#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 3.51 -0.06 0.55 1.01 -0.27 -0.88 121.20 125.05 3dfy s ILE 4 Ca 0.00 1.07 0.11 0.00 0.00 0.00 0.00 60.65 61.84 3dfy s ILE 4 Cb 0.00 -3.69 -0.17 0.00 0.01 0.00 0.00 42.46 38.61 3dfy s ILE 4 CO 0.00 0.08 0.27 1.33 0.00 0.00 0.00 174.94 176.62 3dfy n VAL 5 N 3.97 0.00 -3.55 2.92 0.24 0.18 -0.13 118.33 121.98 3dfy n VAL 5 Ca 0.11 -0.26 -0.15 0.00 -2.04 0.00 0.00 64.34 62.00 3dfy n VAL 5 Cb 0.43 0.32 -0.06 0.00 -1.47 0.00 0.00 33.84 33.06 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 -3.17 -0.57 -0.05 -1.34 2.47 -1.01 -4.93 114.94 106.34 3dfy s ASN 6 Ca -0.03 0.67 0.00 0.00 0.42 0.00 0.00 52.86 53.92 3dfy s ASN 6 Cb 0.07 0.53 0.02 0.00 -1.45 0.00 0.00 41.25 40.42 3dfy s ASN 6 CO 0.47 -0.50 -0.03 -0.69 -3.72 0.00 0.00 177.10 172.63 3dfy s VAL 7 N -1.04 0.46 -0.02 -5.21 1.01 -1.26 -0.24 120.40 114.08 3dfy s VAL 7 Ca -0.07 -0.04 0.05 0.00 0.00 0.00 0.00 61.98 61.92 3dfy s VAL 7 Cb -0.01 -0.52 -0.01 0.00 0.00 0.00 0.00 36.38 35.84 3dfy s VAL 7 CO 0.07 0.22 -0.18 -0.54 0.00 0.00 0.00 175.10 174.67 3dfy s LYS 8 N 1.18 1.59 -0.11 2.72 1.02 -0.03 -4.77 119.74 121.34 3dfy s LYS 8 Ca -0.07 -0.64 0.02 0.00 0.02 0.00 0.00 55.97 55.30 3dfy s LYS 8 Cb -0.14 -1.48 -0.01 0.00 -0.52 0.00 0.00 37.83 35.68 3dfy s LYS 8 CO -0.01 0.34 -0.16 -0.51 -0.92 0.00 0.00 175.35 174.08 3dfy s LEU 9 N -0.26 2.56 -0.06 3.17 1.02 -1.26 -1.15 118.68 122.69 3dfy s LEU 9 Ca 0.03 -0.36 -0.04 0.00 0.02 0.00 0.00 54.13 53.78 3dfy s LEU 9 Cb -0.09 -1.55 0.03 0.00 0.02 0.00 0.00 46.19 44.60 3dfy s LEU 9 CO 0.00 0.20 0.15 -0.94 0.02 0.00 0.00 176.35 175.78 3dfy s SER 10 N 0.12 -0.14 0.29 2.29 1.04 -0.70 -4.97 113.70 111.64 3dfy s SER 10 Ca -0.08 0.31 -0.30 0.00 0.48 0.00 0.00 55.95 56.36 3dfy s SER 10 Cb -0.15 0.25 -0.10 0.00 0.10 0.00 0.00 66.02 66.12 3dfy s SER 10 CO 0.05 -0.10 1.44 -0.22 0.98 0.00 0.00 173.24 175.40 3dfy s LEU 11 N 0.61 4.38 -0.09 2.42 2.96 -1.26 -1.08 118.68 126.62 3dfy s LEU 11 Ca -0.04 2.76 -0.01 0.00 -0.22 0.00 0.00 54.13 56.61 3dfy s LEU 11 Cb -0.06 -3.64 0.03 0.00 0.50 0.00 0.00 46.19 43.02 3dfy s LEU 11 CO -0.03 -0.72 -0.02 -0.54 -1.32 0.00 0.00 176.35 173.72 3dfy s LYS 12 N -0.86 0.90 -0.16 1.98 -0.14 0.37 -4.89 119.74 116.94 3dfy s LYS 12 Ca 0.57 -0.03 -0.07 0.00 -1.36 0.00 0.00 55.97 55.08 3dfy s LYS 12 Cb -0.43 -1.22 -0.04 0.00 -1.68 0.00 0.00 37.83 34.46 3dfy s LYS 12 CO 0.48 -0.31 0.08 1.03 -0.76 0.00 0.00 175.35 175.87 3dfy s ARG 13 N 1.88 3.76 -0.04 1.68 0.52 -1.26 -0.90 118.95 124.59 3dfy s ARG 13 Ca 0.05 -0.29 0.04 0.00 -0.52 0.00 0.00 55.73 55.01 3dfy s ARG 13 Cb -0.13 -3.18 0.00 0.00 0.52 0.00 0.00 34.95 32.16 3dfy s ARG 13 CO -0.06 0.45 -0.15 0.71 0.02 0.00 0.00 175.30 176.27 3dfy s TYR 14 N -0.10 1.51 -0.08 -0.53 2.02 -0.07 -4.99 117.35 115.12 3dfy s TYR 14 Ca 0.08 -0.45 -0.17 0.00 -0.37 0.00 0.00 57.07 56.16 3dfy s TYR 14 Cb -0.12 -1.04 -0.05 0.00 -0.40 0.00 0.00 41.96 40.35 3dfy s TYR 14 CO 0.01 -0.18 0.45 -2.00 -1.57 0.00 0.00 175.55 172.26 3dfy s GLU 15 N 0.19 4.21 0.48 -0.62 2.12 -1.26 0.10 118.70 123.92 3dfy s GLU 15 Ca -0.06 0.43 -0.19 0.00 0.36 0.00 0.00 54.97 55.50 3dfy s GLU 15 Cb -0.12 -3.37 -0.09 0.00 0.26 0.00 0.00 34.13 30.82 3dfy s GLU 15 CO 0.02 0.34 0.99 0.71 -0.54 0.00 0.00 175.26 176.78 3dfy s TYR 16 N 0.05 3.21 0.13 5.30 2.02 -1.26 -0.50 117.35 126.30 3dfy s TYR 16 Ca 0.25 1.57 -0.15 0.00 -0.37 0.00 0.00 57.07 58.36 3dfy s TYR 16 Cb -0.16 -2.92 -0.00 0.00 -0.40 0.00 0.00 41.96 38.48 3dfy s TYR 16 CO 0.11 -0.47 1.63 0.93 -1.57 0.00 0.00 175.55 176.18 3dfy h GLU 17 N 1.49 0.67 0.00 -0.62 4.39 -1.47 -3.46 114.58 115.58 3dfy h GLU 17 Ca -0.49 -0.16 -0.19 0.00 0.34 0.00 0.00 59.36 58.86 3dfy h GLU 17 Cb 1.20 -0.09 -0.14 0.00 -0.10 0.00 0.00 28.75 29.62 3dfy h GLU 17 CO 0.60 0.68 -0.26 1.63 -1.16 0.00 0.00 179.01 180.50 3dfy n LYS 18 N -4.54 0.75 -4.11 2.33 5.02 -1.26 -5.14 118.16 111.21 3dfy n LYS 18 Ca -0.00 -1.53 -0.35 0.00 -2.02 0.00 0.00 58.31 54.41 3dfy n LYS 18 Cb 0.21 -0.68 -0.11 0.00 -0.02 0.00 0.00 35.03 34.42 3dfy n LYS 18 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3dfy s GLU 29 N 0.19 3.77 -0.26 1.97 2.12 -1.26 -5.18 118.70 120.05 3dfy s GLU 29 Ca 0.21 -0.45 -0.12 0.00 0.36 0.00 0.00 54.97 54.97 3dfy s GLU 29 Cb 0.29 -3.11 -0.05 0.00 0.26 0.00 0.00 34.13 31.52 3dfy s GLU 29 CO -0.10 0.15 0.21 0.45 -0.54 0.00 0.00 175.26 175.44 3dfy s SER 30 N 0.66 6.10 -0.37 -1.70 0.15 0.11 -4.92 113.70 113.74 3dfy s SER 30 Ca 0.01 0.09 -0.08 0.00 0.70 0.00 0.00 55.95 56.67 3dfy s SER 30 Cb -0.14 -2.13 0.05 0.00 -1.71 0.00 0.00 66.02 62.09 3dfy s SER 30 CO 0.02 -0.03 0.18 -0.13 1.20 0.00 0.00 173.24 174.48 3dfy s ARG 31 N 1.55 2.66 0.44 5.44 0.52 -1.26 -0.89 118.95 127.41 3dfy s ARG 31 Ca 0.09 -1.24 0.07 0.00 -0.52 0.00 0.00 55.73 54.12 3dfy s ARG 31 Cb -0.15 -3.63 -0.03 0.00 0.52 0.00 0.00 34.95 31.66 3dfy s ARG 31 CO 0.09 -0.76 0.23 -0.80 0.02 0.00 0.00 175.30 174.07 3dfy s ASN 32 N 1.65 4.51 -0.21 0.23 0.01 -0.08 -4.65 114.94 116.40 3dfy s ASN 32 Ca 0.01 -1.11 0.01 0.00 -0.71 0.00 0.00 52.86 51.06 3dfy s ASN 32 Cb -0.20 -0.27 0.03 0.00 0.41 0.00 0.00 41.25 41.22 3dfy s ASN 32 CO 0.04 -0.67 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.10 3dfy s VAL 33 N -2.63 2.18 0.10 1.60 1.01 -0.36 -0.48 120.40 121.82 3dfy s VAL 33 Ca 0.38 -1.14 -0.21 0.00 0.00 0.00 0.00 61.98 61.01 3dfy s VAL 33 Cb 0.02 -2.04 -0.07 0.00 0.00 0.00 0.00 36.38 34.29 3dfy s VAL 33 CO 0.22 0.34 0.63 -0.70 0.00 0.00 0.00 175.10 175.59 3dfy s GLU 34 N 1.24 4.32 -0.14 2.72 2.12 -0.24 -0.27 118.70 128.45 3dfy s GLU 34 Ca 0.01 0.87 0.00 0.00 0.36 0.00 0.00 54.97 56.21 3dfy s GLU 34 Cb -0.15 -3.25 -0.00 0.00 0.26 0.00 0.00 34.13 30.98 3dfy s GLU 34 CO -0.10 0.60 -0.15 0.08 -0.54 0.00 0.00 175.26 175.15 3dfy s VAL 35 N -1.05 2.71 -0.16 3.70 1.01 0.12 -1.72 120.40 125.02 3dfy s VAL 35 Ca 0.31 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.54 3dfy s VAL 35 Cb -0.21 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.04 3dfy s VAL 35 CO 0.21 0.52 -0.18 -0.70 0.00 0.00 0.00 175.10 174.95 3dfy s GLU 36 N 0.67 3.11 -0.19 2.72 2.12 -0.30 -1.03 118.70 125.80 3dfy s GLU 36 Ca -0.08 -0.80 -0.04 0.00 0.36 0.00 0.00 54.97 54.41 3dfy s GLU 36 Cb -0.16 -2.56 -0.02 0.00 0.26 0.00 0.00 34.13 31.65 3dfy s GLU 36 CO 0.02 -0.04 -0.02 0.42 -0.54 0.00 0.00 175.26 175.10 3dfy s ILE 37 N 0.92 3.81 -0.19 -3.70 1.01 0.61 -0.85 121.20 122.81 3dfy s ILE 37 Ca -0.04 -0.37 -0.06 0.00 0.00 0.00 0.00 60.65 60.18 3dfy s ILE 37 Cb -0.15 -2.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.58 3dfy s ILE 37 CO -0.03 0.45 0.02 -0.69 0.00 0.00 0.00 174.94 174.69 3dfy s VAL 38 N 0.86 4.29 0.20 2.92 1.01 0.66 -0.69 120.40 129.66 3dfy s VAL 38 Ca -0.00 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.79 3dfy s VAL 38 Cb -0.14 -2.94 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3dfy s VAL 38 CO 0.02 0.44 0.37 -0.76 0.00 0.00 0.00 175.10 175.16 3dfy s LEU 39 N 0.71 4.26 0.62 3.92 1.02 0.23 0.52 118.68 129.95 3dfy s LEU 39 Ca 0.01 0.28 0.39 0.00 0.02 0.00 0.00 54.13 54.84 3dfy s LEU 39 Cb -0.14 -3.06 1.99 0.00 0.02 0.00 0.00 46.19 45.01 3dfy s LEU 39 CO 0.02 -0.04 2.22 1.05 0.02 0.00 0.00 176.35 179.62 3dfy h GLU 40 N 1.82 0.00 0.00 1.70 4.11 -1.33 0.43 114.58 121.30 3dfy h GLU 40 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 3dfy h GLU 40 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3dfy h GLU 40 CO 0.67 0.01 0.00 -1.13 0.07 0.00 0.00 179.01 178.63 3dfy n SER 41 N -3.16 0.39 0.00 3.06 3.41 -1.26 -4.90 113.62 111.16 3dfy n SER 41 Ca -0.02 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 3dfy n SER 41 Cb 0.16 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.47 3dfy n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dfy n GLY 42 N 1.20 2.36 3.77 5.00 0.00 0.14 -5.06 105.19 112.60 3dfy n GLY 42 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.56 2.66 -0.09 1.61 1.01 -1.26 -4.73 120.40 117.04 3dfy s VAL 43 Ca 0.00 0.60 0.03 0.00 0.00 0.00 0.00 61.98 62.60 3dfy s VAL 43 Cb 0.00 -3.35 0.01 0.00 0.00 0.00 0.00 36.38 33.04 3dfy s VAL 43 CO 0.00 0.09 -0.18 -0.54 0.00 0.00 0.00 175.10 174.47 3dfy s LYS 44 N -2.21 2.39 0.02 2.72 1.02 -1.26 -0.60 119.74 121.81 3dfy s LYS 44 Ca 0.56 -0.64 0.04 0.00 0.02 0.00 0.00 55.97 55.95 3dfy s LYS 44 Cb -0.38 -1.92 -0.03 0.00 -0.52 0.00 0.00 37.83 34.99 3dfy s LYS 44 CO 0.48 0.05 -0.08 0.20 -0.92 0.00 0.00 175.35 175.08 3dfy s GLY 45 N 0.67 1.74 0.03 -3.33 0.00 0.13 -4.68 107.32 101.88 3dfy s GLY 45 Ca -0.13 -1.05 0.05 0.00 0.00 0.00 0.00 44.72 43.59 3dfy s GLY 45 CO 0.03 -0.93 -0.16 -0.19 0.00 0.00 0.00 173.10 171.86 3dfy s TYR 46 N -1.02 1.39 0.25 1.90 2.02 -1.26 -0.28 117.35 120.35 3dfy s TYR 46 Ca 0.17 -0.33 0.02 0.00 -0.37 0.00 0.00 57.07 56.56 3dfy s TYR 46 Cb -0.11 -0.84 -0.04 0.00 -0.40 0.00 0.00 41.96 40.57 3dfy s TYR 46 CO 0.08 0.04 0.18 0.20 -1.57 0.00 0.00 175.55 174.48 3dfy s GLY 47 N -0.96 1.78 -0.08 0.71 0.00 -0.19 -4.03 107.32 104.54 3dfy s GLY 47 Ca 0.04 -1.83 -0.04 0.00 0.00 0.00 0.00 44.72 42.88 3dfy s GLY 47 CO 0.01 -1.43 0.19 1.85 0.00 0.00 0.00 173.10 173.71 3dfy s GLU 48 N -3.90 0.15 -0.28 2.90 2.12 -1.26 -0.71 118.70 117.73 3dfy s GLU 48 Ca 0.39 0.41 -0.09 0.00 0.36 0.00 0.00 54.97 56.04 3dfy s GLU 48 Cb 0.05 -0.12 -0.03 0.00 0.26 0.00 0.00 34.13 34.30 3dfy s GLU 48 CO 0.18 -0.14 0.14 0.00 -0.54 0.00 0.00 175.26 174.89 3dfy s ALA 49 N 1.04 3.33 -0.64 6.30 0.00 0.62 -4.40 121.76 128.01 3dfy s ALA 49 Ca -0.08 -1.18 -0.05 0.00 0.00 0.00 0.00 51.96 50.65 3dfy s ALA 49 Cb -0.10 -2.31 0.17 0.00 0.00 0.00 0.00 23.12 20.88 3dfy s ALA 49 CO -0.06 -0.62 0.48 0.45 0.00 0.00 0.00 175.76 176.01 3dfy s SER 50 N 1.67 5.54 0.73 0.00 0.15 -1.26 -1.22 113.70 119.30 3dfy s SER 50 Ca 0.06 -2.72 -0.14 0.00 0.70 0.00 0.00 55.95 53.84 3dfy s SER 50 Cb -0.16 -1.93 0.04 0.00 -1.71 0.00 0.00 66.02 62.26 3dfy s SER 50 CO 0.07 -0.43 1.17 -2.16 1.20 0.00 0.00 173.24 173.09 3dfy s PRO 51 N 0.13 2.24 -0.10 5.44 0.04 -1.26 -4.66 135.00 136.82 3dfy s PRO 51 Ca 0.16 1.63 -0.01 0.00 0.04 0.00 0.00 61.00 62.81 3dfy s PRO 51 Cb -0.19 -1.86 0.03 0.00 0.04 0.00 0.00 34.50 32.52 3dfy s PRO 51 CO -0.04 -1.73 -0.01 0.45 0.04 0.00 0.00 177.00 175.70 3dfy s SER 52 N -2.26 1.98 0.07 6.66 0.15 -1.26 -4.90 113.70 114.14 3dfy s SER 52 Ca 0.71 -0.28 -0.16 0.00 0.70 0.00 0.00 55.95 56.92 3dfy s SER 52 Cb -0.26 -0.57 -0.14 0.00 -1.71 0.00 0.00 66.02 63.34 3dfy s SER 52 CO 0.45 -0.20 1.31 0.15 1.20 0.00 0.00 173.24 176.16 3dfy h PHE 53 N 8.27 0.78 -0.31 3.44 3.57 -1.83 -1.78 116.94 129.09 3dfy h PHE 53 Ca -0.21 -0.30 -0.05 0.00 3.53 0.00 0.00 57.97 60.94 3dfy h PHE 53 Cb 1.12 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 3dfy h PHE 53 CO 0.44 1.07 0.01 -0.09 -2.23 0.00 0.00 178.31 177.51 3dfy h ARG 54 N 0.28 0.55 0.06 1.11 2.43 -1.93 0.27 114.38 117.14 3dfy h ARG 54 Ca -0.00 -0.17 -0.21 0.00 -0.81 0.00 0.00 59.98 58.78 3dfy h ARG 54 Cb 1.05 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.54 3dfy h ARG 54 CO 0.10 0.68 -1.10 0.28 -1.51 0.00 0.00 179.97 178.41 3dfy h VAL 55 N 0.35 1.14 -0.01 0.20 2.07 -1.98 -3.40 116.25 114.62 3dfy h VAL 55 Ca 0.09 -2.33 0.00 0.00 0.82 0.00 0.00 66.70 65.28 3dfy h VAL 55 Cb 0.43 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 32.89 3dfy h VAL 55 CO 0.01 0.57 -0.44 0.59 0.02 0.00 0.00 177.57 178.33 3dfy n ASN 56 N -4.20 1.48 0.00 0.57 3.02 -0.74 -4.97 115.26 110.41 3dfy n ASN 56 Ca -0.24 -1.24 0.00 0.00 -0.03 0.00 0.00 54.58 53.07 3dfy n ASN 56 Cb 0.76 0.58 0.00 0.00 -0.61 0.00 0.00 39.78 40.51 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 1.22 0.40 3.85 7.41 0.00 0.08 -4.95 105.19 113.21 3dfy n GLY 57 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.50 3.87 -0.03 1.61 2.02 -0.76 -4.83 118.70 120.08 3dfy s GLU 58 Ca 0.00 0.93 0.01 0.00 0.02 0.00 0.00 54.97 55.93 3dfy s GLU 58 Cb 0.00 -2.12 0.02 0.00 0.10 0.00 0.00 34.13 32.12 3dfy s GLU 58 CO 0.00 -0.34 -0.05 1.03 0.02 0.00 0.00 175.26 175.92 3dfy s ARG 59 N -4.25 0.76 0.32 1.61 0.52 -1.26 -2.66 118.95 113.99 3dfy s ARG 59 Ca 0.58 -0.14 0.07 0.00 -0.52 0.00 0.00 55.73 55.72 3dfy s ARG 59 Cb -0.10 -0.76 0.76 0.00 0.52 0.00 0.00 34.95 35.37 3dfy s ARG 59 CO 0.35 -0.02 1.81 -0.24 0.02 0.00 0.00 175.30 177.21 3dfy h VAL 60 N 5.87 0.75 -0.22 3.52 3.04 -1.94 -1.03 116.25 126.25 3dfy h VAL 60 Ca -0.36 -0.26 -0.06 0.00 -1.01 0.00 0.00 66.70 65.01 3dfy h VAL 60 Cb 1.16 -0.07 -0.01 0.00 -2.01 0.00 0.00 31.29 30.36 3dfy h VAL 60 CO 0.48 0.14 -0.12 -0.33 -1.01 0.00 0.00 177.57 176.73 3dfy h GLU 61 N 0.76 0.36 -0.40 4.17 3.07 -1.98 -2.60 114.58 117.96 3dfy h GLU 61 Ca 0.54 -0.09 -0.14 0.00 -0.50 0.00 0.00 59.36 59.17 3dfy h GLU 61 Cb 0.85 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.70 3dfy h GLU 61 CO -0.32 0.50 -0.30 0.00 -1.40 0.00 0.00 179.01 177.49 3dfy h ALA 62 N 1.53 0.71 0.21 3.43 0.00 -1.62 -2.51 119.26 121.02 3dfy h ALA 62 Ca 0.07 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 3dfy h ALA 62 Cb 0.43 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3dfy h ALA 62 CO 0.02 0.66 -0.10 -0.07 0.00 0.00 0.00 179.25 179.77 3dfy h LEU 63 N 0.73 -0.24 -1.61 0.00 4.07 -1.21 -2.77 115.31 114.28 3dfy h LEU 63 Ca 0.08 -0.03 0.11 0.00 0.08 0.00 0.00 57.88 58.12 3dfy h LEU 63 Cb 0.86 0.06 -0.04 0.00 1.08 0.00 0.00 40.66 42.63 3dfy h LEU 63 CO 0.08 -0.13 0.43 -0.07 -1.08 0.00 0.00 178.44 177.67 3dfy h LEU 64 N -0.33 0.39 -1.83 1.67 3.38 -1.46 -2.12 115.31 115.00 3dfy h LEU 64 Ca -0.03 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3dfy h LEU 64 Cb 0.26 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 3dfy h LEU 64 CO 0.05 0.23 -0.03 0.00 0.09 0.00 0.00 178.44 178.78 3dfy h ALA 65 N 1.68 1.03 -0.53 1.53 0.00 -1.15 -2.94 119.26 118.89 3dfy h ALA 65 Ca 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3dfy h ALA 65 Cb 0.59 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3dfy h ALA 65 CO -0.09 0.03 0.00 0.44 0.00 0.00 0.00 179.25 179.64 3dfy n ILE 66 N -3.16 2.33 -0.18 0.00 -5.35 -0.80 -4.62 119.36 107.58 3dfy n ILE 66 Ca -0.00 -1.42 -0.01 0.00 -0.27 0.00 0.00 62.75 61.05 3dfy n ILE 66 Cb 0.26 -0.12 0.07 0.00 -1.74 0.00 0.00 39.64 38.11 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 3.55 0.07 -0.55 6.28 4.81 -1.62 -1.50 114.58 125.62 3dfy h GLU 67 Ca 0.00 -0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.26 3dfy h GLU 67 Cb 1.68 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 31.00 3dfy h GLU 67 CO 0.35 0.05 0.31 -0.91 -0.73 0.00 0.00 179.01 178.07 3dfy h ASN 68 N 0.07 0.48 -0.72 1.04 2.35 -1.87 -0.90 115.58 116.04 3dfy h ASN 68 Ca 0.28 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 56.03 3dfy h ASN 68 Cb 0.45 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 3dfy h ASN 68 CO -0.51 0.33 0.36 0.00 -1.65 0.00 0.00 177.43 175.95 3dfy h ALA 69 N 1.27 0.92 -0.33 -0.83 0.00 -1.69 0.42 119.26 119.02 3dfy h ALA 69 Ca 0.23 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3dfy h ALA 69 Cb 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3dfy h ALA 69 CO -0.13 0.47 0.10 0.28 0.00 0.00 0.00 179.25 179.97 3dfy h VAL 70 N 1.00 1.21 -0.75 0.00 2.07 -0.91 0.37 116.25 119.24 3dfy h VAL 70 Ca 0.25 -0.68 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 3dfy h VAL 70 Cb 0.10 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 3dfy h VAL 70 CO -0.03 0.23 0.35 -0.09 0.02 0.00 0.00 177.57 178.05 3dfy h ARG 71 N 0.38 1.08 -0.57 1.57 2.43 -0.90 -2.36 114.38 116.01 3dfy h ARG 71 Ca 0.11 -0.16 -0.05 0.00 -0.81 0.00 0.00 59.98 59.06 3dfy h ARG 71 Cb 0.26 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 3dfy h ARG 71 CO -0.00 0.85 0.14 1.49 -1.51 0.00 0.00 179.97 180.94 3dfy h GLU 72 N 1.05 0.89 -0.26 0.20 4.22 -0.64 -1.11 114.58 118.93 3dfy h GLU 72 Ca 0.26 -0.18 -0.03 0.00 0.08 0.00 0.00 59.36 59.49 3dfy h GLU 72 Cb 0.13 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3dfy h GLU 72 CO -0.03 0.79 0.05 0.52 -2.18 0.00 0.00 179.01 178.15 3dfy h MET 73 N 0.85 0.37 0.00 1.92 2.86 -0.37 -3.35 114.93 117.21 3dfy h MET 73 Ca 0.19 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3dfy h MET 73 Cb 0.30 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.90 3dfy h MET 73 CO -0.00 0.37 0.00 0.44 1.06 0.00 0.00 176.91 178.78 3dfy n ILE 74 N -4.37 0.00 -1.88 -1.22 -5.35 -1.16 -5.01 119.36 100.37 3dfy n ILE 74 Ca 0.01 -0.32 -0.41 0.00 -0.27 0.00 0.00 62.75 61.76 3dfy n ILE 74 Cb 0.17 1.25 -0.00 0.00 -1.74 0.00 0.00 39.64 39.32 3dfy n ILE 74 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 3dfy s THR 75 N -0.20 2.22 0.00 7.28 2.01 -0.43 -2.26 115.64 124.26 3dfy s THR 75 Ca 0.00 0.22 0.00 0.00 0.31 0.00 0.00 61.69 62.22 3dfy s THR 75 Cb 0.00 -3.14 0.00 0.00 0.01 0.00 0.00 72.50 69.37 3dfy s THR 75 CO 0.00 0.05 0.00 0.61 -0.69 0.00 0.00 174.62 174.59 3dfy n GLY 76 N 0.55 2.09 3.76 4.40 0.00 0.82 -4.95 105.19 111.85 3dfy n GLY 76 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.33 4.73 0.02 -0.61 1.01 -0.96 -4.59 121.20 118.47 3dfy s ILE 77 Ca 0.00 1.51 -0.30 0.00 0.00 0.00 0.00 60.65 61.86 3dfy s ILE 77 Cb 0.00 -4.05 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 3dfy s ILE 77 CO 0.00 0.41 1.11 -0.62 0.00 0.00 0.00 174.94 175.85 3dfy s ASP 78 N -0.31 7.18 0.37 3.58 -1.08 -1.26 -1.11 116.67 124.04 3dfy s ASP 78 Ca 0.35 1.85 0.25 0.00 -0.52 0.00 0.00 52.55 54.48 3dfy s ASP 78 Cb -0.20 -2.57 1.34 0.00 -1.46 0.00 0.00 42.92 40.03 3dfy s ASP 78 CO 0.22 -0.41 1.75 -0.37 0.52 0.00 0.00 175.17 176.88 3dfy h VAL 79 N 4.70 0.00 0.00 1.11 -1.51 -1.95 0.40 116.25 119.00 3dfy h VAL 79 Ca -0.40 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.07 3dfy h VAL 79 Cb 1.21 0.55 0.00 0.00 -2.13 0.00 0.00 31.29 30.91 3dfy h VAL 79 CO 0.80 0.00 0.00 -2.11 -1.23 0.00 0.00 177.57 175.03 3dfy n ARG 80 N -2.37 0.15 -1.79 5.19 1.85 -1.26 -1.90 116.66 116.53 3dfy n ARG 80 Ca -0.02 0.34 -0.33 0.00 -1.00 0.00 0.00 57.85 56.84 3dfy n ARG 80 Cb 0.04 -1.76 0.05 0.00 -1.05 0.00 0.00 32.46 29.74 3dfy n ARG 80 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3dfy n ASN 81 N -2.04 6.69 0.21 2.89 3.02 0.13 -4.80 115.26 121.36 3dfy n ASN 81 Ca 0.03 -3.79 0.18 0.00 -0.03 0.00 0.00 54.58 50.98 3dfy n ASN 81 Cb 0.25 -0.80 0.84 0.00 -0.61 0.00 0.00 39.78 39.45 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 2.39 0.00 0.00 3.10 -0.00 -1.53 -0.48 116.97 120.45 3dfy h TYR 82 Ca 0.51 0.00 -0.05 0.00 0.00 0.00 0.00 58.73 59.19 3dfy h TYR 82 Cb 0.75 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.48 3dfy h TYR 82 CO 1.16 0.00 -0.24 0.00 -0.00 0.00 0.00 178.16 179.08 3dfy h ALA 83 N 1.64 1.49 -0.14 0.10 0.00 -1.88 0.60 119.26 121.07 3dfy h ALA 83 Ca 0.09 -0.22 -0.21 0.00 0.00 0.00 0.00 54.91 54.57 3dfy h ALA 83 Cb 0.62 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3dfy h ALA 83 CO -0.00 0.30 -0.75 0.00 0.00 0.00 0.00 179.25 178.80 3dfy h ARG 84 N 0.00 0.67 -0.49 0.00 3.08 -1.48 -1.17 114.38 114.99 3dfy h ARG 84 Ca -0.00 -0.54 -0.09 0.00 0.07 0.00 0.00 59.98 59.42 3dfy h ARG 84 Cb 0.46 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.60 3dfy h ARG 84 CO 0.03 1.16 -0.07 0.82 -1.07 0.00 0.00 179.97 180.84 3dfy h ILE 85 N 0.46 1.26 -0.28 2.04 2.04 -1.37 -1.62 117.51 120.04 3dfy h ILE 85 Ca -0.04 -1.15 -0.04 0.00 1.00 0.00 0.00 64.86 64.63 3dfy h ILE 85 Cb 1.36 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.38 3dfy h ILE 85 CO 0.15 0.40 0.03 -0.26 0.00 0.00 0.00 178.15 178.47 3dfy h PHE 86 N 0.79 0.51 -0.30 1.37 -1.00 -0.77 -1.05 116.94 116.50 3dfy h PHE 86 Ca 0.14 -0.08 -0.01 0.00 2.81 0.00 0.00 57.97 60.83 3dfy h PHE 86 Cb 0.57 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 39.98 3dfy h PHE 86 CO 0.03 0.59 0.14 1.49 -1.61 0.00 0.00 178.31 178.95 3dfy h GLU 87 N 0.29 0.43 -0.59 1.51 4.81 -1.06 -1.56 114.58 118.40 3dfy h GLU 87 Ca 0.08 -0.07 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 3dfy h GLU 87 Cb 0.37 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 3dfy h GLU 87 CO 0.01 0.42 0.39 0.82 -0.73 0.00 0.00 179.01 179.92 3dfy h ILE 88 N 0.34 1.13 0.00 2.32 2.04 -1.23 -2.25 117.51 119.87 3dfy h ILE 88 Ca 0.10 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.69 3dfy h ILE 88 Cb 0.14 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 3dfy h ILE 88 CO -0.01 0.14 0.00 0.71 0.00 0.00 0.00 178.15 178.99 3dfy h THR 89 N 0.78 0.00 0.00 -0.27 1.35 -0.99 -2.43 112.91 111.35 3dfy h THR 89 Ca 0.22 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.70 3dfy h THR 89 Cb -0.07 1.24 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 3dfy h THR 89 CO -0.06 0.00 0.00 0.44 -0.25 0.00 0.00 175.52 175.65 3dfy h ASP 90 N 0.00 0.00 0.85 5.36 3.32 -0.65 -0.73 116.42 124.57 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 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 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 -2.35 0.15 -1.01 3.56 1.74 -0.92 -3.03 116.66 114.80 3dfy n ARG 91 Ca -0.00 0.31 -0.19 0.00 -0.77 0.00 0.00 57.85 57.20 3dfy n ARG 91 Cb 0.11 -1.75 0.02 0.00 -1.02 0.00 0.00 32.46 29.82 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 -2.03 6.55 0.11 0.55 4.77 -0.28 -4.52 117.00 122.15 3dfy n LEU 92 Ca 0.03 -3.48 0.10 0.00 -0.03 0.00 0.00 56.01 52.63 3dfy n LEU 92 Cb 0.27 -1.08 0.45 0.00 -2.33 0.00 0.00 43.42 40.73 3dfy n LEU 92 CO 0.21 1.32 0.80 2.22 -1.33 0.00 0.00 177.39 180.61 3dfy n PHE 93 N 0.37 0.61 1.08 -1.77 1.16 -1.17 -0.46 117.46 117.27 3dfy n PHE 93 Ca 0.35 0.27 0.12 0.00 -1.87 0.00 0.00 57.45 56.32 3dfy n PHE 93 Cb 0.58 -0.93 0.24 0.00 -1.61 0.00 0.00 39.48 37.75 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 -0.55 -0.95 2.51 4.97 0.00 -1.26 -4.10 105.19 105.80 3dfy n GLY 94 Ca 0.01 -0.41 -0.18 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.15 1.64 -0.29 1.61 3.72 0.39 -4.77 117.46 118.60 3dfy n PHE 95 Ca 0.08 -3.45 0.10 0.00 -0.05 0.00 0.00 57.45 54.12 3dfy n PHE 95 Cb 0.35 -0.37 0.26 0.00 -0.94 0.00 0.00 39.48 38.77 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 2.94 0.47 -0.41 -1.08 0.13 -1.65 -0.54 132.00 131.86 3dfy h PRO 96 Ca 0.08 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 65.16 3dfy h PRO 96 Cb 0.94 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 31.94 3dfy h PRO 96 CO 0.61 0.31 0.17 0.66 -0.23 0.00 0.00 178.00 179.52 3dfy h SER 97 N 0.48 0.51 0.28 1.44 4.64 -1.80 0.17 113.55 119.27 3dfy h SER 97 Ca 0.50 -0.05 -0.21 0.00 -0.47 0.00 0.00 61.79 61.56 3dfy h SER 97 Cb 0.85 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3dfy h SER 97 CO -0.45 0.46 -0.87 0.25 -0.87 0.00 0.00 176.83 175.35 3dfy h LEU 98 N 0.57 0.55 -0.53 5.97 5.85 -1.51 -1.00 115.31 125.21 3dfy h LEU 98 Ca 0.14 -0.41 0.05 0.00 0.84 0.00 0.00 57.88 58.50 3dfy h LEU 98 Cb 0.11 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.93 3dfy h LEU 98 CO -0.02 1.19 0.27 0.50 -0.34 0.00 0.00 178.44 180.05 3dfy h LYS 99 N 0.27 0.51 -0.08 1.25 3.64 -0.03 -0.30 116.57 121.83 3dfy h LYS 99 Ca -0.06 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 3dfy h LYS 99 Cb 1.49 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 33.19 3dfy h LYS 99 CO 0.15 0.34 0.02 0.00 -2.27 0.00 0.00 179.45 177.69 3dfy h ALA 100 N 1.28 0.11 -0.15 5.00 0.00 -0.57 -2.08 119.26 122.85 3dfy h ALA 100 Ca 0.23 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.04 3dfy h ALA 100 Cb 0.13 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3dfy h ALA 100 CO -0.16 -0.26 -0.08 0.00 0.00 0.00 0.00 179.25 178.76 3dfy h ALA 101 N 0.80 0.05 -0.56 0.00 0.00 -0.73 -0.34 119.26 118.48 3dfy h ALA 101 Ca 0.03 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3dfy h ALA 101 Cb 0.25 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3dfy h ALA 101 CO 0.00 -0.52 0.12 0.28 0.00 0.00 0.00 179.25 179.14 3dfy h VAL 102 N -0.06 1.25 -0.57 0.00 2.07 -1.08 -1.24 116.25 116.61 3dfy h VAL 102 Ca 0.08 -0.90 -0.07 0.00 0.82 0.00 0.00 66.70 66.63 3dfy h VAL 102 Cb 0.19 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 3dfy h VAL 102 CO -0.19 0.33 0.08 1.56 0.02 0.00 0.00 177.57 179.37 3dfy h GLN 103 N 0.80 0.95 -0.17 1.57 4.20 -1.16 -1.46 115.11 119.83 3dfy h GLN 103 Ca 0.17 -0.26 -0.16 0.00 0.06 0.00 0.00 58.65 58.46 3dfy h GLN 103 Cb 0.36 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 3dfy h GLN 103 CO 0.00 0.91 -0.55 0.35 -0.67 0.00 0.00 178.83 178.88 3dfy h PHE 104 N 0.85 0.65 -0.36 2.96 3.57 -0.93 -2.57 116.94 121.10 3dfy h PHE 104 Ca 0.17 -0.23 -0.03 0.00 3.53 0.00 0.00 57.97 61.41 3dfy h PHE 104 Cb 0.43 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 3dfy h PHE 104 CO 0.03 0.95 0.11 0.00 -2.23 0.00 0.00 178.31 177.17 3dfy h ALA 105 N 1.00 1.51 -0.49 2.41 0.00 -1.06 0.15 119.26 122.78 3dfy h ALA 105 Ca 0.01 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 3dfy h ALA 105 Cb 1.09 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3dfy h ALA 105 CO 0.10 0.37 0.11 1.15 0.00 0.00 0.00 179.25 180.98 3dfy h THR 106 N 0.51 1.24 -0.13 0.00 2.02 -0.96 -1.03 112.91 114.57 3dfy h THR 106 Ca 0.12 -0.86 -0.13 0.00 0.77 0.00 0.00 66.41 66.32 3dfy h THR 106 Cb 0.17 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 3dfy h THR 106 CO -0.01 0.31 -0.47 -0.07 0.37 0.00 0.00 175.52 175.65 3dfy h LEU 107 N 0.67 0.36 -0.58 2.58 3.38 -0.94 -0.30 115.31 120.48 3dfy h LEU 107 Ca 0.15 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 3dfy h LEU 107 Cb 0.34 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3dfy h LEU 107 CO 0.00 0.78 0.03 -0.78 0.09 0.00 0.00 178.44 178.56 3dfy h ASP 108 N 0.27 0.98 -0.13 -0.43 3.58 -0.52 -0.59 116.42 119.58 3dfy h ASP 108 Ca 0.02 -0.29 -0.07 0.00 0.42 0.00 0.00 57.03 57.10 3dfy h ASP 108 Cb 0.94 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.72 3dfy h ASP 108 CO 0.08 1.03 -0.20 0.00 -2.88 0.00 0.00 179.24 177.27 3dfy h ALA 109 N 0.98 0.19 -0.22 -0.78 0.00 -1.03 -3.03 119.26 115.37 3dfy h ALA 109 Ca 0.17 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.73 3dfy h ALA 109 Cb 0.51 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3dfy h ALA 109 CO 0.02 0.13 0.12 1.25 0.00 0.00 0.00 179.25 180.77 3dfy h LEU 110 N -0.05 0.18 -1.65 0.00 5.85 -0.96 -2.51 115.31 116.17 3dfy h LEU 110 Ca 0.01 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3dfy h LEU 110 Cb 0.76 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 3dfy h LEU 110 CO 0.05 0.14 0.21 0.77 -0.34 0.00 0.00 178.44 179.26 3dfy h SER 111 N 0.24 0.39 -0.44 1.25 4.64 -1.17 -0.58 113.55 117.89 3dfy h SER 111 Ca 0.09 -0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.30 3dfy h SER 111 Cb 0.01 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3dfy h SER 111 CO -0.05 0.29 -0.08 1.56 -0.87 0.00 0.00 176.83 177.67 3dfy h GLN 112 N 0.46 0.84 0.00 4.77 4.20 -1.33 0.17 115.11 124.21 3dfy h GLN 112 Ca 0.12 -0.31 -0.04 0.00 0.06 0.00 0.00 58.65 58.49 3dfy h GLN 112 Cb -0.03 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 3dfy h GLN 112 CO -0.02 0.94 -0.17 0.93 -0.67 0.00 0.00 178.83 179.83 3dfy h GLU 113 N 0.67 0.00 -0.01 1.46 5.08 -0.93 -2.15 114.58 118.70 3dfy h GLU 113 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3dfy h GLU 113 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3dfy h GLU 113 CO 0.04 0.17 -0.24 1.28 -1.00 0.00 0.00 179.01 179.26 3dfy n LEU 114 N -3.44 0.94 -0.50 1.33 4.77 -0.30 -4.95 117.00 114.84 3dfy n LEU 114 Ca -0.01 -0.22 -0.05 0.00 -0.03 0.00 0.00 56.01 55.71 3dfy n LEU 114 Cb 0.35 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 41.30 3dfy n LEU 114 CO 0.31 0.18 -0.06 0.61 -1.33 0.00 0.00 177.39 177.10 3dfy n GLY 115 N 1.34 0.28 0.00 -0.72 0.00 -0.30 -5.02 105.19 100.77 3dfy n GLY 115 Ca 0.12 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.79 0.00 -4.38 2.61 5.66 0.43 -5.02 114.28 109.79 3dfy n THR 116 Ca -0.05 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.69 3dfy n THR 116 Cb 0.47 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.15 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 -0.14 1.83 0.20 1.09 -0.21 -1.26 -4.04 119.66 117.12 3dfy s GLN 117 Ca 0.00 -1.50 -0.11 0.00 0.02 0.00 0.00 55.36 53.77 3dfy s GLN 117 Cb 0.00 -1.96 0.23 0.00 1.00 0.00 0.00 33.01 32.28 3dfy s GLN 117 CO 0.00 0.39 1.73 0.28 -2.12 0.00 0.00 175.29 175.57 3dfy h VAL 118 N 2.65 0.76 -0.96 1.09 2.07 -1.93 -1.77 116.25 118.16 3dfy h VAL 118 Ca -0.45 -0.11 0.11 0.00 0.82 0.00 0.00 66.70 67.07 3dfy h VAL 118 Cb 1.23 0.40 -0.08 0.00 -1.52 0.00 0.00 31.29 31.31 3dfy h VAL 118 CO 0.55 0.06 0.60 0.00 0.02 0.00 0.00 177.57 178.79 3dfy h TYR 120 N 0.95 0.81 -0.43 0.00 0.05 -1.70 0.12 116.97 116.77 3dfy h TYR 120 Ca 0.47 -0.28 0.02 0.00 0.05 0.00 0.00 58.73 58.99 3dfy h TYR 120 Cb 0.45 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 38.01 3dfy h TYR 120 CO -0.02 1.04 0.28 1.25 -1.05 0.00 0.00 178.16 179.67 3dfy h LEU 121 N 0.50 0.43 -1.60 3.88 5.85 -0.40 -1.25 115.31 122.71 3dfy h LEU 121 Ca 0.01 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3dfy h LEU 121 Cb 1.09 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.02 3dfy h LEU 121 CO 0.11 0.30 0.00 0.18 -0.34 0.00 0.00 178.44 178.69 3dfy n LEU 122 N -4.48 2.35 0.00 2.25 4.77 -0.50 -4.89 117.00 116.50 3dfy n LEU 122 Ca 0.04 -1.18 0.00 0.00 -0.03 0.00 0.00 56.01 54.84 3dfy n LEU 122 Cb 0.12 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 3dfy n LEU 122 CO 0.35 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.52 3dfy n GLY 123 N 0.94 0.92 3.75 -0.72 0.00 -0.47 -3.71 105.19 105.90 3dfy n GLY 123 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.48 0.22 -0.02 0.00 0.39 -4.87 105.19 100.41 3dfy n GLY 124 Ca 0.00 0.14 -0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.52 0.69 -6.15 1.61 1.63 -1.17 -3.45 116.57 108.21 3dfy h LYS 125 Ca -0.53 -0.06 -0.57 0.00 -0.85 0.00 0.00 60.65 58.65 3dfy h LYS 125 Cb 1.35 -0.15 -0.18 0.00 -0.60 0.00 0.00 32.23 32.65 3dfy h LYS 125 CO 0.64 0.49 -0.80 1.03 -3.45 0.00 0.00 179.45 177.37 3dfy s ARG 126 N -6.04 1.35 -0.00 1.90 0.52 -0.56 -4.97 118.95 111.16 3dfy s ARG 126 Ca -0.13 -1.45 0.16 0.00 -0.52 0.00 0.00 55.73 53.80 3dfy s ARG 126 Cb 0.12 -1.50 -0.19 0.00 0.52 0.00 0.00 34.95 33.90 3dfy s ARG 126 CO 0.75 0.31 0.64 -0.25 0.02 0.00 0.00 175.30 176.77 3dfy n ASP 127 N 0.28 0.83 -3.75 0.23 8.00 -1.26 -4.63 116.55 116.26 3dfy n ASP 127 Ca -0.13 -0.75 -0.13 0.00 0.71 0.00 0.00 54.79 54.49 3dfy n ASP 127 Cb 0.57 1.12 -0.09 0.00 -0.02 0.00 0.00 41.12 42.69 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 -2.63 0.57 0.17 -1.24 2.12 -1.26 -3.57 118.70 112.85 3dfy s GLU 128 Ca 0.04 0.16 0.02 0.00 0.36 0.00 0.00 54.97 55.55 3dfy s GLU 128 Cb 0.12 0.26 -0.05 0.00 0.26 0.00 0.00 34.13 34.73 3dfy s GLU 128 CO 0.67 -0.13 0.00 0.96 -0.54 0.00 0.00 175.26 176.23 3dfy s ILE 129 N -0.60 0.64 -0.05 -3.70 -4.36 -0.23 -4.98 121.20 107.92 3dfy s ILE 129 Ca -0.07 -1.97 0.04 0.00 -0.26 0.00 0.00 60.65 58.38 3dfy s ILE 129 Cb -0.04 -2.10 0.00 0.00 1.25 0.00 0.00 42.46 41.58 3dfy s ILE 129 CO 0.03 -0.49 -0.15 -0.70 0.24 0.00 0.00 174.94 173.86 3dfy s GLU 130 N -3.92 1.70 0.16 0.37 2.12 -1.26 -0.84 118.70 117.03 3dfy s GLU 130 Ca 0.23 -0.53 0.06 0.00 0.36 0.00 0.00 54.97 55.09 3dfy s GLU 130 Cb 0.06 -1.46 -0.04 0.00 0.26 0.00 0.00 34.13 32.95 3dfy s GLU 130 CO 0.03 0.17 0.06 -0.08 -0.54 0.00 0.00 175.26 174.90 3dfy s THR 131 N 0.22 4.07 0.42 -1.70 -1.32 0.32 -3.82 115.64 113.83 3dfy s THR 131 Ca -0.07 -1.24 -0.03 0.00 -1.21 0.00 0.00 61.69 59.14 3dfy s THR 131 Cb -0.12 -3.05 0.09 0.00 -1.51 0.00 0.00 72.50 67.90 3dfy s THR 131 CO 0.03 -0.09 0.57 -0.90 -2.21 0.00 0.00 174.62 172.02 3dfy n ASP 132 N -0.14 0.48 -3.98 8.08 5.68 -0.29 -4.75 116.55 121.62 3dfy n ASP 132 Ca -0.09 -1.47 -0.09 0.00 -0.50 0.00 0.00 54.79 52.63 3dfy n ASP 132 Cb 0.55 -0.40 -0.11 0.00 -1.14 0.00 0.00 41.12 40.02 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 -4.03 0.33 -0.03 0.11 2.20 -1.16 -4.50 119.74 112.66 3dfy s LYS 133 Ca 0.36 -0.62 -0.07 0.00 -0.36 0.00 0.00 55.97 55.28 3dfy s LYS 133 Cb -0.02 0.12 -0.04 0.00 -1.51 0.00 0.00 37.83 36.38 3dfy s LYS 133 CO 0.24 -0.05 0.23 0.99 -0.36 0.00 0.00 175.35 176.40 3dfy s THR 134 N -1.55 5.36 -0.41 3.43 2.01 -1.26 -1.26 115.64 121.96 3dfy s THR 134 Ca -0.15 0.19 -0.05 0.00 0.31 0.00 0.00 61.69 61.99 3dfy s THR 134 Cb -0.09 -3.53 0.10 0.00 0.01 0.00 0.00 72.50 68.99 3dfy s THR 134 CO -0.01 0.45 0.22 -0.69 -0.69 0.00 0.00 174.62 173.90 3dfy s VAL 135 N -1.21 3.56 1.10 3.82 1.01 0.69 -4.95 120.40 124.42 3dfy s VAL 135 Ca 0.24 -1.87 -0.17 0.00 0.00 0.00 0.00 61.98 60.18 3dfy s VAL 135 Cb -0.13 -3.36 0.24 0.00 0.00 0.00 0.00 36.38 33.14 3dfy s VAL 135 CO 0.13 -0.64 1.16 -0.83 0.00 0.00 0.00 175.10 174.92 3dfy s GLY 136 N 1.98 1.63 0.09 4.51 0.00 -1.26 -2.05 107.32 112.22 3dfy s GLY 136 Ca 0.06 -0.93 -0.31 0.00 0.00 0.00 0.00 44.72 43.55 3dfy s GLY 136 CO -0.02 -0.12 1.35 -0.42 0.00 0.00 0.00 173.10 173.88 3dfy s ILE 137 N -3.25 3.52 0.11 0.90 1.01 -1.26 -4.78 121.20 117.45 3dfy s ILE 137 Ca 0.70 1.07 -0.23 0.00 0.00 0.00 0.00 60.65 62.20 3dfy s ILE 137 Cb -0.09 -3.69 0.08 0.00 0.01 0.00 0.00 42.46 38.77 3dfy s ILE 137 CO 0.55 0.07 1.06 -0.67 0.00 0.00 0.00 174.94 175.96 3dfy n ASP 138 N 4.15 -1.47 -4.72 3.58 -0.08 -1.26 -5.06 116.55 111.69 3dfy n ASP 138 Ca 0.11 -1.65 -0.34 0.00 -1.51 0.00 0.00 54.79 51.40 3dfy n ASP 138 Cb 0.43 2.36 0.09 0.00 2.34 0.00 0.00 41.12 46.35 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 -2.06 2.25 0.26 5.18 -4.23 -1.26 -4.67 115.64 111.11 3dfy s THR 139 Ca 0.24 0.12 -0.01 0.00 -1.18 0.00 0.00 61.69 60.86 3dfy s THR 139 Cb -0.02 -2.73 0.24 0.00 1.34 0.00 0.00 72.50 71.34 3dfy s THR 139 CO 0.03 -0.06 1.78 0.58 -0.54 0.00 0.00 174.62 176.41 3dfy h VAL 140 N -0.26 0.79 -0.12 2.29 2.07 -1.98 0.16 116.25 119.20 3dfy h VAL 140 Ca -0.48 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 66.82 3dfy h VAL 140 Cb 1.30 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 3dfy h VAL 140 CO 0.50 0.13 0.01 1.05 0.02 0.00 0.00 177.57 179.28 3dfy h GLU 141 N 0.70 0.05 -0.26 1.57 9.09 -1.99 0.65 114.58 124.39 3dfy h GLU 141 Ca 0.46 -0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.78 3dfy h GLU 141 Cb 0.59 -0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 27.66 3dfy h GLU 141 CO -0.33 0.04 -0.20 -0.91 0.05 0.00 0.00 179.01 177.66 3dfy h ASN 142 N 0.06 0.48 -0.37 3.06 2.35 -1.64 -1.75 115.58 117.76 3dfy h ASN 142 Ca 0.05 -0.15 -0.03 0.00 -0.55 0.00 0.00 56.30 55.63 3dfy h ASN 142 Cb 0.05 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 3dfy h ASN 142 CO -0.08 0.69 0.12 0.03 -1.65 0.00 0.00 177.43 176.54 3dfy h ARG 143 N 0.43 0.58 -0.22 0.81 3.08 -0.23 -1.04 114.38 117.80 3dfy h ARG 143 Ca 0.07 -0.12 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 3dfy h ARG 143 Cb 0.60 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 3dfy h ARG 143 CO 0.04 0.59 -0.17 0.28 -1.07 0.00 0.00 179.97 179.65 3dfy h VAL 144 N 0.46 1.22 -0.10 2.04 2.07 -0.68 -1.78 116.25 119.47 3dfy h VAL 144 Ca 0.12 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 3dfy h VAL 144 Cb 0.25 1.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 3dfy h VAL 144 CO -0.00 0.32 -0.01 0.50 0.02 0.00 0.00 177.57 178.39 3dfy h LYS 145 N 0.34 0.20 -0.40 1.57 1.63 -0.98 -1.05 116.57 117.88 3dfy h LYS 145 Ca 0.06 -0.07 0.05 0.00 -0.85 0.00 0.00 60.65 59.84 3dfy h LYS 145 Cb 0.50 -0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.07 3dfy h LYS 145 CO 0.03 0.48 0.14 0.93 -3.45 0.00 0.00 179.45 177.58 3dfy h GLU 146 N -0.11 0.29 -0.15 1.90 5.08 -0.97 -1.58 114.58 119.05 3dfy h GLU 146 Ca 0.03 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.39 3dfy h GLU 146 Cb 0.40 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 3dfy h GLU 146 CO 0.01 0.19 0.00 0.00 -1.00 0.00 0.00 179.01 178.21 3dfy h ALA 147 N 1.26 0.13 -0.64 3.43 0.00 -1.23 0.10 119.26 122.31 3dfy h ALA 147 Ca 0.18 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.17 3dfy h ALA 147 Cb 0.17 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 3dfy h ALA 147 CO -0.19 -0.44 0.39 0.87 0.00 0.00 0.00 179.25 179.88 3dfy h LYS 148 N 0.05 0.75 -0.08 0.00 1.57 -0.82 0.21 116.57 118.24 3dfy h LYS 148 Ca 0.07 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 3dfy h LYS 148 Cb 0.08 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 3dfy h LYS 148 CO -0.12 0.49 0.03 -0.22 -0.57 0.00 0.00 179.45 179.06 3dfy h LYS 149 N 0.77 0.13 -0.59 3.15 3.64 -0.94 -0.26 116.57 122.47 3dfy h LYS 149 Ca 0.26 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.65 3dfy h LYS 149 Cb 0.04 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 3dfy h LYS 149 CO -0.11 0.28 0.35 0.82 -2.27 0.00 0.00 179.45 178.52 3dfy h ILE 150 N -0.05 1.05 -0.48 2.00 2.04 -0.45 -1.04 117.51 120.59 3dfy h ILE 150 Ca 0.03 -0.24 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 3dfy h ILE 150 Cb 0.21 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 3dfy h ILE 150 CO -0.00 0.13 0.25 0.15 0.00 0.00 0.00 178.15 178.68 3dfy h PHE 151 N 0.69 0.66 0.00 1.37 3.57 -0.45 -2.14 116.94 120.65 3dfy h PHE 151 Ca 0.24 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 3dfy h PHE 151 Cb 0.04 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 38.57 3dfy h PHE 151 CO -0.06 0.51 -0.12 1.49 -2.23 0.00 0.00 178.31 177.89 3dfy h GLU 152 N 0.63 0.00 0.00 1.11 4.81 -0.45 -0.07 114.58 120.61 3dfy h GLU 152 Ca 0.17 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 3dfy h GLU 152 Cb 0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.45 3dfy h GLU 152 CO -0.02 0.12 0.00 0.39 -0.73 0.00 0.00 179.01 178.77 3dfy n GLU 153 N -4.02 0.46 -0.01 1.92 1.02 -0.45 -4.87 120.64 114.70 3dfy n GLU 153 Ca -0.02 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 3dfy n GLU 153 Cb 0.21 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.13 3dfy n GLU 153 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dfy n GLY 154 N 0.63 0.40 3.71 0.62 0.00 -0.04 -4.74 105.19 105.77 3dfy n GLY 154 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.01 3.16 -1.07 1.61 0.08 -1.11 -4.82 117.98 113.82 3dfy s PHE 155 Ca 0.00 0.89 0.09 0.00 0.12 0.00 0.00 56.93 58.03 3dfy s PHE 155 Cb 0.00 -3.71 0.12 0.00 -0.57 0.00 0.00 43.02 38.86 3dfy s PHE 155 CO 0.00 -2.52 0.90 0.54 -0.10 0.00 0.00 175.22 174.04 3dfy n ARG 156 N 4.14 0.93 -4.27 0.44 5.12 -1.26 -4.49 116.66 117.28 3dfy n ARG 156 Ca 0.12 -1.28 -0.27 0.00 -1.93 0.00 0.00 57.85 54.49 3dfy n ARG 156 Cb 0.42 -1.19 -0.17 0.00 -1.16 0.00 0.00 32.46 30.36 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 -0.83 1.29 -0.09 1.55 1.01 -1.26 -0.37 120.40 121.69 3dfy s VAL 157 Ca 0.13 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.62 3dfy s VAL 157 Cb 0.08 -1.22 0.01 0.00 0.00 0.00 0.00 36.38 35.26 3dfy s VAL 157 CO 0.12 0.40 -0.14 -0.63 0.00 0.00 0.00 175.10 174.86 3dfy s ILE 158 N 1.19 1.35 -0.21 2.22 1.01 -0.10 -2.97 121.20 123.69 3dfy s ILE 158 Ca -0.03 -0.56 -0.16 0.00 0.00 0.00 0.00 60.65 59.89 3dfy s ILE 158 Cb -0.14 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 3dfy s ILE 158 CO -0.04 0.41 0.41 -0.75 0.00 0.00 0.00 174.94 174.97 3dfy s LYS 159 N 0.94 4.15 -0.24 2.79 2.20 -0.39 -1.97 119.74 127.22 3dfy s LYS 159 Ca -0.08 0.20 -0.05 0.00 -0.36 0.00 0.00 55.97 55.68 3dfy s LYS 159 Cb -0.15 -3.56 -0.01 0.00 -1.51 0.00 0.00 37.83 32.60 3dfy s LYS 159 CO -0.00 -0.09 0.01 0.42 -0.36 0.00 0.00 175.35 175.33 3dfy s ILE 160 N 1.48 3.78 0.03 5.43 1.01 0.11 -0.23 121.20 132.81 3dfy s ILE 160 Ca 0.19 -0.40 -0.24 0.00 0.00 0.00 0.00 60.65 60.20 3dfy s ILE 160 Cb -0.15 -2.77 -0.05 0.00 0.01 0.00 0.00 42.46 39.50 3dfy s ILE 160 CO 0.08 0.35 0.73 -0.54 0.00 0.00 0.00 174.94 175.57 3dfy s LYS 161 N 1.53 4.46 0.00 2.79 1.02 -0.87 -1.48 119.74 127.19 3dfy s LYS 161 Ca 0.06 1.00 0.00 0.00 0.02 0.00 0.00 55.97 57.05 3dfy s LYS 161 Cb -0.15 -3.36 0.00 0.00 -0.52 0.00 0.00 37.83 33.80 3dfy s LYS 161 CO -0.00 0.29 0.00 1.33 -0.92 0.00 0.00 175.35 176.04 3dfy n VAL 162 N 2.84 0.00 0.00 3.17 0.24 -0.32 -4.44 118.33 119.82 3dfy n VAL 162 Ca -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 3dfy n VAL 162 Cb 0.50 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.87 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 0.00 1.96 0.04 7.63 0.00 -1.26 -4.15 105.19 109.41 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 -0.03 0.65 -3.29 1.61 1.02 -1.26 -4.29 120.64 115.05 3dfy n GLU 164 Ca 0.00 -0.11 -0.08 0.00 -0.02 0.00 0.00 57.16 56.95 3dfy n GLU 164 Cb 0.00 -1.59 -0.05 0.00 -0.02 0.00 0.00 31.44 29.78 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 -4.78 0.07 0.19 1.62 3.84 -1.26 -5.06 114.94 109.56 3dfy s ASN 165 Ca -0.06 -0.60 -0.21 0.00 0.21 0.00 0.00 52.86 52.20 3dfy s ASN 165 Cb 0.13 1.21 0.13 0.00 -0.55 0.00 0.00 41.25 42.17 3dfy s ASN 165 CO 0.88 -0.31 1.58 0.25 -2.79 0.00 0.00 177.10 176.71 3dfy h LEU 166 N 7.79 -1.19 -0.07 3.21 5.85 -1.98 0.31 115.31 129.22 3dfy h LEU 166 Ca -0.03 0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.94 3dfy h LEU 166 Cb 1.12 0.60 -0.02 0.00 0.37 0.00 0.00 40.66 42.73 3dfy h LEU 166 CO 0.22 -0.30 -0.05 0.50 -0.34 0.00 0.00 178.44 178.47 3dfy h LYS 167 N -0.15 -0.05 -0.32 1.25 3.64 -2.00 -1.63 116.57 117.30 3dfy h LYS 167 Ca 0.24 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.55 3dfy h LYS 167 Cb 0.56 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 3dfy h LYS 167 CO -0.71 -0.03 -0.11 0.93 -2.27 0.00 0.00 179.45 177.26 3dfy h GLU 168 N -0.05 0.55 -0.46 1.90 5.08 -1.84 -2.63 114.58 117.13 3dfy h GLU 168 Ca 0.04 -0.16 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 3dfy h GLU 168 Cb 0.12 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 3dfy h GLU 168 CO -0.10 0.65 0.06 -0.44 -1.00 0.00 0.00 179.01 178.18 3dfy h ASP 169 N 0.51 0.74 -0.48 1.42 3.32 -0.02 0.38 116.42 122.28 3dfy h ASP 169 Ca 0.09 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 56.87 3dfy h ASP 169 Cb 0.49 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 3dfy h ASP 169 CO 0.03 0.82 0.29 0.40 -1.72 0.00 0.00 179.24 179.06 3dfy h ILE 170 N 0.63 1.16 -0.41 0.35 2.04 -1.22 -0.99 117.51 119.07 3dfy h ILE 170 Ca 0.14 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.63 3dfy h ILE 170 Cb 0.41 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 3dfy h ILE 170 CO 0.01 0.16 0.25 -0.08 0.00 0.00 0.00 178.15 178.50 3dfy h GLU 171 N 0.65 0.54 -0.73 2.37 4.81 -1.13 -2.03 114.58 119.06 3dfy h GLU 171 Ca 0.17 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3dfy h GLU 171 Cb 0.01 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.24 3dfy h GLU 171 CO -0.03 0.39 0.46 0.00 -0.73 0.00 0.00 179.01 179.10 3dfy h ALA 172 N 1.12 0.93 -0.40 2.92 0.00 0.14 -1.45 119.26 122.52 3dfy h ALA 172 Ca 0.15 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3dfy h ALA 172 Cb -0.02 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 3dfy h ALA 172 CO -0.03 0.37 0.18 0.28 0.00 0.00 0.00 179.25 180.06 3dfy h VAL 173 N 0.99 1.18 -0.23 0.00 2.07 -0.92 -0.81 116.25 118.54 3dfy h VAL 173 Ca 0.26 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 3dfy h VAL 173 Cb -0.07 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 3dfy h VAL 173 CO -0.05 0.20 0.13 -0.08 0.02 0.00 0.00 177.57 177.79 3dfy h GLU 174 N 0.51 0.32 -0.64 1.57 4.81 -1.06 -0.44 114.58 119.65 3dfy h GLU 174 Ca 0.14 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3dfy h GLU 174 Cb 0.15 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 3dfy h GLU 174 CO -0.01 0.28 0.39 0.93 -0.73 0.00 0.00 179.01 179.87 3dfy h GLU 175 N 0.27 0.86 -0.70 1.92 4.39 -1.15 -1.21 114.58 118.96 3dfy h GLU 175 Ca 0.08 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 59.66 3dfy h GLU 175 Cb 0.05 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.49 3dfy h GLU 175 CO -0.01 0.61 0.25 0.82 -1.16 0.00 0.00 179.01 179.52 3dfy h ILE 176 N 0.86 1.25 -0.91 3.13 2.04 -0.95 -2.73 117.51 120.21 3dfy h ILE 176 Ca 0.23 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 65.25 3dfy h ILE 176 Cb -0.04 0.47 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 3dfy h ILE 176 CO -0.04 0.33 0.50 0.00 0.00 0.00 0.00 178.15 178.93 3dfy h ALA 177 N 1.12 1.17 -0.70 1.87 0.00 -0.62 -2.76 119.26 119.33 3dfy h ALA 177 Ca 0.23 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.06 3dfy h ALA 177 Cb 0.25 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 3dfy h ALA 177 CO -0.01 0.67 0.46 0.87 0.00 0.00 0.00 179.25 181.24 3dfy h LYS 178 N 1.27 0.76 -0.70 0.00 1.57 -0.91 -2.78 116.57 115.77 3dfy h LYS 178 Ca 0.32 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3dfy h LYS 178 Cb 0.02 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.16 3dfy h LYS 178 CO -0.05 0.50 0.00 1.33 -0.57 0.00 0.00 179.45 180.66 3dfy n VAL 179 N -4.47 0.96 -2.59 0.50 0.24 -1.06 -4.45 118.33 107.46 3dfy n VAL 179 Ca 0.10 -0.98 -0.04 0.00 -2.04 0.00 0.00 64.34 61.38 3dfy n VAL 179 Cb 0.18 0.54 0.05 0.00 -1.47 0.00 0.00 33.84 33.14 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 1.62 1.38 -1.66 3.34 -2.24 -1.05 -4.73 114.28 110.95 3dfy n THR 180 Ca 0.24 -2.92 -0.50 0.00 -2.27 0.00 0.00 64.05 58.59 3dfy n THR 180 Cb 0.62 0.73 -0.05 0.00 -2.10 0.00 0.00 70.33 69.53 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 -0.49 1.70 0.00 -0.78 1.74 -1.23 -1.55 116.66 116.05 3dfy n ARG 181 Ca 0.14 0.62 0.00 0.00 -0.77 0.00 0.00 57.85 57.84 3dfy n ARG 181 Cb 0.88 -2.35 0.00 0.00 -1.02 0.00 0.00 32.46 29.96 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 3.54 1.10 3.92 -0.13 0.00 -1.26 -5.09 105.19 107.27 3dfy n GLY 182 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.09 3.77 0.13 4.61 0.00 -0.59 -4.97 121.76 122.62 3dfy s ALA 183 Ca 0.00 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.21 3dfy s ALA 183 Cb 0.00 -2.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.01 3dfy s ALA 183 CO 0.00 0.35 0.23 0.15 0.00 0.00 0.00 175.76 176.49 3dfy s LYS 184 N -3.47 3.32 -0.02 0.00 1.02 0.50 -4.97 119.74 116.12 3dfy s LYS 184 Ca 0.40 -0.62 0.06 0.00 0.02 0.00 0.00 55.97 55.83 3dfy s LYS 184 Cb -0.11 -2.91 -0.02 0.00 -0.52 0.00 0.00 37.83 34.27 3dfy s LYS 184 CO 0.30 0.53 -0.21 0.71 -0.92 0.00 0.00 175.35 175.76 3dfy s TYR 185 N -1.68 1.86 -0.16 3.18 2.02 -1.26 -0.93 117.35 120.38 3dfy s TYR 185 Ca 0.34 -0.36 0.02 0.00 -0.37 0.00 0.00 57.07 56.70 3dfy s TYR 185 Cb -0.11 -1.20 0.01 0.00 -0.40 0.00 0.00 41.96 40.26 3dfy s TYR 185 CO 0.27 -0.03 -0.21 0.42 -1.57 0.00 0.00 175.55 174.43 3dfy s ILE 186 N -0.48 2.03 -0.18 2.71 1.01 -0.83 0.09 121.20 125.55 3dfy s ILE 186 Ca 0.08 -0.94 -0.04 0.00 0.00 0.00 0.00 60.65 59.75 3dfy s ILE 186 Cb -0.08 -1.81 -0.02 0.00 0.01 0.00 0.00 42.46 40.55 3dfy s ILE 186 CO -0.01 0.54 -0.03 -0.69 0.00 0.00 0.00 174.94 174.75 3dfy s VAL 187 N 1.04 3.82 -0.30 2.92 1.01 -0.16 0.09 120.40 128.83 3dfy s VAL 187 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.60 3dfy s VAL 187 Cb -0.14 -2.70 0.06 0.00 0.00 0.00 0.00 36.38 33.60 3dfy s VAL 187 CO -0.07 0.46 -0.02 -0.62 0.00 0.00 0.00 175.10 174.85 3dfy s ASP 188 N 0.71 4.76 0.00 3.32 -1.08 -0.55 0.48 116.67 124.31 3dfy s ASP 188 Ca -0.01 -1.40 0.28 0.00 -0.52 0.00 0.00 52.55 50.90 3dfy s ASP 188 Cb -0.14 -1.66 1.16 0.00 -1.46 0.00 0.00 42.92 40.82 3dfy s ASP 188 CO 0.02 -0.26 1.81 0.00 0.52 0.00 0.00 175.17 177.26 3dfy n ALA 189 N 4.54 2.74 -4.26 3.66 0.00 -0.99 -1.17 120.51 125.03 3dfy n ALA 189 Ca -0.12 -0.36 -0.31 0.00 0.00 0.00 0.00 53.44 52.65 3dfy n ALA 189 Cb 0.43 -1.25 -0.08 0.00 0.00 0.00 0.00 19.45 18.55 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 -0.44 0.16 -0.62 0.00 4.13 -1.20 -1.14 115.26 116.13 3dfy n ASN 190 Ca 0.17 -1.20 -0.08 0.00 1.68 0.00 0.00 54.58 55.15 3dfy n ASN 190 Cb 0.30 -1.99 -0.03 0.00 -1.54 0.00 0.00 39.78 36.52 3dfy n ASN 190 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 3dfy n MET 191 N -4.48 -1.28 0.20 3.52 2.81 0.83 -4.90 117.12 113.83 3dfy n MET 191 Ca -0.26 0.73 0.12 0.00 -1.81 0.00 0.00 57.70 56.48 3dfy n MET 191 Cb 0.66 -4.86 0.18 0.00 -0.71 0.00 0.00 33.22 28.49 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 -3.91 3.03 0.00 -1.10 -3.34 103.07 97.75 3dfy h GLY 192 Ca -0.17 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.62 3dfy h GLY 192 CO 0.24 0.00 -0.38 -0.19 0.00 0.00 0.00 176.54 176.21 3dfy s TYR 193 N -3.21 3.49 0.77 5.60 2.02 -0.33 -4.84 117.35 120.85 3dfy s TYR 193 Ca 0.07 0.27 -0.10 0.00 -0.37 0.00 0.00 57.07 56.94 3dfy s TYR 193 Cb 0.06 -1.79 0.08 0.00 -0.40 0.00 0.00 41.96 39.90 3dfy s TYR 193 CO 0.67 0.43 1.12 0.95 -1.57 0.00 0.00 175.55 177.15 3dfy s THR 194 N -1.81 2.11 0.17 -0.71 -4.23 -1.26 -4.21 115.64 105.70 3dfy s THR 194 Ca 0.37 -0.12 -0.14 0.00 -1.18 0.00 0.00 61.69 60.62 3dfy s THR 194 Cb -0.11 -3.00 0.06 0.00 1.34 0.00 0.00 72.50 70.79 3dfy s THR 194 CO 0.29 0.00 1.80 1.56 -0.54 0.00 0.00 174.62 177.73 3dfy h GLN 195 N -0.89 0.53 -0.58 3.99 4.20 -1.93 0.66 115.11 121.10 3dfy h GLN 195 Ca -0.45 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.15 3dfy h GLN 195 Cb 1.32 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.96 3dfy h GLN 195 CO 0.62 0.35 0.05 0.87 -0.67 0.00 0.00 178.83 180.05 3dfy h LYS 196 N 0.55 0.97 -0.53 1.46 1.79 -1.99 -1.56 116.57 117.26 3dfy h LYS 196 Ca 0.20 -0.27 -0.12 0.00 -2.18 0.00 0.00 60.65 58.28 3dfy h LYS 196 Cb 0.04 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.56 3dfy h LYS 196 CO -0.10 0.93 -0.13 0.93 -1.08 0.00 0.00 179.45 180.00 3dfy h GLU 197 N 0.90 1.03 -0.78 3.15 5.08 -1.83 -0.95 114.58 121.17 3dfy h GLU 197 Ca 0.17 -0.39 -0.03 0.00 -1.00 0.00 0.00 59.36 58.12 3dfy h GLU 197 Cb 0.46 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 3dfy h GLU 197 CO 0.02 1.08 0.37 0.00 -1.00 0.00 0.00 179.01 179.48 3dfy h ALA 198 N 0.93 1.01 -0.21 3.43 0.00 -0.56 -0.62 119.26 123.24 3dfy h ALA 198 Ca 0.14 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 3dfy h ALA 198 Cb 0.70 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3dfy h ALA 198 CO 0.05 0.58 -0.09 0.28 0.00 0.00 0.00 179.25 180.07 3dfy h VAL 199 N 1.11 1.30 -0.69 0.00 2.07 -1.15 -2.95 116.25 115.95 3dfy h VAL 199 Ca 0.27 -1.14 0.05 0.00 0.82 0.00 0.00 66.70 66.70 3dfy h VAL 199 Cb 0.12 1.61 -0.05 0.00 -1.52 0.00 0.00 31.29 31.45 3dfy h VAL 199 CO -0.03 0.35 0.40 -0.08 0.02 0.00 0.00 177.57 178.23 3dfy h GLU 200 N 0.13 0.74 -0.03 1.57 4.57 -0.85 -1.53 114.58 119.18 3dfy h GLU 200 Ca 0.05 -0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.22 3dfy h GLU 200 Cb 0.57 -0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 28.95 3dfy h GLU 200 CO 0.03 0.49 -0.21 0.35 -1.18 0.00 0.00 179.01 178.49 3dfy h PHE 201 N 0.76 -0.54 -0.57 0.92 3.57 -1.09 0.72 116.94 120.71 3dfy h PHE 201 Ca 0.30 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.83 3dfy h PHE 201 Cb 0.13 0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 3dfy h PHE 201 CO -0.06 -0.29 0.36 0.00 -2.23 0.00 0.00 178.31 176.09 3dfy h ALA 202 N 0.59 0.73 -0.69 2.41 0.00 -1.30 -1.33 119.26 119.67 3dfy h ALA 202 Ca 0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3dfy h ALA 202 Cb 0.41 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3dfy h ALA 202 CO -0.21 0.11 0.33 0.00 0.00 0.00 0.00 179.25 179.47 3dfy h ARG 203 N 0.72 1.00 -0.22 0.00 3.08 -0.93 0.35 114.38 118.38 3dfy h ARG 203 Ca 0.22 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 3dfy h ARG 203 Cb -0.03 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.84 3dfy h ARG 203 CO -0.07 0.80 0.05 0.00 -1.07 0.00 0.00 179.97 179.67 3dfy h ALA 204 N 1.15 0.29 -0.48 0.04 0.00 -0.53 0.15 119.26 119.88 3dfy h ALA 204 Ca 0.24 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3dfy h ALA 204 Cb 0.13 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3dfy h ALA 204 CO -0.03 -0.06 0.03 0.28 0.00 0.00 0.00 179.25 179.48 3dfy h VAL 205 N 0.18 1.23 -0.22 0.00 2.07 -1.13 -2.59 116.25 115.80 3dfy h VAL 205 Ca 0.07 -0.93 -0.02 0.00 0.82 0.00 0.00 66.70 66.64 3dfy h VAL 205 Cb 0.28 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 3dfy h VAL 205 CO 0.00 0.33 0.06 0.22 0.02 0.00 0.00 177.57 178.20 3dfy h TYR 206 N 0.73 0.36 -0.00 1.57 3.20 -0.66 -2.41 116.97 119.77 3dfy h TYR 206 Ca 0.15 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.98 3dfy h TYR 206 Cb 0.40 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.56 3dfy h TYR 206 CO 0.02 0.45 0.02 1.96 -1.64 0.00 0.00 178.16 178.97 3dfy h GLN 207 N 0.17 0.00 -0.01 1.82 1.08 -0.67 0.35 115.11 117.86 3dfy h GLN 207 Ca 0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 3dfy h GLN 207 Cb 0.27 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 3dfy h GLN 207 CO 0.00 0.00 -0.03 1.63 -0.95 0.00 0.00 178.83 179.48 3dfy n LYS 208 N -3.12 1.14 -1.07 1.46 4.76 -0.94 -4.89 118.16 115.50 3dfy n LYS 208 Ca -0.03 -0.38 -0.02 0.00 -2.87 0.00 0.00 58.31 55.01 3dfy n LYS 208 Cb 0.09 -1.49 -0.01 0.00 -1.84 0.00 0.00 35.03 31.78 3dfy n LYS 208 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3dfy n GLY 209 N 1.13 0.58 3.86 0.72 0.00 0.12 -5.02 105.19 106.57 3dfy n GLY 209 Ca 0.20 -0.84 -0.37 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.08 5.41 -0.14 -0.61 1.01 -0.98 -5.05 121.20 118.77 3dfy s ILE 210 Ca 0.00 0.34 -0.04 0.00 0.00 0.00 0.00 60.65 60.95 3dfy s ILE 210 Cb 0.00 -3.47 -0.03 0.00 0.01 0.00 0.00 42.46 38.97 3dfy s ILE 210 CO 0.00 0.59 -0.00 -0.62 0.00 0.00 0.00 174.94 174.91 3dfy s ASP 211 N -0.90 5.14 -0.20 3.58 2.15 -1.26 -4.19 116.67 120.99 3dfy s ASP 211 Ca 0.16 0.02 -0.03 0.00 0.43 0.00 0.00 52.55 53.13 3dfy s ASP 211 Cb -0.13 -1.71 -0.01 0.00 -0.30 0.00 0.00 42.92 40.78 3dfy s ASP 211 CO 0.05 0.25 -0.06 -0.63 -0.17 0.00 0.00 175.17 174.61 3dfy s ILE 212 N -0.09 3.28 0.10 4.11 1.01 -1.26 -4.29 121.20 124.05 3dfy s ILE 212 Ca 0.04 -0.53 -0.16 0.00 0.00 0.00 0.00 60.65 59.99 3dfy s ILE 212 Cb -0.13 -2.47 -0.08 0.00 0.01 0.00 0.00 42.46 39.80 3dfy s ILE 212 CO 0.02 0.45 1.46 0.00 0.00 0.00 0.00 174.94 176.86 3dfy h ALA 213 N 7.85 0.42 -3.27 9.38 0.00 -0.73 -3.40 119.26 129.52 3dfy h ALA 213 Ca -0.39 -0.34 -0.29 0.00 0.00 0.00 0.00 54.91 53.89 3dfy h ALA 213 Cb 1.17 -0.10 -0.34 0.00 0.00 0.00 0.00 17.79 18.51 3dfy h ALA 213 CO 0.60 0.33 -0.66 0.08 0.00 0.00 0.00 179.25 179.60 3dfy s VAL 214 N -4.56 -0.12 -0.46 0.00 1.01 -1.20 -4.29 120.40 110.78 3dfy s VAL 214 Ca -0.13 0.28 -0.10 0.00 0.00 0.00 0.00 61.98 62.03 3dfy s VAL 214 Cb 0.08 -0.21 0.10 0.00 0.00 0.00 0.00 36.38 36.36 3dfy s VAL 214 CO 0.80 0.11 0.33 -0.47 0.00 0.00 0.00 175.10 175.88 3dfy s TYR 215 N 1.62 3.37 -0.07 5.22 5.04 -0.17 -0.99 117.35 131.37 3dfy s TYR 215 Ca -0.04 -1.65 -0.24 0.00 -2.44 0.00 0.00 57.07 52.71 3dfy s TYR 215 Cb -0.12 -3.32 -0.04 0.00 0.35 0.00 0.00 41.96 38.84 3dfy s TYR 215 CO -0.05 -0.93 0.72 -2.00 -1.34 0.00 0.00 175.55 171.94 3dfy s GLU 216 N 1.42 4.44 -0.22 4.97 2.12 0.18 -0.46 118.70 131.15 3dfy s GLU 216 Ca 0.04 0.90 -0.01 0.00 0.36 0.00 0.00 54.97 56.27 3dfy s GLU 216 Cb -0.25 -3.45 0.00 0.00 0.26 0.00 0.00 34.13 30.68 3dfy s GLU 216 CO 0.01 0.04 0.16 0.94 -0.54 0.00 0.00 175.26 175.87 3dfy n GLN 217 N 3.85 -0.42 0.21 4.30 -0.06 0.80 -2.35 117.38 123.70 3dfy n GLN 217 Ca -0.01 0.21 0.09 0.00 -2.00 0.00 0.00 57.00 55.28 3dfy n GLN 217 Cb 0.51 -0.59 0.42 0.00 -4.06 0.00 0.00 30.24 26.53 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 0.65 0.00 -5.85 3.69 0.13 -1.85 0.24 132.00 129.01 3dfy h PRO 218 Ca -0.17 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.36 3dfy h PRO 218 Cb 0.38 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.40 3dfy h PRO 218 CO 0.10 0.27 -0.56 0.14 -0.23 0.00 0.00 178.00 177.71 3dfy s VAL 219 N -3.66 2.27 0.63 1.56 -7.23 -1.26 -1.18 120.40 111.53 3dfy s VAL 219 Ca 0.00 -1.88 -0.17 0.00 -1.81 0.00 0.00 61.98 58.12 3dfy s VAL 219 Cb 0.11 -2.94 -0.06 0.00 0.56 0.00 0.00 36.38 34.05 3dfy s VAL 219 CO 0.65 -0.05 0.64 0.54 -0.31 0.00 0.00 175.10 176.57 3dfy n ARG 220 N -1.07 0.53 0.19 4.82 1.74 -1.26 -4.23 116.66 117.39 3dfy n ARG 220 Ca -0.03 0.22 0.08 0.00 -0.77 0.00 0.00 57.85 57.34 3dfy n ARG 220 Cb 0.65 -1.86 0.60 0.00 -1.02 0.00 0.00 32.46 30.83 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 0.09 0.10 0.00 5.56 0.11 -1.93 -2.03 114.38 116.28 3dfy h ARG 221 Ca -0.46 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.61 3dfy h ARG 221 Cb 1.38 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 32.43 3dfy h ARG 221 CO 0.46 0.07 -0.24 0.93 0.10 0.00 0.00 179.97 181.29 3dfy h GLU 222 N 0.10 0.00 -4.38 0.08 4.39 -1.94 -3.41 114.58 109.42 3dfy h GLU 222 Ca 0.05 0.00 -0.72 0.00 0.34 0.00 0.00 59.36 59.02 3dfy h GLU 222 Cb 0.06 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 28.61 3dfy h GLU 222 CO -0.01 0.00 2.35 -3.47 -1.16 0.00 0.00 179.01 176.72 3dfy n ASP 223 N -2.29 4.66 -0.13 1.42 2.03 -0.76 -4.73 116.55 116.74 3dfy n ASP 223 Ca 0.04 -2.95 -0.09 0.00 0.52 0.00 0.00 54.79 52.31 3dfy n ASP 223 Cb 0.45 -1.61 0.04 0.00 -0.72 0.00 0.00 41.12 39.27 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 4.37 1.27 -0.30 5.18 1.08 -1.83 -1.98 117.51 125.30 3dfy h ILE 224 Ca 0.46 -1.33 -0.05 0.00 -0.39 0.00 0.00 64.86 63.54 3dfy h ILE 224 Cb 0.72 1.11 -0.02 0.00 -3.07 0.00 0.00 36.82 35.57 3dfy h ILE 224 CO 1.62 0.46 -0.05 -0.33 -0.69 0.00 0.00 178.15 179.16 3dfy h GLU 225 N 0.80 0.47 -0.30 2.37 4.39 -1.98 -2.09 114.58 118.24 3dfy h GLU 225 Ca 0.11 -0.11 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 3dfy h GLU 225 Cb 0.74 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 3dfy h GLU 225 CO 0.06 0.54 0.11 0.78 -1.16 0.00 0.00 179.01 179.34 3dfy h GLY 226 N 0.84 0.48 0.64 -3.84 0.00 -1.82 0.82 103.07 100.19 3dfy h GLY 226 Ca 0.09 -0.27 0.06 0.00 0.00 0.00 0.00 47.33 47.22 3dfy h GLY 226 CO 0.02 0.25 0.34 1.41 0.00 0.00 0.00 176.54 178.56 3dfy h LEU 227 N 0.33 0.48 -0.70 3.11 3.38 -1.01 0.08 115.31 120.98 3dfy h LEU 227 Ca 0.10 0.04 -0.10 0.00 0.09 0.00 0.00 57.88 58.01 3dfy h LEU 227 Cb 0.20 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3dfy h LEU 227 CO -0.01 0.31 -0.06 0.50 0.09 0.00 0.00 178.44 179.27 3dfy h LYS 228 N 0.62 0.94 -0.40 1.13 3.64 -1.09 0.15 116.57 121.55 3dfy h LYS 228 Ca 0.29 -0.31 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 3dfy h LYS 228 Cb 0.22 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 3dfy h LYS 228 CO -0.20 0.97 0.15 0.35 -2.27 0.00 0.00 179.45 178.45 3dfy h PHE 229 N 0.86 0.61 -0.60 1.91 3.57 -0.00 -0.62 116.94 122.67 3dfy h PHE 229 Ca 0.15 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.50 3dfy h PHE 229 Cb 0.59 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.12 3dfy h PHE 229 CO 0.04 0.55 -0.00 0.28 -2.23 0.00 0.00 178.31 176.95 3dfy h VAL 230 N 0.50 1.26 -0.76 1.41 2.07 -0.79 -2.56 116.25 117.39 3dfy h VAL 230 Ca 0.13 -1.14 0.05 0.00 0.82 0.00 0.00 66.70 66.56 3dfy h VAL 230 Cb 0.20 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 3dfy h VAL 230 CO -0.01 0.41 0.46 -0.09 0.02 0.00 0.00 177.57 178.37 3dfy h ARG 231 N 0.95 0.84 -0.44 1.57 2.43 -0.34 0.52 114.38 119.92 3dfy h ARG 231 Ca 0.17 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 3dfy h ARG 231 Cb 0.55 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 3dfy h ARG 231 CO 0.03 0.56 0.08 0.35 -1.51 0.00 0.00 179.97 179.48 3dfy h PHE 232 N 0.87 0.76 0.02 2.20 3.57 -0.78 -3.31 116.94 120.27 3dfy h PHE 232 Ca 0.32 -0.10 -0.27 0.00 3.53 0.00 0.00 57.97 61.45 3dfy h PHE 232 Cb 0.12 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 38.61 3dfy h PHE 232 CO -0.05 0.72 -1.50 0.45 -2.23 0.00 0.00 178.31 175.70 3dfy h HIS 233 N 0.58 0.06 -2.87 0.41 3.86 -1.17 -3.47 115.15 112.55 3dfy h HIS 233 Ca 0.13 -0.04 -0.53 0.00 -1.16 0.00 0.00 60.37 58.78 3dfy h HIS 233 Cb 0.36 -0.00 0.04 0.00 1.06 0.00 0.00 27.41 28.87 3dfy h HIS 233 CO 0.02 1.06 0.84 0.45 0.86 0.00 0.00 177.93 181.17 3dfy s SER 234 N -6.38 6.65 0.00 2.45 0.15 0.18 -4.89 113.70 111.86 3dfy s SER 234 Ca -0.04 2.54 0.30 0.00 0.70 0.00 0.00 55.95 59.45 3dfy s SER 234 Cb 0.08 -2.59 1.48 0.00 -1.71 0.00 0.00 66.02 63.28 3dfy s SER 234 CO 0.82 -0.78 2.04 -0.81 1.20 0.00 0.00 173.24 175.71 3dfy n PRO 235 N 4.01 0.36 -4.29 5.44 -0.04 -1.26 -4.78 135.00 134.44 3dfy n PRO 235 Ca 0.13 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.28 3dfy n PRO 235 Cb 0.40 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.26 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 -2.64 2.87 0.32 0.54 0.08 -1.26 -5.03 117.98 112.86 3dfy s PHE 236 Ca 0.26 -0.07 -0.29 0.00 0.12 0.00 0.00 56.93 56.95 3dfy s PHE 236 Cb 0.20 -1.53 -0.12 0.00 -0.57 0.00 0.00 43.02 41.00 3dfy s PHE 236 CO 0.47 0.42 1.45 -2.30 -0.10 0.00 0.00 175.22 175.16 3dfy n PRO 237 N 1.00 2.42 -4.25 0.24 -0.02 -1.26 -4.81 135.00 128.33 3dfy n PRO 237 Ca -0.13 0.86 -0.35 0.00 -2.02 0.00 0.00 63.50 61.85 3dfy n PRO 237 Cb 0.52 -2.55 -0.10 0.00 -0.02 0.00 0.00 33.50 31.36 3dfy n PRO 237 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3dfy s VAL 238 N -0.63 4.48 0.11 -1.45 1.01 -1.26 -1.00 120.40 121.66 3dfy s VAL 238 Ca 0.59 -0.17 0.09 0.00 0.00 0.00 0.00 61.98 62.49 3dfy s VAL 238 Cb -0.54 -2.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 3dfy s VAL 238 CO 0.57 0.56 -0.18 0.00 0.00 0.00 0.00 175.10 176.05 3dfy s ALA 239 N -0.45 2.69 -0.13 5.51 0.00 0.39 -1.01 121.76 128.76 3dfy s ALA 239 Ca 0.09 -1.33 -0.06 0.00 0.00 0.00 0.00 51.96 50.66 3dfy s ALA 239 Cb -0.12 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 22.28 3dfy s ALA 239 CO 0.02 0.59 0.08 0.00 0.00 0.00 0.00 175.76 176.46 3dfy s ALA 240 N -1.12 3.58 0.00 0.00 0.00 -0.37 -0.14 121.76 123.71 3dfy s ALA 240 Ca 0.18 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.42 3dfy s ALA 240 Cb -0.11 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.19 3dfy s ALA 240 CO 0.10 0.48 0.00 -3.47 0.00 0.00 0.00 175.76 172.87 3dfy n ASP 241 N 2.48 0.00 0.13 0.00 -0.08 -1.26 -0.50 116.55 117.32 3dfy n ASP 241 Ca -0.19 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 0.74 0.00 2.34 0.00 0.00 41.12 44.74 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 0.18 114.58 115.23 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 0.00 0.43 -1.40 0.00 0.00 179.01 178.04 3dfy n SER 243 N -4.12 0.04 -3.90 1.42 7.64 -1.26 -4.41 113.62 109.03 3dfy n SER 243 Ca 0.04 0.50 -0.29 0.00 1.01 0.00 0.00 58.87 60.13 3dfy n SER 243 Cb 0.41 -0.52 -0.13 0.00 -1.01 0.00 0.00 64.21 62.96 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 -3.01 3.33 -0.20 -0.43 0.00 0.64 -4.75 121.76 117.35 3dfy s ALA 244 Ca 0.13 -3.39 -0.01 0.00 0.00 0.00 0.00 51.96 48.69 3dfy s ALA 244 Cb 0.17 -2.12 -0.12 0.00 0.00 0.00 0.00 23.12 21.05 3dfy s ALA 244 CO 0.50 -2.05 -0.20 0.54 0.00 0.00 0.00 175.76 174.56 3dfy n ARG 245 N 2.76 0.48 -4.29 0.00 1.74 -1.26 -4.82 116.66 111.26 3dfy n ARG 245 Ca 0.11 0.13 -0.25 0.00 -0.77 0.00 0.00 57.85 57.07 3dfy n ARG 245 Cb 0.34 -1.36 -0.08 0.00 -1.02 0.00 0.00 32.46 30.33 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 -2.39 2.41 0.44 0.55 -4.23 -1.26 -3.07 115.64 108.09 3dfy s THR 246 Ca -0.27 -1.86 0.15 0.00 -1.18 0.00 0.00 61.69 58.53 3dfy s THR 246 Cb 0.08 -2.92 0.19 0.00 1.34 0.00 0.00 72.50 71.19 3dfy s THR 246 CO 0.43 -0.09 1.99 0.07 -0.54 0.00 0.00 174.62 176.49 3dfy h LYS 247 N 1.64 0.00 -0.21 3.99 2.10 -1.94 -1.48 116.57 120.67 3dfy h LYS 247 Ca -0.43 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.08 3dfy h LYS 247 Cb 1.25 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.57 3dfy h LYS 247 CO 0.70 0.19 -0.44 0.74 -2.00 0.00 0.00 179.45 178.64 3dfy h PHE 248 N 0.00 0.62 -0.43 0.07 0.04 -1.97 -1.22 116.94 114.05 3dfy h PHE 248 Ca -0.00 -0.19 -0.02 0.00 2.80 0.00 0.00 57.97 60.56 3dfy h PHE 248 Cb 0.33 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.34 3dfy h PHE 248 CO 0.00 0.86 0.20 -0.44 -0.60 0.00 0.00 178.31 178.34 3dfy h ASP 249 N 0.42 0.57 -0.70 2.17 3.32 -1.62 -1.99 116.42 118.59 3dfy h ASP 249 Ca 0.03 -0.13 -0.07 0.00 0.02 0.00 0.00 57.03 56.87 3dfy h ASP 249 Cb 0.93 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.31 3dfy h ASP 249 CO 0.08 0.54 0.15 0.58 -1.72 0.00 0.00 179.24 178.87 3dfy h VAL 250 N 0.55 1.26 -0.91 -1.35 2.07 -1.16 -0.51 116.25 116.21 3dfy h VAL 250 Ca 0.15 -1.01 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 3dfy h VAL 250 Cb 0.13 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 3dfy h VAL 250 CO -0.02 0.38 0.51 -0.03 0.02 0.00 0.00 177.57 178.44 3dfy h MET 251 N 1.07 1.26 -0.54 1.57 1.85 -1.05 0.60 114.93 119.69 3dfy h MET 251 Ca 0.22 -0.14 -0.05 0.00 -0.61 0.00 0.00 59.70 59.12 3dfy h MET 251 Cb 0.40 -0.25 -0.02 0.00 0.43 0.00 0.00 31.60 32.16 3dfy h MET 251 CO 0.01 0.91 0.14 -0.09 -0.40 0.00 0.00 176.91 177.48 3dfy h ARG 252 N 1.27 0.86 -0.67 0.39 2.43 -0.82 0.59 114.38 118.43 3dfy h ARG 252 Ca 0.32 -0.20 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 3dfy h ARG 252 Cb 0.01 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 3dfy h ARG 252 CO -0.05 0.81 0.22 -0.07 -1.51 0.00 0.00 179.97 179.37 3dfy h LEU 253 N 0.76 0.94 -0.19 3.80 3.38 -0.50 -0.61 115.31 122.88 3dfy h LEU 253 Ca 0.17 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3dfy h LEU 253 Cb 0.33 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3dfy h LEU 253 CO 0.00 0.86 -0.03 0.58 0.09 0.00 0.00 178.44 179.95 3dfy h VAL 254 N 0.98 1.28 -0.53 1.22 2.07 -0.52 -0.07 116.25 120.67 3dfy h VAL 254 Ca 0.22 -0.97 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 3dfy h VAL 254 Cb 0.25 1.53 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 3dfy h VAL 254 CO -0.01 0.29 0.32 0.11 0.02 0.00 0.00 177.57 178.30 3dfy h LYS 255 N 0.08 0.71 -0.00 1.57 1.57 -0.67 -1.44 116.57 118.39 3dfy h LYS 255 Ca 0.05 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3dfy h LYS 255 Cb 0.45 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3dfy h LYS 255 CO 0.02 0.50 -0.19 0.39 -0.57 0.00 0.00 179.45 179.60 3dfy n GLU 256 N -4.43 0.26 -3.81 3.15 -0.58 -0.26 -4.92 120.64 110.05 3dfy n GLU 256 Ca 0.05 -0.09 -0.27 0.00 -0.42 0.00 0.00 57.16 56.43 3dfy n GLU 256 Cb 0.07 -1.50 0.04 0.00 -0.57 0.00 0.00 31.44 29.48 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 -1.29 -5.70 0.10 3.49 1.02 -0.11 -4.90 120.64 113.24 3dfy n GLU 257 Ca 0.09 0.64 -0.01 0.00 -0.02 0.00 0.00 57.16 57.86 3dfy n GLU 257 Cb 0.31 -5.47 -0.04 0.00 -0.02 0.00 0.00 31.44 26.23 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 0.95 0.56 -2.55 0.62 0.00 -1.64 -3.46 119.26 113.75 3dfy h ALA 258 Ca -0.59 -0.66 -0.15 0.00 0.00 0.00 0.00 54.91 53.51 3dfy h ALA 258 Cb 1.37 -0.07 -0.14 0.00 0.00 0.00 0.00 17.79 18.95 3dfy h ALA 258 CO 0.63 0.88 -0.49 0.14 0.00 0.00 0.00 179.25 180.40 3dfy s VAL 259 N -2.86 0.07 -0.10 0.00 -7.23 -1.26 -2.89 120.40 106.12 3dfy s VAL 259 Ca 0.02 -1.69 0.11 0.00 -1.81 0.00 0.00 61.98 58.61 3dfy s VAL 259 Cb 0.08 -2.02 -0.24 0.00 0.56 0.00 0.00 36.38 34.77 3dfy s VAL 259 CO 0.78 -0.33 0.44 0.47 -0.31 0.00 0.00 175.10 176.15 3dfy n ASP 260 N -0.17 0.89 -4.18 4.85 8.00 -0.18 -4.95 116.55 120.82 3dfy n ASP 260 Ca -0.05 0.26 -0.15 0.00 0.71 0.00 0.00 54.79 55.56 3dfy n ASP 260 Cb 0.64 0.06 -0.11 0.00 -0.02 0.00 0.00 41.12 41.69 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 -2.56 1.08 -0.08 1.24 1.51 -0.30 -1.38 117.35 116.85 3dfy s TYR 261 Ca -0.10 -0.63 0.03 0.00 -1.01 0.00 0.00 57.07 55.36 3dfy s TYR 261 Cb 0.07 -0.59 0.01 0.00 -0.11 0.00 0.00 41.96 41.34 3dfy s TYR 261 CO 0.81 0.01 -0.17 0.08 -1.11 0.00 0.00 175.55 175.17 3dfy s VAL 262 N -2.30 1.49 -0.46 0.71 1.01 -0.82 -1.24 120.40 118.79 3dfy s VAL 262 Ca 0.05 -0.68 -0.18 0.00 0.00 0.00 0.00 61.98 61.17 3dfy s VAL 262 Cb -0.04 -1.33 0.04 0.00 0.00 0.00 0.00 36.38 35.05 3dfy s VAL 262 CO 0.00 0.44 0.50 0.21 0.00 0.00 0.00 175.10 176.24 3dfy s ASN 263 N 0.60 6.20 0.01 3.32 2.47 0.34 -2.30 114.94 125.58 3dfy s ASN 263 Ca -0.15 -0.85 -0.25 0.00 0.42 0.00 0.00 52.86 52.03 3dfy s ASN 263 Cb -0.16 -2.24 -0.05 0.00 -1.45 0.00 0.00 41.25 37.35 3dfy s ASN 263 CO 0.05 -0.70 0.76 -0.63 -3.72 0.00 0.00 177.10 172.86 3dfy s ILE 264 N 2.23 4.84 -0.10 -5.21 1.01 0.19 -4.67 121.20 119.48 3dfy s ILE 264 Ca 0.12 1.61 0.01 0.00 0.00 0.00 0.00 60.65 62.38 3dfy s ILE 264 Cb -0.19 -4.11 0.02 0.00 0.01 0.00 0.00 42.46 38.19 3dfy s ILE 264 CO 0.12 0.31 -0.11 -0.54 0.00 0.00 0.00 174.94 174.72 3dfy s LYS 265 N 0.29 1.82 0.45 2.79 1.02 -1.26 -0.57 119.74 124.28 3dfy s LYS 265 Ca 0.39 -0.40 0.14 0.00 0.02 0.00 0.00 55.97 56.12 3dfy s LYS 265 Cb -0.20 -1.66 1.06 0.00 -0.52 0.00 0.00 37.83 36.51 3dfy s LYS 265 CO 0.22 -0.14 2.02 -0.07 -0.92 0.00 0.00 175.35 176.47 3dfy h LEU 266 N 7.65 0.31 -1.70 3.17 3.38 -1.87 0.73 115.31 126.97 3dfy h LEU 266 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3dfy h LEU 266 Cb 1.16 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3dfy h LEU 266 CO 0.46 0.20 0.00 0.24 0.09 0.00 0.00 178.44 179.43 3dfy h MET 267 N 0.35 0.00 0.05 1.13 2.86 -1.91 0.42 114.93 117.83 3dfy h MET 267 Ca 0.21 0.00 -0.38 0.00 -2.06 0.00 0.00 59.70 57.47 3dfy h MET 267 Cb 0.38 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.99 3dfy h MET 267 CO -0.05 0.00 -2.23 1.63 1.06 0.00 0.00 176.91 177.32 3dfy n LYS 268 N -2.85 0.69 -0.02 1.72 5.02 0.17 -2.66 118.16 120.22 3dfy n LYS 268 Ca -0.00 0.22 0.06 0.00 -2.02 0.00 0.00 58.31 56.57 3dfy n LYS 268 Cb 0.21 -1.61 -0.14 0.00 -0.02 0.00 0.00 35.03 33.47 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 -3.45 0.82 -0.28 4.39 7.64 -0.71 -4.67 113.62 117.36 3dfy n SER 269 Ca -0.40 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.52 3dfy n SER 269 Cb 1.00 1.68 -0.01 0.00 -1.01 0.00 0.00 64.21 65.86 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 1.55 -1.63 0.22 0.23 0.00 0.15 -3.23 105.19 102.48 3dfy n GLY 270 Ca -0.08 -1.45 -0.15 0.00 0.00 0.00 0.00 46.02 44.35 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 -0.26 1.30 0.40 -0.61 1.08 -1.83 -2.72 117.51 114.86 3dfy h ILE 271 Ca -0.00 -1.66 -0.00 0.00 -0.39 0.00 0.00 64.86 62.80 3dfy h ILE 271 Cb 0.26 1.71 -0.03 0.00 -3.07 0.00 0.00 36.82 35.69 3dfy h ILE 271 CO 0.00 0.53 -0.43 0.77 -0.69 0.00 0.00 178.15 178.34 3dfy h SER 272 N 0.51 -1.17 0.02 1.72 4.64 -1.95 -0.32 113.55 117.00 3dfy h SER 272 Ca 0.02 0.10 -0.07 0.00 -0.47 0.00 0.00 61.79 61.37 3dfy h SER 272 Cb 1.07 0.40 -0.01 0.00 -0.31 0.00 0.00 62.40 63.54 3dfy h SER 272 CO 0.10 -0.57 -0.18 0.44 -0.87 0.00 0.00 176.83 175.75 3dfy h ASP 273 N -0.85 0.29 -0.67 4.97 5.19 -1.66 -2.59 116.42 121.11 3dfy h ASP 273 Ca -0.03 -0.08 -0.03 0.00 -0.62 0.00 0.00 57.03 56.27 3dfy h ASP 273 Cb 0.76 -0.08 -0.03 0.00 0.18 0.00 0.00 39.33 40.16 3dfy h ASP 273 CO -0.08 0.50 0.29 0.00 -3.12 0.00 0.00 179.24 176.82 3dfy h ALA 274 N 1.53 0.86 -0.64 3.45 0.00 -1.13 0.15 119.26 123.49 3dfy h ALA 274 Ca 0.05 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 3dfy h ALA 274 Cb 0.49 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3dfy h ALA 274 CO 0.03 0.46 0.23 -0.07 0.00 0.00 0.00 179.25 179.90 3dfy h LEU 275 N 0.93 0.87 -0.46 0.00 3.38 -0.74 -1.90 115.31 117.40 3dfy h LEU 275 Ca 0.22 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 3dfy h LEU 275 Cb 0.18 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3dfy h LEU 275 CO -0.02 0.80 -0.09 0.00 0.09 0.00 0.00 178.44 179.22 3dfy h ALA 276 N 1.32 0.64 -0.35 1.53 0.00 -1.01 -2.81 119.26 118.58 3dfy h ALA 276 Ca 0.21 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 3dfy h ALA 276 Cb 0.22 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3dfy h ALA 276 CO -0.01 0.52 -0.06 0.82 0.00 0.00 0.00 179.25 180.51 3dfy h ILE 277 N 0.72 1.22 -0.34 0.00 2.04 -0.42 -0.47 117.51 120.27 3dfy h ILE 277 Ca 0.12 -0.94 -0.02 0.00 1.00 0.00 0.00 64.86 65.01 3dfy h ILE 277 Cb 0.63 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 3dfy h ILE 277 CO 0.04 0.32 0.12 0.58 0.00 0.00 0.00 178.15 179.21 3dfy h VAL 278 N 0.54 1.19 -0.21 1.67 2.07 -1.22 -0.20 116.25 120.10 3dfy h VAL 278 Ca 0.11 -0.61 -0.11 0.00 0.82 0.00 0.00 66.70 66.90 3dfy h VAL 278 Cb 0.43 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3dfy h VAL 278 CO 0.02 0.21 -0.34 -0.33 0.02 0.00 0.00 177.57 177.15 3dfy h GLU 279 N 0.40 0.44 -0.34 1.57 4.39 -1.23 -1.50 114.58 118.31 3dfy h GLU 279 Ca 0.11 -0.20 -0.13 0.00 0.34 0.00 0.00 59.36 59.49 3dfy h GLU 279 Cb 0.21 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 3dfy h GLU 279 CO -0.01 0.73 -0.28 0.82 -1.16 0.00 0.00 179.01 179.11 3dfy h ILE 280 N 0.38 1.29 0.04 3.13 2.04 -0.92 -2.58 117.51 120.89 3dfy h ILE 280 Ca 0.04 -1.44 -0.00 0.00 1.00 0.00 0.00 64.86 64.46 3dfy h ILE 280 Cb 0.79 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 38.33 3dfy h ILE 280 CO 0.06 0.47 -0.02 0.00 0.00 0.00 0.00 178.15 178.66 3dfy h ALA 281 N 0.75 -0.05 0.00 1.87 0.00 -0.83 -2.34 119.26 118.66 3dfy h ALA 281 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dfy h ALA 281 Cb 0.85 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3dfy h ALA 281 CO 0.07 -0.48 0.00 0.39 0.00 0.00 0.00 179.25 179.24 3dfy n GLU 282 N -5.06 0.07 -0.09 0.00 1.02 -0.58 -1.58 120.64 114.42 3dfy n GLU 282 Ca -0.08 0.21 0.11 0.00 -0.02 0.00 0.00 57.16 57.38 3dfy n GLU 282 Cb 0.09 -1.50 0.14 0.00 -0.02 0.00 0.00 31.44 30.16 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 -1.43 3.03 -0.65 1.62 7.64 -0.92 -4.59 113.62 118.33 3dfy n SER 283 Ca 0.05 -1.91 0.00 0.00 1.01 0.00 0.00 58.87 58.02 3dfy n SER 283 Cb 0.16 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 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 1.26 0.11 -0.01 6.43 3.41 -0.61 -5.01 113.62 119.20 3dfy n SER 284 Ca 0.15 -1.89 -0.00 0.00 -0.26 0.00 0.00 58.87 56.87 3dfy n SER 284 Cb 0.54 -0.18 -0.00 0.00 -0.26 0.00 0.00 64.21 64.31 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 0.07 0.27 3.76 5.00 0.00 -1.11 -4.99 105.19 108.20 3dfy n GLY 285 Ca 0.00 -0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.02 4.43 0.37 0.99 2.96 -1.04 -5.01 118.68 121.36 3dfy s LEU 286 Ca 0.00 1.21 0.03 0.00 -0.22 0.00 0.00 54.13 55.14 3dfy s LEU 286 Cb 0.00 -2.96 -0.02 0.00 0.50 0.00 0.00 46.19 43.71 3dfy s LEU 286 CO 0.00 0.10 0.55 -0.54 -1.32 0.00 0.00 176.35 175.14 3dfy s LYS 287 N -0.24 3.23 0.11 1.98 1.02 -0.48 -4.38 119.74 120.99 3dfy s LYS 287 Ca 0.32 -0.63 0.04 0.00 0.02 0.00 0.00 55.97 55.72 3dfy s LYS 287 Cb -0.19 -2.70 -0.04 0.00 -0.52 0.00 0.00 37.83 34.39 3dfy s LYS 287 CO 0.18 0.01 -0.11 -0.51 -0.92 0.00 0.00 175.35 174.01 3dfy s LEU 288 N -4.32 2.44 0.04 3.17 1.43 -1.26 -1.95 118.68 118.24 3dfy s LEU 288 Ca 0.43 -0.87 -0.02 0.00 -1.03 0.00 0.00 54.13 52.65 3dfy s LEU 288 Cb -0.10 -0.35 -0.03 0.00 0.03 0.00 0.00 46.19 45.75 3dfy s LEU 288 CO 0.34 -0.26 0.01 0.00 0.23 0.00 0.00 176.35 176.67 3dfy s MET 289 N -3.03 0.55 -0.04 1.70 0.23 -0.97 -1.24 119.30 116.49 3dfy s MET 289 Ca 0.09 -0.96 0.07 0.00 -1.03 0.00 0.00 55.69 53.86 3dfy s MET 289 Cb -0.02 0.20 -0.01 0.00 -1.53 0.00 0.00 34.83 33.47 3dfy s MET 289 CO 0.01 -0.11 -0.24 -1.50 -2.03 0.00 0.00 175.02 171.15 3dfy s ILE 290 N -3.04 1.91 0.00 3.16 2.07 -0.90 -0.64 121.20 123.77 3dfy s ILE 290 Ca -0.01 -1.01 0.00 0.00 -1.41 0.00 0.00 60.65 58.22 3dfy s ILE 290 Cb 0.01 -1.60 0.00 0.00 0.13 0.00 0.00 42.46 41.00 3dfy s ILE 290 CO -0.07 0.54 0.00 0.61 -1.91 0.00 0.00 174.94 174.11 3dfy n GLY 291 N 2.74 5.77 3.67 1.50 0.00 0.26 -0.44 105.19 118.69 3dfy n GLY 291 Ca -0.17 -2.00 -0.11 0.00 0.00 0.00 0.00 46.02 43.75 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 -0.53 0.00 -2.03 0.00 2.81 -1.26 -4.99 117.12 111.12 3dfy n MET 293 Ca -0.04 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 55.76 3dfy n MET 293 Cb 0.61 0.00 0.06 0.00 -0.71 0.00 0.00 33.22 33.17 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 4.54 4.21 3.76 3.03 0.00 -1.26 -4.77 105.19 114.70 3dfy n GLY 294 Ca 0.00 -1.78 -0.39 0.00 0.00 0.00 0.00 46.02 43.85 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 -3.25 3.58 0.62 1.61 8.01 -1.26 -4.90 118.70 123.10 3dfy s GLU 295 Ca 0.40 2.23 -0.04 0.00 0.01 0.00 0.00 54.97 57.57 3dfy s GLU 295 Cb 0.37 -2.52 0.13 0.00 -4.31 0.00 0.00 34.13 27.80 3dfy s GLU 295 CO -0.02 -0.84 0.85 -1.13 0.01 0.00 0.00 175.26 174.13 3dfy n SER 296 N -0.42 0.72 -0.32 -0.19 3.41 -1.26 -2.39 113.62 113.17 3dfy n SER 296 Ca 0.07 -1.71 0.06 0.00 -0.26 0.00 0.00 58.87 57.03 3dfy n SER 296 Cb 0.44 -0.59 0.21 0.00 -0.26 0.00 0.00 64.21 64.02 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 -0.74 0.71 0.08 4.04 4.64 -1.92 0.10 113.55 120.46 3dfy h SER 297 Ca -0.28 0.06 -0.07 0.00 -0.47 0.00 0.00 61.79 61.04 3dfy h SER 297 Cb 0.93 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.93 3dfy h SER 297 CO 0.26 0.36 -0.22 0.25 -0.87 0.00 0.00 176.83 176.61 3dfy h LEU 298 N 0.80 0.25 0.04 5.97 6.46 -1.94 -1.72 115.31 125.16 3dfy h LEU 298 Ca 0.46 -0.07 -0.17 0.00 -0.12 0.00 0.00 57.88 57.98 3dfy h LEU 298 Cb 0.52 -0.07 0.02 0.00 -0.73 0.00 0.00 40.66 40.40 3dfy h LEU 298 CO -0.29 0.48 -0.69 1.23 -0.62 0.00 0.00 178.44 178.55 3dfy h GLY 299 N 0.92 0.45 2.00 3.75 0.00 -1.36 -3.22 103.07 105.60 3dfy h GLY 299 Ca 0.04 -0.86 -0.02 0.00 0.00 0.00 0.00 47.33 46.49 3dfy h GLY 299 CO 0.04 0.76 -0.12 1.19 0.00 0.00 0.00 176.54 178.41 3dfy h ILE 300 N -0.14 0.50 -0.82 2.60 6.09 -0.80 -1.26 117.51 123.69 3dfy h ILE 300 Ca -0.10 -0.56 0.14 0.00 -1.37 0.00 0.00 64.86 62.97 3dfy h ILE 300 Cb 1.42 1.38 -0.06 0.00 0.47 0.00 0.00 36.82 40.03 3dfy h ILE 300 CO 0.13 0.11 0.54 -1.13 -3.07 0.00 0.00 178.15 174.73 3dfy h ASN 301 N 0.00 0.54 -0.61 2.19 -1.24 -1.32 -0.31 115.58 114.83 3dfy h ASN 301 Ca -0.00 0.03 0.02 0.00 0.71 0.00 0.00 56.30 57.06 3dfy h ASN 301 Cb 0.37 -0.08 -0.04 0.00 0.73 0.00 0.00 38.32 39.30 3dfy h ASN 301 CO 0.02 0.28 0.38 1.56 -1.29 0.00 0.00 177.43 178.38 3dfy h GLN 302 N 0.58 0.74 0.02 6.67 4.20 -1.35 -1.93 115.11 124.04 3dfy h GLN 302 Ca 0.40 -0.04 -0.21 0.00 0.06 0.00 0.00 58.65 58.86 3dfy h GLN 302 Cb 0.74 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 3dfy h GLN 302 CO -0.16 0.49 -0.94 0.77 -0.67 0.00 0.00 178.83 178.32 3dfy h SER 303 N 0.76 0.18 -0.39 1.46 0.02 -1.30 -2.67 113.55 111.62 3dfy h SER 303 Ca 0.24 -0.16 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 3dfy h SER 303 Cb -0.02 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 3dfy h SER 303 CO -0.08 1.02 0.11 0.58 -1.14 0.00 0.00 176.83 177.32 3dfy h VAL 304 N 0.06 1.22 -0.58 2.27 2.07 -0.85 0.88 116.25 121.32 3dfy h VAL 304 Ca -0.04 -0.72 -0.08 0.00 0.82 0.00 0.00 66.70 66.67 3dfy h VAL 304 Cb 1.61 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 32.31 3dfy h VAL 304 CO 0.14 0.25 0.02 0.45 0.02 0.00 0.00 177.57 178.45 3dfy h HIS 305 N 0.48 1.06 -0.35 1.57 -0.00 -1.40 0.15 115.15 116.65 3dfy h HIS 305 Ca 0.12 -0.16 -0.03 0.00 -0.00 0.00 0.00 60.37 60.31 3dfy h HIS 305 Cb 0.27 -0.28 -0.02 0.00 -0.00 0.00 0.00 27.41 27.38 3dfy h HIS 305 CO 0.01 0.93 0.12 0.35 -0.00 0.00 0.00 177.93 179.34 3dfy h PHE 306 N 0.91 0.56 -0.44 2.45 3.57 -1.16 0.25 116.94 123.08 3dfy h PHE 306 Ca 0.17 -0.05 -0.11 0.00 3.53 0.00 0.00 57.97 61.51 3dfy h PHE 306 Cb 0.50 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 3dfy h PHE 306 CO 0.03 0.54 -0.16 0.00 -2.23 0.00 0.00 178.31 176.49 3dfy h ALA 307 N 0.96 0.61 -0.04 2.41 0.00 -0.66 -1.05 119.26 121.50 3dfy h ALA 307 Ca 0.11 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3dfy h ALA 307 Cb 0.23 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3dfy h ALA 307 CO -0.01 0.55 -0.01 -0.07 0.00 0.00 0.00 179.25 179.71 3dfy h LEU 308 N 0.72 0.08 0.13 0.00 3.38 -0.87 0.23 115.31 118.96 3dfy h LEU 308 Ca 0.11 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 3dfy h LEU 308 Cb 0.71 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3dfy h LEU 308 CO 0.05 0.45 -0.06 1.23 0.09 0.00 0.00 178.44 180.21 3dfy h GLY 309 N -0.30 -0.18 1.80 0.83 0.00 -0.48 -1.46 103.07 103.28 3dfy h GLY 309 Ca 0.01 0.07 -0.24 0.00 0.00 0.00 0.00 47.33 47.16 3dfy h GLY 309 CO 0.00 -0.06 -1.11 -0.91 0.00 0.00 0.00 176.54 174.46 3dfy h THR 310 N -0.17 1.59 -3.08 4.70 1.35 -1.27 -1.55 112.91 114.48 3dfy h THR 310 Ca -0.02 -3.18 -0.39 0.00 -0.55 0.00 0.00 66.41 62.28 3dfy h THR 310 Cb 0.13 2.86 -0.02 0.00 -1.73 0.00 0.00 68.15 69.39 3dfy h THR 310 CO 0.03 0.92 -0.49 0.61 -0.25 0.00 0.00 175.52 176.34 3dfy n GLY 311 N 1.40 -0.41 0.01 5.82 0.00 0.80 -4.76 105.19 108.05 3dfy n GLY 311 Ca -0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.93 3.03 -2.81 4.61 0.00 -1.26 -4.93 120.51 117.22 3dfy n ALA 312 Ca -0.23 -0.24 -0.36 0.00 0.00 0.00 0.00 53.44 52.61 3dfy n ALA 312 Cb 0.67 -1.25 -0.08 0.00 0.00 0.00 0.00 19.45 18.80 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 -3.03 3.43 0.08 0.00 0.08 -1.26 -4.41 117.98 112.88 3dfy s PHE 313 Ca 0.11 0.36 -0.10 0.00 0.12 0.00 0.00 56.93 57.42 3dfy s PHE 313 Cb 0.17 -1.97 -0.22 0.00 -0.57 0.00 0.00 43.02 40.43 3dfy s PHE 313 CO 0.65 0.53 1.19 0.93 -0.10 0.00 0.00 175.22 178.41 3dfy h GLU 314 N 5.55 0.55 -5.28 0.44 4.39 -1.53 -3.46 114.58 115.23 3dfy h GLU 314 Ca -0.49 -0.67 -0.40 0.00 0.34 0.00 0.00 59.36 58.14 3dfy h GLU 314 Cb 1.20 0.21 -0.21 0.00 -0.10 0.00 0.00 28.75 29.85 3dfy h GLU 314 CO 0.62 1.27 -0.77 -0.06 -1.16 0.00 0.00 179.01 178.91 3dfy s PHE 315 N -3.11 1.18 -0.10 4.33 0.08 -1.24 -5.06 117.98 114.06 3dfy s PHE 315 Ca -0.08 -0.48 0.01 0.00 0.12 0.00 0.00 56.93 56.51 3dfy s PHE 315 Cb 0.07 -0.66 0.02 0.00 -0.57 0.00 0.00 43.02 41.88 3dfy s PHE 315 CO 0.91 0.05 -0.12 -1.01 -0.10 0.00 0.00 175.22 174.95 3dfy s HIS 316 N -1.37 1.66 -0.70 0.36 3.76 -1.25 -2.12 115.29 115.62 3dfy s HIS 316 Ca -0.02 -0.76 0.05 0.00 -0.15 0.00 0.00 55.06 54.18 3dfy s HIS 316 Cb -0.09 -1.26 0.21 0.00 1.11 0.00 0.00 32.58 32.55 3dfy s HIS 316 CO 0.02 -0.44 0.65 -3.47 -0.85 0.00 0.00 174.74 170.64 3dfy n ASP 317 N 4.38 3.51 -3.43 1.40 2.03 0.42 -1.14 116.55 123.72 3dfy n ASP 317 Ca -0.18 -3.31 -0.27 0.00 0.52 0.00 0.00 54.79 51.55 3dfy n ASP 317 Cb 0.51 -0.75 -0.08 0.00 -0.72 0.00 0.00 41.12 40.07 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 1.49 3.16 -0.23 -2.67 4.77 -1.26 -3.27 117.00 118.99 3dfy n LEU 318 Ca 0.24 -5.31 0.03 0.00 -0.03 0.00 0.00 56.01 50.94 3dfy n LEU 318 Cb 0.38 -0.48 0.03 0.00 -2.33 0.00 0.00 43.42 41.01 3dfy n LEU 318 CO 0.35 2.03 0.38 -0.90 -1.33 0.00 0.00 177.39 177.91 3dfy n ASP 319 N 1.05 1.63 -0.29 -1.43 5.75 -1.26 -4.73 116.55 117.28 3dfy n ASP 319 Ca 0.28 -1.37 0.05 0.00 -0.01 0.00 0.00 54.79 53.74 3dfy n ASP 319 Cb 0.42 -0.02 0.20 0.00 -1.03 0.00 0.00 41.12 40.69 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 1.04 0.56 0.95 -1.12 4.64 -1.86 -0.11 113.55 117.64 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 0.30 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 3dfy h SER 320 CO 0.00 0.27 -0.01 1.12 -0.87 0.00 0.00 176.83 177.34 3dfy h HIS 321 N 0.67 0.00 0.00 4.77 2.07 -1.75 -2.41 115.15 118.49 3dfy h HIS 321 Ca 0.43 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.95 3dfy h HIS 321 Cb 0.54 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.52 3dfy h HIS 321 CO -0.09 0.01 0.00 -0.07 -3.07 0.00 0.00 177.93 174.72 3dfy h LEU 322 N 0.00 0.00 0.00 6.12 3.38 -1.34 -3.16 115.31 120.31 3dfy h LEU 322 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dfy h LEU 322 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3dfy h LEU 322 CO 0.00 0.00 -1.00 0.23 0.09 0.00 0.00 178.44 177.76 3dfy n MET 323 N -2.34 0.32 -3.57 1.13 2.81 -0.91 -4.95 117.12 109.62 3dfy n MET 323 Ca 0.05 0.01 -0.23 0.00 -1.81 0.00 0.00 57.70 55.72 3dfy n MET 323 Cb 0.42 -1.62 -0.02 0.00 -0.71 0.00 0.00 33.22 31.30 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 -4.09 4.11 -0.27 4.03 1.43 -1.20 -1.14 118.68 121.55 3dfy s LEU 324 Ca 0.03 0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 53.35 3dfy s LEU 324 Cb 0.14 -3.18 -0.05 0.00 0.03 0.00 0.00 46.19 43.13 3dfy s LEU 324 CO 0.79 -0.21 0.25 -0.54 0.23 0.00 0.00 176.35 176.87 3dfy s LYS 325 N -4.15 3.99 -0.09 1.70 1.02 0.35 -4.86 119.74 117.68 3dfy s LYS 325 Ca 0.38 -0.19 -0.00 0.00 0.02 0.00 0.00 55.97 56.18 3dfy s LYS 325 Cb -0.09 -3.64 0.02 0.00 -0.52 0.00 0.00 37.83 33.59 3dfy s LYS 325 CO 0.34 -0.18 -0.07 -1.21 -0.92 0.00 0.00 175.35 173.31 3dfy s GLU 326 N 1.77 1.32 0.14 1.68 2.02 -1.26 -4.42 118.70 119.95 3dfy s GLU 326 Ca 0.10 -0.19 -0.31 0.00 0.02 0.00 0.00 54.97 54.58 3dfy s GLU 326 Cb -0.16 -1.38 -0.09 0.00 0.10 0.00 0.00 34.13 32.60 3dfy s GLU 326 CO 0.10 -0.22 1.52 1.49 0.02 0.00 0.00 175.26 178.17 3dfy h GLU 327 N 7.95 -0.23 -5.06 1.61 4.81 -2.02 -3.41 114.58 118.22 3dfy h GLU 327 Ca -0.29 0.02 -0.38 0.00 -0.13 0.00 0.00 59.36 58.57 3dfy h GLU 327 Cb 1.14 0.05 -0.23 0.00 0.63 0.00 0.00 28.75 30.34 3dfy h GLU 327 CO 0.39 -0.15 -0.77 0.54 -0.73 0.00 0.00 179.01 178.29 3dfy s VAL 328 N -5.48 0.92 0.28 0.32 0.11 -1.26 -5.12 120.40 110.16 3dfy s VAL 328 Ca -0.13 -1.04 -0.30 0.00 -2.93 0.00 0.00 61.98 57.58 3dfy s VAL 328 Cb 0.09 -0.88 -0.10 0.00 -1.53 0.00 0.00 36.38 33.96 3dfy s VAL 328 CO 0.59 -0.15 1.39 0.12 -3.33 0.00 0.00 175.10 173.73 3dfy s PHE 329 N -1.04 3.02 -0.11 1.54 5.36 -1.26 -4.93 117.98 120.56 3dfy s PHE 329 Ca -0.02 1.16 0.14 0.00 -0.96 0.00 0.00 56.93 57.25 3dfy s PHE 329 Cb -0.09 -3.77 0.26 0.00 -0.34 0.00 0.00 43.02 39.08 3dfy s PHE 329 CO 0.01 -2.39 1.13 0.54 -1.46 0.00 0.00 175.22 173.05 3dfy n ARG 330 N 1.81 1.00 -3.65 10.12 1.74 -1.26 -5.05 116.66 121.37 3dfy n ARG 330 Ca 0.04 -2.33 -0.34 0.00 -0.77 0.00 0.00 57.85 54.45 3dfy n ARG 330 Cb 0.41 -1.23 -0.05 0.00 -1.02 0.00 0.00 32.46 30.56 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 -2.50 2.29 -0.65 -0.13 0.00 -1.26 -3.90 107.32 101.16 3dfy s GLY 331 Ca 0.26 -0.48 -0.03 0.00 0.00 0.00 0.00 44.72 44.47 3dfy s GLY 331 CO -0.00 -0.31 2.51 0.28 0.00 0.00 0.00 173.10 175.58 3dfy n LYS 332 N 0.70 2.80 -3.94 2.90 5.02 -1.26 -4.87 118.16 119.52 3dfy n LYS 332 Ca -0.07 -2.84 -0.09 0.00 -2.02 0.00 0.00 58.31 53.29 3dfy n LYS 332 Cb 0.52 -2.23 -0.03 0.00 -0.02 0.00 0.00 35.03 33.27 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 -2.39 0.26 -0.21 2.13 -0.12 -1.26 -4.81 117.98 111.58 3dfy s PHE 333 Ca 0.56 -0.69 -0.06 0.00 -0.05 0.00 0.00 56.93 56.69 3dfy s PHE 333 Cb 0.37 0.42 -0.03 0.00 -0.63 0.00 0.00 43.02 43.15 3dfy s PHE 333 CO -0.26 -1.19 0.03 0.42 -0.05 0.00 0.00 175.22 174.17 3dfy s ILE 334 N -3.55 4.24 -0.30 -4.49 1.01 0.66 -4.96 121.20 113.80 3dfy s ILE 334 Ca 0.19 -0.21 -0.10 0.00 0.00 0.00 0.00 60.65 60.52 3dfy s ILE 334 Cb -0.03 -2.93 -0.02 0.00 0.01 0.00 0.00 42.46 39.49 3dfy s ILE 334 CO 0.10 0.41 0.17 -1.58 0.00 0.00 0.00 174.94 174.05 3dfy s GLN 335 N 0.98 3.54 -0.48 2.79 2.00 -1.26 -1.16 119.66 126.07 3dfy s GLN 335 Ca 0.03 -0.59 0.03 0.00 -2.00 0.00 0.00 55.36 52.83 3dfy s GLN 335 Cb -0.14 -3.61 0.15 0.00 0.80 0.00 0.00 33.01 30.21 3dfy s GLN 335 CO 0.02 -0.34 0.29 0.34 -0.50 0.00 0.00 175.29 175.10 3dfy s ASP 336 N 1.67 3.55 0.48 6.67 2.15 0.10 -5.02 116.67 126.28 3dfy s ASP 336 Ca 0.06 -2.89 0.00 0.00 0.43 0.00 0.00 52.55 50.14 3dfy s ASP 336 Cb -0.17 -1.07 0.00 0.00 -0.30 0.00 0.00 42.92 41.39 3dfy s ASP 336 CO 0.08 -0.22 0.00 0.61 -0.17 0.00 0.00 175.17 175.46 3dfy n GLY 337 N 3.18 1.63 0.00 2.66 0.00 -1.26 -2.05 105.19 109.35 3dfy n GLY 337 Ca 0.13 -0.66 0.12 0.00 0.00 0.00 0.00 46.02 45.62 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 12.96 0.70 -3.97 1.61 -0.04 -1.26 -4.82 135.00 140.17 3dfy n PRO 338 Ca 0.00 0.01 -0.32 0.00 -0.04 0.00 0.00 63.50 63.16 3dfy n PRO 338 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 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 -2.11 3.25 -0.05 0.54 0.52 -0.87 -0.53 118.95 119.70 3dfy s ARG 339 Ca 0.35 -0.48 0.02 0.00 -0.52 0.00 0.00 55.73 55.10 3dfy s ARG 339 Cb 0.17 -2.95 0.01 0.00 0.52 0.00 0.00 34.95 32.70 3dfy s ARG 339 CO 0.30 0.62 -0.10 -1.64 0.02 0.00 0.00 175.30 174.50 3dfy s MET 340 N -2.24 1.40 0.26 3.54 -1.94 -0.02 0.01 119.30 120.32 3dfy s MET 340 Ca 0.30 -0.35 0.02 0.00 -1.71 0.00 0.00 55.69 53.95 3dfy s MET 340 Cb -0.13 -1.21 -0.05 0.00 2.01 0.00 0.00 34.83 35.45 3dfy s MET 340 CO 0.22 0.04 0.09 1.03 -0.01 0.00 0.00 175.02 176.39 3dfy s ARG 341 N 0.59 1.43 -0.01 2.03 0.52 -0.31 -1.07 118.95 122.13 3dfy s ARG 341 Ca -0.11 -1.77 -0.01 0.00 -0.52 0.00 0.00 55.73 53.31 3dfy s ARG 341 Cb -0.14 -0.34 -0.04 0.00 0.52 0.00 0.00 34.95 34.96 3dfy s ARG 341 CO 0.02 -0.28 0.09 0.54 0.02 0.00 0.00 175.30 175.69 3dfy s VAL 342 N -3.70 4.79 -2.61 3.52 0.11 -1.23 -0.24 120.40 121.03 3dfy s VAL 342 Ca 0.37 -0.36 0.21 0.00 -2.93 0.00 0.00 61.98 59.27 3dfy s VAL 342 Cb 0.08 -3.18 0.17 0.00 -1.53 0.00 0.00 36.38 31.91 3dfy s VAL 342 CO 0.14 0.37 1.16 1.17 -3.33 0.00 0.00 175.10 174.61