1.10 0.46 0.00 -2.33 0.00 0.00 43.42 40.64 3dfy n LEU 92 CO 0.17 1.41 0.81 2.22 -1.33 0.00 0.00 177.39 180.67 3dfy n PHE 93 N 0.33 0.63 1.05 -1.77 1.16 -1.17 -0.71 117.46 116.98 3dfy n PHE 93 Ca 0.40 0.26 0.13 0.00 -1.87 0.00 0.00 57.45 56.37 3dfy n PHE 93 Cb 0.57 -0.93 0.41 0.00 -1.61 0.00 0.00 39.48 37.93 3dfy n PHE 93 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3dfy n GLY 94 N -0.31 -1.28 2.45 4.97 0.00 -1.26 -3.99 105.19 105.76 3dfy n GLY 94 Ca 0.02 -0.26 -0.19 0.00 0.00 0.00 0.00 46.02 45.59 3dfy n GLY 94 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3dfy n PHE 95 N -1.42 1.39 -0.29 1.61 3.72 0.12 -4.76 117.46 117.82 3dfy n PHE 95 Ca 0.07 -3.63 0.11 0.00 -0.05 0.00 0.00 57.45 53.95 3dfy n PHE 95 Cb 0.33 -0.40 0.27 0.00 -0.94 0.00 0.00 39.48 38.74 3dfy n PHE 95 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3dfy h PRO 96 N 2.97 0.39 -0.51 -1.08 0.13 -1.66 -0.49 132.00 131.75 3dfy h PRO 96 Ca 0.08 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 3dfy h PRO 96 Cb 0.91 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 31.92 3dfy h PRO 96 CO 0.59 0.26 0.28 0.66 -0.23 0.00 0.00 178.00 179.56 3dfy h SER 97 N 0.40 0.62 -0.09 1.44 4.64 -1.82 0.39 113.55 119.14 3dfy h SER 97 Ca 0.52 -0.04 -0.23 0.00 -0.47 0.00 0.00 61.79 61.56 3dfy h SER 97 Cb 0.93 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 62.88 3dfy h SER 97 CO -0.50 0.51 -0.86 0.25 -0.87 0.00 0.00 176.83 175.36 3dfy h LEU 98 N 0.71 0.90 -0.57 5.97 5.85 -1.49 -1.73 115.31 124.96 3dfy h LEU 98 Ca 0.18 -0.68 0.08 0.00 0.84 0.00 0.00 57.88 58.30 3dfy h LEU 98 Cb 0.02 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 40.72 3dfy h LEU 98 CO -0.03 1.45 0.23 0.50 -0.34 0.00 0.00 178.44 180.25 3dfy h LYS 99 N 0.44 0.41 -0.38 1.25 3.64 -0.46 0.32 116.57 121.80 3dfy h LYS 99 Ca -0.08 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 3dfy h LYS 99 Cb 1.50 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 33.21 3dfy h LYS 99 CO 0.17 0.27 0.19 0.00 -2.27 0.00 0.00 179.45 177.82 3dfy h ALA 100 N 1.37 0.49 -0.56 5.00 0.00 -0.83 -1.50 119.26 123.23 3dfy h ALA 100 Ca 0.28 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3dfy h ALA 100 Cb 0.30 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3dfy h ALA 100 CO -0.26 0.03 0.25 0.00 0.00 0.00 0.00 179.25 179.27 3dfy h ALA 101 N 1.05 0.72 -0.33 0.00 0.00 -0.50 -0.43 119.26 119.77 3dfy h ALA 101 Ca 0.13 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 3dfy h ALA 101 Cb 0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3dfy h ALA 101 CO -0.02 0.30 -0.28 0.28 0.00 0.00 0.00 179.25 179.53 3dfy h VAL 102 N 0.76 1.29 -0.48 0.00 2.07 -0.90 -0.96 116.25 118.03 3dfy h VAL 102 Ca 0.19 -1.44 -0.06 0.00 0.82 0.00 0.00 66.70 66.21 3dfy h VAL 102 Cb 0.15 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 3dfy h VAL 102 CO -0.02 0.47 0.06 1.56 0.02 0.00 0.00 177.57 179.66 3dfy h GLN 103 N 0.54 0.80 -0.26 1.57 4.20 -1.15 -1.57 115.11 119.25 3dfy h GLN 103 Ca 0.06 -0.23 -0.07 0.00 0.06 0.00 0.00 58.65 58.48 3dfy h GLN 103 Cb 0.85 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.54 3dfy h GLN 103 CO 0.07 0.82 -0.10 0.35 -0.67 0.00 0.00 178.83 179.30 3dfy h PHE 104 N 0.67 0.60 -0.57 2.96 3.57 -1.06 -2.60 116.94 120.50 3dfy h PHE 104 Ca 0.14 -0.14 0.11 0.00 3.53 0.00 0.00 57.97 61.61 3dfy h PHE 104 Cb 0.42 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 3dfy h PHE 104 CO 0.03 0.77 0.39 0.00 -2.23 0.00 0.00 178.31 177.26 3dfy h ALA 105 N 0.74 2.11 -0.35 2.41 0.00 -1.06 0.17 119.26 123.27 3dfy h ALA 105 Ca 0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3dfy h ALA 105 Cb 0.60 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3dfy h ALA 105 CO 0.03 -0.24 0.08 1.15 0.00 0.00 0.00 179.25 180.27 3dfy h THR 106 N 0.32 1.23 -0.01 0.00 2.02 -0.95 -1.79 112.91 113.73 3dfy h THR 106 Ca 0.27 -0.78 -0.10 0.00 0.77 0.00 0.00 66.41 66.57 3dfy h THR 106 Cb 0.62 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 68.08 3dfy h THR 106 CO -0.06 0.26 -0.45 -0.07 0.37 0.00 0.00 175.52 175.57 3dfy h LEU 107 N 0.41 0.01 -0.44 2.58 3.38 -0.65 -0.83 115.31 119.78 3dfy h LEU 107 Ca 0.11 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3dfy h LEU 107 Cb 0.32 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3dfy h LEU 107 CO 0.00 0.46 0.14 -0.78 0.09 0.00 0.00 178.44 178.36 3dfy h ASP 108 N 0.01 0.65 -0.27 -0.43 3.58 -0.45 -0.37 116.42 119.14 3dfy h ASP 108 Ca -0.00 -0.21 -0.13 0.00 0.42 0.00 0.00 57.03 57.11 3dfy h ASP 108 Cb 0.80 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 41.68 3dfy h ASP 108 CO 0.06 0.68 -0.35 0.00 -2.88 0.00 0.00 179.24 176.75 3dfy h ALA 109 N 0.99 0.41 -0.15 -0.78 0.00 -1.08 -2.92 119.26 115.73 3dfy h ALA 109 Ca 0.14 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.63 3dfy h ALA 109 Cb 0.27 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3dfy h ALA 109 CO -0.00 0.47 0.08 1.25 0.00 0.00 0.00 179.25 181.04 3dfy h LEU 110 N 0.45 0.12 -1.23 0.00 5.85 -0.98 -1.93 115.31 117.58 3dfy h LEU 110 Ca 0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.76 3dfy h LEU 110 Cb 0.93 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.91 3dfy h LEU 110 CO 0.08 0.09 0.48 0.77 -0.34 0.00 0.00 178.44 179.52 3dfy h SER 111 N 0.16 0.88 -0.52 1.25 4.64 -1.10 0.23 113.55 119.09 3dfy h SER 111 Ca 0.06 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.31 3dfy h SER 111 Cb 0.00 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 61.85 3dfy h SER 111 CO -0.04 0.65 0.19 1.56 -0.87 0.00 0.00 176.83 178.32 3dfy h GLN 112 N 1.02 0.78 0.00 4.77 4.20 -1.29 0.43 115.11 125.03 3dfy h GLN 112 Ca 0.27 -0.15 -0.06 0.00 0.06 0.00 0.00 58.65 58.77 3dfy h GLN 112 Cb -0.09 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 3dfy h GLN 112 CO -0.06 0.71 -0.28 0.93 -0.67 0.00 0.00 178.83 179.47 3dfy h GLU 113 N 0.70 0.00 -0.14 1.46 5.08 -0.55 -1.79 114.58 119.33 3dfy h GLU 113 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3dfy h GLU 113 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3dfy h GLU 113 CO -0.01 0.28 0.00 1.28 -1.00 0.00 0.00 179.01 179.56 3dfy n LEU 114 N -3.57 1.94 -2.91 1.33 4.77 -0.01 -4.94 117.00 113.60 3dfy n LEU 114 Ca -0.01 -0.76 -0.20 0.00 -0.03 0.00 0.00 56.01 55.01 3dfy n LEU 114 Cb 0.42 -0.09 0.05 0.00 -2.33 0.00 0.00 43.42 41.47 3dfy n LEU 114 CO 0.34 0.38 0.12 0.61 -1.33 0.00 0.00 177.39 177.52 3dfy n GLY 115 N 1.20 -0.33 0.00 -0.72 0.00 0.14 -4.99 105.19 100.50 3dfy n GLY 115 Ca 0.17 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.26 3dfy n GLY 115 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3dfy n THR 116 N -4.51 0.00 -4.43 2.61 5.66 0.13 -5.01 114.28 108.73 3dfy n THR 116 Ca -0.04 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.72 3dfy n THR 116 Cb 0.57 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.24 3dfy n THR 116 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3dfy s GLN 117 N -0.36 1.54 0.19 1.09 -0.21 -1.26 -4.01 119.66 116.64 3dfy s GLN 117 Ca 0.00 -1.62 -0.12 0.00 0.02 0.00 0.00 55.36 53.64 3dfy s GLN 117 Cb 0.00 -1.70 0.19 0.00 1.00 0.00 0.00 33.01 32.49 3dfy s GLN 117 CO 0.00 0.34 1.74 0.28 -2.12 0.00 0.00 175.29 175.53 3dfy h VAL 118 N 2.78 0.80 -0.94 1.09 2.07 -1.93 -1.68 116.25 118.44 3dfy h VAL 118 Ca -0.43 -0.12 0.13 0.00 0.82 0.00 0.00 66.70 67.11 3dfy h VAL 118 Cb 1.23 0.44 -0.09 0.00 -1.52 0.00 0.00 31.29 31.35 3dfy h VAL 118 CO 0.54 0.06 0.56 0.00 0.02 0.00 0.00 177.57 178.76 3dfy h TYR 120 N 0.85 0.32 0.00 0.00 0.05 -1.70 0.07 116.97 116.57 3dfy h TYR 120 Ca 0.48 -0.11 -0.04 0.00 0.05 0.00 0.00 58.73 59.12 3dfy h TYR 120 Cb 0.56 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.23 3dfy h TYR 120 CO -0.03 0.72 -0.20 1.25 -1.05 0.00 0.00 178.16 178.84 3dfy h LEU 121 N 0.21 0.00 -1.95 3.88 5.85 -0.11 -2.17 115.31 121.02 3dfy h LEU 121 Ca 0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3dfy h LEU 121 Cb 0.96 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.99 3dfy h LEU 121 CO 0.08 0.20 0.00 0.18 -0.34 0.00 0.00 178.44 178.56 3dfy n LEU 122 N -3.62 2.89 0.00 2.25 4.77 -0.34 -4.93 117.00 118.02 3dfy n LEU 122 Ca -0.01 -1.30 0.00 0.00 -0.03 0.00 0.00 56.01 54.67 3dfy n LEU 122 Cb 0.33 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3dfy n LEU 122 CO 0.33 0.65 0.00 0.61 -1.33 0.00 0.00 177.39 177.65 3dfy n GLY 123 N 1.39 1.16 3.97 -0.72 0.00 -0.82 -3.91 105.19 106.26 3dfy n GLY 123 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 3dfy n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dfy n GLY 124 N 0.00 -0.45 0.23 -0.02 0.00 -0.04 -4.89 105.19 100.02 3dfy n GLY 124 Ca 0.00 0.17 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 3dfy n GLY 124 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3dfy h LYS 125 N -1.92 0.55 -5.38 1.61 3.64 -1.13 -3.45 116.57 110.50 3dfy h LYS 125 Ca -0.59 -0.25 -0.41 0.00 -1.27 0.00 0.00 60.65 58.13 3dfy h LYS 125 Cb 1.38 -0.01 -0.21 0.00 -0.41 0.00 0.00 32.23 32.98 3dfy h LYS 125 CO 0.69 0.81 -0.78 1.03 -2.27 0.00 0.00 179.45 178.93 3dfy s ARG 126 N -4.37 0.86 -0.00 1.90 0.52 -0.64 -4.96 118.95 112.26 3dfy s ARG 126 Ca -0.07 -1.02 0.21 0.00 -0.52 0.00 0.00 55.73 54.33 3dfy s ARG 126 Cb 0.13 -0.85 -0.20 0.00 0.52 0.00 0.00 34.95 34.55 3dfy s ARG 126 CO 0.81 0.18 0.91 -0.25 0.02 0.00 0.00 175.30 176.98 3dfy n ASP 127 N 1.13 0.97 -3.69 0.23 8.00 -1.26 -4.62 116.55 117.31 3dfy n ASP 127 Ca -0.20 -0.96 -0.14 0.00 0.71 0.00 0.00 54.79 54.20 3dfy n ASP 127 Cb 0.55 0.98 -0.08 0.00 -0.02 0.00 0.00 41.12 42.55 3dfy n ASP 127 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3dfy s GLU 128 N -3.01 0.69 0.11 -1.24 2.12 -1.26 -4.00 118.70 112.11 3dfy s GLU 128 Ca 0.08 0.32 0.02 0.00 0.36 0.00 0.00 54.97 55.75 3dfy s GLU 128 Cb 0.16 0.33 -0.04 0.00 0.26 0.00 0.00 34.13 34.83 3dfy s GLU 128 CO 0.86 -0.15 -0.07 0.96 -0.54 0.00 0.00 175.26 176.32 3dfy s ILE 129 N -0.52 0.77 -0.09 -3.70 -4.36 -0.53 -4.98 121.20 107.79 3dfy s ILE 129 Ca -0.06 -1.94 0.02 0.00 -0.26 0.00 0.00 60.65 58.40 3dfy s ILE 129 Cb -0.03 -1.70 0.01 0.00 1.25 0.00 0.00 42.46 41.99 3dfy s ILE 129 CO 0.04 -0.85 -0.16 -0.70 0.24 0.00 0.00 174.94 173.51 3dfy s GLU 130 N -3.79 2.17 0.17 0.37 2.12 -1.26 -0.67 118.70 117.81 3dfy s GLU 130 Ca 0.12 -0.56 0.03 0.00 0.36 0.00 0.00 54.97 54.92 3dfy s GLU 130 Cb 0.05 -1.79 -0.03 0.00 0.26 0.00 0.00 34.13 32.61 3dfy s GLU 130 CO -0.04 0.01 0.28 -0.08 -0.54 0.00 0.00 175.26 174.89 3dfy s THR 131 N 0.78 5.24 0.00 -1.70 -1.32 -0.11 -3.78 115.64 114.76 3dfy s THR 131 Ca -0.11 -0.77 0.00 0.00 -1.21 0.00 0.00 61.69 59.59 3dfy s THR 131 Cb -0.16 -3.72 0.00 0.00 -1.51 0.00 0.00 72.50 67.11 3dfy s THR 131 CO 0.02 -0.14 0.00 -0.90 -2.21 0.00 0.00 174.62 171.39 3dfy n ASP 132 N -0.68 0.00 -3.83 8.08 5.68 -0.04 -4.75 116.55 121.00 3dfy n ASP 132 Ca -0.07 -0.97 -0.12 0.00 -0.50 0.00 0.00 54.79 53.12 3dfy n ASP 132 Cb 0.55 0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 40.40 3dfy n ASP 132 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 3dfy s LYS 133 N -2.36 0.23 0.02 0.11 2.20 -1.08 -4.53 119.74 114.34 3dfy s LYS 133 Ca 0.00 0.11 -0.16 0.00 -0.36 0.00 0.00 55.97 55.56 3dfy s LYS 133 Cb 0.00 0.11 -0.06 0.00 -1.51 0.00 0.00 37.83 36.37 3dfy s LYS 133 CO 0.00 -0.04 0.45 0.99 -0.36 0.00 0.00 175.35 176.40 3dfy s THR 134 N -0.17 4.94 -0.41 3.43 2.01 -1.26 -1.74 115.64 122.44 3dfy s THR 134 Ca -0.03 0.95 -0.09 0.00 0.31 0.00 0.00 61.69 62.83 3dfy s THR 134 Cb -0.02 -3.76 0.07 0.00 0.01 0.00 0.00 72.50 68.80 3dfy s THR 134 CO 0.00 0.57 0.24 -0.69 -0.69 0.00 0.00 174.62 174.05 3dfy s VAL 135 N -1.09 4.14 1.15 3.82 1.01 0.65 -4.96 120.40 125.13 3dfy s VAL 135 Ca 0.25 -1.39 -0.18 0.00 0.00 0.00 0.00 61.98 60.66 3dfy s VAL 135 Cb -0.17 -3.53 0.26 0.00 0.00 0.00 0.00 36.38 32.94 3dfy s VAL 135 CO 0.15 -0.48 1.13 -0.83 0.00 0.00 0.00 175.10 175.08 3dfy s GLY 136 N 2.02 1.60 0.11 4.51 0.00 -1.26 -1.88 107.32 112.42 3dfy s GLY 136 Ca 0.03 -0.92 -0.30 0.00 0.00 0.00 0.00 44.72 43.53 3dfy s GLY 136 CO 0.02 -0.07 1.02 -0.42 0.00 0.00 0.00 173.10 173.64 3dfy s ILE 137 N -3.11 4.33 0.00 0.90 1.01 -1.26 -4.75 121.20 118.33 3dfy s ILE 137 Ca 0.71 1.91 0.00 0.00 0.00 0.00 0.00 60.65 63.26 3dfy s ILE 137 Cb -0.10 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.15 3dfy s ILE 137 CO 0.56 0.28 0.00 -0.67 0.00 0.00 0.00 174.94 175.10 3dfy n ASP 138 N 2.87 0.00 -4.83 3.58 -0.08 -1.26 -5.07 116.55 111.76 3dfy n ASP 138 Ca 0.03 0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 52.99 3dfy n ASP 138 Cb 0.48 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.88 3dfy n ASP 138 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 3dfy s THR 139 N -2.21 4.49 0.54 5.18 -4.23 -1.26 -4.82 115.64 113.33 3dfy s THR 139 Ca 0.00 1.30 0.30 0.00 -1.18 0.00 0.00 61.69 62.11 3dfy s THR 139 Cb 0.00 -3.63 0.45 0.00 1.34 0.00 0.00 72.50 70.66 3dfy s THR 139 CO 0.00 -0.36 1.92 0.58 -0.54 0.00 0.00 174.62 176.21 3dfy h VAL 140 N 1.72 0.57 -0.13 2.29 2.07 -1.98 0.44 116.25 121.23 3dfy h VAL 140 Ca -0.48 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 66.92 3dfy h VAL 140 Cb 1.18 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 3dfy h VAL 140 CO 0.62 0.00 -0.36 -0.08 0.02 0.00 0.00 177.57 177.77 3dfy h GLU 141 N 0.00 0.47 0.00 1.57 4.81 -1.99 -1.97 114.58 117.47 3dfy h GLU 141 Ca 0.35 -0.33 -0.15 0.00 -0.13 0.00 0.00 59.36 59.10 3dfy h GLU 141 Cb 1.46 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.87 3dfy h GLU 141 CO -0.00 0.95 -0.72 -0.91 -0.73 0.00 0.00 179.01 177.60 3dfy h ASN 142 N 0.06 0.00 -0.10 1.04 -0.26 -1.39 -2.63 115.58 112.31 3dfy h ASN 142 Ca -0.01 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.72 3dfy h ASN 142 Cb 0.97 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 38.23 3dfy h ASN 142 CO 0.08 0.72 0.04 0.03 -1.06 0.00 0.00 177.43 177.23 3dfy h ARG 143 N 0.00 0.16 0.00 0.81 3.08 -0.19 -0.31 114.38 117.93 3dfy h ARG 143 Ca -0.01 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 3dfy h ARG 143 Cb 1.30 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.32 3dfy h ARG 143 CO 0.09 0.29 -0.31 0.28 -1.07 0.00 0.00 179.97 179.25 3dfy h VAL 144 N -0.01 1.13 -0.04 2.04 2.07 -1.37 -1.81 116.25 118.25 3dfy h VAL 144 Ca 0.03 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.45 3dfy h VAL 144 Cb 0.20 1.61 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 3dfy h VAL 144 CO -0.00 0.30 -0.01 0.50 0.02 0.00 0.00 177.57 178.38 3dfy h LYS 145 N 0.00 0.07 -0.14 1.57 1.63 -1.06 -1.55 116.57 117.09 3dfy h LYS 145 Ca -0.00 -0.03 0.02 0.00 -0.85 0.00 0.00 60.65 59.79 3dfy h LYS 145 Cb 0.58 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.19 3dfy h LYS 145 CO 0.04 0.42 0.01 0.93 -3.45 0.00 0.00 179.45 177.40 3dfy h GLU 146 N -0.28 0.06 -0.43 1.90 5.08 -0.83 -2.01 114.58 118.08 3dfy h GLU 146 Ca 0.01 -0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 3dfy h GLU 146 Cb 0.39 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.57 3dfy h GLU 146 CO 0.00 0.04 0.08 0.00 -1.00 0.00 0.00 179.01 178.14 3dfy h ALA 147 N 1.11 0.47 -0.28 3.43 0.00 -1.32 0.14 119.26 122.81 3dfy h ALA 147 Ca 0.07 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3dfy h ALA 147 Cb 0.07 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3dfy h ALA 147 CO -0.10 -0.32 0.10 -0.22 0.00 0.00 0.00 179.25 178.71 3dfy h LYS 148 N 0.21 0.22 -0.06 0.00 3.64 -1.01 0.16 116.57 119.74 3dfy h LYS 148 Ca 0.21 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 3dfy h LYS 148 Cb 0.26 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3dfy h LYS 148 CO -0.28 0.15 0.04 -0.22 -2.27 0.00 0.00 179.45 176.87 3dfy h LYS 149 N 0.23 0.08 -0.35 1.90 3.64 -0.79 -0.02 116.57 121.25 3dfy h LYS 149 Ca 0.12 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.55 3dfy h LYS 149 Cb 0.09 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.84 3dfy h LYS 149 CO -0.13 0.07 0.06 0.82 -2.27 0.00 0.00 179.45 178.01 3dfy h ILE 150 N 0.06 0.81 -0.12 2.00 2.04 -0.32 -0.24 117.51 121.74 3dfy h ILE 150 Ca 0.02 -0.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 3dfy h ILE 150 Cb 0.01 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 3dfy h ILE 150 CO -0.00 0.03 -0.06 0.15 0.00 0.00 0.00 178.15 178.26 3dfy h PHE 151 N 0.17 0.18 -0.48 1.37 3.57 -0.46 -2.63 116.94 118.67 3dfy h PHE 151 Ca 0.17 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.56 3dfy h PHE 151 Cb 0.20 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 3dfy h PHE 151 CO -0.20 0.25 -0.07 1.49 -2.23 0.00 0.00 178.31 177.56 3dfy h GLU 152 N 0.18 0.89 -0.69 1.11 4.81 0.72 -3.03 114.58 118.57 3dfy h GLU 152 Ca 0.04 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 3dfy h GLU 152 Cb 0.24 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.55 3dfy h GLU 152 CO 0.01 0.96 0.00 -0.85 -0.73 0.00 0.00 179.01 178.40 3dfy n GLU 153 N -4.27 0.99 0.00 1.92 0.28 -0.59 -4.86 120.64 114.10 3dfy n GLU 153 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 3dfy n GLU 153 Cb 0.36 -1.35 0.00 0.00 1.43 0.00 0.00 31.44 31.89 3dfy n GLU 153 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3dfy n GLY 154 N 0.15 1.97 3.70 -1.84 0.00 -1.14 -4.74 105.19 103.28 3dfy n GLY 154 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3dfy n GLY 154 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dfy s PHE 155 N -2.53 2.72 -0.93 1.61 0.08 -1.18 -4.86 117.98 112.89 3dfy s PHE 155 Ca 0.00 0.55 0.10 0.00 0.12 0.00 0.00 56.93 57.70 3dfy s PHE 155 Cb 0.00 -3.86 0.25 0.00 -0.57 0.00 0.00 43.02 38.84 3dfy s PHE 155 CO 0.00 -3.33 1.17 0.54 -0.10 0.00 0.00 175.22 173.50 3dfy n ARG 156 N 5.06 2.48 -3.78 0.44 5.12 -1.26 -4.43 116.66 120.29 3dfy n ARG 156 Ca 0.14 -1.86 -0.26 0.00 -1.93 0.00 0.00 57.85 53.94 3dfy n ARG 156 Cb 0.41 -1.24 -0.17 0.00 -1.16 0.00 0.00 32.46 30.30 3dfy n ARG 156 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3dfy s VAL 157 N -0.98 0.58 -0.16 1.55 1.01 -1.26 -0.19 120.40 120.95 3dfy s VAL 157 Ca 0.20 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.84 3dfy s VAL 157 Cb 0.11 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.58 3dfy s VAL 157 CO 0.14 0.01 -0.15 -0.63 0.00 0.00 0.00 175.10 174.48 3dfy s ILE 158 N 1.85 2.65 -0.23 2.22 1.01 -0.26 -2.64 121.20 125.80 3dfy s ILE 158 Ca 0.01 -0.77 -0.16 0.00 0.00 0.00 0.00 60.65 59.74 3dfy s ILE 158 Cb -0.15 -2.12 -0.04 0.00 0.01 0.00 0.00 42.46 40.16 3dfy s ILE 158 CO -0.07 0.51 0.39 -0.75 0.00 0.00 0.00 174.94 175.03 3dfy s LYS 159 N 0.91 4.11 -0.24 2.79 2.20 -0.71 -1.34 119.74 127.46 3dfy s LYS 159 Ca -0.03 0.15 -0.06 0.00 -0.36 0.00 0.00 55.97 55.67 3dfy s LYS 159 Cb -0.15 -3.58 -0.01 0.00 -1.51 0.00 0.00 37.83 32.58 3dfy s LYS 159 CO -0.02 -0.14 0.02 0.42 -0.36 0.00 0.00 175.35 175.28 3dfy s ILE 160 N 1.62 3.79 0.13 5.43 1.01 0.28 -0.25 121.20 133.22 3dfy s ILE 160 Ca 0.18 -0.43 -0.27 0.00 0.00 0.00 0.00 60.65 60.13 3dfy s ILE 160 Cb -0.15 -2.79 -0.07 0.00 0.01 0.00 0.00 42.46 39.46 3dfy s ILE 160 CO 0.08 0.33 0.84 -0.54 0.00 0.00 0.00 174.94 175.65 3dfy s LYS 161 N 1.53 4.62 0.06 2.79 1.02 -0.79 -1.61 119.74 127.37 3dfy s LYS 161 Ca 0.05 1.25 0.00 0.00 0.02 0.00 0.00 55.97 57.29 3dfy s LYS 161 Cb -0.15 -3.32 0.00 0.00 -0.52 0.00 0.00 37.83 33.84 3dfy s LYS 161 CO 0.00 0.40 0.08 1.33 -0.92 0.00 0.00 175.35 176.24 3dfy n VAL 162 N 2.20 0.00 0.00 3.17 0.24 -0.16 -4.52 118.33 119.26 3dfy n VAL 162 Ca -0.02 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 3dfy n VAL 162 Cb 0.49 0.20 0.00 0.00 -1.47 0.00 0.00 33.84 33.06 3dfy n VAL 162 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3dfy n GLY 163 N -0.11 1.96 0.05 7.63 0.00 -1.26 -4.14 105.19 109.32 3dfy n GLY 163 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 3dfy n GLY 163 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dfy n GLU 164 N 0.00 0.64 -3.31 1.61 1.02 -1.26 -4.31 120.64 115.03 3dfy n GLU 164 Ca 0.00 -0.09 -0.10 0.00 -0.02 0.00 0.00 57.16 56.95 3dfy n GLU 164 Cb 0.00 -1.62 -0.06 0.00 -0.02 0.00 0.00 31.44 29.74 3dfy n GLU 164 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3dfy s ASN 165 N -4.84 0.39 0.15 1.62 3.84 -1.26 -5.06 114.94 109.79 3dfy s ASN 165 Ca -0.06 -0.81 -0.29 0.00 0.21 0.00 0.00 52.86 51.91 3dfy s ASN 165 Cb 0.12 1.04 -0.03 0.00 -0.55 0.00 0.00 41.25 41.84 3dfy s ASN 165 CO 0.87 -0.30 1.56 0.25 -2.79 0.00 0.00 177.10 176.69 3dfy h LEU 166 N 7.67 -1.70 -0.37 3.21 5.85 -1.99 0.27 115.31 128.25 3dfy h LEU 166 Ca -0.03 0.25 0.07 0.00 0.84 0.00 0.00 57.88 59.02 3dfy h LEU 166 Cb 1.11 0.74 -0.07 0.00 0.37 0.00 0.00 40.66 42.81 3dfy h LEU 166 CO 0.22 -0.35 -0.05 0.50 -0.34 0.00 0.00 178.44 178.43 3dfy h LYS 167 N -0.27 0.05 -0.00 1.25 3.64 -2.00 -1.13 116.57 118.10 3dfy h LYS 167 Ca 0.14 -0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.40 3dfy h LYS 167 Cb 0.56 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 3dfy h LYS 167 CO -0.68 0.03 -0.55 0.93 -2.27 0.00 0.00 179.45 176.92 3dfy h GLU 168 N 0.05 0.00 -0.30 1.90 5.08 -1.84 -2.46 114.58 117.02 3dfy h GLU 168 Ca 0.18 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.50 3dfy h GLU 168 Cb 0.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 3dfy h GLU 168 CO -0.34 0.55 0.03 -0.44 -1.00 0.00 0.00 179.01 177.80 3dfy h ASP 169 N 0.00 0.49 -0.79 1.42 3.32 0.25 0.61 116.42 121.72 3dfy h ASP 169 Ca -0.01 -0.28 -0.03 0.00 0.02 0.00 0.00 57.03 56.74 3dfy h ASP 169 Cb 0.97 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.35 3dfy h ASP 169 CO 0.07 0.65 0.39 0.40 -1.72 0.00 0.00 179.24 179.02 3dfy h ILE 170 N 0.31 1.25 -0.23 0.35 2.04 -1.19 -0.54 117.51 119.50 3dfy h ILE 170 Ca 0.09 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.24 3dfy h ILE 170 Cb 0.38 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 3dfy h ILE 170 CO 0.01 0.29 0.08 -0.08 0.00 0.00 0.00 178.15 178.45 3dfy h GLU 171 N 1.12 0.36 -0.46 2.37 4.81 -1.15 -2.17 114.58 119.46 3dfy h GLU 171 Ca 0.27 -0.07 0.03 0.00 -0.13 0.00 0.00 59.36 59.46 3dfy h GLU 171 Cb 0.11 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.40 3dfy h GLU 171 CO -0.04 0.43 0.24 0.00 -0.73 0.00 0.00 179.01 178.92 3dfy h ALA 172 N 0.91 0.58 -0.36 2.92 0.00 0.69 -1.94 119.26 122.06 3dfy h ALA 172 Ca 0.08 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 3dfy h ALA 172 Cb 0.22 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3dfy h ALA 172 CO -0.00 -0.10 -0.06 0.28 0.00 0.00 0.00 179.25 179.37 3dfy h VAL 173 N 0.48 1.23 -0.38 0.00 2.07 -1.01 -1.13 116.25 117.52 3dfy h VAL 173 Ca 0.19 -0.98 -0.13 0.00 0.82 0.00 0.00 66.70 66.61 3dfy h VAL 173 Cb 0.08 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 3dfy h VAL 173 CO -0.12 0.33 -0.27 -0.08 0.02 0.00 0.00 177.57 177.45 3dfy h GLU 174 N 0.56 0.85 -0.30 1.57 4.81 -1.01 -1.24 114.58 119.83 3dfy h GLU 174 Ca 0.11 -0.41 -0.15 0.00 -0.13 0.00 0.00 59.36 58.78 3dfy h GLU 174 Cb 0.45 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 3dfy h GLU 174 CO 0.02 1.05 -0.43 0.93 -0.73 0.00 0.00 179.01 179.85 3dfy h GLU 175 N 0.66 0.75 -0.52 1.92 4.39 -1.20 -2.39 114.58 118.20 3dfy h GLU 175 Ca 0.07 -0.41 -0.11 0.00 0.34 0.00 0.00 59.36 59.25 3dfy h GLU 175 Cb 0.84 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.49 3dfy h GLU 175 CO 0.07 1.03 -0.11 0.82 -1.16 0.00 0.00 179.01 179.66 3dfy h ILE 176 N 0.61 1.27 -0.92 3.13 2.04 -1.17 -2.85 117.51 119.61 3dfy h ILE 176 Ca 0.04 -1.25 -0.00 0.00 1.00 0.00 0.00 64.86 64.65 3dfy h ILE 176 Cb 0.99 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 3dfy h ILE 176 CO 0.09 0.44 0.57 0.00 0.00 0.00 0.00 178.15 179.25 3dfy h ALA 177 N 0.99 1.27 -0.54 1.87 0.00 -1.04 -2.42 119.26 119.39 3dfy h ALA 177 Ca 0.14 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3dfy h ALA 177 Cb 0.66 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3dfy h ALA 177 CO 0.05 0.64 0.21 0.87 0.00 0.00 0.00 179.25 181.01 3dfy h LYS 178 N 1.26 0.79 -0.54 0.00 1.57 -1.21 -3.07 116.57 115.37 3dfy h LYS 178 Ca 0.33 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3dfy h LYS 178 Cb -0.08 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.09 3dfy h LYS 178 CO -0.07 0.65 0.00 1.33 -0.57 0.00 0.00 179.45 180.80 3dfy n VAL 179 N -4.33 2.63 -2.76 0.50 0.24 -0.94 -4.40 118.33 109.27 3dfy n VAL 179 Ca 0.04 -1.46 -0.01 0.00 -2.04 0.00 0.00 64.34 60.87 3dfy n VAL 179 Cb 0.17 -0.24 0.08 0.00 -1.47 0.00 0.00 33.84 32.38 3dfy n VAL 179 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3dfy n THR 180 N 0.51 0.70 -1.70 3.34 -2.24 -1.01 -4.59 114.28 109.29 3dfy n THR 180 Ca 0.27 -2.09 -0.43 0.00 -2.27 0.00 0.00 64.05 59.53 3dfy n THR 180 Cb 1.13 1.15 -0.03 0.00 -2.10 0.00 0.00 70.33 70.48 3dfy n THR 180 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3dfy n ARG 181 N -0.98 2.61 0.00 -0.78 1.74 -1.23 -1.93 116.66 116.10 3dfy n ARG 181 Ca -0.04 0.94 0.00 0.00 -0.77 0.00 0.00 57.85 57.99 3dfy n ARG 181 Cb 0.84 -2.78 0.00 0.00 -1.02 0.00 0.00 32.46 29.49 3dfy n ARG 181 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dfy n GLY 182 N 3.91 2.58 3.91 -0.13 0.00 -1.26 -5.09 105.19 109.11 3dfy n GLY 182 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 3dfy n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dfy s ALA 183 N -2.40 3.39 0.14 4.61 0.00 -0.81 -5.00 121.76 121.68 3dfy s ALA 183 Ca 0.00 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 51.50 3dfy s ALA 183 Cb 0.00 -2.61 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 3dfy s ALA 183 CO 0.00 -0.38 0.19 0.15 0.00 0.00 0.00 175.76 175.72 3dfy s LYS 184 N -4.77 3.15 -0.02 0.00 1.02 0.73 -4.98 119.74 114.87 3dfy s LYS 184 Ca 0.48 -0.71 0.07 0.00 0.02 0.00 0.00 55.97 55.83 3dfy s LYS 184 Cb -0.10 -2.81 -0.02 0.00 -0.52 0.00 0.00 37.83 34.38 3dfy s LYS 184 CO 0.45 0.52 -0.23 0.71 -0.92 0.00 0.00 175.35 175.88 3dfy s TYR 185 N -1.68 2.08 -0.16 3.18 2.02 -1.26 -1.11 117.35 120.43 3dfy s TYR 185 Ca 0.32 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.64 3dfy s TYR 185 Cb -0.11 -1.34 0.01 0.00 -0.40 0.00 0.00 41.96 40.12 3dfy s TYR 185 CO 0.26 -0.04 -0.20 0.42 -1.57 0.00 0.00 175.55 174.41 3dfy s ILE 186 N -0.53 2.10 -0.18 2.71 -1.09 -0.45 -0.92 121.20 122.85 3dfy s ILE 186 Ca 0.08 -0.94 -0.02 0.00 -2.23 0.00 0.00 60.65 57.54 3dfy s ILE 186 Cb -0.09 -1.86 -0.01 0.00 -1.58 0.00 0.00 42.46 38.92 3dfy s ILE 186 CO -0.01 0.54 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.48 3dfy s VAL 187 N 1.06 3.27 -0.28 2.92 1.01 -0.27 1.00 120.40 129.11 3dfy s VAL 187 Ca -0.01 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 3dfy s VAL 187 Cb -0.14 -2.44 0.04 0.00 0.00 0.00 0.00 36.38 33.83 3dfy s VAL 187 CO -0.07 0.47 -0.03 -0.62 0.00 0.00 0.00 175.10 174.84 3dfy s ASP 188 N 1.00 4.65 0.00 3.32 -1.08 -0.63 0.19 116.67 124.12 3dfy s ASP 188 Ca -0.00 -1.13 0.28 0.00 -0.52 0.00 0.00 52.55 51.18 3dfy s ASP 188 Cb -0.15 -1.68 1.04 0.00 -1.46 0.00 0.00 42.92 40.67 3dfy s ASP 188 CO -0.00 -0.20 1.74 0.00 0.52 0.00 0.00 175.17 177.22 3dfy n ALA 189 N 4.63 2.88 -4.27 3.66 0.00 -0.94 -0.98 120.51 125.49 3dfy n ALA 189 Ca -0.14 -0.32 -0.30 0.00 0.00 0.00 0.00 53.44 52.67 3dfy n ALA 189 Cb 0.45 -1.25 -0.09 0.00 0.00 0.00 0.00 19.45 18.56 3dfy n ALA 189 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3dfy n ASN 190 N -0.81 0.70 -0.37 0.00 3.02 -1.20 -1.02 115.26 115.58 3dfy n ASN 190 Ca 0.14 -1.24 -0.05 0.00 -0.03 0.00 0.00 54.58 53.40 3dfy n ASN 190 Cb 0.31 -1.82 -0.02 0.00 -0.61 0.00 0.00 39.78 37.64 3dfy n ASN 190 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 3dfy n MET 191 N -4.55 -1.39 0.24 3.52 2.81 -0.13 -4.90 117.12 112.73 3dfy n MET 191 Ca -0.32 0.58 0.14 0.00 -1.81 0.00 0.00 57.70 56.29 3dfy n MET 191 Cb 0.69 -4.73 0.35 0.00 -0.71 0.00 0.00 33.22 28.83 3dfy n MET 191 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 3dfy h GLY 192 N 0.00 0.00 -3.70 3.03 0.00 -1.09 -3.35 103.07 97.96 3dfy h GLY 192 Ca -0.10 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.72 3dfy h GLY 192 CO 0.14 0.00 -0.43 -0.19 0.00 0.00 0.00 176.54 176.06 3dfy s TYR 193 N -3.37 3.47 0.62 5.60 2.02 -0.55 -4.85 117.35 120.29 3dfy s TYR 193 Ca 0.05 0.10 -0.06 0.00 -0.37 0.00 0.00 57.07 56.79 3dfy s TYR 193 Cb 0.06 -1.66 0.03 0.00 -0.40 0.00 0.00 41.96 39.99 3dfy s TYR 193 CO 0.63 0.46 0.93 0.95 -1.57 0.00 0.00 175.55 176.95 3dfy s THR 194 N -1.85 3.20 0.17 -0.71 -4.23 -1.26 -4.22 115.64 106.73 3dfy s THR 194 Ca 0.35 -0.11 -0.16 0.00 -1.18 0.00 0.00 61.69 60.59 3dfy s THR 194 Cb -0.10 -3.30 0.09 0.00 1.34 0.00 0.00 72.50 70.53 3dfy s THR 194 CO 0.29 -0.31 1.68 1.56 -0.54 0.00 0.00 174.62 177.30 3dfy h GLN 195 N -0.29 0.05 -0.70 3.99 4.20 -1.92 0.51 115.11 120.94 3dfy h GLN 195 Ca -0.45 -0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.21 3dfy h GLN 195 Cb 1.28 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 29.01 3dfy h GLN 195 CO 0.60 0.04 0.23 0.87 -0.67 0.00 0.00 178.83 179.90 3dfy h LYS 196 N 0.06 1.07 -0.30 1.46 1.79 -1.98 -1.94 116.57 116.73 3dfy h LYS 196 Ca 0.21 -0.21 -0.13 0.00 -2.18 0.00 0.00 60.65 58.34 3dfy h LYS 196 Cb 0.31 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.78 3dfy h LYS 196 CO -0.39 0.90 -0.34 0.93 -1.08 0.00 0.00 179.45 179.48 3dfy h GLU 197 N 1.03 0.65 -0.64 3.15 5.08 -1.81 -1.80 114.58 120.25 3dfy h GLU 197 Ca 0.23 -0.30 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 3dfy h GLU 197 Cb 0.27 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 3dfy h GLU 197 CO -0.01 0.90 0.16 0.00 -1.00 0.00 0.00 179.01 179.05 3dfy h ALA 198 N 1.08 1.06 -0.23 3.43 0.00 -0.57 -0.30 119.26 123.74 3dfy h ALA 198 Ca 0.06 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.56 3dfy h ALA 198 Cb 0.84 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3dfy h ALA 198 CO 0.07 0.62 -0.54 0.28 0.00 0.00 0.00 179.25 179.68 3dfy h VAL 199 N 0.96 1.30 -0.85 0.00 2.07 -1.24 -2.94 116.25 115.55 3dfy h VAL 199 Ca 0.20 -1.74 -0.01 0.00 0.82 0.00 0.00 66.70 65.97 3dfy h VAL 199 Cb 0.34 1.80 -0.04 0.00 -1.52 0.00 0.00 31.29 31.87 3dfy h VAL 199 CO 0.00 0.56 0.51 -0.08 0.02 0.00 0.00 177.57 178.58 3dfy h GLU 200 N 0.50 1.16 0.09 1.57 4.57 -1.00 -0.81 114.58 120.67 3dfy h GLU 200 Ca -0.00 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 3dfy h GLU 200 Cb 1.15 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 29.49 3dfy h GLU 200 CO 0.12 0.82 -0.09 0.35 -1.18 0.00 0.00 179.01 179.02 3dfy h PHE 201 N 1.18 -0.23 -0.57 0.92 3.57 -1.03 0.70 116.94 121.47 3dfy h PHE 201 Ca 0.31 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.83 3dfy h PHE 201 Cb -0.04 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.75 3dfy h PHE 201 CO -0.00 -0.14 0.35 0.00 -2.23 0.00 0.00 178.31 176.28 3dfy h ALA 202 N 0.69 0.74 -0.58 2.41 0.00 -1.30 -1.75 119.26 119.48 3dfy h ALA 202 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3dfy h ALA 202 Cb 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3dfy h ALA 202 CO -0.03 0.07 0.13 0.00 0.00 0.00 0.00 179.25 179.42 3dfy h ARG 203 N 0.68 0.94 0.06 0.00 3.08 -0.86 -1.06 114.38 117.22 3dfy h ARG 203 Ca 0.23 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 3dfy h ARG 203 Cb 0.02 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.95 3dfy h ARG 203 CO -0.10 0.87 -0.03 0.00 -1.07 0.00 0.00 179.97 179.65 3dfy h ALA 204 N 1.02 -0.08 -0.87 0.04 0.00 -0.61 -0.11 119.26 118.65 3dfy h ALA 204 Ca 0.18 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.03 3dfy h ALA 204 Cb 0.37 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 3dfy h ALA 204 CO 0.00 -0.49 0.57 0.28 0.00 0.00 0.00 179.25 179.62 3dfy h VAL 205 N -0.19 1.23 -0.52 0.00 2.07 -1.29 -2.55 116.25 115.00 3dfy h VAL 205 Ca -0.01 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 3dfy h VAL 205 Cb 0.17 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 29.86 3dfy h VAL 205 CO 0.01 0.22 0.26 0.22 0.02 0.00 0.00 177.57 178.30 3dfy h TYR 206 N 1.18 0.73 0.00 1.57 3.20 -0.96 -2.22 116.97 120.47 3dfy h TYR 206 Ca 0.32 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.16 3dfy h TYR 206 Cb -0.13 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 37.91 3dfy h TYR 206 CO -0.01 0.56 -0.01 1.96 -1.64 0.00 0.00 178.16 179.02 3dfy h GLN 207 N 0.69 0.00 -0.51 1.82 1.08 -0.61 0.59 115.11 118.17 3dfy h GLN 207 Ca 0.18 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 3dfy h GLN 207 Cb 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 3dfy h GLN 207 CO -0.02 0.01 0.00 1.63 -0.95 0.00 0.00 178.83 179.50 3dfy n LYS 208 N -3.26 2.26 -1.28 1.46 5.02 -0.87 -4.89 118.16 116.59 3dfy n LYS 208 Ca -0.02 -1.47 -0.10 0.00 -2.02 0.00 0.00 58.31 54.69 3dfy n LYS 208 Cb 0.12 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.59 3dfy n LYS 208 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dfy n GLY 209 N 0.87 1.08 3.88 0.72 0.00 0.20 -5.00 105.19 106.95 3dfy n GLY 209 Ca 0.13 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 3dfy n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dfy s ILE 210 N -2.20 5.06 -0.09 -0.61 1.01 -1.01 -5.04 121.20 118.32 3dfy s ILE 210 Ca 0.00 0.31 0.03 0.00 0.00 0.00 0.00 60.65 60.98 3dfy s ILE 210 Cb 0.00 -3.63 -0.01 0.00 0.01 0.00 0.00 42.46 38.82 3dfy s ILE 210 CO 0.00 0.07 -0.18 -0.62 0.00 0.00 0.00 174.94 174.21 3dfy s ASP 211 N -2.22 3.67 -0.24 3.58 2.15 -1.26 -4.22 116.67 118.13 3dfy s ASP 211 Ca 0.41 -0.37 -0.03 0.00 0.43 0.00 0.00 52.55 52.99 3dfy s ASP 211 Cb -0.12 -1.22 0.01 0.00 -0.30 0.00 0.00 42.92 41.29 3dfy s ASP 211 CO 0.22 0.23 -0.05 -0.63 -0.17 0.00 0.00 175.17 174.76 3dfy s ILE 212 N -0.03 3.06 0.13 4.11 1.01 -1.26 -4.33 121.20 123.89 3dfy s ILE 212 Ca -0.05 -0.82 -0.14 0.00 0.00 0.00 0.00 60.65 59.64 3dfy s ILE 212 Cb -0.14 -2.49 -0.02 0.00 0.01 0.00 0.00 42.46 39.82 3dfy s ILE 212 CO 0.04 0.29 1.57 0.00 0.00 0.00 0.00 174.94 176.84 3dfy h ALA 213 N 8.06 0.56 -3.28 9.38 0.00 -1.41 -3.39 119.26 129.18 3dfy h ALA 213 Ca -0.36 -0.27 -0.31 0.00 0.00 0.00 0.00 54.91 53.97 3dfy h ALA 213 Cb 1.13 -0.15 -0.36 0.00 0.00 0.00 0.00 17.79 18.41 3dfy h ALA 213 CO 0.59 0.36 -0.68 0.08 0.00 0.00 0.00 179.25 179.60 3dfy s VAL 214 N -4.97 -0.13 -0.49 0.00 1.01 -1.22 -4.32 120.40 110.28 3dfy s VAL 214 Ca -0.13 0.31 -0.10 0.00 0.00 0.00 0.00 61.98 62.07 3dfy s VAL 214 Cb 0.10 -0.19 0.12 0.00 0.00 0.00 0.00 36.38 36.41 3dfy s VAL 214 CO 0.80 0.13 0.38 -0.47 0.00 0.00 0.00 175.10 175.94 3dfy s TYR 215 N 1.77 3.42 -0.03 5.22 5.04 0.20 -1.11 117.35 131.85 3dfy s TYR 215 Ca -0.01 -1.83 -0.25 0.00 -2.44 0.00 0.00 57.07 52.53 3dfy s TYR 215 Cb -0.12 -3.54 -0.04 0.00 0.35 0.00 0.00 41.96 38.61 3dfy s TYR 215 CO -0.04 -0.99 0.77 -2.00 -1.34 0.00 0.00 175.55 171.94 3dfy s GLU 216 N 1.32 4.48 -0.06 4.97 2.12 0.13 -0.97 118.70 130.70 3dfy s GLU 216 Ca 0.06 1.04 -0.01 0.00 0.36 0.00 0.00 54.97 56.42 3dfy s GLU 216 Cb -0.26 -3.43 0.00 0.00 0.26 0.00 0.00 34.13 30.70 3dfy s GLU 216 CO -0.01 0.09 0.04 0.94 -0.54 0.00 0.00 175.26 175.79 3dfy n GLN 217 N 3.57 -0.12 0.23 4.30 -0.06 0.37 -2.21 117.38 123.46 3dfy n GLN 217 Ca -0.00 0.06 0.11 0.00 -2.00 0.00 0.00 57.00 55.17 3dfy n GLN 217 Cb 0.51 -0.16 0.43 0.00 -4.06 0.00 0.00 30.24 26.96 3dfy n GLN 217 CO 0.00 0.00 0.00 -1.00 -0.20 0.00 0.00 177.06 175.86 3dfy h PRO 218 N 0.76 0.00 -5.75 3.69 0.13 -1.84 -0.29 132.00 128.69 3dfy h PRO 218 Ca -0.05 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.49 3dfy h PRO 218 Cb 0.10 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.13 3dfy h PRO 218 CO 0.03 0.17 -0.51 0.14 -0.23 0.00 0.00 178.00 177.59 3dfy s VAL 219 N -3.52 2.04 0.60 1.56 -7.23 -1.26 -1.49 120.40 111.11 3dfy s VAL 219 Ca 0.02 -1.80 -0.18 0.00 -1.81 0.00 0.00 61.98 58.21 3dfy s VAL 219 Cb 0.09 -2.84 -0.06 0.00 0.56 0.00 0.00 36.38 34.13 3dfy s VAL 219 CO 0.63 0.00 0.74 0.54 -0.31 0.00 0.00 175.10 176.70 3dfy n ARG 220 N -1.21 0.66 0.14 4.82 1.74 -1.26 -4.26 116.66 117.30 3dfy n ARG 220 Ca -0.04 0.26 0.06 0.00 -0.77 0.00 0.00 57.85 57.36 3dfy n ARG 220 Cb 0.65 -1.94 0.53 0.00 -1.02 0.00 0.00 32.46 30.69 3dfy n ARG 220 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 3dfy h ARG 221 N 0.29 0.25 0.00 5.56 0.11 -1.93 -2.23 114.38 116.43 3dfy h ARG 221 Ca -0.47 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.59 3dfy h ARG 221 Cb 1.38 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 32.40 3dfy h ARG 221 CO 0.48 0.17 -0.26 0.93 0.10 0.00 0.00 179.97 181.40 3dfy h GLU 222 N 0.26 0.00 -4.36 0.08 4.39 -1.94 -3.41 114.58 109.60 3dfy h GLU 222 Ca 0.07 0.00 -0.72 0.00 0.34 0.00 0.00 59.36 59.05 3dfy h GLU 222 Cb -0.02 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.55 3dfy h GLU 222 CO -0.01 0.00 2.54 -3.47 -1.16 0.00 0.00 179.01 176.91 3dfy n ASP 223 N -2.35 4.48 -0.21 1.42 2.03 -0.84 -4.73 116.55 116.36 3dfy n ASP 223 Ca 0.04 -2.93 -0.09 0.00 0.52 0.00 0.00 54.79 52.34 3dfy n ASP 223 Cb 0.45 -1.63 0.04 0.00 -0.72 0.00 0.00 41.12 39.26 3dfy n ASP 223 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 3dfy h ILE 224 N 4.34 1.26 -0.04 5.18 1.08 -1.83 -1.83 117.51 125.67 3dfy h ILE 224 Ca 0.48 -1.14 -0.06 0.00 -0.39 0.00 0.00 64.86 63.75 3dfy h ILE 224 Cb 0.71 0.78 -0.01 0.00 -3.07 0.00 0.00 36.82 35.23 3dfy h ILE 224 CO 1.68 0.42 -0.25 -0.33 -0.69 0.00 0.00 178.15 178.97 3dfy h GLU 225 N 0.98 0.08 -0.35 2.37 4.39 -1.98 -1.94 114.58 118.11 3dfy h GLU 225 Ca 0.17 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.76 3dfy h GLU 225 Cb 0.55 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 3dfy h GLU 225 CO 0.03 0.33 -0.13 0.78 -1.16 0.00 0.00 179.01 178.86 3dfy h GLY 226 N 0.85 0.77 0.94 -3.84 0.00 -1.77 -1.15 103.07 98.88 3dfy h GLY 226 Ca 0.01 -0.67 0.01 0.00 0.00 0.00 0.00 47.33 46.68 3dfy h GLY 226 CO 0.04 0.61 0.24 1.41 0.00 0.00 0.00 176.54 178.84 3dfy h LEU 227 N 0.50 0.41 -1.17 3.11 3.38 -0.96 -1.18 115.31 119.40 3dfy h LEU 227 Ca 0.08 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 3dfy h LEU 227 Cb 0.66 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 3dfy h LEU 227 CO 0.04 0.29 0.26 0.50 0.09 0.00 0.00 178.44 179.63 3dfy h LYS 228 N 0.50 0.84 -0.35 1.13 3.64 -1.21 0.61 116.57 121.73 3dfy h LYS 228 Ca 0.15 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 3dfy h LYS 228 Cb -0.02 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 3dfy h LYS 228 CO -0.06 0.67 -0.01 0.35 -2.27 0.00 0.00 179.45 178.13 3dfy h PHE 229 N 0.83 0.68 -0.54 1.91 3.57 -0.68 -1.62 116.94 121.09 3dfy h PHE 229 Ca 0.20 -0.12 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 3dfy h PHE 229 Cb 0.12 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 3dfy h PHE 229 CO 0.01 0.74 0.01 0.28 -2.23 0.00 0.00 178.31 177.11 3dfy h VAL 230 N 0.43 1.25 -0.93 1.41 2.07 -0.88 -2.57 116.25 117.03 3dfy h VAL 230 Ca 0.10 -1.07 0.02 0.00 0.82 0.00 0.00 66.70 66.56 3dfy h VAL 230 Cb 0.47 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 3dfy h VAL 230 CO 0.02 0.38 0.61 -0.09 0.02 0.00 0.00 177.57 178.52 3dfy h ARG 231 N 0.85 1.19 -0.35 1.57 2.43 -0.60 0.32 114.38 119.78 3dfy h ARG 231 Ca 0.16 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.18 3dfy h ARG 231 Cb 0.50 -0.27 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 3dfy h ARG 231 CO 0.02 0.79 -0.08 0.35 -1.51 0.00 0.00 179.97 179.54 3dfy h PHE 232 N 1.23 0.76 0.00 2.20 3.57 -0.91 -3.30 116.94 120.49 3dfy h PHE 232 Ca 0.35 -0.16 -0.13 0.00 3.53 0.00 0.00 57.97 61.55 3dfy h PHE 232 Cb -0.10 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.43 3dfy h PHE 232 CO -0.00 0.84 -1.08 0.45 -2.23 0.00 0.00 178.31 176.29 3dfy h HIS 233 N 0.47 0.00 -3.08 0.41 3.86 -1.24 -3.46 115.15 112.11 3dfy h HIS 233 Ca 0.09 0.00 -0.55 0.00 -1.16 0.00 0.00 60.37 58.75 3dfy h HIS 233 Cb 0.59 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.04 3dfy h HIS 233 CO 0.05 0.50 0.69 0.45 0.86 0.00 0.00 177.93 180.48 3dfy s SER 234 N -5.96 7.03 0.00 2.45 0.15 0.11 -4.89 113.70 112.59 3dfy s SER 234 Ca -0.00 1.90 0.23 0.00 0.70 0.00 0.00 55.95 58.78 3dfy s SER 234 Cb 0.08 -2.56 1.03 0.00 -1.71 0.00 0.00 66.02 62.86 3dfy s SER 234 CO 0.79 -0.58 1.73 -0.81 1.20 0.00 0.00 173.24 175.57 3dfy n PRO 235 N 4.95 0.10 -4.14 5.44 -0.04 -1.26 -4.74 135.00 135.31 3dfy n PRO 235 Ca 0.11 0.10 -0.31 0.00 -0.04 0.00 0.00 63.50 63.36 3dfy n PRO 235 Cb 0.46 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.34 3dfy n PRO 235 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3dfy s PHE 236 N -2.87 3.08 0.28 0.54 0.08 -1.26 -5.05 117.98 112.79 3dfy s PHE 236 Ca 0.14 0.04 -0.30 0.00 0.12 0.00 0.00 56.93 56.93 3dfy s PHE 236 Cb 0.15 -1.60 -0.11 0.00 -0.57 0.00 0.00 43.02 40.89 3dfy s PHE 236 CO 0.39 0.49 1.57 -2.14 -0.10 0.00 0.00 175.22 175.43 3dfy s PRO 237 N -2.12 4.15 -0.14 0.24 0.02 -1.26 -4.83 135.00 131.05 3dfy s PRO 237 Ca 0.25 2.53 -0.05 0.00 0.02 0.00 0.00 61.00 63.74 3dfy s PRO 237 Cb -0.12 -3.04 -0.04 0.00 0.02 0.00 0.00 34.50 31.32 3dfy s PRO 237 CO 0.17 -0.60 0.05 0.08 -0.33 0.00 0.00 177.00 176.37 3dfy s VAL 238 N 0.03 4.68 0.15 3.83 1.01 -1.26 -0.63 120.40 128.21 3dfy s VAL 238 Ca 0.63 -0.09 0.09 0.00 0.00 0.00 0.00 61.98 62.61 3dfy s VAL 238 Cb -0.47 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 3dfy s VAL 238 CO 0.47 0.53 -0.16 0.00 0.00 0.00 0.00 175.10 175.94 3dfy s ALA 239 N -0.25 2.76 -0.12 5.51 0.00 -0.14 -0.58 121.76 128.94 3dfy s ALA 239 Ca 0.07 -1.43 -0.05 0.00 0.00 0.00 0.00 51.96 50.55 3dfy s ALA 239 Cb -0.12 -0.64 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 3dfy s ALA 239 CO 0.02 0.53 0.06 0.00 0.00 0.00 0.00 175.76 176.36 3dfy s ALA 240 N -1.42 3.47 0.00 0.00 0.00 -0.20 -0.48 121.76 123.13 3dfy s ALA 240 Ca 0.21 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.43 3dfy s ALA 240 Cb -0.10 -1.74 0.00 0.00 0.00 0.00 0.00 23.12 21.29 3dfy s ALA 240 CO 0.12 0.47 0.00 -3.47 0.00 0.00 0.00 175.76 172.88 3dfy n ASP 241 N 2.52 0.00 0.18 0.00 -0.08 -1.26 0.08 116.55 117.99 3dfy n ASP 241 Ca -0.18 0.00 0.17 0.00 -1.51 0.00 0.00 54.79 53.26 3dfy n ASP 241 Cb 0.54 0.00 0.79 0.00 2.34 0.00 0.00 41.12 44.79 3dfy n ASP 241 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 3dfy h GLU 242 N 0.00 0.00 -0.00 -0.67 3.07 -1.94 0.74 114.58 115.78 3dfy h GLU 242 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3dfy h GLU 242 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3dfy h GLU 242 CO 0.00 0.00 -0.11 0.43 -1.40 0.00 0.00 179.01 177.93 3dfy n SER 243 N -3.95 0.18 -3.87 1.42 7.64 -1.26 -4.46 113.62 109.32 3dfy n SER 243 Ca 0.02 0.06 -0.29 0.00 1.01 0.00 0.00 58.87 59.67 3dfy n SER 243 Cb 0.34 -0.25 -0.13 0.00 -1.01 0.00 0.00 64.21 63.17 3dfy n SER 243 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dfy s ALA 244 N -2.83 3.33 -0.21 -0.43 0.00 0.25 -4.73 121.76 117.14 3dfy s ALA 244 Ca 0.19 -3.44 0.00 0.00 0.00 0.00 0.00 51.96 48.71 3dfy s ALA 244 Cb 0.19 -2.10 -0.13 0.00 0.00 0.00 0.00 23.12 21.08 3dfy s ALA 244 CO 0.54 -2.06 -0.19 0.54 0.00 0.00 0.00 175.76 174.59 3dfy n ARG 245 N 2.56 0.51 -4.29 0.00 1.74 -1.26 -4.84 116.66 111.09 3dfy n ARG 245 Ca 0.14 0.13 -0.25 0.00 -0.77 0.00 0.00 57.85 57.10 3dfy n ARG 245 Cb 0.35 -1.40 -0.08 0.00 -1.02 0.00 0.00 32.46 30.30 3dfy n ARG 245 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3dfy s THR 246 N -2.41 2.45 0.44 0.55 -4.23 -1.26 -3.25 115.64 107.93 3dfy s THR 246 Ca -0.28 -1.86 0.19 0.00 -1.18 0.00 0.00 61.69 58.55 3dfy s THR 246 Cb 0.08 -2.91 0.22 0.00 1.34 0.00 0.00 72.50 71.23 3dfy s THR 246 CO 0.47 -0.10 2.02 0.07 -0.54 0.00 0.00 174.62 176.54 3dfy h LYS 247 N 1.66 0.00 -0.31 3.99 2.10 -1.95 -1.76 116.57 120.30 3dfy h LYS 247 Ca -0.43 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.05 3dfy h LYS 247 Cb 1.25 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.58 3dfy h LYS 247 CO 0.70 0.16 -0.47 0.74 -2.00 0.00 0.00 179.45 178.58 3dfy h PHE 248 N 0.00 1.01 -0.52 0.07 0.04 -1.97 -1.39 116.94 114.18 3dfy h PHE 248 Ca -0.00 -0.33 0.01 0.00 2.80 0.00 0.00 57.97 60.45 3dfy h PHE 248 Cb 0.33 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.25 3dfy h PHE 248 CO 0.00 1.13 0.33 -0.44 -0.60 0.00 0.00 178.31 178.74 3dfy h ASP 249 N 0.65 0.56 -0.59 2.17 3.32 -1.66 -1.60 116.42 119.28 3dfy h ASP 249 Ca 0.03 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 3dfy h ASP 249 Cb 1.05 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 3dfy h ASP 249 CO 0.10 0.40 0.18 0.58 -1.72 0.00 0.00 179.24 178.79 3dfy h VAL 250 N 0.67 1.24 -1.00 -1.35 2.07 -1.34 0.21 116.25 116.75 3dfy h VAL 250 Ca 0.20 -0.84 0.02 0.00 0.82 0.00 0.00 66.70 66.90 3dfy h VAL 250 Cb -0.04 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 3dfy h VAL 250 CO -0.06 0.32 0.66 -0.03 0.02 0.00 0.00 177.57 178.48 3dfy h MET 251 N 0.84 1.29 -0.31 1.57 1.85 -0.96 0.22 114.93 119.43 3dfy h MET 251 Ca 0.19 -0.08 -0.02 0.00 -0.61 0.00 0.00 59.70 59.19 3dfy h MET 251 Cb 0.30 -0.29 -0.01 0.00 0.43 0.00 0.00 31.60 32.02 3dfy h MET 251 CO -0.00 0.85 0.13 -0.09 -0.40 0.00 0.00 176.91 177.39 3dfy h ARG 252 N 1.33 0.47 -0.96 0.39 2.43 -0.66 0.04 114.38 117.42 3dfy h ARG 252 Ca 0.38 -0.08 0.04 0.00 -0.81 0.00 0.00 59.98 59.50 3dfy h ARG 252 Cb -0.10 -0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 29.32 3dfy h ARG 252 CO -0.10 0.47 0.62 -0.07 -1.51 0.00 0.00 179.97 179.39 3dfy h LEU 253 N 0.36 1.04 -0.17 3.80 3.38 -0.24 -0.10 115.31 123.37 3dfy h LEU 253 Ca 0.10 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 3dfy h LEU 253 Cb 0.18 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3dfy h LEU 253 CO -0.01 0.71 -0.08 0.58 0.09 0.00 0.00 178.44 179.73 3dfy h VAL 254 N 1.21 1.31 -0.92 1.22 2.07 -0.67 0.05 116.25 120.52 3dfy h VAL 254 Ca 0.38 -1.13 0.02 0.00 0.82 0.00 0.00 66.70 66.80 3dfy h VAL 254 Cb 0.01 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 3dfy h VAL 254 CO -0.13 0.34 0.61 0.11 0.02 0.00 0.00 177.57 178.52 3dfy h LYS 255 N 0.05 1.18 -0.01 1.57 1.57 -0.63 -1.37 116.57 118.94 3dfy h LYS 255 Ca 0.04 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3dfy h LYS 255 Cb 0.56 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3dfy h LYS 255 CO 0.02 0.78 -0.05 0.39 -0.57 0.00 0.00 179.45 180.03 3dfy n GLU 256 N -4.41 1.01 -3.91 3.15 -0.58 -0.08 -4.93 120.64 110.89 3dfy n GLU 256 Ca 0.11 -0.33 -0.27 0.00 -0.42 0.00 0.00 57.16 56.25 3dfy n GLU 256 Cb 0.04 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 29.43 3dfy n GLU 256 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3dfy n GLU 257 N -0.71 -4.40 0.02 3.49 1.02 -0.09 -4.90 120.64 115.08 3dfy n GLU 257 Ca 0.18 0.52 -0.08 0.00 -0.02 0.00 0.00 57.16 57.76 3dfy n GLU 257 Cb 0.25 -5.08 -0.13 0.00 -0.02 0.00 0.00 31.44 26.46 3dfy n GLU 257 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dfy h ALA 258 N 0.89 0.55 -2.46 0.62 0.00 -1.57 -3.46 119.26 113.83 3dfy h ALA 258 Ca -0.60 -1.17 -0.22 0.00 0.00 0.00 0.00 54.91 52.92 3dfy h ALA 258 Cb 1.37 0.14 -0.15 0.00 0.00 0.00 0.00 17.79 19.16 3dfy h ALA 258 CO 0.64 1.41 -0.64 0.14 0.00 0.00 0.00 179.25 180.80 3dfy s VAL 259 N -2.66 0.13 -0.13 0.00 -7.23 -1.26 -3.09 120.40 106.17 3dfy s VAL 259 Ca -0.02 -1.95 0.18 0.00 -1.81 0.00 0.00 61.98 58.38 3dfy s VAL 259 Cb 0.09 -2.22 -0.23 0.00 0.56 0.00 0.00 36.38 34.58 3dfy s VAL 259 CO 0.82 -0.29 0.45 0.47 -0.31 0.00 0.00 175.10 176.24 3dfy n ASP 260 N -0.18 0.36 -4.10 4.85 8.00 0.25 -4.96 116.55 120.77 3dfy n ASP 260 Ca -0.03 0.16 -0.11 0.00 0.71 0.00 0.00 54.79 55.52 3dfy n ASP 260 Cb 0.65 0.83 -0.11 0.00 -0.02 0.00 0.00 41.12 42.47 3dfy n ASP 260 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3dfy s TYR 261 N -2.85 0.73 -0.07 1.24 1.51 -0.35 -1.21 117.35 116.35 3dfy s TYR 261 Ca -0.07 -0.70 0.03 0.00 -1.01 0.00 0.00 57.07 55.32 3dfy s TYR 261 Cb 0.09 -0.44 0.01 0.00 -0.11 0.00 0.00 41.96 41.51 3dfy s TYR 261 CO 0.84 -0.13 -0.16 0.08 -1.11 0.00 0.00 175.55 175.07 3dfy s VAL 262 N -2.45 1.41 -0.49 0.71 1.01 -0.75 -1.03 120.40 118.81 3dfy s VAL 262 Ca -0.00 -0.64 -0.17 0.00 0.00 0.00 0.00 61.98 61.16 3dfy s VAL 262 Cb -0.03 -1.25 0.07 0.00 0.00 0.00 0.00 36.38 35.17 3dfy s VAL 262 CO -0.02 0.41 0.49 0.21 0.00 0.00 0.00 175.10 176.19 3dfy s ASN 263 N 0.53 6.18 0.11 3.32 2.47 0.11 -2.40 114.94 125.26 3dfy s ASN 263 Ca -0.15 -1.18 -0.28 0.00 0.42 0.00 0.00 52.86 51.67 3dfy s ASN 263 Cb -0.16 -2.23 -0.06 0.00 -1.45 0.00 0.00 41.25 37.35 3dfy s ASN 263 CO 0.05 -0.75 0.87 -0.63 -3.72 0.00 0.00 177.10 172.92 3dfy s ILE 264 N 2.04 4.52 -0.06 -5.21 1.01 -0.37 -4.66 121.20 118.46 3dfy s ILE 264 Ca 0.08 1.89 -0.00 0.00 0.00 0.00 0.00 60.65 62.61 3dfy s ILE 264 Cb -0.22 -4.23 0.03 0.00 0.01 0.00 0.00 42.46 38.04 3dfy s ILE 264 CO 0.09 0.38 -0.02 -0.54 0.00 0.00 0.00 174.94 174.84 3dfy s LYS 265 N -0.27 0.71 0.54 2.79 1.02 -1.26 -0.72 119.74 122.54 3dfy s LYS 265 Ca 0.42 0.02 0.21 0.00 0.02 0.00 0.00 55.97 56.64 3dfy s LYS 265 Cb -0.23 -0.93 1.41 0.00 -0.52 0.00 0.00 37.83 37.57 3dfy s LYS 265 CO 0.27 -0.22 2.13 -0.07 -0.92 0.00 0.00 175.35 176.54 3dfy h LEU 266 N 7.88 0.00 -0.48 3.17 3.38 -1.86 0.65 115.31 128.04 3dfy h LEU 266 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3dfy h LEU 266 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 3dfy h LEU 266 CO 0.35 0.00 0.00 0.23 0.09 0.00 0.00 178.44 179.11 3dfy n MET 267 N -4.33 0.14 -0.13 1.13 2.81 -1.26 0.16 117.12 115.64 3dfy n MET 267 Ca -0.00 0.37 -0.19 0.00 -1.81 0.00 0.00 57.70 56.06 3dfy n MET 267 Cb 0.21 -1.77 -0.11 0.00 -0.71 0.00 0.00 33.22 30.85 3dfy n MET 267 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3dfy n LYS 268 N -2.03 0.62 -0.06 0.03 5.02 0.13 -2.94 118.16 118.93 3dfy n LYS 268 Ca 0.03 0.16 -0.03 0.00 -2.02 0.00 0.00 58.31 56.45 3dfy n LYS 268 Cb 0.22 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.59 3dfy n LYS 268 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3dfy n SER 269 N -3.39 0.71 0.00 4.39 7.64 -0.65 -4.69 113.62 117.62 3dfy n SER 269 Ca -0.46 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.42 3dfy n SER 269 Cb 0.96 1.21 0.00 0.00 -1.01 0.00 0.00 64.21 65.37 3dfy n SER 269 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dfy n GLY 270 N 1.78 -1.18 0.16 0.23 0.00 0.12 -3.54 105.19 102.76 3dfy n GLY 270 Ca -0.21 -1.60 -0.14 0.00 0.00 0.00 0.00 46.02 44.07 3dfy n GLY 270 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3dfy h ILE 271 N 0.00 1.36 0.05 -0.61 1.08 -1.83 -2.77 117.51 114.78 3dfy h ILE 271 Ca 0.00 -1.60 0.03 0.00 -0.39 0.00 0.00 64.86 62.90 3dfy h ILE 271 Cb 0.00 2.00 -0.05 0.00 -3.07 0.00 0.00 36.82 35.71 3dfy h ILE 271 CO 0.00 0.48 -0.33 0.77 -0.69 0.00 0.00 178.15 178.38 3dfy h SER 272 N 0.11 -0.97 0.15 1.72 4.64 -1.94 -0.81 113.55 116.44 3dfy h SER 272 Ca 0.00 0.12 -0.11 0.00 -0.47 0.00 0.00 61.79 61.33 3dfy h SER 272 Cb 0.93 0.38 -0.01 0.00 -0.31 0.00 0.00 62.40 63.39 3dfy h SER 272 CO 0.07 -0.40 -0.40 0.44 -0.87 0.00 0.00 176.83 175.68 3dfy h ASP 273 N -0.51 0.34 -0.45 4.97 5.19 -1.68 -2.44 116.42 121.84 3dfy h ASP 273 Ca 0.05 -0.14 -0.01 0.00 -0.62 0.00 0.00 57.03 56.31 3dfy h ASP 273 Cb 0.57 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 39.97 3dfy h ASP 273 CO -0.24 0.71 0.25 0.00 -3.12 0.00 0.00 179.24 176.84 3dfy h ALA 274 N 1.31 0.57 -0.84 3.45 0.00 -1.15 0.46 119.26 123.06 3dfy h ALA 274 Ca 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3dfy h ALA 274 Cb 0.82 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 3dfy h ALA 274 CO 0.07 0.08 0.47 -0.07 0.00 0.00 0.00 179.25 179.79 3dfy h LEU 275 N 0.59 1.04 -0.25 0.00 3.38 -0.98 -1.56 115.31 117.52 3dfy h LEU 275 Ca 0.16 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 3dfy h LEU 275 Cb 0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3dfy h LEU 275 CO -0.03 0.83 0.11 0.00 0.09 0.00 0.00 178.44 179.45 3dfy h ALA 276 N 1.34 0.33 -0.84 1.53 0.00 -0.94 -2.77 119.26 117.91 3dfy h ALA 276 Ca 0.30 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3dfy h ALA 276 Cb 0.01 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 3dfy h ALA 276 CO -0.05 -0.10 0.49 0.82 0.00 0.00 0.00 179.25 180.41 3dfy h ILE 277 N 0.27 1.24 -0.43 0.00 2.04 -0.53 -0.27 117.51 119.82 3dfy h ILE 277 Ca 0.09 -0.54 0.03 0.00 1.00 0.00 0.00 64.86 65.43 3dfy h ILE 277 Cb 0.14 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.26 3dfy h ILE 277 CO -0.01 0.25 0.24 0.58 0.00 0.00 0.00 178.15 179.22 3dfy h VAL 278 N 1.16 1.02 -0.51 1.67 2.07 -1.12 0.19 116.25 120.73 3dfy h VAL 278 Ca 0.30 -0.17 -0.12 0.00 0.82 0.00 0.00 66.70 67.53 3dfy h VAL 278 Cb -0.02 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 3dfy h VAL 278 CO -0.05 0.09 -0.16 -0.33 0.02 0.00 0.00 177.57 177.14 3dfy h GLU 279 N 0.49 0.99 -0.30 1.57 4.39 -1.16 -1.18 114.58 119.38 3dfy h GLU 279 Ca 0.18 -0.39 -0.02 0.00 0.34 0.00 0.00 59.36 59.47 3dfy h GLU 279 Cb 0.04 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 3dfy h GLU 279 CO -0.10 1.07 0.13 0.82 -1.16 0.00 0.00 179.01 179.77 3dfy h ILE 280 N 0.87 1.17 -0.02 3.13 2.04 -0.70 -2.25 117.51 121.76 3dfy h ILE 280 Ca 0.13 -0.52 0.02 0.00 1.00 0.00 0.00 64.86 65.48 3dfy h ILE 280 Cb 0.72 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 3dfy h ILE 280 CO 0.06 0.18 -0.08 0.00 0.00 0.00 0.00 178.15 178.31 3dfy h ALA 281 N 0.97 -0.06 0.00 1.87 0.00 -0.45 -2.22 119.26 119.36 3dfy h ALA 281 Ca 0.10 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3dfy h ALA 281 Cb 0.17 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3dfy h ALA 281 CO -0.01 -0.56 0.00 0.39 0.00 0.00 0.00 179.25 179.07 3dfy n GLU 282 N -5.20 0.02 -0.17 0.00 1.02 -0.46 -1.92 120.64 113.92 3dfy n GLU 282 Ca -0.05 0.26 0.09 0.00 -0.02 0.00 0.00 57.16 57.43 3dfy n GLU 282 Cb 0.13 -1.50 0.18 0.00 -0.02 0.00 0.00 31.44 30.23 3dfy n GLU 282 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3dfy n SER 283 N -1.48 3.10 -0.33 1.62 7.64 -0.85 -4.54 113.62 118.77 3dfy n SER 283 Ca 0.04 -1.90 0.00 0.00 1.01 0.00 0.00 58.87 58.01 3dfy n SER 283 Cb 0.15 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 3dfy n SER 283 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3dfy n SER 284 N 1.09 0.00 -1.19 6.43 3.41 -0.81 -5.02 113.62 117.54 3dfy n SER 284 Ca 0.15 -1.57 -0.13 0.00 -0.26 0.00 0.00 58.87 57.06 3dfy n SER 284 Cb 0.50 -0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 3dfy n SER 284 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dfy n GLY 285 N 0.00 0.65 3.82 5.00 0.00 -1.07 -5.00 105.19 108.59 3dfy n GLY 285 Ca 0.00 -0.40 -0.38 0.00 0.00 0.00 0.00 46.02 45.24 3dfy n GLY 285 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dfy s LEU 286 N -3.23 4.41 0.26 0.99 2.96 -0.83 -5.01 118.68 118.24 3dfy s LEU 286 Ca 0.00 0.80 -0.00 0.00 -0.22 0.00 0.00 54.13 54.71 3dfy s LEU 286 Cb 0.00 -2.48 -0.04 0.00 0.50 0.00 0.00 46.19 44.17 3dfy s LEU 286 CO 0.00 0.27 0.46 -0.54 -1.32 0.00 0.00 176.35 175.22 3dfy s LYS 287 N -0.67 3.51 0.11 1.98 -0.14 -0.35 -4.45 119.74 119.74 3dfy s LYS 287 Ca 0.21 -0.35 0.05 0.00 -1.36 0.00 0.00 55.97 54.53 3dfy s LYS 287 Cb -0.15 -2.76 -0.04 0.00 -1.68 0.00 0.00 37.83 33.20 3dfy s LYS 287 CO 0.10 0.30 -0.13 -0.51 -0.76 0.00 0.00 175.35 174.34 3dfy s LEU 288 N -3.76 2.39 0.05 3.17 1.43 -1.26 -1.81 118.68 118.89 3dfy s LEU 288 Ca 0.39 -0.79 -0.01 0.00 -1.03 0.00 0.00 54.13 52.69 3dfy s LEU 288 Cb -0.10 -0.51 -0.04 0.00 0.03 0.00 0.00 46.19 45.57 3dfy s LEU 288 CO 0.31 -0.16 -0.03 0.00 0.23 0.00 0.00 176.35 176.71 3dfy s MET 289 N -2.61 0.60 -0.04 1.70 0.23 -1.01 -1.55 119.30 116.63 3dfy s MET 289 Ca 0.07 -1.18 0.04 0.00 -1.03 0.00 0.00 55.69 53.59 3dfy s MET 289 Cb -0.05 0.19 -0.00 0.00 -1.53 0.00 0.00 34.83 33.44 3dfy s MET 289 CO 0.02 -0.10 -0.16 -1.50 -2.03 0.00 0.00 175.02 171.25 3dfy s ILE 290 N -3.75 1.32 0.00 3.16 2.07 -1.03 -1.24 121.20 121.74 3dfy s ILE 290 Ca 0.06 -0.67 0.00 0.00 -1.41 0.00 0.00 60.65 58.63 3dfy s ILE 290 Cb 0.07 -1.13 0.00 0.00 0.13 0.00 0.00 42.46 41.52 3dfy s ILE 290 CO -0.09 0.38 0.00 0.61 -1.91 0.00 0.00 174.94 173.93 3dfy n GLY 291 N 3.09 6.18 3.60 1.50 0.00 0.10 -0.32 105.19 119.34 3dfy n GLY 291 Ca -0.18 -1.95 -0.12 0.00 0.00 0.00 0.00 46.02 43.77 3dfy n GLY 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dfy n MET 293 N -0.52 0.00 -1.58 0.00 2.81 -1.26 -4.99 117.12 111.57 3dfy n MET 293 Ca -0.02 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.81 3dfy n MET 293 Cb 0.61 0.00 0.09 0.00 -0.71 0.00 0.00 33.22 33.21 3dfy n MET 293 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3dfy n GLY 294 N 4.71 4.39 3.76 3.03 0.00 -1.26 -4.76 105.19 115.06 3dfy n GLY 294 Ca 0.00 -1.66 -0.39 0.00 0.00 0.00 0.00 46.02 43.97 3dfy n GLY 294 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dfy s GLU 295 N -2.94 3.54 0.00 1.61 8.01 -1.26 -4.89 118.70 122.77 3dfy s GLU 295 Ca 0.40 2.22 0.00 0.00 0.01 0.00 0.00 54.97 57.60 3dfy s GLU 295 Cb 0.38 -2.49 0.00 0.00 -4.31 0.00 0.00 34.13 27.71 3dfy s GLU 295 CO -0.04 -0.87 0.00 -1.13 0.01 0.00 0.00 175.26 173.23 3dfy n SER 296 N -0.49 0.00 -0.25 -0.19 3.41 -1.26 -2.80 113.62 112.04 3dfy n SER 296 Ca 0.07 -0.79 -0.05 0.00 -0.26 0.00 0.00 58.87 57.84 3dfy n SER 296 Cb 0.44 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.44 3dfy n SER 296 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3dfy h SER 297 N 0.00 0.84 0.10 4.04 4.64 -1.93 0.40 113.55 121.65 3dfy h SER 297 Ca 0.00 -0.07 -0.05 0.00 -0.47 0.00 0.00 61.79 61.20 3dfy h SER 297 Cb 0.00 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 61.87 3dfy h SER 297 CO 0.00 0.66 -0.18 0.25 -0.87 0.00 0.00 176.83 176.69 3dfy h LEU 298 N 0.95 0.16 0.12 5.97 6.46 -1.94 -2.12 115.31 124.91 3dfy h LEU 298 Ca 0.25 -0.04 -0.30 0.00 -0.12 0.00 0.00 57.88 57.67 3dfy h LEU 298 Cb -0.02 -0.04 0.03 0.00 -0.73 0.00 0.00 40.66 39.89 3dfy h LEU 298 CO -0.05 0.36 -1.27 1.23 -0.62 0.00 0.00 178.44 178.09 3dfy h GLY 299 N 0.77 0.65 2.00 3.75 0.00 -1.71 -3.21 103.07 105.32 3dfy h GLY 299 Ca 0.03 -1.40 -0.03 0.00 0.00 0.00 0.00 47.33 45.93 3dfy h GLY 299 CO 0.03 1.23 -0.13 1.19 0.00 0.00 0.00 176.54 178.87 3dfy h ILE 300 N 0.24 0.40 -0.94 2.60 6.09 -0.78 -2.24 117.51 122.87 3dfy h ILE 300 Ca -0.19 -0.72 0.12 0.00 -1.37 0.00 0.00 64.86 62.70 3dfy h ILE 300 Cb 1.95 1.52 -0.07 0.00 0.47 0.00 0.00 36.82 40.68 3dfy h ILE 300 CO 0.24 0.12 0.60 -1.13 -3.07 0.00 0.00 178.15 174.91 3dfy h ASN 301 N 0.00 0.81 -0.38 2.19 -1.24 -1.38 -0.74 115.58 114.83 3dfy h ASN 301 Ca -0.00 0.04 0.02 0.00 0.71 0.00 0.00 56.30 57.07 3dfy h ASN 301 Cb 0.51 -0.12 -0.03 0.00 0.73 0.00 0.00 38.32 39.41 3dfy h ASN 301 CO 0.02 0.44 0.21 1.56 -1.29 0.00 0.00 177.43 178.37 3dfy h GLN 302 N 0.87 0.42 -0.00 6.67 4.20 -1.53 -2.01 115.11 123.74 3dfy h GLN 302 Ca 0.46 -0.03 -0.15 0.00 0.06 0.00 0.00 58.65 58.99 3dfy h GLN 302 Cb 0.54 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 3dfy h GLN 302 CO -0.22 0.28 -0.72 0.77 -0.67 0.00 0.00 178.83 178.26 3dfy h SER 303 N 0.43 0.01 -0.16 1.46 0.02 -1.42 -2.67 113.55 111.22 3dfy h SER 303 Ca 0.16 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 3dfy h SER 303 Cb 0.03 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 3dfy h SER 303 CO -0.08 0.73 0.02 0.58 -1.14 0.00 0.00 176.83 176.93 3dfy h VAL 304 N 0.00 1.23 -0.57 2.27 2.07 -0.92 0.26 116.25 120.60 3dfy h VAL 304 Ca -0.01 -0.76 -0.04 0.00 0.82 0.00 0.00 66.70 66.71 3dfy h VAL 304 Cb 1.28 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 32.46 3dfy h VAL 304 CO 0.09 0.23 0.18 0.45 0.02 0.00 0.00 177.57 178.54 3dfy h HIS 305 N 0.03 0.87 -0.22 1.57 -0.00 -1.38 0.72 115.15 116.74 3dfy h HIS 305 Ca 0.05 -0.07 -0.02 0.00 -0.00 0.00 0.00 60.37 60.33 3dfy h HIS 305 Cb 0.33 -0.26 -0.01 0.00 -0.00 0.00 0.00 27.41 27.47 3dfy h HIS 305 CO 0.02 0.71 0.05 0.35 -0.00 0.00 0.00 177.93 179.06 3dfy h PHE 306 N 0.83 0.37 -0.34 2.45 3.57 -1.29 0.15 116.94 122.69 3dfy h PHE 306 Ca 0.19 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 3dfy h PHE 306 Cb 0.24 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 3dfy h PHE 306 CO 0.02 0.46 0.08 0.00 -2.23 0.00 0.00 178.31 176.64 3dfy h ALA 307 N 0.87 0.45 0.11 2.41 0.00 -0.62 -1.14 119.26 121.33 3dfy h ALA 307 Ca 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3dfy h ALA 307 Cb 0.28 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3dfy h ALA 307 CO 0.00 0.12 -0.05 -0.07 0.00 0.00 0.00 179.25 179.25 3dfy h LEU 308 N 0.40 -0.12 0.15 0.00 3.38 -0.79 0.28 115.31 118.61 3dfy h LEU 308 Ca 0.11 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3dfy h LEU 308 Cb 0.30 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3dfy h LEU 308 CO 0.00 0.11 -0.07 1.23 0.09 0.00 0.00 178.44 179.80 3dfy h GLY 309 N -0.36 -0.21 1.96 0.83 0.00 -0.68 -1.68 103.07 102.94 3dfy h GLY 309 Ca -0.01 0.08 -0.20 0.00 0.00 0.00 0.00 47.33 47.20 3dfy h GLY 309 CO 0.02 -0.08 -0.93 -0.91 0.00 0.00 0.00 176.54 174.65 3dfy h THR 310 N -0.22 1.64 -2.88 4.70 1.35 -1.27 -1.11 112.91 115.11 3dfy h THR 310 Ca -0.02 -3.09 -0.30 0.00 -0.55 0.00 0.00 66.41 62.45 3dfy h THR 310 Cb 0.17 2.68 -0.05 0.00 -1.73 0.00 0.00 68.15 69.23 3dfy h THR 310 CO 0.03 0.88 -0.35 0.61 -0.25 0.00 0.00 175.52 176.45 3dfy n GLY 311 N 1.10 0.09 0.04 5.82 0.00 0.98 -4.80 105.19 108.42 3dfy n GLY 311 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 3dfy n GLY 311 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dfy n ALA 312 N -1.29 2.89 -2.80 4.61 0.00 -1.26 -4.91 120.51 117.75 3dfy n ALA 312 Ca -0.17 -0.24 -0.35 0.00 0.00 0.00 0.00 53.44 52.68 3dfy n ALA 312 Cb 0.59 -1.30 -0.09 0.00 0.00 0.00 0.00 19.45 18.65 3dfy n ALA 312 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3dfy s PHE 313 N -2.84 3.31 0.11 0.00 0.08 -1.26 -4.44 117.98 112.94 3dfy s PHE 313 Ca 0.17 0.18 -0.10 0.00 0.12 0.00 0.00 56.93 57.30 3dfy s PHE 313 Cb 0.19 -2.03 -0.13 0.00 -0.57 0.00 0.00 43.02 40.48 3dfy s PHE 313 CO 0.57 0.29 1.31 0.93 -0.10 0.00 0.00 175.22 178.23 3dfy h GLU 314 N 6.25 0.70 -5.15 0.44 4.39 -1.63 -3.46 114.58 116.12 3dfy h GLU 314 Ca -0.42 -0.61 -0.38 0.00 0.34 0.00 0.00 59.36 58.30 3dfy h GLU 314 Cb 1.18 0.14 -0.21 0.00 -0.10 0.00 0.00 28.75 29.75 3dfy h GLU 314 CO 0.67 1.21 -0.77 -0.06 -1.16 0.00 0.00 179.01 178.91 3dfy s PHE 315 N -3.63 1.08 -0.11 4.33 0.08 -1.25 -5.06 117.98 113.43 3dfy s PHE 315 Ca -0.09 -0.48 0.01 0.00 0.12 0.00 0.00 56.93 56.49 3dfy s PHE 315 Cb 0.09 -0.61 0.02 0.00 -0.57 0.00 0.00 43.02 41.94 3dfy s PHE 315 CO 0.90 0.02 -0.11 -1.01 -0.10 0.00 0.00 175.22 174.92 3dfy s HIS 316 N -1.36 1.69 -0.77 0.36 3.76 -1.25 -2.47 115.29 115.26 3dfy s HIS 316 Ca -0.03 -0.81 0.03 0.00 -0.15 0.00 0.00 55.06 54.10 3dfy s HIS 316 Cb -0.10 -1.29 0.26 0.00 1.11 0.00 0.00 32.58 32.56 3dfy s HIS 316 CO 0.02 -0.47 0.92 -3.47 -0.85 0.00 0.00 174.74 170.89 3dfy n ASP 317 N 4.48 4.43 -3.52 1.40 2.03 0.56 -0.86 116.55 125.07 3dfy n ASP 317 Ca -0.17 -3.41 -0.28 0.00 0.52 0.00 0.00 54.79 51.45 3dfy n ASP 317 Cb 0.51 -0.84 -0.08 0.00 -0.72 0.00 0.00 41.12 39.98 3dfy n ASP 317 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3dfy n LEU 318 N 1.09 3.79 -0.14 -2.67 4.77 -1.26 -3.09 117.00 119.49 3dfy n LEU 318 Ca 0.28 -5.40 0.02 0.00 -0.03 0.00 0.00 56.01 50.87 3dfy n LEU 318 Cb 0.39 -0.71 0.02 0.00 -2.33 0.00 0.00 43.42 40.78 3dfy n LEU 318 CO 0.48 2.00 0.32 -0.90 -1.33 0.00 0.00 177.39 177.95 3dfy n ASP 319 N 1.03 1.35 -0.33 -1.43 5.75 -1.26 -4.77 116.55 116.89 3dfy n ASP 319 Ca 0.28 -1.20 0.14 0.00 -0.01 0.00 0.00 54.79 54.00 3dfy n ASP 319 Cb 0.40 -0.00 0.36 0.00 -1.03 0.00 0.00 41.12 40.84 3dfy n ASP 319 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 3dfy h SER 320 N 0.66 0.72 1.29 -1.12 4.64 -1.85 0.13 113.55 118.02 3dfy h SER 320 Ca 0.00 0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3dfy h SER 320 Cb 0.17 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3dfy h SER 320 CO 0.00 0.28 -0.02 1.12 -0.87 0.00 0.00 176.83 177.34 3dfy h HIS 321 N 0.71 0.00 0.00 4.77 2.07 -1.78 -2.57 115.15 118.35 3dfy h HIS 321 Ca 0.54 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.06 3dfy h HIS 321 Cb 0.91 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.89 3dfy h HIS 321 CO -0.00 0.02 -0.11 1.28 -3.07 0.00 0.00 177.93 176.04 3dfy n LEU 322 N -3.11 0.79 0.06 6.12 4.77 0.43 -3.24 117.00 122.82 3dfy n LEU 322 Ca 0.02 0.51 0.11 0.00 -0.03 0.00 0.00 56.01 56.62 3dfy n LEU 322 Cb 0.38 -0.30 0.01 0.00 -2.33 0.00 0.00 43.42 41.18 3dfy n LEU 322 CO 0.29 -0.16 -0.05 0.23 -1.33 0.00 0.00 177.39 176.38 3dfy n MET 323 N -2.23 0.49 -2.92 3.23 2.81 -0.98 -4.94 117.12 112.58 3dfy n MET 323 Ca 0.05 0.04 -0.21 0.00 -1.81 0.00 0.00 57.70 55.78 3dfy n MET 323 Cb 0.43 -1.70 0.02 0.00 -0.71 0.00 0.00 33.22 31.26 3dfy n MET 323 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3dfy s LEU 324 N -4.71 3.54 -0.29 4.03 1.43 -1.17 -1.32 118.68 120.19 3dfy s LEU 324 Ca 0.00 -0.03 -0.06 0.00 -1.03 0.00 0.00 54.13 53.01 3dfy s LEU 324 Cb 0.12 -2.89 0.01 0.00 0.03 0.00 0.00 46.19 43.46 3dfy s LEU 324 CO 0.80 -0.85 0.07 -0.54 0.23 0.00 0.00 176.35 176.06 3dfy s LYS 325 N -4.55 3.08 -0.07 1.70 1.02 -0.80 -4.79 119.74 115.33 3dfy s LYS 325 Ca 0.53 -0.86 0.02 0.00 0.02 0.00 0.00 55.97 55.67 3dfy s LYS 325 Cb -0.10 -3.34 0.02 0.00 -0.52 0.00 0.00 37.83 33.88 3dfy s LYS 325 CO 0.36 -0.44 -0.11 -1.21 -0.92 0.00 0.00 175.35 173.04 3dfy s GLU 326 N 1.49 1.57 0.06 1.68 2.02 -1.26 -4.54 118.70 119.71 3dfy s GLU 326 Ca 0.02 -0.35 -0.27 0.00 0.02 0.00 0.00 54.97 54.39 3dfy s GLU 326 Cb -0.17 -1.36 -0.17 0.00 0.10 0.00 0.00 34.13 32.53 3dfy s GLU 326 CO 0.02 -0.03 1.55 0.93 0.02 0.00 0.00 175.26 177.75 3dfy h GLU 327 N 7.16 -0.38 -5.80 1.61 3.07 -2.04 -3.43 114.58 114.78 3dfy h GLU 327 Ca -0.32 0.03 -0.67 0.00 -0.50 0.00 0.00 59.36 57.90 3dfy h GLU 327 Cb 1.18 0.09 -0.32 0.00 -0.84 0.00 0.00 28.75 28.86 3dfy h GLU 327 CO 0.46 -0.18 -0.88 0.54 -1.40 0.00 0.00 179.01 177.56 3dfy s VAL 328 N -5.65 1.97 0.26 3.13 0.11 -1.26 -5.10 120.40 113.87 3dfy s VAL 328 Ca -0.15 -1.01 -0.30 0.00 -2.93 0.00 0.00 61.98 57.59 3dfy s VAL 328 Cb 0.04 -1.68 -0.11 0.00 -1.53 0.00 0.00 36.38 33.10 3dfy s VAL 328 CO 0.62 0.55 1.53 0.12 -3.33 0.00 0.00 175.10 174.58 3dfy s PHE 329 N -0.04 2.89 -0.08 1.54 5.36 -1.26 -4.93 117.98 121.46 3dfy s PHE 329 Ca -0.06 0.87 0.11 0.00 -0.96 0.00 0.00 56.93 56.89 3dfy s PHE 329 Cb -0.14 -3.95 0.17 0.00 -0.34 0.00 0.00 43.02 38.76 3dfy s PHE 329 CO 0.04 -3.18 1.07 0.54 -1.46 0.00 0.00 175.22 172.23 3dfy n ARG 330 N 2.38 1.68 -3.72 10.12 1.74 -1.26 -5.05 116.66 122.56 3dfy n ARG 330 Ca 0.08 -2.06 -0.31 0.00 -0.77 0.00 0.00 57.85 54.78 3dfy n ARG 330 Cb 0.39 -1.24 -0.05 0.00 -1.02 0.00 0.00 32.46 30.54 3dfy n ARG 330 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3dfy s GLY 331 N -2.07 2.22 -1.02 -0.13 0.00 -1.26 -3.98 107.32 101.10 3dfy s GLY 331 Ca 0.19 -0.61 -0.04 0.00 0.00 0.00 0.00 44.72 44.26 3dfy s GLY 331 CO 0.02 -0.55 2.31 0.28 0.00 0.00 0.00 173.10 175.16 3dfy n LYS 332 N 0.11 4.13 -3.88 2.90 5.02 -1.26 -4.87 118.16 120.31 3dfy n LYS 332 Ca -0.03 -3.50 -0.08 0.00 -2.02 0.00 0.00 58.31 52.68 3dfy n LYS 332 Cb 0.52 -2.45 -0.01 0.00 -0.02 0.00 0.00 35.03 33.06 3dfy n LYS 332 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 3dfy s PHE 333 N -2.29 0.03 -0.25 2.13 -0.12 -1.26 -4.84 117.98 111.37 3dfy s PHE 333 Ca 0.52 -0.52 -0.07 0.00 -0.05 0.00 0.00 56.93 56.80 3dfy s PHE 333 Cb 0.26 0.63 -0.03 0.00 -0.63 0.00 0.00 43.02 43.25 3dfy s PHE 333 CO -0.16 -1.28 0.06 0.42 -0.05 0.00 0.00 175.22 174.20 3dfy s ILE 334 N -3.48 4.23 -0.52 -4.49 1.01 0.23 -4.96 121.20 113.23 3dfy s ILE 334 Ca 0.15 -0.22 -0.16 0.00 0.00 0.00 0.00 60.65 60.41 3dfy s ILE 334 Cb -0.05 -2.99 0.10 0.00 0.01 0.00 0.00 42.46 39.54 3dfy s ILE 334 CO 0.09 0.33 0.50 -1.58 0.00 0.00 0.00 174.94 174.28 3dfy s GLN 335 N 1.60 3.01 -0.73 2.79 2.00 -1.26 -1.12 119.66 125.94 3dfy s GLN 335 Ca 0.06 -1.46 -0.04 0.00 -2.00 0.00 0.00 55.36 51.93 3dfy s GLN 335 Cb -0.15 -4.22 0.19 0.00 0.80 0.00 0.00 33.01 29.62 3dfy s GLN 335 CO 0.03 -1.24 0.58 0.34 -0.50 0.00 0.00 175.29 174.49 3dfy s ASP 336 N 3.18 5.61 1.61 6.67 2.15 0.28 -5.00 116.67 131.16 3dfy s ASP 336 Ca 0.06 -3.11 0.00 0.00 0.43 0.00 0.00 52.55 49.92 3dfy s ASP 336 Cb -0.26 -1.91 0.00 0.00 -0.30 0.00 0.00 42.92 40.45 3dfy s ASP 336 CO 0.05 -0.33 0.00 0.61 -0.17 0.00 0.00 175.17 175.34 3dfy n GLY 337 N 3.17 2.69 0.18 2.66 0.00 -1.26 -1.95 105.19 110.67 3dfy n GLY 337 Ca 0.13 -0.26 0.15 0.00 0.00 0.00 0.00 46.02 46.03 3dfy n GLY 337 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dfy n PRO 338 N 13.22 1.06 -4.14 1.61 -0.04 -1.26 -4.88 135.00 140.56 3dfy n PRO 338 Ca 0.00 -0.35 -0.28 0.00 -0.04 0.00 0.00 63.50 62.82 3dfy n PRO 338 Cb 0.00 -1.49 -0.07 0.00 -0.04 0.00 0.00 33.50 31.89 3dfy n PRO 338 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3dfy s ARG 339 N -2.18 2.56 -0.05 0.54 0.52 -0.82 -0.93 118.95 118.58 3dfy s ARG 339 Ca 0.38 -0.93 0.04 0.00 -0.52 0.00 0.00 55.73 54.70 3dfy s ARG 339 Cb 0.21 -2.50 0.00 0.00 0.52 0.00 0.00 34.95 33.18 3dfy s ARG 339 CO 0.40 0.50 -0.16 -1.64 0.02 0.00 0.00 175.30 174.42 3dfy s MET 340 N -2.64 1.85 0.31 3.54 -1.94 0.15 -0.56 119.30 120.01 3dfy s MET 340 Ca 0.27 -0.58 0.04 0.00 -1.71 0.00 0.00 55.69 53.71 3dfy s MET 340 Cb -0.11 -1.56 -0.04 0.00 2.01 0.00 0.00 34.83 35.13 3dfy s MET 340 CO 0.19 0.18 0.18 1.03 -0.01 0.00 0.00 175.02 176.59 3dfy s ARG 341 N 0.21 1.63 0.14 2.03 0.52 -0.28 -1.45 118.95 121.75 3dfy s ARG 341 Ca -0.08 -1.93 0.10 0.00 -0.52 0.00 0.00 55.73 53.30 3dfy s ARG 341 Cb -0.13 -0.03 -0.04 0.00 0.52 0.00 0.00 34.95 35.27 3dfy s ARG 341 CO 0.03 -0.49 -0.24 0.54 0.02 0.00 0.00 175.30 175.16 3dfy s VAL 342 N -3.58 2.11 -2.00 3.52 0.11 -1.26 0.77 120.40 120.08 3dfy s VAL 342 Ca 0.36 -1.78 0.20 0.00 -2.93 0.00 0.00 61.98 57.83 3dfy s VAL 342 Cb 0.04 -1.91 0.58 0.00 -1.53 0.00 0.00 36.38 33.56 3dfy s VAL 342 CO 0.19 -0.03 1.60 0.29 -3.33 0.00 0.00 175.10 173.82