#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 3.55 -0.03 0.55 1.01 -0.63 -0.64 121.20 125.01 3dfy s ILE 4 Ca 0.00 1.08 0.10 0.00 0.00 0.00 0.00 60.65 61.83 3dfy s ILE 4 Cb 0.00 -3.69 -0.15 0.00 0.01 0.00 0.00 42.46 38.63 3dfy s ILE 4 CO 0.00 0.06 0.18 1.33 0.00 0.00 0.00 174.94 176.51 3dfy n VAL 5 N 4.11 0.14 -3.61 2.92 0.24 0.79 -0.35 118.33 122.56 3dfy n VAL 5 Ca 0.11 -0.27 -0.16 0.00 -2.04 0.00 0.00 64.34 61.99 3dfy n VAL 5 Cb 0.43 0.04 -0.07 0.00 -1.47 0.00 0.00 33.84 32.77 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 -3.39 -0.55 -0.07 -1.34 2.47 -0.98 -4.93 114.94 106.15 3dfy s ASN 6 Ca -0.04 0.73 -0.00 0.00 0.42 0.00 0.00 52.86 53.97 3dfy s ASN 6 Cb 0.06 0.69 0.03 0.00 -1.45 0.00 0.00 41.25 40.58 3dfy s ASN 6 CO 0.41 -0.46 -0.02 -0.69 -3.72 0.00 0.00 177.10 172.62 3dfy s VAL 7 N -0.79 0.48 -0.02 -5.21 1.01 -1.26 -0.34 120.40 114.27 3dfy s VAL 7 Ca -0.08 0.01 0.07 0.00 0.00 0.00 0.00 61.98 61.98 3dfy s VAL 7 Cb -0.02 -0.58 -0.02 0.00 0.00 0.00 0.00 36.38 35.76 3dfy s VAL 7 CO 0.06 0.26 -0.23 -0.54 0.00 0.00 0.00 175.10 174.65 3dfy s LYS 8 N 1.61 1.92 -0.14 2.72 1.02 0.44 -4.77 119.74 122.55 3dfy s LYS 8 Ca -0.00 -0.82 0.00 0.00 0.02 0.00 0.00 55.97 55.17 3dfy s LYS 8 Cb -0.13 -1.82 -0.01 0.00 -0.52 0.00 0.00 37.83 35.35 3dfy s LYS 8 CO -0.04 0.48 -0.14 -0.51 -0.92 0.00 0.00 175.35 174.22 3dfy s LEU 9 N -0.49 2.59 -0.03 3.17 1.02 -1.26 -0.82 118.68 122.86 3dfy s LEU 9 Ca 0.08 -0.39 0.02 0.00 0.02 0.00 0.00 54.13 53.85 3dfy s LEU 9 Cb -0.09 -1.58 0.01 0.00 0.02 0.00 0.00 46.19 44.55 3dfy s LEU 9 CO -0.00 0.14 -0.07 -0.44 0.02 0.00 0.00 176.35 176.00 3dfy s SER 10 N 0.52 1.01 0.20 2.29 0.01 -0.42 -4.96 113.70 112.35 3dfy s SER 10 Ca -0.10 -0.15 -0.30 0.00 1.31 0.00 0.00 55.95 56.71 3dfy s SER 10 Cb -0.16 -0.36 -0.09 0.00 0.21 0.00 0.00 66.02 65.62 3dfy s SER 10 CO 0.04 0.01 1.26 -0.22 0.41 0.00 0.00 173.24 174.74 3dfy s LEU 11 N 0.49 4.43 -0.11 2.44 2.96 -1.26 -0.73 118.68 126.90 3dfy s LEU 11 Ca -0.07 2.35 -0.01 0.00 -0.22 0.00 0.00 54.13 56.18 3dfy s LEU 11 Cb -0.11 -3.61 0.03 0.00 0.50 0.00 0.00 46.19 43.01 3dfy s LEU 11 CO 0.00 -0.46 -0.01 -0.54 -1.32 0.00 0.00 176.35 174.03 3dfy s LYS 12 N -0.30 0.84 -0.04 1.98 -0.14 0.57 -4.90 119.74 117.75 3dfy s LYS 12 Ca 0.54 -0.09 -0.06 0.00 -1.36 0.00 0.00 55.97 55.00 3dfy s LYS 12 Cb -0.35 -1.35 -0.04 0.00 -1.68 0.00 0.00 37.83 34.41 3dfy s LYS 12 CO 0.38 -0.36 0.20 1.03 -0.76 0.00 0.00 175.35 175.85 3dfy s ARG 13 N 1.88 3.51 -0.04 1.68 0.52 -1.26 -0.66 118.95 124.58 3dfy s ARG 13 Ca 0.04 -0.14 0.01 0.00 -0.52 0.00 0.00 55.73 55.11 3dfy s ARG 13 Cb -0.13 -3.13 0.02 0.00 0.52 0.00 0.00 34.95 32.23 3dfy s ARG 13 CO -0.06 0.71 -0.02 0.71 0.02 0.00 0.00 175.30 176.65 3dfy s TYR 14 N -1.20 0.54 -0.03 -0.53 2.02 -0.06 -4.98 117.35 113.10 3dfy s TYR 14 Ca 0.23 -0.10 -0.22 0.00 -0.37 0.00 0.00 57.07 56.61 3dfy s TYR 14 Cb -0.13 -0.55 -0.05 0.00 -0.40 0.00 0.00 41.96 40.83 3dfy s TYR 14 CO 0.12 -0.17 0.64 -2.00 -1.57 0.00 0.00 175.55 172.57 3dfy s GLU 15 N 1.03 4.38 0.53 -0.62 2.12 -1.26 0.03 118.70 124.91 3dfy s GLU 15 Ca -0.09 0.79 -0.18 0.00 0.36 0.00 0.00 54.97 55.85 3dfy s GLU 15 Cb -0.14 -3.39 -0.07 0.00 0.26 0.00 0.00 34.13 30.80 3dfy s GLU 15 CO -0.01 0.24 1.03 0.71 -0.54 0.00 0.00 175.26 176.68 3dfy s TYR 16 N 0.24 3.12 0.19 5.30 2.02 -1.26 -0.94 117.35 126.01 3dfy s TYR 16 Ca 0.33 1.53 0.03 0.00 -0.37 0.00 0.00 57.07 58.60 3dfy s TYR 16 Cb -0.18 -2.96 0.09 0.00 -0.40 0.00 0.00 41.96 38.50 3dfy s TYR 16 CO 0.17 -0.77 1.44 1.49 -1.57 0.00 0.00 175.55 176.31 3dfy h GLU 17 N 1.02 0.21 -3.82 -0.62 4.57 -1.45 -3.46 114.58 111.03 3dfy h GLU 17 Ca -0.48 -0.20 -0.12 0.00 -1.18 0.00 0.00 59.36 57.38 3dfy h GLU 17 Cb 1.21 0.05 -0.17 0.00 -0.16 0.00 0.00 28.75 29.68 3dfy h GLU 17 CO 0.59 0.89 -0.51 0.15 -1.18 0.00 0.00 179.01 178.95 3dfy s LYS 18 N -3.41 0.62 -0.23 1.92 -0.14 -1.26 -5.16 119.74 112.09 3dfy s LYS 18 Ca -0.03 -0.80 -0.28 0.00 -1.36 0.00 0.00 55.97 53.49 3dfy s LYS 18 Cb 0.11 0.24 -0.04 0.00 -1.68 0.00 0.00 37.83 36.46 3dfy s LYS 18 CO 0.82 -0.16 2.08 -2.14 -0.76 0.00 0.00 175.35 175.19 3dfy s PRO 19 N -2.83 3.26 -0.10 -1.68 0.02 -1.26 -5.14 135.00 127.27 3dfy s PRO 19 Ca -0.03 1.91 -0.25 0.00 0.02 0.00 0.00 61.00 62.65 3dfy s PRO 19 Cb 0.00 -4.31 -0.03 0.00 0.02 0.00 0.00 34.50 30.19 3dfy s PRO 19 CO -0.06 -1.95 0.79 -2.00 -0.33 0.00 0.00 177.00 173.45 3dfy s GLU 29 N 6.01 4.40 -0.28 5.54 2.12 -1.26 -5.12 118.70 130.11 3dfy s GLU 29 Ca 0.94 1.00 -0.13 0.00 0.36 0.00 0.00 54.97 57.14 3dfy s GLU 29 Cb -0.31 -3.50 -0.04 0.00 0.26 0.00 0.00 34.13 30.54 3dfy s GLU 29 CO 0.35 -0.10 0.28 0.45 -0.54 0.00 0.00 175.26 175.69 3dfy s SER 30 N 0.97 6.13 -0.39 -1.70 0.15 0.10 -4.91 113.70 114.06 3dfy s SER 30 Ca 0.40 0.12 -0.10 0.00 0.70 0.00 0.00 55.95 57.07 3dfy s SER 30 Cb -0.18 -2.16 0.05 0.00 -1.71 0.00 0.00 66.02 62.02 3dfy s SER 30 CO 0.17 -0.12 0.23 -0.13 1.20 0.00 0.00 173.24 174.59 3dfy s ARG 31 N 1.91 2.72 0.45 5.44 0.52 -1.26 -0.89 118.95 127.84 3dfy s ARG 31 Ca 0.11 -1.25 0.07 0.00 -0.52 0.00 0.00 55.73 54.13 3dfy s ARG 31 Cb -0.16 -3.74 -0.02 0.00 0.52 0.00 0.00 34.95 31.54 3dfy s ARG 31 CO 0.11 -0.81 0.28 -0.80 0.02 0.00 0.00 175.30 174.09 3dfy s ASN 32 N 1.81 4.65 -0.23 0.23 0.01 0.16 -4.68 114.94 116.88 3dfy s ASN 32 Ca 0.02 -1.03 0.02 0.00 -0.71 0.00 0.00 52.86 51.15 3dfy s ASN 32 Cb -0.21 -0.28 0.05 0.00 0.41 0.00 0.00 41.25 41.22 3dfy s ASN 32 CO 0.04 -0.71 -0.10 -0.69 -1.51 0.00 0.00 177.10 174.14 3dfy s VAL 33 N -2.61 1.85 0.18 1.60 1.01 -0.40 -0.32 120.40 121.71 3dfy s VAL 33 Ca 0.41 -1.34 -0.26 0.00 0.00 0.00 0.00 61.98 60.79 3dfy s VAL 33 Cb 0.00 -1.99 -0.08 0.00 0.00 0.00 0.00 36.38 34.32 3dfy s VAL 33 CO 0.23 0.02 0.81 -0.70 0.00 0.00 0.00 175.10 175.46 3dfy s GLU 34 N 1.26 4.62 -0.11 2.72 2.12 0.09 -0.51 118.70 128.89 3dfy s GLU 34 Ca -0.06 1.22 0.01 0.00 0.36 0.00 0.00 54.97 56.51 3dfy s GLU 34 Cb -0.18 -3.27 -0.01 0.00 0.26 0.00 0.00 34.13 30.92 3dfy s GLU 34 CO -0.06 0.55 -0.16 0.08 -0.54 0.00 0.00 175.26 175.13 3dfy s VAL 35 N -1.12 2.83 -0.13 3.70 1.01 0.47 -1.30 120.40 125.85 3dfy s VAL 35 Ca 0.37 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.62 3dfy s VAL 35 Cb -0.24 -2.16 0.01 0.00 0.00 0.00 0.00 36.38 34.00 3dfy s VAL 35 CO 0.27 0.54 -0.20 -0.70 0.00 0.00 0.00 175.10 175.01 3dfy s GLU 36 N 0.21 2.76 -0.18 2.72 2.12 -0.00 -1.35 118.70 124.98 3dfy s GLU 36 Ca -0.10 -0.76 -0.03 0.00 0.36 0.00 0.00 54.97 54.44 3dfy s GLU 36 Cb -0.16 -2.25 -0.02 0.00 0.26 0.00 0.00 34.13 31.97 3dfy s GLU 36 CO 0.06 -0.02 -0.07 0.42 -0.54 0.00 0.00 175.26 175.11 3dfy s ILE 37 N 0.85 3.43 -0.17 -3.70 1.01 0.01 -0.42 121.20 122.21 3dfy s ILE 37 Ca -0.07 -0.50 -0.04 0.00 0.00 0.00 0.00 60.65 60.03 3dfy s ILE 37 Cb -0.15 -2.51 -0.02 0.00 0.01 0.00 0.00 42.46 39.78 3dfy s ILE 37 CO -0.01 0.47 -0.04 -0.69 0.00 0.00 0.00 174.94 174.67 3dfy s VAL 38 N 0.84 3.80 0.16 2.92 1.01 0.54 -0.72 120.40 128.95 3dfy s VAL 38 Ca -0.02 -0.38 -0.00 0.00 0.00 0.00 0.00 61.98 61.58 3dfy s VAL 38 Cb -0.15 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 3dfy s VAL 38 CO 0.01 0.48 0.33 -0.76 0.00 0.00 0.00 175.10 175.16 3dfy s LEU 39 N 0.57 4.29 0.53 3.92 1.02 -0.12 -0.15 118.68 128.73 3dfy s LEU 39 Ca -0.03 0.33 0.35 0.00 0.02 0.00 0.00 54.13 54.81 3dfy s LEU 39 Cb -0.14 -3.08 1.91 0.00 0.02 0.00 0.00 46.19 44.91 3dfy s LEU 39 CO 0.03 0.03 2.08 1.05 0.02 0.00 0.00 176.35 179.55 3dfy h GLU 40 N 2.32 0.00 0.00 1.70 4.11 -1.20 0.39 114.58 121.90 3dfy h GLU 40 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 3dfy h GLU 40 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3dfy h GLU 40 CO 0.70 0.00 -0.12 -1.13 0.07 0.00 0.00 179.01 178.53 3dfy n SER 41 N -2.75 0.76 0.00 3.06 3.41 -1.26 -4.93 113.62 111.92 3dfy n SER 41 Ca -0.02 0.48 0.00 0.00 -0.26 0.00 0.00 58.87 59.07 3dfy n SER 41 Cb 0.07 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.42 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 1.32 2.89 3.76 5.00 0.00 0.14 -5.07 105.19 113.23 3dfy n GLY 42 Ca 0.05 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 -2.63 2.34 -0.08 1.61 1.01 -1.26 -4.72 120.40 116.67 3dfy s VAL 43 Ca 0.00 0.28 0.03 0.00 0.00 0.00 0.00 61.98 62.29 3dfy s VAL 43 Cb 0.00 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.23 3dfy s VAL 43 CO 0.00 0.03 -0.18 -0.54 0.00 0.00 0.00 175.10 174.41 3dfy s LYS 44 N -2.53 2.33 -0.01 2.72 1.02 -1.26 -0.95 119.74 121.07 3dfy s LYS 44 Ca 0.63 -0.64 0.04 0.00 0.02 0.00 0.00 55.97 56.02 3dfy s LYS 44 Cb -0.40 -1.83 -0.03 0.00 -0.52 0.00 0.00 37.83 35.05 3dfy s LYS 44 CO 0.50 0.11 -0.12 0.20 -0.92 0.00 0.00 175.35 175.11 3dfy s GLY 45 N 0.49 1.62 -0.02 -3.33 0.00 0.11 -4.66 107.32 101.53 3dfy s GLY 45 Ca -0.16 -1.04 0.05 0.00 0.00 0.00 0.00 44.72 43.57 3dfy s GLY 45 CO 0.06 -0.88 -0.19 -0.19 0.00 0.00 0.00 173.10 171.91 3dfy s TYR 46 N -0.87 1.74 0.23 1.90 2.02 -1.26 -0.81 117.35 120.29 3dfy s TYR 46 Ca 0.14 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.46 3dfy s TYR 46 Cb -0.11 -1.13 -0.05 0.00 -0.40 0.00 0.00 41.96 40.27 3dfy s TYR 46 CO 0.04 -0.07 0.10 0.20 -1.57 0.00 0.00 175.55 174.25 3dfy s GLY 47 N -0.31 1.57 -0.04 0.71 0.00 -0.46 -4.15 107.32 104.64 3dfy s GLY 47 Ca 0.04 -1.78 -0.03 0.00 0.00 0.00 0.00 44.72 42.96 3dfy s GLY 47 CO 0.00 -1.51 0.11 1.85 0.00 0.00 0.00 173.10 173.55 3dfy s GLU 48 N -4.08 0.09 -0.26 2.90 2.12 -1.26 -0.40 118.70 117.81 3dfy s GLU 48 Ca 0.37 0.22 -0.07 0.00 0.36 0.00 0.00 54.97 55.85 3dfy s GLU 48 Cb 0.07 -0.07 -0.02 0.00 0.26 0.00 0.00 34.13 34.38 3dfy s GLU 48 CO 0.12 -0.09 0.07 0.00 -0.54 0.00 0.00 175.26 174.83 3dfy s ALA 49 N 0.57 3.13 -0.69 6.30 0.00 0.33 -4.40 121.76 127.00 3dfy s ALA 49 Ca -0.04 -1.22 -0.03 0.00 0.00 0.00 0.00 51.96 50.66 3dfy s ALA 49 Cb -0.06 -2.10 0.18 0.00 0.00 0.00 0.00 23.12 21.14 3dfy s ALA 49 CO -0.02 -0.61 0.53 0.45 0.00 0.00 0.00 175.76 176.10 3dfy s SER 50 N 1.58 5.46 0.74 0.00 0.15 -1.26 -1.27 113.70 119.10 3dfy s SER 50 Ca 0.05 -3.03 -0.14 0.00 0.70 0.00 0.00 55.95 53.54 3dfy s SER 50 Cb -0.16 -1.88 0.05 0.00 -1.71 0.00 0.00 66.02 62.32 3dfy s SER 50 CO 0.03 -0.34 1.16 -2.16 1.20 0.00 0.00 173.24 173.14 3dfy s PRO 51 N -0.32 2.14 -0.11 5.44 0.04 -1.26 -4.63 135.00 136.30 3dfy s PRO 51 Ca 0.19 1.59 -0.01 0.00 0.04 0.00 0.00 61.00 62.80 3dfy s PRO 51 Cb -0.17 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.55 3dfy s PRO 51 CO -0.05 -1.80 -0.01 0.45 0.04 0.00 0.00 177.00 175.63 3dfy s SER 52 N -2.38 1.99 0.02 6.66 0.15 -1.26 -4.90 113.70 113.97 3dfy s SER 52 Ca 0.70 -0.28 -0.22 0.00 0.70 0.00 0.00 55.95 56.85 3dfy s SER 52 Cb -0.25 -0.56 -0.16 0.00 -1.71 0.00 0.00 66.02 63.33 3dfy s SER 52 CO 0.47 -0.20 1.33 0.15 1.20 0.00 0.00 173.24 176.19 3dfy h PHE 53 N 8.28 0.27 -0.15 3.44 3.57 -1.85 -0.80 116.94 129.70 3dfy h PHE 53 Ca -0.21 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.21 3dfy h PHE 53 Cb 1.12 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.80 3dfy h PHE 53 CO 0.44 0.63 0.09 -0.09 -2.23 0.00 0.00 178.31 177.15 3dfy h ARG 54 N -0.18 0.21 0.03 1.11 2.43 -1.94 0.19 114.38 116.24 3dfy h ARG 54 Ca 0.02 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 3dfy h ARG 54 Cb 0.58 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 3dfy h ARG 54 CO 0.02 0.20 -0.55 0.28 -1.51 0.00 0.00 179.97 178.41 3dfy h VAL 55 N 0.16 1.48 -0.01 0.20 2.07 -1.98 -3.40 116.25 114.77 3dfy h VAL 55 Ca 0.05 -2.34 0.00 0.00 0.82 0.00 0.00 66.70 65.23 3dfy h VAL 55 Cb 0.05 3.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 3dfy h VAL 55 CO -0.01 0.57 -0.45 0.59 0.02 0.00 0.00 177.57 178.29 3dfy n ASN 56 N -4.43 1.51 -0.08 0.57 3.02 -0.42 -4.98 115.26 110.46 3dfy n ASN 56 Ca -0.17 -1.26 -0.01 0.00 -0.03 0.00 0.00 54.58 53.11 3dfy n ASN 56 Cb 0.62 0.58 -0.00 0.00 -0.61 0.00 0.00 39.78 40.36 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 1.24 0.40 3.87 7.41 0.00 0.68 -4.94 105.19 113.85 3dfy n GLY 57 Ca 0.06 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.00 3.68 -0.02 1.61 2.02 -0.91 -4.84 118.70 119.23 3dfy s GLU 58 Ca 0.00 0.68 0.01 0.00 0.02 0.00 0.00 54.97 55.68 3dfy s GLU 58 Cb 0.00 -2.17 0.01 0.00 0.10 0.00 0.00 34.13 32.07 3dfy s GLU 58 CO 0.00 -0.40 -0.04 1.03 0.02 0.00 0.00 175.26 175.87 3dfy s ARG 59 N -4.76 0.56 0.42 1.61 0.52 -1.26 -2.85 118.95 113.19 3dfy s ARG 59 Ca 0.54 -0.11 0.16 0.00 -0.52 0.00 0.00 55.73 55.80 3dfy s ARG 59 Cb -0.11 -0.59 1.06 0.00 0.52 0.00 0.00 34.95 35.83 3dfy s ARG 59 CO 0.46 -0.00 1.90 -0.24 0.02 0.00 0.00 175.30 177.44 3dfy h VAL 60 N 5.69 0.77 -0.15 3.52 3.04 -1.94 -1.10 116.25 126.08 3dfy h VAL 60 Ca -0.35 -0.14 -0.12 0.00 -1.01 0.00 0.00 66.70 65.08 3dfy h VAL 60 Cb 1.16 0.31 -0.01 0.00 -2.01 0.00 0.00 31.29 30.74 3dfy h VAL 60 CO 0.49 0.08 -0.41 -0.33 -1.01 0.00 0.00 177.57 176.38 3dfy h GLU 61 N 0.42 0.34 -0.51 4.17 3.07 -1.98 -2.50 114.58 117.58 3dfy h GLU 61 Ca 0.40 -0.17 -0.12 0.00 -0.50 0.00 0.00 59.36 58.97 3dfy h GLU 61 Cb 0.93 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.82 3dfy h GLU 61 CO -0.13 0.70 -0.15 0.00 -1.40 0.00 0.00 179.01 178.03 3dfy h ALA 62 N 1.29 0.70 0.37 3.43 0.00 -1.63 -1.69 119.26 121.72 3dfy h ALA 62 Ca 0.02 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 3dfy h ALA 62 Cb 0.85 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3dfy h ALA 62 CO 0.07 0.64 -0.18 -0.07 0.00 0.00 0.00 179.25 179.71 3dfy h LEU 63 N 0.86 -0.42 -1.52 0.00 4.07 -1.29 -2.63 115.31 114.37 3dfy h LEU 63 Ca 0.13 0.01 0.10 0.00 0.08 0.00 0.00 57.88 58.19 3dfy h LEU 63 Cb 0.72 0.11 -0.04 0.00 1.08 0.00 0.00 40.66 42.52 3dfy h LEU 63 CO 0.05 -0.29 0.45 -0.07 -1.08 0.00 0.00 178.44 177.51 3dfy h LEU 64 N -0.51 0.48 -2.03 1.67 3.38 -1.40 -2.00 115.31 114.91 3dfy h LEU 64 Ca -0.05 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 3dfy h LEU 64 Cb 0.39 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 3dfy h LEU 64 CO 0.08 0.29 -0.02 0.00 0.09 0.00 0.00 178.44 178.88 3dfy h ALA 65 N 1.66 1.03 -0.52 1.53 0.00 -0.93 -3.05 119.26 118.98 3dfy h ALA 65 Ca 0.31 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 3dfy h ALA 65 Cb 0.51 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3dfy h ALA 65 CO -0.10 0.02 0.05 0.44 0.00 0.00 0.00 179.25 179.66 3dfy n ILE 66 N -3.15 2.68 -0.16 0.00 -5.35 -0.75 -4.67 119.36 107.96 3dfy n ILE 66 Ca -0.01 -1.61 -0.02 0.00 -0.27 0.00 0.00 62.75 60.85 3dfy n ILE 66 Cb 0.22 -0.29 0.06 0.00 -1.74 0.00 0.00 39.64 37.90 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 3.15 0.15 -0.34 6.28 4.81 -1.66 -1.72 114.58 125.24 3dfy h GLU 67 Ca 0.05 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.32 3dfy h GLU 67 Cb 1.91 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 31.21 3dfy h GLU 67 CO 0.47 0.10 0.10 -0.91 -0.73 0.00 0.00 179.01 178.03 3dfy h ASN 68 N 0.15 0.08 -0.67 1.04 2.35 -1.88 -0.37 115.58 116.27 3dfy h ASN 68 Ca 0.26 0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 56.03 3dfy h ASN 68 Cb 0.38 0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.76 3dfy h ASN 68 CO -0.40 0.08 0.35 0.00 -1.65 0.00 0.00 177.43 175.81 3dfy h ALA 69 N 1.24 0.87 -0.76 -0.83 0.00 -1.82 0.13 119.26 118.09 3dfy h ALA 69 Ca 0.16 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3dfy h ALA 69 Cb 0.15 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3dfy h ALA 69 CO -0.18 0.40 0.32 0.28 0.00 0.00 0.00 179.25 180.07 3dfy h VAL 70 N 0.93 1.25 -0.34 0.00 2.07 -0.86 0.16 116.25 119.47 3dfy h VAL 70 Ca 0.23 -0.78 -0.13 0.00 0.82 0.00 0.00 66.70 66.84 3dfy h VAL 70 Cb 0.08 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 3dfy h VAL 70 CO -0.03 0.32 -0.30 -0.09 0.02 0.00 0.00 177.57 177.48 3dfy h ARG 71 N 1.10 0.80 -0.81 1.57 2.43 -0.71 -3.02 114.38 115.75 3dfy h ARG 71 Ca 0.26 -0.41 -0.03 0.00 -0.81 0.00 0.00 59.98 58.99 3dfy h ARG 71 Cb 0.19 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.72 3dfy h ARG 71 CO -0.02 1.04 0.39 1.49 -1.51 0.00 0.00 179.97 181.36 3dfy h GLU 72 N 0.59 1.16 -0.38 0.20 4.22 -0.42 -0.70 114.58 119.25 3dfy h GLU 72 Ca 0.06 -0.17 0.01 0.00 0.08 0.00 0.00 59.36 59.34 3dfy h GLU 72 Cb 0.88 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 3dfy h GLU 72 CO 0.08 0.89 0.25 0.52 -2.18 0.00 0.00 179.01 178.57 3dfy h MET 73 N 1.15 0.46 0.00 1.92 2.86 -0.55 -3.34 114.93 117.43 3dfy h MET 73 Ca 0.28 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 3dfy h MET 73 Cb 0.11 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.67 3dfy h MET 73 CO -0.04 0.31 0.00 0.44 1.06 0.00 0.00 176.91 178.68 3dfy n ILE 74 N -4.48 0.00 -1.97 -1.22 -5.35 -1.12 -5.01 119.36 100.21 3dfy n ILE 74 Ca 0.03 -0.35 -0.41 0.00 -0.27 0.00 0.00 62.75 61.75 3dfy n ILE 74 Cb 0.09 1.20 -0.01 0.00 -1.74 0.00 0.00 39.64 39.18 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 -0.22 2.42 0.00 7.28 2.01 -0.28 -2.25 115.64 124.59 3dfy s THR 75 Ca 0.00 0.41 0.00 0.00 0.31 0.00 0.00 61.69 62.41 3dfy s THR 75 Cb 0.00 -3.26 0.00 0.00 0.01 0.00 0.00 72.50 69.25 3dfy s THR 75 CO 0.00 0.10 0.00 0.61 -0.69 0.00 0.00 174.62 174.64 3dfy n GLY 76 N 0.81 2.59 3.72 4.40 0.00 0.52 -4.96 105.19 112.28 3dfy n GLY 76 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.46 4.84 0.05 -0.61 1.01 -0.96 -4.56 121.20 118.52 3dfy s ILE 77 Ca 0.00 1.74 -0.31 0.00 0.00 0.00 0.00 60.65 62.08 3dfy s ILE 77 Cb 0.00 -4.17 -0.05 0.00 0.01 0.00 0.00 42.46 38.24 3dfy s ILE 77 CO 0.00 0.27 1.21 -0.62 0.00 0.00 0.00 174.94 175.80 3dfy s ASP 78 N 0.52 7.06 0.47 3.58 -1.08 -1.26 -1.61 116.67 124.34 3dfy s ASP 78 Ca 0.43 2.01 0.30 0.00 -0.52 0.00 0.00 52.55 54.77 3dfy s ASP 78 Cb -0.20 -2.58 1.62 0.00 -1.46 0.00 0.00 42.92 40.30 3dfy s ASP 78 CO 0.24 -0.50 1.90 -0.37 0.52 0.00 0.00 175.17 176.96 3dfy h VAL 79 N 4.57 0.00 0.00 1.11 -1.51 -1.94 0.65 116.25 119.12 3dfy h VAL 79 Ca -0.41 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 3dfy h VAL 79 Cb 1.21 0.66 0.00 0.00 -2.13 0.00 0.00 31.29 31.03 3dfy h VAL 79 CO 0.82 0.00 0.00 -2.11 -1.23 0.00 0.00 177.57 175.05 3dfy n ARG 80 N -2.58 0.14 -1.64 5.19 1.85 -1.26 -1.89 116.66 116.47 3dfy n ARG 80 Ca -0.02 0.30 -0.31 0.00 -1.00 0.00 0.00 57.85 56.82 3dfy n ARG 80 Cb 0.09 -1.73 0.05 0.00 -1.05 0.00 0.00 32.46 29.83 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 -1.99 6.66 0.11 2.89 3.02 0.22 -4.79 115.26 121.38 3dfy n ASN 81 Ca 0.04 -3.78 0.20 0.00 -0.03 0.00 0.00 54.58 51.01 3dfy n ASN 81 Cb 0.26 -0.75 0.75 0.00 -0.61 0.00 0.00 39.78 39.44 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 2.14 0.00 0.00 3.10 -0.00 -1.52 0.62 116.97 121.32 3dfy h TYR 82 Ca 0.52 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 59.21 3dfy h TYR 82 Cb 1.01 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.74 3dfy h TYR 82 CO 1.20 0.00 -0.17 0.00 -0.00 0.00 0.00 178.16 179.20 3dfy h ALA 83 N 1.52 1.66 -0.13 0.10 0.00 -1.88 0.16 119.26 120.69 3dfy h ALA 83 Ca 0.18 -0.15 -0.22 0.00 0.00 0.00 0.00 54.91 54.72 3dfy h ALA 83 Cb 1.02 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.79 3dfy h ALA 83 CO -0.00 0.21 -0.78 0.00 0.00 0.00 0.00 179.25 178.68 3dfy h ARG 84 N 0.00 0.71 -0.61 0.00 3.08 -1.27 -1.46 114.38 114.83 3dfy h ARG 84 Ca -0.00 -0.59 -0.07 0.00 0.07 0.00 0.00 59.98 59.39 3dfy h ARG 84 Cb 0.31 0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 3dfy h ARG 84 CO 0.02 1.20 0.10 0.82 -1.07 0.00 0.00 179.97 181.04 3dfy h ILE 85 N 0.48 1.25 -0.19 2.04 2.04 -1.28 -1.74 117.51 120.12 3dfy h ILE 85 Ca -0.05 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 3dfy h ILE 85 Cb 1.40 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 3dfy h ILE 85 CO 0.16 0.36 0.07 -0.26 0.00 0.00 0.00 178.15 178.48 3dfy h PHE 86 N 0.93 0.30 -0.44 1.37 -1.00 -0.59 -0.86 116.94 116.64 3dfy h PHE 86 Ca 0.19 -0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.94 3dfy h PHE 86 Cb 0.40 -0.09 -0.02 0.00 3.61 0.00 0.00 35.95 39.85 3dfy h PHE 86 CO 0.03 0.35 0.27 1.49 -1.61 0.00 0.00 178.31 178.84 3dfy h GLU 87 N 0.15 0.60 -0.44 1.51 4.81 -1.08 -1.30 114.58 118.84 3dfy h GLU 87 Ca 0.06 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3dfy h GLU 87 Cb 0.19 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 3dfy h GLU 87 CO -0.00 0.44 0.22 0.82 -0.73 0.00 0.00 179.01 179.75 3dfy h ILE 88 N 0.59 1.17 0.00 2.32 2.04 -1.23 -2.45 117.51 119.95 3dfy h ILE 88 Ca 0.16 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.54 3dfy h ILE 88 Cb -0.00 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 3dfy h ILE 88 CO -0.03 0.19 0.00 0.35 0.00 0.00 0.00 178.15 178.66 3dfy n THR 89 N -4.67 0.78 0.31 -0.27 -2.24 -0.34 -1.87 114.28 105.97 3dfy n THR 89 Ca 0.01 0.14 0.15 0.00 -2.27 0.00 0.00 64.05 62.08 3dfy n THR 89 Cb 0.10 -1.01 0.70 0.00 -2.10 0.00 0.00 70.33 68.03 3dfy n THR 89 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3dfy h ASP 90 N 0.00 0.00 0.60 3.42 3.32 -0.73 -1.22 116.42 121.81 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 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 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 -2.65 0.05 -1.05 3.56 1.74 -0.78 -2.90 116.66 114.62 3dfy n ARG 91 Ca 0.00 0.27 -0.22 0.00 -0.77 0.00 0.00 57.85 57.14 3dfy n ARG 91 Cb 0.19 -1.59 0.04 0.00 -1.02 0.00 0.00 32.46 30.08 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 -1.68 6.75 0.17 0.55 4.77 -0.46 -4.58 117.00 122.51 3dfy n LEU 92 Ca 0.03 -3.59 0.13 0.00 -0.03 0.00 0.00 56.01 52.55 3dfy n LEU 92 Cb 0.20 -1.06 0.60 0.00 -2.33 0.00 0.00 43.42 40.84 3dfy n LEU 92 CO 0.16 1.32 0.87 2.19 -1.33 0.00 0.00 177.39 180.61 3dfy h PHE 93 N 1.72 0.00 -0.01 -1.77 -5.15 -1.76 0.35 116.94 110.32 3dfy h PHE 93 Ca 0.37 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.14 3dfy h PHE 93 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.03 3dfy h PHE 93 CO 1.00 0.00 -0.34 0.41 -2.00 0.00 0.00 178.31 177.38 3dfy n GLY 94 N -0.71 -0.71 2.44 6.09 0.00 -1.26 -4.10 105.19 106.94 3dfy n GLY 94 Ca -0.00 -0.41 -0.19 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.80 1.34 -0.28 1.61 3.72 0.10 -4.76 117.46 118.39 3dfy n PHE 95 Ca 0.10 -3.64 0.09 0.00 -0.05 0.00 0.00 57.45 53.96 3dfy n PHE 95 Cb 0.35 -0.41 0.33 0.00 -0.94 0.00 0.00 39.48 38.82 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 0.78 -0.18 -1.08 0.13 -1.68 -0.77 132.00 132.16 3dfy h PRO 96 Ca 0.09 -0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 65.14 3dfy h PRO 96 Cb 0.90 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.85 3dfy h PRO 96 CO 0.59 0.52 -0.01 0.66 -0.23 0.00 0.00 178.00 179.52 3dfy h SER 97 N 0.80 0.24 0.58 1.44 4.64 -1.82 0.15 113.55 119.58 3dfy h SER 97 Ca 0.44 -0.03 -0.28 0.00 -0.47 0.00 0.00 61.79 61.44 3dfy h SER 97 Cb 0.57 -0.06 0.01 0.00 -0.31 0.00 0.00 62.40 62.61 3dfy h SER 97 CO -0.20 0.30 -1.28 0.25 -0.87 0.00 0.00 176.83 175.03 3dfy h LEU 98 N 0.26 0.49 -0.42 5.97 5.85 -1.61 -2.00 115.31 123.85 3dfy h LEU 98 Ca 0.06 -0.53 0.03 0.00 0.84 0.00 0.00 57.88 58.29 3dfy h LEU 98 Cb 0.20 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 3dfy h LEU 98 CO 0.01 1.41 0.21 0.50 -0.34 0.00 0.00 178.44 180.22 3dfy h LYS 99 N 0.09 0.41 -0.18 1.25 3.64 -0.37 -0.58 116.57 120.83 3dfy h LYS 99 Ca -0.15 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.20 3dfy h LYS 99 Cb 2.00 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 33.72 3dfy h LYS 99 CO 0.22 0.27 0.11 0.00 -2.27 0.00 0.00 179.45 177.77 3dfy h ALA 100 N 1.23 0.23 -0.13 5.00 0.00 -0.70 -1.92 119.26 122.97 3dfy h ALA 100 Ca 0.18 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.06 3dfy h ALA 100 Cb 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3dfy h ALA 100 CO -0.13 -0.25 0.06 0.00 0.00 0.00 0.00 179.25 178.93 3dfy h ALA 101 N 1.02 0.15 -0.37 0.00 0.00 -0.93 -0.63 119.26 118.49 3dfy h ALA 101 Ca 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3dfy h ALA 101 Cb 0.04 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3dfy h ALA 101 CO -0.01 -0.38 0.08 0.28 0.00 0.00 0.00 179.25 179.22 3dfy h VAL 102 N 0.14 1.23 -0.50 0.00 2.07 -1.08 0.11 116.25 118.21 3dfy h VAL 102 Ca 0.05 -0.79 -0.03 0.00 0.82 0.00 0.00 66.70 66.75 3dfy h VAL 102 Cb 0.01 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 3dfy h VAL 102 CO -0.04 0.27 0.18 1.56 0.02 0.00 0.00 177.57 179.56 3dfy h GLN 103 N 0.46 0.76 -0.31 1.57 4.20 -1.26 -1.05 115.11 119.48 3dfy h GLN 103 Ca 0.12 -0.15 -0.15 0.00 0.06 0.00 0.00 58.65 58.52 3dfy h GLN 103 Cb 0.32 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 3dfy h GLN 103 CO 0.00 0.69 -0.42 0.35 -0.67 0.00 0.00 178.83 178.78 3dfy h PHE 104 N 0.67 0.93 -0.33 2.96 3.57 -1.00 -2.52 116.94 121.22 3dfy h PHE 104 Ca 0.16 -0.28 -0.00 0.00 3.53 0.00 0.00 57.97 61.38 3dfy h PHE 104 Cb 0.23 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 3dfy h PHE 104 CO 0.01 1.06 0.20 0.00 -2.23 0.00 0.00 178.31 177.34 3dfy h ALA 105 N 0.90 1.73 -0.48 2.41 0.00 -0.78 0.51 119.26 123.54 3dfy h ALA 105 Ca 0.04 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3dfy h ALA 105 Cb 0.98 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3dfy h ALA 105 CO 0.09 0.24 0.05 1.15 0.00 0.00 0.00 179.25 180.78 3dfy h THR 106 N 0.45 1.25 -0.07 0.00 2.02 -0.78 -1.50 112.91 114.29 3dfy h THR 106 Ca 0.12 -0.98 -0.14 0.00 0.77 0.00 0.00 66.41 66.18 3dfy h THR 106 Cb -0.02 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 3dfy h THR 106 CO -0.02 0.34 -0.59 -0.07 0.37 0.00 0.00 175.52 175.55 3dfy h LEU 107 N 0.68 0.26 -0.41 2.58 3.38 -0.98 0.36 115.31 121.19 3dfy h LEU 107 Ca 0.14 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3dfy h LEU 107 Cb 0.44 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3dfy h LEU 107 CO 0.02 0.79 0.18 -0.78 0.09 0.00 0.00 178.44 178.73 3dfy h ASP 108 N 0.17 0.56 -0.09 -0.43 3.58 -0.73 0.17 116.42 119.65 3dfy h ASP 108 Ca -0.00 -0.15 -0.02 0.00 0.42 0.00 0.00 57.03 57.27 3dfy h ASP 108 Cb 1.08 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 41.99 3dfy h ASP 108 CO 0.09 0.56 -0.03 0.00 -2.88 0.00 0.00 179.24 176.98 3dfy h ALA 109 N 1.02 0.13 -0.44 -0.78 0.00 -1.13 -2.88 119.26 115.18 3dfy h ALA 109 Ca 0.14 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.86 3dfy h ALA 109 Cb 0.17 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 3dfy h ALA 109 CO -0.01 -0.13 0.19 1.25 0.00 0.00 0.00 179.25 180.55 3dfy h LEU 110 N -0.16 0.25 -1.66 0.00 5.85 -0.73 -1.90 115.31 116.96 3dfy h LEU 110 Ca 0.02 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 3dfy h LEU 110 Cb 0.46 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 3dfy h LEU 110 CO 0.01 0.18 0.02 0.77 -0.34 0.00 0.00 178.44 179.08 3dfy h SER 111 N 0.39 0.20 -0.35 1.25 4.64 -0.67 -1.24 113.55 117.76 3dfy h SER 111 Ca 0.20 -0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.41 3dfy h SER 111 Cb 0.14 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 3dfy h SER 111 CO -0.16 0.23 -0.12 1.56 -0.87 0.00 0.00 176.83 177.47 3dfy h GLN 112 N 0.23 0.70 0.00 4.77 4.20 -1.13 0.17 115.11 124.05 3dfy h GLN 112 Ca 0.06 -0.28 -0.05 0.00 0.06 0.00 0.00 58.65 58.43 3dfy h GLN 112 Cb 0.13 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 3dfy h GLN 112 CO 0.00 0.88 -0.23 0.93 -0.67 0.00 0.00 178.83 179.74 3dfy h GLU 113 N 0.49 0.00 -0.00 1.46 5.08 -0.91 -1.91 114.58 118.78 3dfy h GLU 113 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3dfy h GLU 113 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3dfy h GLU 113 CO 0.04 0.23 -0.23 1.28 -1.00 0.00 0.00 179.01 179.33 3dfy n LEU 114 N -3.69 0.71 -0.50 1.33 4.77 -0.54 -4.95 117.00 114.15 3dfy n LEU 114 Ca -0.01 -0.10 -0.04 0.00 -0.03 0.00 0.00 56.01 55.83 3dfy n LEU 114 Cb 0.35 -0.18 -0.00 0.00 -2.33 0.00 0.00 43.42 41.26 3dfy n LEU 114 CO 0.34 0.14 -0.06 0.61 -1.33 0.00 0.00 177.39 177.09 3dfy n GLY 115 N 1.35 0.19 0.00 -0.72 0.00 -0.51 -5.03 105.19 100.48 3dfy n GLY 115 Ca 0.12 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.43 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 -4.00 0.00 -4.44 2.61 5.66 0.48 -5.02 114.28 109.58 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 0.54 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.21 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 0.83 1.59 0.19 1.09 -0.21 -1.26 -4.13 119.66 117.77 3dfy s GLN 117 Ca 0.00 -1.61 -0.12 0.00 0.02 0.00 0.00 55.36 53.65 3dfy s GLN 117 Cb 0.00 -1.82 0.22 0.00 1.00 0.00 0.00 33.01 32.41 3dfy s GLN 117 CO 0.00 0.37 1.73 0.28 -2.12 0.00 0.00 175.29 175.55 3dfy h VAL 118 N 2.84 0.75 -1.00 1.09 2.07 -1.92 -1.86 116.25 118.21 3dfy h VAL 118 Ca -0.44 -0.11 0.16 0.00 0.82 0.00 0.00 66.70 67.14 3dfy h VAL 118 Cb 1.23 0.41 -0.10 0.00 -1.52 0.00 0.00 31.29 31.32 3dfy h VAL 118 CO 0.53 0.06 0.62 0.00 0.02 0.00 0.00 177.57 178.79 3dfy h TYR 120 N 0.85 0.89 -0.69 0.00 0.05 -1.71 0.14 116.97 116.50 3dfy h TYR 120 Ca 0.54 -0.38 0.06 0.00 0.05 0.00 0.00 58.73 59.00 3dfy h TYR 120 Cb 0.74 -0.14 -0.04 0.00 1.01 0.00 0.00 36.73 38.29 3dfy h TYR 120 CO -0.00 1.18 0.46 1.25 -1.05 0.00 0.00 178.16 179.99 3dfy h LEU 121 N 0.47 0.65 -0.52 3.88 5.85 -0.38 -0.90 115.31 124.36 3dfy h LEU 121 Ca -0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3dfy h LEU 121 Cb 1.33 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.22 3dfy h LEU 121 CO 0.14 0.43 0.00 0.18 -0.34 0.00 0.00 178.44 178.85 3dfy n LEU 122 N -4.47 0.79 0.00 2.25 4.77 -0.19 -4.89 117.00 115.26 3dfy n LEU 122 Ca 0.10 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 3dfy n LEU 122 Cb 0.20 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3dfy n LEU 122 CO 0.34 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 3dfy n GLY 123 N 1.06 1.12 3.93 -0.72 0.00 -0.34 -4.04 105.19 106.19 3dfy n GLY 123 Ca 0.20 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 -0.49 0.29 -0.02 0.00 0.46 -4.89 105.19 100.55 3dfy n GLY 124 Ca 0.00 0.17 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.81 0.99 -6.59 1.61 3.64 -1.07 -3.45 116.57 109.89 3dfy h LYS 125 Ca -0.57 -0.28 -0.64 0.00 -1.27 0.00 0.00 60.65 57.89 3dfy h LYS 125 Cb 1.37 -0.11 -0.23 0.00 -0.41 0.00 0.00 32.23 32.85 3dfy h LYS 125 CO 0.69 0.96 -0.86 1.03 -2.27 0.00 0.00 179.45 179.00 3dfy s ARG 126 N -5.13 1.38 -0.00 1.90 0.52 -0.43 -4.97 118.95 112.21 3dfy s ARG 126 Ca -0.12 -1.22 0.22 0.00 -0.52 0.00 0.00 55.73 54.08 3dfy s ARG 126 Cb 0.13 -1.73 -0.20 0.00 0.52 0.00 0.00 34.95 33.68 3dfy s ARG 126 CO 0.84 0.42 0.85 -0.25 0.02 0.00 0.00 175.30 177.17 3dfy n ASP 127 N 1.18 0.73 -3.72 0.23 8.00 -1.26 -4.61 116.55 117.10 3dfy n ASP 127 Ca -0.18 -0.68 -0.14 0.00 0.71 0.00 0.00 54.79 54.50 3dfy n ASP 127 Cb 0.53 1.16 -0.08 0.00 -0.02 0.00 0.00 41.12 42.71 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 -3.13 0.71 0.05 -1.24 2.12 -1.26 -3.72 118.70 112.23 3dfy s GLU 128 Ca 0.04 -0.05 -0.01 0.00 0.36 0.00 0.00 54.97 55.31 3dfy s GLU 128 Cb 0.15 0.32 -0.04 0.00 0.26 0.00 0.00 34.13 34.83 3dfy s GLU 128 CO 0.86 -0.20 -0.03 0.96 -0.54 0.00 0.00 175.26 176.32 3dfy s ILE 129 N -1.16 0.23 -0.05 -3.70 -4.36 -0.35 -4.98 121.20 106.84 3dfy s ILE 129 Ca -0.12 -1.81 0.05 0.00 -0.26 0.00 0.00 60.65 58.51 3dfy s ILE 129 Cb -0.04 -1.52 -0.01 0.00 1.25 0.00 0.00 42.46 42.14 3dfy s ILE 129 CO 0.05 -0.99 -0.20 -0.70 0.24 0.00 0.00 174.94 173.33 3dfy s GLU 130 N -3.91 2.04 0.25 0.37 2.12 -1.26 -0.28 118.70 118.04 3dfy s GLU 130 Ca 0.07 -0.72 0.08 0.00 0.36 0.00 0.00 54.97 54.76 3dfy s GLU 130 Cb 0.08 -1.76 -0.04 0.00 0.26 0.00 0.00 34.13 32.67 3dfy s GLU 130 CO -0.10 0.30 0.16 -0.08 -0.54 0.00 0.00 175.26 175.00 3dfy s THR 131 N -0.05 4.24 0.31 -1.70 -1.32 0.91 -3.90 115.64 114.13 3dfy s THR 131 Ca -0.03 -1.51 0.01 0.00 -1.21 0.00 0.00 61.69 58.95 3dfy s THR 131 Cb -0.12 -3.29 0.06 0.00 -1.51 0.00 0.00 72.50 67.64 3dfy s THR 131 CO 0.03 -0.36 0.43 -0.90 -2.21 0.00 0.00 174.62 171.61 3dfy n ASP 132 N -1.12 0.69 -3.95 8.08 5.68 -0.49 -4.74 116.55 120.69 3dfy n ASP 132 Ca -0.08 -1.56 -0.10 0.00 -0.50 0.00 0.00 54.79 52.56 3dfy n ASP 132 Cb 0.58 -0.27 -0.11 0.00 -1.14 0.00 0.00 41.12 40.18 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 -3.52 0.35 -0.02 0.11 2.20 -1.18 -4.51 119.74 113.17 3dfy s LYS 133 Ca 0.29 -0.56 -0.08 0.00 -0.36 0.00 0.00 55.97 55.26 3dfy s LYS 133 Cb -0.02 0.13 -0.05 0.00 -1.51 0.00 0.00 37.83 36.39 3dfy s LYS 133 CO 0.19 -0.07 0.27 0.99 -0.36 0.00 0.00 175.35 176.37 3dfy s THR 134 N -1.45 5.30 -0.42 3.43 2.01 -1.26 -1.54 115.64 121.70 3dfy s THR 134 Ca -0.16 0.29 -0.05 0.00 0.31 0.00 0.00 61.69 62.09 3dfy s THR 134 Cb -0.09 -3.56 0.11 0.00 0.01 0.00 0.00 72.50 68.97 3dfy s THR 134 CO -0.00 0.45 0.24 -0.69 -0.69 0.00 0.00 174.62 173.92 3dfy s VAL 135 N -1.21 3.53 0.99 3.82 1.01 0.54 -4.95 120.40 124.12 3dfy s VAL 135 Ca 0.24 -1.98 -0.14 0.00 0.00 0.00 0.00 61.98 60.11 3dfy s VAL 135 Cb -0.13 -3.39 0.18 0.00 0.00 0.00 0.00 36.38 33.04 3dfy s VAL 135 CO 0.13 -0.71 1.16 -0.83 0.00 0.00 0.00 175.10 174.85 3dfy s GLY 136 N 2.05 1.61 0.20 4.51 0.00 -1.26 -2.11 107.32 112.31 3dfy s GLY 136 Ca 0.07 -0.70 -0.32 0.00 0.00 0.00 0.00 44.72 43.78 3dfy s GLY 136 CO -0.03 -0.04 1.70 -0.42 0.00 0.00 0.00 173.10 174.31 3dfy s ILE 137 N -3.29 2.12 0.02 0.90 -1.09 -1.26 -4.82 121.20 113.77 3dfy s ILE 137 Ca 0.67 0.08 -0.10 0.00 -2.23 0.00 0.00 60.65 59.06 3dfy s ILE 137 Cb -0.12 -3.05 0.03 0.00 -1.58 0.00 0.00 42.46 37.74 3dfy s ILE 137 CO 0.54 0.01 0.47 -0.67 -1.23 0.00 0.00 174.94 174.06 3dfy n ASP 138 N 4.02 -0.54 -4.78 3.58 -0.08 -1.26 -5.06 116.55 112.43 3dfy n ASP 138 Ca 0.16 -1.19 -0.33 0.00 -1.51 0.00 0.00 54.79 51.92 3dfy n ASP 138 Cb 0.36 0.86 0.04 0.00 2.34 0.00 0.00 41.12 44.72 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 -2.19 3.38 0.52 5.18 -4.23 -1.26 -4.78 115.64 112.26 3dfy s THR 139 Ca 0.11 0.63 0.20 0.00 -1.18 0.00 0.00 61.69 61.45 3dfy s THR 139 Cb -0.01 -3.16 0.33 0.00 1.34 0.00 0.00 72.50 71.00 3dfy s THR 139 CO 0.01 -0.40 2.07 -0.37 -0.54 0.00 0.00 174.62 175.38 3dfy h VAL 140 N 0.08 0.87 0.76 2.29 -1.51 -1.98 0.91 116.25 117.67 3dfy h VAL 140 Ca -0.47 -0.01 -0.04 0.00 -1.23 0.00 0.00 66.70 64.96 3dfy h VAL 140 Cb 1.24 0.84 0.00 0.00 -2.13 0.00 0.00 31.29 31.25 3dfy h VAL 140 CO 0.55 0.01 -0.39 -0.33 -1.23 0.00 0.00 177.57 176.17 3dfy h GLU 141 N 0.03 -1.01 -0.38 5.19 4.39 -2.00 -0.86 114.58 119.93 3dfy h GLU 141 Ca 0.13 0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.89 3dfy h GLU 141 Cb 0.50 0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 29.36 3dfy h GLU 141 CO -0.01 -0.68 0.17 -0.91 -1.16 0.00 0.00 179.01 176.43 3dfy h ASN 142 N -1.05 0.47 -0.65 1.42 2.35 -1.78 -1.97 115.58 114.38 3dfy h ASN 142 Ca -0.10 -0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.58 3dfy h ASN 142 Cb 0.82 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 39.04 3dfy h ASN 142 CO 0.15 0.42 0.28 0.03 -1.65 0.00 0.00 177.43 176.66 3dfy h ARG 143 N 0.53 0.95 -0.26 0.81 3.08 -0.68 0.20 114.38 119.02 3dfy h ARG 143 Ca 0.13 -0.16 -0.14 0.00 0.07 0.00 0.00 59.98 59.89 3dfy h ARG 143 Cb 0.08 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 3dfy h ARG 143 CO -0.02 0.78 -0.38 0.28 -1.07 0.00 0.00 179.97 179.57 3dfy h VAL 144 N 0.90 1.30 -0.38 2.04 2.07 -0.78 -0.27 116.25 121.14 3dfy h VAL 144 Ca 0.22 -1.57 -0.00 0.00 0.82 0.00 0.00 66.70 66.17 3dfy h VAL 144 Cb 0.17 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 3dfy h VAL 144 CO -0.02 0.50 0.24 0.50 0.02 0.00 0.00 177.57 178.81 3dfy h LYS 145 N 0.45 0.51 -0.36 1.57 1.63 -1.19 0.27 116.57 119.44 3dfy h LYS 145 Ca 0.03 -0.04 0.04 0.00 -0.85 0.00 0.00 60.65 59.83 3dfy h LYS 145 Cb 0.97 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.45 3dfy h LYS 145 CO 0.09 0.37 0.13 1.49 -3.45 0.00 0.00 179.45 178.08 3dfy h GLU 146 N 0.50 0.28 -0.26 1.90 4.81 -0.51 -0.71 114.58 120.59 3dfy h GLU 146 Ca 0.14 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 3dfy h GLU 146 Cb -0.02 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 3dfy h GLU 146 CO -0.03 0.18 0.08 0.00 -0.73 0.00 0.00 179.01 178.52 3dfy h ALA 147 N 1.23 0.34 -0.79 2.92 0.00 -0.50 -0.93 119.26 121.53 3dfy h ALA 147 Ca 0.16 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.96 3dfy h ALA 147 Cb 0.14 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 3dfy h ALA 147 CO -0.17 -0.03 0.51 0.87 0.00 0.00 0.00 179.25 180.43 3dfy h LYS 148 N 0.26 0.97 -0.04 0.00 1.57 -0.18 0.24 116.57 119.38 3dfy h LYS 148 Ca 0.08 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3dfy h LYS 148 Cb 0.24 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3dfy h LYS 148 CO -0.00 0.64 0.01 -0.22 -0.57 0.00 0.00 179.45 179.31 3dfy h LYS 149 N 0.99 0.05 -0.34 3.15 3.64 -0.96 -0.76 116.57 122.35 3dfy h LYS 149 Ca 0.31 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.70 3dfy h LYS 149 Cb -0.01 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 3dfy h LYS 149 CO -0.10 0.20 0.17 0.82 -2.27 0.00 0.00 179.45 178.27 3dfy h ILE 150 N -0.10 0.99 -0.35 2.00 2.04 -0.72 -2.13 117.51 119.24 3dfy h ILE 150 Ca 0.01 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.77 3dfy h ILE 150 Cb 0.16 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 3dfy h ILE 150 CO -0.00 0.07 0.17 0.15 0.00 0.00 0.00 178.15 178.54 3dfy h PHE 151 N 0.36 0.32 -0.17 1.37 3.57 -0.41 -1.91 116.94 120.07 3dfy h PHE 151 Ca 0.14 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.70 3dfy h PHE 151 Cb 0.05 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 3dfy h PHE 151 CO -0.10 0.17 0.13 1.49 -2.23 0.00 0.00 178.31 177.77 3dfy h GLU 152 N 0.36 0.00 0.00 1.11 4.81 -0.76 0.89 114.58 120.99 3dfy h GLU 152 Ca 0.15 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3dfy h GLU 152 Cb 0.06 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3dfy h GLU 152 CO -0.10 0.00 0.00 0.39 -0.73 0.00 0.00 179.01 178.57 3dfy n GLU 153 N -4.40 0.44 0.00 1.92 1.02 -0.73 -4.88 120.64 114.02 3dfy n GLU 153 Ca 0.01 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 3dfy n GLU 153 Cb 0.26 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 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 0.66 0.52 3.69 0.62 0.00 0.31 -4.75 105.19 106.24 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 -2.00 3.08 -1.34 1.61 0.08 -1.18 -4.80 117.98 113.42 3dfy s PHE 155 Ca 0.00 1.03 0.12 0.00 0.12 0.00 0.00 56.93 58.20 3dfy s PHE 155 Cb 0.00 -3.55 0.19 0.00 -0.57 0.00 0.00 43.02 39.09 3dfy s PHE 155 CO 0.00 -1.89 1.04 0.54 -0.10 0.00 0.00 175.22 174.81 3dfy n ARG 156 N 5.01 1.53 -4.07 0.44 5.12 -1.26 -4.51 116.66 118.92 3dfy n ARG 156 Ca 0.12 -1.57 -0.27 0.00 -1.93 0.00 0.00 57.85 54.19 3dfy n ARG 156 Cb 0.45 -1.26 -0.17 0.00 -1.16 0.00 0.00 32.46 30.32 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 -1.02 1.21 -0.09 1.55 1.01 -1.26 0.17 120.40 121.97 3dfy s VAL 157 Ca 0.19 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 61.77 3dfy s VAL 157 Cb 0.11 -1.17 0.01 0.00 0.00 0.00 0.00 36.38 35.33 3dfy s VAL 157 CO 0.16 0.39 -0.17 -0.63 0.00 0.00 0.00 175.10 174.86 3dfy s ILE 158 N 1.46 1.55 -0.25 2.22 1.01 0.34 -3.13 121.20 124.39 3dfy s ILE 158 Ca 0.01 -0.70 -0.13 0.00 0.00 0.00 0.00 60.65 59.83 3dfy s ILE 158 Cb -0.13 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 3dfy s ILE 158 CO -0.07 0.45 0.28 -0.75 0.00 0.00 0.00 174.94 174.85 3dfy s LYS 159 N 0.71 4.04 -0.26 2.79 2.20 -0.59 -1.55 119.74 127.08 3dfy s LYS 159 Ca -0.12 -0.10 -0.05 0.00 -0.36 0.00 0.00 55.97 55.33 3dfy s LYS 159 Cb -0.16 -3.61 -0.00 0.00 -1.51 0.00 0.00 37.83 32.55 3dfy s LYS 159 CO 0.03 -0.14 0.02 0.42 -0.36 0.00 0.00 175.35 175.32 3dfy s ILE 160 N 1.63 3.67 0.12 5.43 1.01 0.98 -0.34 121.20 133.71 3dfy s ILE 160 Ca 0.12 -0.59 -0.28 0.00 0.00 0.00 0.00 60.65 59.90 3dfy s ILE 160 Cb -0.15 -2.79 -0.07 0.00 0.01 0.00 0.00 42.46 39.47 3dfy s ILE 160 CO 0.09 0.25 0.87 -0.54 0.00 0.00 0.00 174.94 175.61 3dfy s LYS 161 N 1.49 4.65 0.00 2.79 1.02 -0.90 -1.90 119.74 126.89 3dfy s LYS 161 Ca 0.04 1.31 0.00 0.00 0.02 0.00 0.00 55.97 57.34 3dfy s LYS 161 Cb -0.16 -3.34 0.00 0.00 -0.52 0.00 0.00 37.83 33.81 3dfy s LYS 161 CO -0.00 0.34 0.00 1.33 -0.92 0.00 0.00 175.35 176.10 3dfy n VAL 162 N 2.39 0.00 0.00 3.17 0.24 -0.44 -4.45 118.33 119.24 3dfy n VAL 162 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.29 3dfy n VAL 162 Cb 0.49 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.86 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 2.11 0.06 7.63 0.00 -1.26 -4.22 105.19 109.51 3dfy n GLY 163 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.11 0.55 -3.25 1.61 1.02 -1.26 -4.31 120.64 114.89 3dfy n GLU 164 Ca 0.00 -0.03 -0.05 0.00 -0.02 0.00 0.00 57.16 57.06 3dfy n GLU 164 Cb 0.00 -1.66 -0.04 0.00 -0.02 0.00 0.00 31.44 29.73 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 -4.71 -0.40 0.23 1.62 3.84 -1.26 -5.05 114.94 109.21 3dfy s ASN 165 Ca -0.02 -0.47 -0.15 0.00 0.21 0.00 0.00 52.86 52.43 3dfy s ASN 165 Cb 0.12 1.44 0.26 0.00 -0.55 0.00 0.00 41.25 42.52 3dfy s ASN 165 CO 0.84 -0.29 1.58 0.25 -2.79 0.00 0.00 177.10 176.69 3dfy h LEU 166 N 7.76 -1.02 -0.37 3.21 5.85 -1.98 0.26 115.31 129.01 3dfy h LEU 166 Ca -0.02 0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 3dfy h LEU 166 Cb 1.14 0.58 -0.02 0.00 0.37 0.00 0.00 40.66 42.74 3dfy h LEU 166 CO 0.20 -0.29 0.14 0.50 -0.34 0.00 0.00 178.44 178.65 3dfy h LYS 167 N -0.05 0.57 -0.13 1.25 3.64 -2.00 -2.08 116.57 117.77 3dfy h LYS 167 Ca 0.34 -0.11 -0.11 0.00 -1.27 0.00 0.00 60.65 59.49 3dfy h LYS 167 Cb 0.59 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 3dfy h LYS 167 CO -0.83 0.56 -0.42 0.93 -2.27 0.00 0.00 179.45 177.42 3dfy h GLU 168 N 0.46 0.30 -0.46 1.90 5.08 -1.79 -2.66 114.58 117.41 3dfy h GLU 168 Ca 0.12 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 3dfy h GLU 168 Cb 0.21 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 3dfy h GLU 168 CO -0.01 0.67 0.05 -0.44 -1.00 0.00 0.00 179.01 178.28 3dfy h ASP 169 N 0.25 0.76 -0.58 1.42 3.32 -0.34 0.27 116.42 121.51 3dfy h ASP 169 Ca 0.02 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 3dfy h ASP 169 Cb 0.85 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 3dfy h ASP 169 CO 0.07 0.84 0.32 0.40 -1.72 0.00 0.00 179.24 179.15 3dfy h ILE 170 N 0.64 1.19 -0.36 0.35 2.04 -1.29 -0.89 117.51 119.19 3dfy h ILE 170 Ca 0.14 -0.49 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 3dfy h ILE 170 Cb 0.42 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 3dfy h ILE 170 CO 0.01 0.21 0.15 -0.33 0.00 0.00 0.00 178.15 178.19 3dfy h GLU 171 N 0.79 0.54 -1.00 2.37 5.08 -1.17 -2.23 114.58 118.96 3dfy h GLU 171 Ca 0.20 -0.10 0.04 0.00 -1.00 0.00 0.00 59.36 58.51 3dfy h GLU 171 Cb 0.05 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.15 3dfy h GLU 171 CO -0.03 0.53 0.66 0.00 -1.00 0.00 0.00 179.01 179.16 3dfy h ALA 172 N 0.99 1.35 -0.35 3.43 0.00 -0.13 -0.42 119.26 124.14 3dfy h ALA 172 Ca 0.12 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3dfy h ALA 172 Cb 0.18 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3dfy h ALA 172 CO -0.01 0.54 -0.06 0.28 0.00 0.00 0.00 179.25 180.00 3dfy h VAL 173 N 1.26 1.27 -0.56 0.00 2.07 -0.93 -1.22 116.25 118.15 3dfy h VAL 173 Ca 0.40 -1.11 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 3dfy h VAL 173 Cb 0.03 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 3dfy h VAL 173 CO -0.13 0.36 0.25 -0.08 0.02 0.00 0.00 177.57 178.00 3dfy h GLU 174 N 0.46 0.81 -0.60 1.57 4.81 -0.92 -0.77 114.58 119.94 3dfy h GLU 174 Ca 0.09 -0.13 -0.09 0.00 -0.13 0.00 0.00 59.36 59.10 3dfy h GLU 174 Cb 0.56 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 3dfy h GLU 174 CO 0.03 0.67 0.02 0.93 -0.73 0.00 0.00 179.01 179.94 3dfy h GLU 175 N 0.75 1.04 -0.33 1.92 4.39 -1.01 -1.70 114.58 119.64 3dfy h GLU 175 Ca 0.19 -0.31 -0.11 0.00 0.34 0.00 0.00 59.36 59.46 3dfy h GLU 175 Cb 0.14 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 3dfy h GLU 175 CO -0.02 1.00 -0.26 0.82 -1.16 0.00 0.00 179.01 179.39 3dfy h ILE 176 N 0.96 1.27 -0.69 3.13 2.04 -1.04 -3.03 117.51 120.15 3dfy h ILE 176 Ca 0.18 -1.36 -0.07 0.00 1.00 0.00 0.00 64.86 64.61 3dfy h ILE 176 Cb 0.52 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 3dfy h ILE 176 CO 0.03 0.44 0.16 0.00 0.00 0.00 0.00 178.15 178.78 3dfy h ALA 177 N 1.13 0.91 -0.87 1.87 0.00 -0.81 -2.84 119.26 118.65 3dfy h ALA 177 Ca 0.08 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.78 3dfy h ALA 177 Cb 0.75 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 3dfy h ALA 177 CO 0.06 0.65 0.57 0.87 0.00 0.00 0.00 179.25 181.39 3dfy h LYS 178 N 1.05 1.01 -0.70 0.00 1.57 -1.19 -2.84 116.57 115.46 3dfy h LYS 178 Ca 0.22 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3dfy h LYS 178 Cb 0.39 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.47 3dfy h LYS 178 CO 0.00 0.67 0.00 1.33 -0.57 0.00 0.00 179.45 180.88 3dfy n VAL 179 N -4.46 0.95 -2.71 0.50 0.24 -1.15 -4.34 118.33 107.37 3dfy n VAL 179 Ca 0.12 -0.94 -0.04 0.00 -2.04 0.00 0.00 64.34 61.44 3dfy n VAL 179 Cb 0.14 0.47 0.05 0.00 -1.47 0.00 0.00 33.84 33.02 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 1.55 1.47 -1.67 3.34 -2.24 -1.07 -4.71 114.28 110.94 3dfy n THR 180 Ca 0.24 -3.13 -0.48 0.00 -2.27 0.00 0.00 64.05 58.41 3dfy n THR 180 Cb 0.60 0.92 -0.05 0.00 -2.10 0.00 0.00 70.33 69.70 3dfy n THR 180 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3dfy n ARG 181 N -0.61 2.10 0.00 -0.78 0.63 -1.21 -1.62 116.66 115.16 3dfy n ARG 181 Ca 0.13 0.76 0.00 0.00 -0.92 0.00 0.00 57.85 57.82 3dfy n ARG 181 Cb 0.83 -2.56 0.00 0.00 0.45 0.00 0.00 32.46 31.18 3dfy n ARG 181 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3dfy n GLY 182 N 3.85 1.83 3.92 5.14 0.00 -1.26 -5.09 105.19 113.58 3dfy n GLY 182 Ca 0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.24 3.64 0.14 4.61 0.00 -0.64 -4.98 121.76 122.28 3dfy s ALA 183 Ca 0.00 -0.74 0.03 0.00 0.00 0.00 0.00 51.96 51.25 3dfy s ALA 183 Cb 0.00 -2.23 -0.04 0.00 0.00 0.00 0.00 23.12 20.85 3dfy s ALA 183 CO 0.00 0.04 0.24 0.15 0.00 0.00 0.00 175.76 176.20 3dfy s LYS 184 N -4.07 3.32 0.00 0.00 1.02 0.13 -4.96 119.74 115.18 3dfy s LYS 184 Ca 0.42 -0.63 0.07 0.00 0.02 0.00 0.00 55.97 55.85 3dfy s LYS 184 Cb -0.10 -2.91 -0.02 0.00 -0.52 0.00 0.00 37.83 34.28 3dfy s LYS 184 CO 0.35 0.53 -0.22 0.71 -0.92 0.00 0.00 175.35 175.79 3dfy s TYR 185 N -1.70 1.99 -0.17 3.18 2.02 -1.26 -0.50 117.35 120.90 3dfy s TYR 185 Ca 0.34 -0.38 0.01 0.00 -0.37 0.00 0.00 57.07 56.67 3dfy s TYR 185 Cb -0.11 -1.25 0.02 0.00 -0.40 0.00 0.00 41.96 40.22 3dfy s TYR 185 CO 0.27 0.01 -0.17 0.42 -1.57 0.00 0.00 175.55 174.52 3dfy s ILE 186 N -0.62 1.85 -0.18 2.71 1.01 -0.60 -0.11 121.20 125.27 3dfy s ILE 186 Ca 0.09 -0.84 -0.04 0.00 0.00 0.00 0.00 60.65 59.86 3dfy s ILE 186 Cb -0.09 -1.71 -0.02 0.00 0.01 0.00 0.00 42.46 40.65 3dfy s ILE 186 CO 0.00 0.48 -0.03 -0.69 0.00 0.00 0.00 174.94 174.70 3dfy s VAL 187 N 1.37 3.78 -0.30 2.92 1.01 -0.30 -0.01 120.40 128.88 3dfy s VAL 187 Ca 0.04 -0.38 -0.00 0.00 0.00 0.00 0.00 61.98 61.64 3dfy s VAL 187 Cb -0.13 -2.68 0.06 0.00 0.00 0.00 0.00 36.38 33.62 3dfy s VAL 187 CO -0.12 0.46 -0.02 -0.62 0.00 0.00 0.00 175.10 174.80 3dfy s ASP 188 N 0.79 4.78 0.00 3.32 -1.08 -0.80 0.24 116.67 123.93 3dfy s ASP 188 Ca -0.01 -1.39 0.30 0.00 -0.52 0.00 0.00 52.55 50.93 3dfy s ASP 188 Cb -0.14 -1.67 1.39 0.00 -1.46 0.00 0.00 42.92 41.04 3dfy s ASP 188 CO 0.02 -0.26 1.94 0.00 0.52 0.00 0.00 175.17 177.39 3dfy n ALA 189 N 4.55 2.68 -4.26 3.66 0.00 -0.99 -1.33 120.51 124.82 3dfy n ALA 189 Ca -0.12 -0.31 -0.31 0.00 0.00 0.00 0.00 53.44 52.70 3dfy n ALA 189 Cb 0.43 -1.33 -0.08 0.00 0.00 0.00 0.00 19.45 18.46 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 -0.56 0.24 -0.67 0.00 4.13 -1.23 -1.08 115.26 116.10 3dfy n ASN 190 Ca 0.19 -1.21 -0.09 0.00 1.68 0.00 0.00 54.58 55.16 3dfy n ASN 190 Cb 0.25 -1.94 -0.04 0.00 -1.54 0.00 0.00 39.78 36.51 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 -4.49 -1.37 0.16 3.52 2.81 0.61 -4.90 117.12 113.46 3dfy n MET 191 Ca -0.26 0.76 0.12 0.00 -1.81 0.00 0.00 57.70 56.51 3dfy n MET 191 Cb 0.66 -4.96 0.28 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 -3.59 3.03 0.00 -1.04 -3.35 103.07 98.12 3dfy h GLY 192 Ca -0.18 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.65 3dfy h GLY 192 CO 0.26 0.00 -0.46 -0.19 0.00 0.00 0.00 176.54 176.15 3dfy s TYR 193 N -3.16 3.42 0.73 5.60 2.02 -0.48 -4.83 117.35 120.65 3dfy s TYR 193 Ca 0.09 0.03 -0.08 0.00 -0.37 0.00 0.00 57.07 56.74 3dfy s TYR 193 Cb 0.09 -1.60 0.07 0.00 -0.40 0.00 0.00 41.96 40.12 3dfy s TYR 193 CO 0.64 0.48 1.06 0.95 -1.57 0.00 0.00 175.55 177.11 3dfy s THR 194 N -1.87 2.20 0.14 -0.71 -4.23 -1.26 -4.21 115.64 105.69 3dfy s THR 194 Ca 0.34 -0.21 -0.18 0.00 -1.18 0.00 0.00 61.69 60.47 3dfy s THR 194 Cb -0.10 -2.99 -0.01 0.00 1.34 0.00 0.00 72.50 70.73 3dfy s THR 194 CO 0.28 0.00 1.76 1.56 -0.54 0.00 0.00 174.62 177.68 3dfy h GLN 195 N -0.73 0.26 -0.63 3.99 4.20 -1.93 0.13 115.11 120.40 3dfy h GLN 195 Ca -0.45 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.19 3dfy h GLN 195 Cb 1.32 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 29.01 3dfy h GLN 195 CO 0.61 0.17 0.16 0.87 -0.67 0.00 0.00 178.83 179.97 3dfy h LYS 196 N 0.26 0.98 -0.50 1.46 1.79 -1.99 -1.38 116.57 117.20 3dfy h LYS 196 Ca 0.12 -0.22 -0.11 0.00 -2.18 0.00 0.00 60.65 58.26 3dfy h LYS 196 Cb 0.07 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 30.57 3dfy h LYS 196 CO -0.11 0.87 -0.14 0.93 -1.08 0.00 0.00 179.45 179.93 3dfy h GLU 197 N 0.94 0.97 -0.71 3.15 5.08 -1.84 -1.23 114.58 120.94 3dfy h GLU 197 Ca 0.20 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 3dfy h GLU 197 Cb 0.33 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 3dfy h GLU 197 CO -0.00 1.05 0.46 0.00 -1.00 0.00 0.00 179.01 179.52 3dfy h ALA 198 N 0.89 0.90 -0.26 3.43 0.00 -0.37 0.12 119.26 123.98 3dfy h ALA 198 Ca 0.12 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3dfy h ALA 198 Cb 0.70 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3dfy h ALA 198 CO 0.05 0.34 -0.07 0.28 0.00 0.00 0.00 179.25 179.86 3dfy h VAL 199 N 0.97 1.28 -0.61 0.00 2.07 -1.14 -2.93 116.25 115.90 3dfy h VAL 199 Ca 0.26 -1.09 0.05 0.00 0.82 0.00 0.00 66.70 66.74 3dfy h VAL 199 Cb -0.08 1.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.11 3dfy h VAL 199 CO -0.05 0.34 0.33 -0.08 0.02 0.00 0.00 177.57 178.13 3dfy h GLU 200 N 0.25 0.60 -0.11 1.57 4.57 -0.81 -1.09 114.58 119.55 3dfy h GLU 200 Ca 0.06 -0.04 0.05 0.00 -1.18 0.00 0.00 59.36 58.25 3dfy h GLU 200 Cb 0.54 -0.14 -0.06 0.00 -0.16 0.00 0.00 28.75 28.94 3dfy h GLU 200 CO 0.03 0.40 -0.27 0.35 -1.18 0.00 0.00 179.01 178.34 3dfy h PHE 201 N 0.62 -0.73 -0.74 0.92 3.57 -0.92 0.16 116.94 119.82 3dfy h PHE 201 Ca 0.27 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.81 3dfy h PHE 201 Cb 0.16 0.34 -0.04 0.00 2.79 0.00 0.00 35.95 39.20 3dfy h PHE 201 CO -0.09 -0.35 0.47 0.00 -2.23 0.00 0.00 178.31 176.12 3dfy h ALA 202 N 0.54 0.94 -0.55 2.41 0.00 -1.27 -1.49 119.26 119.84 3dfy h ALA 202 Ca 0.10 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3dfy h ALA 202 Cb 0.49 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3dfy h ALA 202 CO -0.31 0.37 0.11 0.00 0.00 0.00 0.00 179.25 179.42 3dfy h ARG 203 N 1.00 0.89 0.16 0.00 3.08 -0.72 -0.95 114.38 117.84 3dfy h ARG 203 Ca 0.27 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 3dfy h ARG 203 Cb -0.09 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 29.85 3dfy h ARG 203 CO -0.06 0.85 -0.08 0.00 -1.07 0.00 0.00 179.97 179.62 3dfy h ALA 204 N 1.00 -0.22 -0.72 0.04 0.00 -0.39 0.69 119.26 119.66 3dfy h ALA 204 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3dfy h ALA 204 Cb 0.38 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3dfy h ALA 204 CO 0.01 -0.59 0.47 0.28 0.00 0.00 0.00 179.25 179.41 3dfy h VAL 205 N -0.29 1.19 -0.61 0.00 2.07 -1.25 -2.53 116.25 114.83 3dfy h VAL 205 Ca -0.02 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.13 3dfy h VAL 205 Cb 0.23 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.11 3dfy h VAL 205 CO 0.04 0.19 0.38 0.22 0.02 0.00 0.00 177.57 178.42 3dfy h TYR 206 N 0.97 0.79 0.00 1.57 3.20 -0.93 -1.69 116.97 120.89 3dfy h TYR 206 Ca 0.26 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.14 3dfy h TYR 206 Cb -0.09 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 37.91 3dfy h TYR 206 CO -0.02 0.53 0.00 0.37 -1.64 0.00 0.00 178.16 177.40 3dfy h GLN 207 N 0.83 0.00 -0.67 1.82 5.75 -0.43 -0.38 115.11 122.02 3dfy h GLN 207 Ca 0.22 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.72 3dfy h GLN 207 Cb -0.05 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.50 3dfy h GLN 207 CO -0.04 0.00 0.00 1.63 -2.65 0.00 0.00 178.83 177.77 3dfy n LYS 208 N -2.44 2.98 -1.09 1.69 5.02 -0.65 -4.92 118.16 118.74 3dfy n LYS 208 Ca -0.01 -2.55 -0.03 0.00 -2.02 0.00 0.00 58.31 53.70 3dfy n LYS 208 Cb 0.09 -1.66 -0.01 0.00 -0.02 0.00 0.00 35.03 33.42 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 1.40 0.59 3.84 0.72 0.00 -0.15 -5.01 105.19 106.57 3dfy n GLY 209 Ca 0.23 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.93 5.08 -0.14 -0.61 1.01 -1.10 -5.05 121.20 118.46 3dfy s ILE 210 Ca 0.00 0.78 -0.03 0.00 0.00 0.00 0.00 60.65 61.40 3dfy s ILE 210 Cb 0.00 -3.68 -0.03 0.00 0.01 0.00 0.00 42.46 38.76 3dfy s ILE 210 CO 0.00 0.57 -0.05 -0.62 0.00 0.00 0.00 174.94 174.84 3dfy s ASP 211 N -1.01 4.69 -0.24 3.58 2.15 -1.26 -4.18 116.67 120.41 3dfy s ASP 211 Ca 0.23 -0.13 -0.06 0.00 0.43 0.00 0.00 52.55 53.03 3dfy s ASP 211 Cb -0.16 -1.66 -0.01 0.00 -0.30 0.00 0.00 42.92 40.78 3dfy s ASP 211 CO 0.12 0.20 0.02 -0.63 -0.17 0.00 0.00 175.17 174.72 3dfy s ILE 212 N 0.14 3.80 0.08 4.11 1.01 -1.26 -4.28 121.20 124.80 3dfy s ILE 212 Ca -0.02 -0.42 -0.18 0.00 0.00 0.00 0.00 60.65 60.02 3dfy s ILE 212 Cb -0.14 -2.79 -0.09 0.00 0.01 0.00 0.00 42.46 39.45 3dfy s ILE 212 CO 0.03 0.33 1.47 0.00 0.00 0.00 0.00 174.94 176.76 3dfy h ALA 213 N 8.18 0.34 -3.42 9.38 0.00 -0.89 -3.40 119.26 129.45 3dfy h ALA 213 Ca -0.38 -0.28 -0.34 0.00 0.00 0.00 0.00 54.91 53.91 3dfy h ALA 213 Cb 1.16 -0.09 -0.36 0.00 0.00 0.00 0.00 17.79 18.50 3dfy h ALA 213 CO 0.59 0.16 -0.74 0.08 0.00 0.00 0.00 179.25 179.34 3dfy s VAL 214 N -4.72 -0.01 -0.47 0.00 1.01 -1.19 -4.27 120.40 110.75 3dfy s VAL 214 Ca -0.13 0.27 -0.11 0.00 0.00 0.00 0.00 61.98 62.00 3dfy s VAL 214 Cb 0.07 -0.17 0.10 0.00 0.00 0.00 0.00 36.38 36.39 3dfy s VAL 214 CO 0.76 0.14 0.35 -0.47 0.00 0.00 0.00 175.10 175.89 3dfy s TYR 215 N 1.52 3.34 -0.08 5.22 5.04 0.52 -1.14 117.35 131.77 3dfy s TYR 215 Ca -0.03 -1.52 -0.24 0.00 -2.44 0.00 0.00 57.07 52.84 3dfy s TYR 215 Cb -0.13 -3.33 -0.03 0.00 0.35 0.00 0.00 41.96 38.82 3dfy s TYR 215 CO -0.03 -0.92 0.72 -2.00 -1.34 0.00 0.00 175.55 171.97 3dfy s GLU 216 N 1.47 4.41 -0.13 4.97 2.12 0.14 -0.39 118.70 131.29 3dfy s GLU 216 Ca 0.04 0.89 -0.01 0.00 0.36 0.00 0.00 54.97 56.25 3dfy s GLU 216 Cb -0.26 -3.47 0.00 0.00 0.26 0.00 0.00 34.13 30.67 3dfy s GLU 216 CO 0.02 0.01 0.09 0.94 -0.54 0.00 0.00 175.26 175.77 3dfy n GLN 217 N 3.99 -0.34 0.20 4.30 -0.06 0.41 -2.33 117.38 123.55 3dfy n GLN 217 Ca -0.01 0.01 0.05 0.00 -2.00 0.00 0.00 57.00 55.05 3dfy n GLN 217 Cb 0.51 -0.17 0.43 0.00 -4.06 0.00 0.00 30.24 26.95 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 1.08 0.00 -5.94 3.69 0.13 -1.85 0.18 132.00 129.29 3dfy h PRO 218 Ca -0.09 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.48 3dfy h PRO 218 Cb 0.20 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.26 3dfy h PRO 218 CO 0.06 0.32 -0.43 0.14 -0.23 0.00 0.00 178.00 177.85 3dfy s VAL 219 N -4.10 2.22 0.61 1.56 -7.23 -1.26 -1.38 120.40 110.82 3dfy s VAL 219 Ca -0.02 -1.59 -0.18 0.00 -1.81 0.00 0.00 61.98 58.38 3dfy s VAL 219 Cb 0.14 -2.81 -0.07 0.00 0.56 0.00 0.00 36.38 34.20 3dfy s VAL 219 CO 0.69 0.00 0.58 0.54 -0.31 0.00 0.00 175.10 176.60 3dfy n ARG 220 N -1.41 0.51 0.24 4.82 5.12 -1.26 -4.22 116.66 120.46 3dfy n ARG 220 Ca -0.01 0.21 0.08 0.00 -1.93 0.00 0.00 57.85 56.19 3dfy n ARG 220 Cb 0.64 -1.79 0.59 0.00 -1.16 0.00 0.00 32.46 30.74 3dfy n ARG 220 CO 0.00 0.00 0.00 0.07 -1.93 0.00 0.00 177.63 175.77 3dfy h ARG 221 N 0.13 0.00 0.00 5.56 0.11 -1.92 -2.23 114.38 116.03 3dfy h ARG 221 Ca -0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.62 3dfy h ARG 221 Cb 1.38 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.46 3dfy h ARG 221 CO 0.46 0.13 -0.40 0.93 0.10 0.00 0.00 179.97 181.20 3dfy h GLU 222 N 0.00 0.00 -4.67 0.08 4.39 -1.94 -3.41 114.58 109.03 3dfy h GLU 222 Ca -0.00 0.00 -0.70 0.00 0.34 0.00 0.00 59.36 59.00 3dfy h GLU 222 Cb 0.25 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.84 3dfy h GLU 222 CO 0.02 0.00 2.77 -3.47 -1.16 0.00 0.00 179.01 177.16 3dfy n ASP 223 N -2.65 4.29 -0.16 1.42 2.03 -0.84 -4.72 116.55 115.92 3dfy n ASP 223 Ca 0.03 -2.87 -0.11 0.00 0.52 0.00 0.00 54.79 52.35 3dfy n ASP 223 Cb 0.50 -1.69 -0.00 0.00 -0.72 0.00 0.00 41.12 39.21 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 4.57 1.27 -0.88 5.18 1.08 -1.83 -2.12 117.51 124.78 3dfy h ILE 224 Ca 0.52 -1.31 -0.00 0.00 -0.39 0.00 0.00 64.86 63.67 3dfy h ILE 224 Cb 0.73 1.13 -0.04 0.00 -3.07 0.00 0.00 36.82 35.56 3dfy h ILE 224 CO 1.72 0.45 0.53 -0.33 -0.69 0.00 0.00 178.15 179.84 3dfy h GLU 225 N 0.79 1.19 -0.78 2.37 4.39 -1.99 -2.18 114.58 118.37 3dfy h GLU 225 Ca 0.11 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 3dfy h GLU 225 Cb 0.73 -0.25 -0.04 0.00 -0.10 0.00 0.00 28.75 29.09 3dfy h GLU 225 CO 0.06 0.83 0.43 0.78 -1.16 0.00 0.00 179.01 179.94 3dfy h GLY 226 N 1.22 1.16 0.85 -3.84 0.00 -1.86 0.14 103.07 100.75 3dfy h GLY 226 Ca 0.32 -0.53 0.03 0.00 0.00 0.00 0.00 47.33 47.15 3dfy h GLY 226 CO -0.06 0.50 0.42 1.41 0.00 0.00 0.00 176.54 178.82 3dfy h LEU 227 N 1.08 0.69 -0.51 3.11 3.38 -0.83 -0.36 115.31 121.86 3dfy h LEU 227 Ca 0.27 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.18 3dfy h LEU 227 Cb 0.03 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3dfy h LEU 227 CO -0.04 0.47 0.04 0.50 0.09 0.00 0.00 178.44 179.50 3dfy h LYS 228 N 0.82 0.88 -0.19 1.13 3.64 -0.78 0.70 116.57 122.77 3dfy h LYS 228 Ca 0.28 -0.26 0.01 0.00 -1.27 0.00 0.00 60.65 59.41 3dfy h LYS 228 Cb 0.04 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 3dfy h LYS 228 CO -0.11 0.89 0.09 0.35 -2.27 0.00 0.00 179.45 178.39 3dfy h PHE 229 N 0.75 0.16 -0.72 1.91 3.57 -0.18 -0.54 116.94 121.90 3dfy h PHE 229 Ca 0.15 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.60 3dfy h PHE 229 Cb 0.46 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 3dfy h PHE 229 CO 0.03 0.09 0.23 0.28 -2.23 0.00 0.00 178.31 176.72 3dfy h VAL 230 N 0.19 1.26 -0.69 1.41 2.07 -0.92 -2.52 116.25 117.04 3dfy h VAL 230 Ca 0.08 -0.88 0.05 0.00 0.82 0.00 0.00 66.70 66.78 3dfy h VAL 230 Cb 0.03 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.20 3dfy h VAL 230 CO -0.06 0.35 0.40 -0.09 0.02 0.00 0.00 177.57 178.18 3dfy h ARG 231 N 1.07 0.72 -0.14 1.57 2.43 -0.20 0.45 114.38 120.28 3dfy h ARG 231 Ca 0.23 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.35 3dfy h ARG 231 Cb 0.29 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 3dfy h ARG 231 CO -0.01 0.48 0.05 0.35 -1.51 0.00 0.00 179.97 179.33 3dfy h PHE 232 N 0.74 0.22 0.10 2.20 3.57 -0.71 -3.30 116.94 119.76 3dfy h PHE 232 Ca 0.30 -0.02 -0.27 0.00 3.53 0.00 0.00 57.97 61.52 3dfy h PHE 232 Cb 0.16 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 3dfy h PHE 232 CO -0.07 0.32 -1.28 0.45 -2.23 0.00 0.00 178.31 175.51 3dfy h HIS 233 N 0.06 0.37 -2.76 0.41 3.86 -1.29 -3.46 115.15 112.33 3dfy h HIS 233 Ca 0.05 -0.27 -0.52 0.00 -1.16 0.00 0.00 60.37 58.46 3dfy h HIS 233 Cb 0.20 -0.01 0.05 0.00 1.06 0.00 0.00 27.41 28.70 3dfy h HIS 233 CO -0.01 1.24 0.93 0.45 0.86 0.00 0.00 177.93 181.40 3dfy s SER 234 N -6.98 6.53 0.00 2.45 0.15 0.16 -4.88 113.70 111.12 3dfy s SER 234 Ca -0.04 2.68 0.29 0.00 0.70 0.00 0.00 55.95 59.58 3dfy s SER 234 Cb 0.08 -2.59 1.40 0.00 -1.71 0.00 0.00 66.02 63.19 3dfy s SER 234 CO 0.86 -0.87 2.00 -0.81 1.20 0.00 0.00 173.24 175.62 3dfy n PRO 235 N 4.13 0.26 -4.24 5.44 -0.04 -1.26 -4.79 135.00 134.51 3dfy n PRO 235 Ca 0.15 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.31 3dfy n PRO 235 Cb 0.38 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.24 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 -2.74 2.84 0.23 0.54 0.08 -1.26 -5.04 117.98 112.63 3dfy s PHE 236 Ca 0.23 -0.10 -0.32 0.00 0.12 0.00 0.00 56.93 56.86 3dfy s PHE 236 Cb 0.20 -1.49 -0.13 0.00 -0.57 0.00 0.00 43.02 41.03 3dfy s PHE 236 CO 0.48 0.43 1.59 -2.30 -0.10 0.00 0.00 175.22 175.33 3dfy n PRO 237 N 0.80 2.48 -3.95 0.24 -0.02 -1.26 -4.80 135.00 128.48 3dfy n PRO 237 Ca -0.13 0.89 -0.36 0.00 -2.02 0.00 0.00 63.50 61.88 3dfy n PRO 237 Cb 0.52 -2.66 -0.07 0.00 -0.02 0.00 0.00 33.50 31.27 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 0.53 5.24 0.15 -1.45 1.01 -1.26 -0.36 120.40 124.26 3dfy s VAL 238 Ca 0.71 0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.91 3dfy s VAL 238 Cb -0.57 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 3dfy s VAL 238 CO 0.42 0.58 -0.23 0.00 0.00 0.00 0.00 175.10 175.87 3dfy s ALA 239 N -0.70 2.54 -0.15 5.51 0.00 0.48 -0.92 121.76 128.53 3dfy s ALA 239 Ca 0.13 -1.49 -0.06 0.00 0.00 0.00 0.00 51.96 50.53 3dfy s ALA 239 Cb -0.12 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 3dfy s ALA 239 CO 0.03 0.51 0.06 0.00 0.00 0.00 0.00 175.76 176.36 3dfy s ALA 240 N -1.31 3.45 0.00 0.00 0.00 -0.53 -0.44 121.76 122.92 3dfy s ALA 240 Ca 0.18 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.40 3dfy s ALA 240 Cb -0.09 -1.81 0.00 0.00 0.00 0.00 0.00 23.12 21.21 3dfy s ALA 240 CO 0.09 0.36 0.00 -3.47 0.00 0.00 0.00 175.76 172.74 3dfy n ASP 241 N 2.92 0.00 0.16 0.00 -0.08 -1.26 -0.64 116.55 117.65 3dfy n ASP 241 Ca -0.18 0.00 0.15 0.00 -1.51 0.00 0.00 54.79 53.25 3dfy n ASP 241 Cb 0.53 0.00 0.72 0.00 2.34 0.00 0.00 41.12 44.71 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 0.13 114.58 115.17 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 -4.26 0.10 -3.93 1.42 7.64 -1.26 -4.41 113.62 108.92 3dfy n SER 243 Ca 0.02 0.51 -0.29 0.00 1.01 0.00 0.00 58.87 60.12 3dfy n SER 243 Cb 0.32 -0.54 -0.13 0.00 -1.01 0.00 0.00 64.21 62.85 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 -3.02 3.45 -0.18 -0.43 0.00 0.47 -4.73 121.76 117.32 3dfy s ALA 244 Ca 0.12 -3.45 -0.01 0.00 0.00 0.00 0.00 51.96 48.62 3dfy s ALA 244 Cb 0.17 -2.16 -0.11 0.00 0.00 0.00 0.00 23.12 21.02 3dfy s ALA 244 CO 0.50 -2.05 -0.17 0.54 0.00 0.00 0.00 175.76 174.58 3dfy n ARG 245 N 2.74 0.43 -4.36 0.00 1.74 -1.26 -4.82 116.66 111.13 3dfy n ARG 245 Ca 0.10 0.12 -0.25 0.00 -0.77 0.00 0.00 57.85 57.04 3dfy n ARG 245 Cb 0.33 -1.31 -0.09 0.00 -1.02 0.00 0.00 32.46 30.38 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 -2.35 2.39 0.47 0.55 -4.23 -1.26 -3.11 115.64 108.10 3dfy s THR 246 Ca -0.24 -1.93 0.22 0.00 -1.18 0.00 0.00 61.69 58.56 3dfy s THR 246 Cb 0.07 -2.87 0.26 0.00 1.34 0.00 0.00 72.50 71.29 3dfy s THR 246 CO 0.38 -0.11 2.08 0.07 -0.54 0.00 0.00 174.62 176.50 3dfy h LYS 247 N 1.72 0.00 -0.20 3.99 2.10 -1.94 -1.48 116.57 120.77 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 0.71 0.12 -0.58 0.74 -2.00 0.00 0.00 179.45 178.43 3dfy h PHE 248 N 0.00 0.80 -0.72 0.07 0.04 -1.96 -1.75 116.94 113.42 3dfy h PHE 248 Ca -0.00 -0.30 -0.02 0.00 2.80 0.00 0.00 57.97 60.45 3dfy h PHE 248 Cb 0.25 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.22 3dfy h PHE 248 CO 0.00 1.06 0.37 -0.44 -0.60 0.00 0.00 178.31 178.70 3dfy h ASP 249 N 0.48 0.92 -0.12 2.17 3.32 -1.61 -2.24 116.42 119.33 3dfy h ASP 249 Ca 0.00 -0.11 -0.13 0.00 0.02 0.00 0.00 57.03 56.81 3dfy h ASP 249 Cb 1.15 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.45 3dfy h ASP 249 CO 0.11 0.77 -0.35 0.58 -1.72 0.00 0.00 179.24 178.64 3dfy h VAL 250 N 1.00 1.29 -0.52 -1.35 2.07 -1.28 -1.10 116.25 116.36 3dfy h VAL 250 Ca 0.25 -1.48 -0.07 0.00 0.82 0.00 0.00 66.70 66.22 3dfy h VAL 250 Cb 0.07 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 3dfy h VAL 250 CO -0.04 0.48 0.06 -0.03 0.02 0.00 0.00 177.57 178.06 3dfy h MET 251 N 0.53 0.83 -0.25 1.57 1.85 -1.06 -0.39 114.93 118.01 3dfy h MET 251 Ca 0.06 -0.20 -0.04 0.00 -0.61 0.00 0.00 59.70 58.90 3dfy h MET 251 Cb 0.85 -0.11 -0.01 0.00 0.43 0.00 0.00 31.60 32.76 3dfy h MET 251 CO 0.07 0.80 0.00 -0.09 -0.40 0.00 0.00 176.91 177.29 3dfy h ARG 252 N 0.79 0.44 -0.76 0.39 2.43 -1.13 0.03 114.38 116.57 3dfy h ARG 252 Ca 0.16 -0.14 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 3dfy h ARG 252 Cb 0.39 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.86 3dfy h ARG 252 CO 0.01 0.61 0.49 -0.07 -1.51 0.00 0.00 179.97 179.50 3dfy h LEU 253 N 0.22 0.82 -0.32 3.80 3.38 -0.84 0.95 115.31 123.32 3dfy h LEU 253 Ca 0.07 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 3dfy h LEU 253 Cb 0.41 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3dfy h LEU 253 CO 0.01 0.58 0.10 0.58 0.09 0.00 0.00 178.44 179.80 3dfy h VAL 254 N 0.97 1.20 -0.37 1.22 2.07 -0.92 -0.20 116.25 120.23 3dfy h VAL 254 Ca 0.29 -0.66 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 3dfy h VAL 254 Cb -0.04 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 3dfy h VAL 254 CO -0.09 0.23 0.09 0.11 0.02 0.00 0.00 177.57 177.93 3dfy h LYS 255 N 0.36 0.54 -0.00 1.57 1.57 -0.49 -1.40 116.57 118.73 3dfy h LYS 255 Ca 0.10 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3dfy h LYS 255 Cb 0.25 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3dfy h LYS 255 CO -0.00 0.50 -0.12 0.39 -0.57 0.00 0.00 179.45 179.64 3dfy n GLU 256 N -4.34 0.54 -3.92 3.15 -0.58 0.28 -4.91 120.64 110.86 3dfy n GLU 256 Ca 0.02 -0.17 -0.29 0.00 -0.42 0.00 0.00 57.16 56.31 3dfy n GLU 256 Cb 0.18 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.57 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 -1.08 -4.81 0.07 3.49 1.02 -0.17 -4.89 120.64 114.26 3dfy n GLU 257 Ca 0.13 0.55 -0.10 0.00 -0.02 0.00 0.00 57.16 57.72 3dfy n GLU 257 Cb 0.29 -5.26 -0.13 0.00 -0.02 0.00 0.00 31.44 26.32 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 0.92 0.29 -2.35 0.62 0.00 -1.59 -3.46 119.26 113.70 3dfy h ALA 258 Ca -0.59 -0.93 -0.23 0.00 0.00 0.00 0.00 54.91 53.16 3dfy h ALA 258 Cb 1.37 -0.07 -0.15 0.00 0.00 0.00 0.00 17.79 18.95 3dfy h ALA 258 CO 0.66 1.18 -0.66 0.14 0.00 0.00 0.00 179.25 180.57 3dfy s VAL 259 N -2.69 0.37 -0.10 0.00 -7.23 -1.26 -3.19 120.40 106.30 3dfy s VAL 259 Ca -0.01 -1.94 0.12 0.00 -1.81 0.00 0.00 61.98 58.34 3dfy s VAL 259 Cb 0.09 -2.05 -0.24 0.00 0.56 0.00 0.00 36.38 34.75 3dfy s VAL 259 CO 0.84 -0.50 0.43 0.47 -0.31 0.00 0.00 175.10 176.03 3dfy n ASP 260 N -0.15 0.80 -4.20 4.85 8.00 -0.10 -4.95 116.55 120.80 3dfy n ASP 260 Ca -0.06 0.26 -0.14 0.00 0.71 0.00 0.00 54.79 55.56 3dfy n ASP 260 Cb 0.63 0.13 -0.10 0.00 -0.02 0.00 0.00 41.12 41.76 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 1.11 -0.08 1.24 1.51 -0.15 -1.54 117.35 116.88 3dfy s TYR 261 Ca -0.09 -0.73 0.02 0.00 -1.01 0.00 0.00 57.07 55.25 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 -0.12 0.08 -1.11 0.00 0.00 175.55 175.22 3dfy s VAL 262 N -2.95 1.18 -0.50 0.71 1.01 -0.84 -1.45 120.40 117.56 3dfy s VAL 262 Ca 0.11 -0.48 -0.18 0.00 0.00 0.00 0.00 61.98 61.43 3dfy s VAL 262 Cb 0.00 -1.09 0.07 0.00 0.00 0.00 0.00 36.38 35.37 3dfy s VAL 262 CO -0.01 0.37 0.54 0.21 0.00 0.00 0.00 175.10 176.22 3dfy s ASN 263 N 0.82 6.19 0.14 3.32 2.47 0.19 -2.12 114.94 125.95 3dfy s ASN 263 Ca -0.11 -1.16 -0.29 0.00 0.42 0.00 0.00 52.86 51.72 3dfy s ASN 263 Cb -0.15 -2.25 -0.07 0.00 -1.45 0.00 0.00 41.25 37.33 3dfy s ASN 263 CO 0.02 -0.82 0.91 -0.63 -3.72 0.00 0.00 177.10 172.86 3dfy s ILE 264 N 2.22 4.42 -0.08 -5.21 1.01 0.61 -4.69 121.20 119.49 3dfy s ILE 264 Ca 0.10 1.97 0.00 0.00 0.00 0.00 0.00 60.65 62.73 3dfy s ILE 264 Cb -0.22 -4.28 0.02 0.00 0.01 0.00 0.00 42.46 38.00 3dfy s ILE 264 CO 0.09 0.39 -0.06 -0.54 0.00 0.00 0.00 174.94 174.81 3dfy s LYS 265 N -0.39 1.25 0.48 2.79 1.02 -1.26 -0.77 119.74 122.85 3dfy s LYS 265 Ca 0.43 -0.19 0.15 0.00 0.02 0.00 0.00 55.97 56.38 3dfy s LYS 265 Cb -0.23 -1.28 1.13 0.00 -0.52 0.00 0.00 37.83 36.93 3dfy s LYS 265 CO 0.29 -0.18 2.07 -0.07 -0.92 0.00 0.00 175.35 176.54 3dfy h LEU 266 N 7.76 0.19 -1.16 3.17 3.38 -1.87 0.76 115.31 127.55 3dfy h LEU 266 Ca -0.30 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3dfy h LEU 266 Cb 1.15 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3dfy h LEU 266 CO 0.41 0.13 0.00 0.24 0.09 0.00 0.00 178.44 179.31 3dfy h MET 267 N 0.23 0.00 0.04 1.13 2.86 -1.91 0.28 114.93 117.55 3dfy h MET 267 Ca 0.13 0.00 -0.37 0.00 -2.06 0.00 0.00 59.70 57.40 3dfy h MET 267 Cb 0.24 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.85 3dfy h MET 267 CO -0.02 0.00 -2.16 1.63 1.06 0.00 0.00 176.91 177.42 3dfy n LYS 268 N -2.59 0.66 -0.03 1.72 5.02 0.17 -2.84 118.16 120.27 3dfy n LYS 268 Ca 0.01 0.27 0.06 0.00 -2.02 0.00 0.00 58.31 56.63 3dfy n LYS 268 Cb 0.23 -1.61 -0.15 0.00 -0.02 0.00 0.00 35.03 33.48 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 -3.68 0.43 -0.05 4.39 7.64 -0.64 -4.70 113.62 117.01 3dfy n SER 269 Ca -0.41 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.48 3dfy n SER 269 Cb 0.95 1.70 -0.00 0.00 -1.01 0.00 0.00 64.21 65.85 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 1.48 -1.65 0.24 0.23 0.00 0.98 -3.31 105.19 103.16 3dfy n GLY 270 Ca -0.10 -1.50 -0.15 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.05 1.28 0.37 -0.61 1.08 -1.82 -2.81 117.51 114.94 3dfy h ILE 271 Ca -0.00 -1.80 -0.00 0.00 -0.39 0.00 0.00 64.86 62.66 3dfy h ILE 271 Cb 0.05 1.73 -0.02 0.00 -3.07 0.00 0.00 36.82 35.51 3dfy h ILE 271 CO 0.00 0.58 -0.33 0.77 -0.69 0.00 0.00 178.15 178.49 3dfy h SER 272 N 0.62 -0.87 -0.12 1.72 4.64 -1.95 -0.87 113.55 116.72 3dfy h SER 272 Ca -0.00 0.07 -0.08 0.00 -0.47 0.00 0.00 61.79 61.31 3dfy h SER 272 Cb 1.22 0.29 -0.02 0.00 -0.31 0.00 0.00 62.40 63.59 3dfy h SER 272 CO 0.13 -0.47 -0.15 0.44 -0.87 0.00 0.00 176.83 175.90 3dfy h ASP 273 N -0.71 0.49 -0.63 4.97 5.19 -1.66 -2.32 116.42 121.75 3dfy h ASP 273 Ca -0.03 -0.14 -0.05 0.00 -0.62 0.00 0.00 57.03 56.20 3dfy h ASP 273 Cb 0.63 -0.13 -0.03 0.00 0.18 0.00 0.00 39.33 39.98 3dfy h ASP 273 CO -0.04 0.67 0.21 0.00 -3.12 0.00 0.00 179.24 176.96 3dfy h ALA 274 N 1.38 1.13 -0.60 3.45 0.00 -1.26 0.34 119.26 123.71 3dfy h ALA 274 Ca 0.08 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 3dfy h ALA 274 Cb 0.54 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3dfy h ALA 274 CO 0.03 0.60 -0.01 -0.07 0.00 0.00 0.00 179.25 179.80 3dfy h LEU 275 N 0.97 1.04 -0.49 0.00 3.38 -0.82 -1.61 115.31 117.77 3dfy h LEU 275 Ca 0.22 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 3dfy h LEU 275 Cb 0.26 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 3dfy h LEU 275 CO -0.01 1.09 0.08 0.00 0.09 0.00 0.00 178.44 179.69 3dfy h ALA 276 N 1.01 0.65 -0.56 1.53 0.00 -0.84 -2.69 119.26 118.37 3dfy h ALA 276 Ca 0.17 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3dfy h ALA 276 Cb 0.57 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3dfy h ALA 276 CO 0.03 0.39 0.19 0.82 0.00 0.00 0.00 179.25 180.68 3dfy h ILE 277 N 0.69 1.21 -0.45 0.00 2.04 -0.11 -1.03 117.51 119.87 3dfy h ILE 277 Ca 0.15 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 3dfy h ILE 277 Cb 0.40 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 3dfy h ILE 277 CO 0.01 0.27 0.22 0.58 0.00 0.00 0.00 178.15 179.24 3dfy h VAL 278 N 0.81 1.18 -0.56 1.67 2.07 -1.10 -0.50 116.25 119.82 3dfy h VAL 278 Ca 0.19 -0.50 -0.09 0.00 0.82 0.00 0.00 66.70 67.12 3dfy h VAL 278 Cb 0.22 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 3dfy h VAL 278 CO -0.01 0.19 -0.02 -0.33 0.02 0.00 0.00 177.57 177.43 3dfy h GLU 279 N 0.58 1.00 -0.50 1.57 4.39 -1.12 -1.58 114.58 118.94 3dfy h GLU 279 Ca 0.16 -0.33 -0.05 0.00 0.34 0.00 0.00 59.36 59.48 3dfy h GLU 279 Cb 0.10 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 3dfy h GLU 279 CO -0.02 1.00 0.13 0.82 -1.16 0.00 0.00 179.01 179.78 3dfy h ILE 280 N 0.88 1.24 0.02 3.13 2.04 -1.05 -2.17 117.51 121.59 3dfy h ILE 280 Ca 0.16 -0.82 -0.00 0.00 1.00 0.00 0.00 64.86 65.19 3dfy h ILE 280 Cb 0.56 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 3dfy h ILE 280 CO 0.03 0.30 -0.01 0.00 0.00 0.00 0.00 178.15 178.47 3dfy h ALA 281 N 1.00 -0.03 0.00 1.87 0.00 -0.94 -2.27 119.26 118.89 3dfy h ALA 281 Ca 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3dfy h ALA 281 Cb 0.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3dfy h ALA 281 CO -0.00 -0.50 0.00 0.39 0.00 0.00 0.00 179.25 179.14 3dfy n GLU 282 N -5.08 0.20 -0.01 0.00 1.02 -0.61 -1.61 120.64 114.55 3dfy n GLU 282 Ca -0.07 0.15 0.08 0.00 -0.02 0.00 0.00 57.16 57.29 3dfy n GLU 282 Cb 0.06 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.05 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 -1.31 2.37 -0.60 1.62 7.64 -0.83 -4.63 113.62 117.88 3dfy n SER 283 Ca 0.07 -1.68 0.01 0.00 1.01 0.00 0.00 58.87 58.28 3dfy n SER 283 Cb 0.13 -0.01 0.01 0.00 -1.01 0.00 0.00 64.21 63.33 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 0.90 0.26 -0.18 6.43 3.41 -0.63 -5.01 113.62 118.79 3dfy n SER 284 Ca 0.10 -2.07 -0.02 0.00 -0.26 0.00 0.00 58.87 56.61 3dfy n SER 284 Cb 0.40 -0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 64.12 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 -0.02 0.46 3.74 5.00 0.00 -1.10 -4.99 105.19 108.28 3dfy n GLY 285 Ca 0.02 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.55 4.36 0.42 0.99 2.96 -1.00 -5.01 118.68 120.85 3dfy s LEU 286 Ca 0.00 1.15 -0.03 0.00 -0.22 0.00 0.00 54.13 55.03 3dfy s LEU 286 Cb 0.00 -2.98 -0.04 0.00 0.50 0.00 0.00 46.19 43.67 3dfy s LEU 286 CO 0.00 -0.00 0.68 -0.54 -1.32 0.00 0.00 176.35 175.17 3dfy s LYS 287 N 0.31 3.53 0.12 1.98 -0.14 -0.59 -4.40 119.74 120.55 3dfy s LYS 287 Ca 0.34 -0.02 0.05 0.00 -1.36 0.00 0.00 55.97 54.98 3dfy s LYS 287 Cb -0.18 -2.50 -0.04 0.00 -1.68 0.00 0.00 37.83 33.43 3dfy s LYS 287 CO 0.17 -0.05 -0.12 -0.51 -0.76 0.00 0.00 175.35 174.08 3dfy s LEU 288 N -4.51 2.42 0.05 3.17 1.43 -1.26 -1.98 118.68 118.00 3dfy s LEU 288 Ca 0.44 -0.84 -0.03 0.00 -1.03 0.00 0.00 54.13 52.67 3dfy s LEU 288 Cb -0.10 -0.46 -0.02 0.00 0.03 0.00 0.00 46.19 45.64 3dfy s LEU 288 CO 0.41 -0.20 0.04 0.00 0.23 0.00 0.00 176.35 176.83 3dfy s MET 289 N -2.87 0.60 -0.05 1.70 0.23 -0.90 -1.35 119.30 116.66 3dfy s MET 289 Ca 0.09 -0.95 0.04 0.00 -1.03 0.00 0.00 55.69 53.84 3dfy s MET 289 Cb -0.03 0.22 -0.00 0.00 -1.53 0.00 0.00 34.83 33.49 3dfy s MET 289 CO 0.02 -0.14 -0.18 -1.50 -2.03 0.00 0.00 175.02 171.20 3dfy s ILE 290 N -3.16 1.50 0.00 3.16 2.07 -0.94 -0.28 121.20 123.55 3dfy s ILE 290 Ca -0.00 -0.74 0.00 0.00 -1.41 0.00 0.00 60.65 58.49 3dfy s ILE 290 Cb 0.02 -1.30 0.00 0.00 0.13 0.00 0.00 42.46 41.31 3dfy s ILE 290 CO -0.07 0.43 0.00 0.61 -1.91 0.00 0.00 174.94 174.00 3dfy n GLY 291 N 3.24 6.21 3.66 1.50 0.00 0.05 0.10 105.19 119.95 3dfy n GLY 291 Ca -0.19 -2.03 -0.10 0.00 0.00 0.00 0.00 46.02 43.69 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 -0.50 0.00 -1.97 0.00 2.81 -1.26 -4.98 117.12 111.22 3dfy n MET 293 Ca -0.03 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.80 3dfy n MET 293 Cb 0.61 0.00 0.06 0.00 -0.71 0.00 0.00 33.22 33.18 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 4.36 3.72 3.76 3.03 0.00 -1.26 -4.78 105.19 114.01 3dfy n GLY 294 Ca 0.00 -1.59 -0.39 0.00 0.00 0.00 0.00 46.02 44.04 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 -3.00 3.33 0.75 1.61 8.01 -1.26 -4.90 118.70 123.24 3dfy s GLU 295 Ca 0.38 2.28 -0.03 0.00 0.01 0.00 0.00 54.97 57.62 3dfy s GLU 295 Cb 0.37 -2.39 0.15 0.00 -4.31 0.00 0.00 34.13 27.95 3dfy s GLU 295 CO -0.04 -1.05 1.03 -1.13 0.01 0.00 0.00 175.26 174.08 3dfy n SER 296 N -0.74 1.15 -0.29 -0.19 3.41 -1.26 -2.71 113.62 112.98 3dfy n SER 296 Ca 0.09 -2.02 0.07 0.00 -0.26 0.00 0.00 58.87 56.74 3dfy n SER 296 Cb 0.44 -0.69 0.22 0.00 -0.26 0.00 0.00 64.21 63.91 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 -0.76 0.49 -0.41 4.04 4.64 -1.93 0.30 113.55 119.94 3dfy h SER 297 Ca -0.34 0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.07 3dfy h SER 297 Cb 1.20 0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 3dfy h SER 297 CO 0.34 0.21 0.24 0.25 -0.87 0.00 0.00 176.83 177.00 3dfy h LEU 298 N 0.60 0.51 -0.00 5.97 5.85 -1.94 -1.70 115.31 124.59 3dfy h LEU 298 Ca 0.45 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 59.13 3dfy h LEU 298 Cb 0.64 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.54 3dfy h LEU 298 CO -0.36 0.41 -0.06 1.23 -0.34 0.00 0.00 178.44 179.31 3dfy h GLY 299 N 0.65 0.05 2.00 3.75 0.00 -0.86 -3.23 103.07 105.43 3dfy h GLY 299 Ca 0.15 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 3dfy h GLY 299 CO -0.03 0.07 -0.03 1.19 0.00 0.00 0.00 176.54 177.75 3dfy h ILE 300 N -0.69 0.35 -0.78 2.60 6.09 -0.78 -0.23 117.51 124.05 3dfy h ILE 300 Ca -0.01 -0.17 0.10 0.00 -1.37 0.00 0.00 64.86 63.42 3dfy h ILE 300 Cb 0.82 1.12 -0.05 0.00 0.47 0.00 0.00 36.82 39.18 3dfy h ILE 300 CO 0.01 0.03 0.51 -1.13 -3.07 0.00 0.00 178.15 174.51 3dfy h ASN 301 N 0.00 0.62 -0.63 2.19 -1.24 -1.32 -0.16 115.58 115.04 3dfy h ASN 301 Ca -0.00 0.02 0.01 0.00 0.71 0.00 0.00 56.30 57.04 3dfy h ASN 301 Cb 0.12 -0.11 -0.03 0.00 0.73 0.00 0.00 38.32 39.02 3dfy h ASN 301 CO 0.00 0.36 0.41 1.56 -1.29 0.00 0.00 177.43 178.47 3dfy h GLN 302 N 0.68 0.80 0.00 6.67 4.20 -1.16 -1.90 115.11 124.40 3dfy h GLN 302 Ca 0.37 -0.05 -0.18 0.00 0.06 0.00 0.00 58.65 58.84 3dfy h GLN 302 Cb 0.50 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 3dfy h GLN 302 CO -0.14 0.53 -0.88 0.77 -0.67 0.00 0.00 178.83 178.44 3dfy h SER 303 N 0.83 0.00 -0.22 1.46 0.02 -1.39 -2.76 113.55 111.49 3dfy h SER 303 Ca 0.23 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.17 3dfy h SER 303 Cb -0.07 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 3dfy h SER 303 CO -0.06 0.88 0.06 0.58 -1.14 0.00 0.00 176.83 177.15 3dfy h VAL 304 N 0.00 1.19 -0.58 2.27 2.07 -0.75 0.75 116.25 121.20 3dfy h VAL 304 Ca -0.01 -0.62 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 3dfy h VAL 304 Cb 1.56 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 32.50 3dfy h VAL 304 CO 0.11 0.20 0.09 0.45 0.02 0.00 0.00 177.57 178.44 3dfy h HIS 305 N 0.17 0.98 -0.09 1.57 -0.00 -1.40 0.22 115.15 116.60 3dfy h HIS 305 Ca 0.07 -0.12 -0.01 0.00 -0.00 0.00 0.00 60.37 60.31 3dfy h HIS 305 Cb 0.24 -0.27 -0.00 0.00 -0.00 0.00 0.00 27.41 27.37 3dfy h HIS 305 CO 0.00 0.84 0.03 0.35 -0.00 0.00 0.00 177.93 179.15 3dfy h PHE 306 N 0.88 0.14 -0.38 2.45 3.57 -1.23 0.19 116.94 122.57 3dfy h PHE 306 Ca 0.18 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 3dfy h PHE 306 Cb 0.39 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.08 3dfy h PHE 306 CO 0.02 0.28 0.17 0.00 -2.23 0.00 0.00 178.31 176.55 3dfy h ALA 307 N 0.85 0.49 -0.16 2.41 0.00 -0.67 -0.55 119.26 121.63 3dfy h ALA 307 Ca 0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 3dfy h ALA 307 Cb 0.20 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3dfy h ALA 307 CO -0.00 0.07 0.01 -0.07 0.00 0.00 0.00 179.25 179.26 3dfy h LEU 308 N 0.47 0.26 0.36 0.00 3.38 -0.90 0.15 115.31 119.03 3dfy h LEU 308 Ca 0.13 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 3dfy h LEU 308 Cb 0.15 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3dfy h LEU 308 CO -0.01 0.48 -0.18 1.23 0.09 0.00 0.00 178.44 180.05 3dfy h GLY 309 N 0.03 -0.51 2.00 0.83 0.00 -0.51 -1.11 103.07 103.80 3dfy h GLY 309 Ca 0.05 0.19 -0.16 0.00 0.00 0.00 0.00 47.33 47.40 3dfy h GLY 309 CO 0.01 -0.19 -0.77 -0.91 0.00 0.00 0.00 176.54 174.68 3dfy h THR 310 N -0.56 1.40 -2.79 4.70 1.35 -1.19 -0.85 112.91 114.98 3dfy h THR 310 Ca -0.05 -2.78 -0.33 0.00 -0.55 0.00 0.00 66.41 62.70 3dfy h THR 310 Cb 0.42 2.56 -0.05 0.00 -1.73 0.00 0.00 68.15 69.35 3dfy h THR 310 CO 0.08 0.75 -0.39 0.61 -0.25 0.00 0.00 175.52 176.33 3dfy n GLY 311 N 1.05 0.10 0.11 5.82 0.00 0.52 -4.80 105.19 107.98 3dfy n GLY 311 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.26 2.98 -2.77 4.61 0.00 -1.26 -4.92 120.51 117.89 3dfy n ALA 312 Ca -0.19 -0.30 -0.35 0.00 0.00 0.00 0.00 53.44 52.60 3dfy n ALA 312 Cb 0.62 -1.25 -0.09 0.00 0.00 0.00 0.00 19.45 18.73 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 -2.67 3.29 0.09 0.00 0.08 -1.26 -4.40 117.98 113.11 3dfy s PHE 313 Ca 0.22 0.24 -0.05 0.00 0.12 0.00 0.00 56.93 57.46 3dfy s PHE 313 Cb 0.19 -1.88 -0.24 0.00 -0.57 0.00 0.00 43.02 40.52 3dfy s PHE 313 CO 0.55 0.47 1.17 0.93 -0.10 0.00 0.00 175.22 178.24 3dfy h GLU 314 N 5.42 0.33 -4.96 0.44 4.39 -1.57 -3.46 114.58 115.18 3dfy h GLU 314 Ca -0.49 -0.50 -0.35 0.00 0.34 0.00 0.00 59.36 58.36 3dfy h GLU 314 Cb 1.20 0.18 -0.22 0.00 -0.10 0.00 0.00 28.75 29.81 3dfy h GLU 314 CO 0.58 1.21 -0.76 -0.06 -1.16 0.00 0.00 179.01 178.82 3dfy s PHE 315 N -2.82 0.94 -0.11 4.33 0.08 -1.24 -5.07 117.98 114.10 3dfy s PHE 315 Ca -0.05 -0.46 0.01 0.00 0.12 0.00 0.00 56.93 56.55 3dfy s PHE 315 Cb 0.07 -0.55 0.02 0.00 -0.57 0.00 0.00 43.02 41.99 3dfy s PHE 315 CO 0.89 -0.01 -0.12 -1.01 -0.10 0.00 0.00 175.22 174.87 3dfy s HIS 316 N -1.25 1.73 -0.75 0.36 3.76 -1.25 -2.22 115.29 115.66 3dfy s HIS 316 Ca -0.05 -0.82 0.03 0.00 -0.15 0.00 0.00 55.06 54.07 3dfy s HIS 316 Cb -0.10 -1.31 0.24 0.00 1.11 0.00 0.00 32.58 32.53 3dfy s HIS 316 CO 0.01 -0.47 0.81 -3.47 -0.85 0.00 0.00 174.74 170.77 3dfy n ASP 317 N 4.45 4.07 -3.61 1.40 2.03 0.11 -1.40 116.55 123.61 3dfy n ASP 317 Ca -0.17 -3.36 -0.28 0.00 0.52 0.00 0.00 54.79 51.50 3dfy n ASP 317 Cb 0.51 -0.82 -0.09 0.00 -0.72 0.00 0.00 41.12 40.00 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 1.29 3.58 0.00 -2.67 4.77 -1.26 -3.28 117.00 119.42 3dfy n LEU 318 Ca 0.27 -5.36 0.00 0.00 -0.03 0.00 0.00 56.01 50.88 3dfy n LEU 318 Cb 0.38 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 3dfy n LEU 318 CO 0.42 1.94 0.31 -0.90 -1.33 0.00 0.00 177.39 177.84 3dfy n ASP 319 N 1.25 1.23 -0.21 -1.43 5.75 -1.26 -4.76 116.55 117.12 3dfy n ASP 319 Ca 0.26 -1.28 0.10 0.00 -0.01 0.00 0.00 54.79 53.87 3dfy n ASP 319 Cb 0.39 0.00 0.38 0.00 -1.03 0.00 0.00 41.12 40.86 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 0.00 0.62 1.01 -1.12 4.64 -1.86 0.95 113.55 117.79 3dfy h SER 320 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3dfy h SER 320 Cb 0.17 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 3dfy h SER 320 CO 0.00 0.36 0.00 1.12 -0.87 0.00 0.00 176.83 177.44 3dfy h HIS 321 N 0.68 0.00 0.00 4.77 2.07 -1.81 -2.55 115.15 118.31 3dfy h HIS 321 Ca 0.37 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.89 3dfy h HIS 321 Cb 0.51 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.49 3dfy h HIS 321 CO -0.00 0.00 -0.16 1.28 -3.07 0.00 0.00 177.93 175.98 3dfy n LEU 322 N -2.49 0.68 -0.11 6.12 4.77 0.32 -3.29 117.00 123.00 3dfy n LEU 322 Ca 0.03 0.47 0.11 0.00 -0.03 0.00 0.00 56.01 56.58 3dfy n LEU 322 Cb 0.30 -0.31 0.08 0.00 -2.33 0.00 0.00 43.42 41.16 3dfy n LEU 322 CO 0.24 -0.12 0.25 0.23 -1.33 0.00 0.00 177.39 176.67 3dfy n MET 323 N -2.11 0.31 -3.91 3.23 2.81 -0.96 -4.95 117.12 111.54 3dfy n MET 323 Ca 0.05 -0.23 -0.21 0.00 -1.81 0.00 0.00 57.70 55.50 3dfy n MET 323 Cb 0.42 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.40 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 -2.85 3.86 -0.18 4.03 1.43 -1.21 -1.13 118.68 122.64 3dfy s LEU 324 Ca 0.13 -0.26 -0.06 0.00 -1.03 0.00 0.00 54.13 52.91 3dfy s LEU 324 Cb 0.17 -2.46 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 3dfy s LEU 324 CO 0.72 -0.19 0.04 -0.54 0.23 0.00 0.00 176.35 176.61 3dfy s LYS 325 N -3.96 3.86 -0.03 1.70 1.02 -0.12 -4.85 119.74 117.37 3dfy s LYS 325 Ca 0.37 -0.40 -0.00 0.00 0.02 0.00 0.00 55.97 55.95 3dfy s LYS 325 Cb -0.08 -3.15 0.03 0.00 -0.52 0.00 0.00 37.83 34.12 3dfy s LYS 325 CO 0.27 0.21 0.04 -1.21 -0.92 0.00 0.00 175.35 173.75 3dfy s GLU 326 N 0.51 -0.03 0.27 1.68 2.02 -1.26 -4.41 118.70 117.48 3dfy s GLU 326 Ca 0.01 0.23 -0.04 0.00 0.02 0.00 0.00 54.97 55.19 3dfy s GLU 326 Cb -0.13 -0.27 0.35 0.00 0.10 0.00 0.00 34.13 34.19 3dfy s GLU 326 CO 0.01 -0.18 1.95 1.05 0.02 0.00 0.00 175.26 178.11 3dfy h GLU 327 N 7.40 1.21 -4.06 1.61 4.11 -2.03 -3.42 114.58 119.38 3dfy h GLU 327 Ca -0.43 -0.07 -0.28 0.00 0.07 0.00 0.00 59.36 58.65 3dfy h GLU 327 Cb 1.12 -0.27 -0.28 0.00 0.50 0.00 0.00 28.75 29.82 3dfy h GLU 327 CO 0.44 0.80 -0.74 0.54 0.07 0.00 0.00 179.01 180.13 3dfy s VAL 328 N -6.03 0.23 0.32 -1.06 0.11 -1.26 -5.13 120.40 107.58 3dfy s VAL 328 Ca -0.12 -0.20 -0.29 0.00 -2.93 0.00 0.00 61.98 58.43 3dfy s VAL 328 Cb 0.18 -0.22 -0.11 0.00 -1.53 0.00 0.00 36.38 34.70 3dfy s VAL 328 CO 0.81 0.02 1.54 0.12 -3.33 0.00 0.00 175.10 174.25 3dfy s PHE 329 N -0.19 2.73 -0.07 1.54 5.36 -1.26 -4.93 117.98 121.16 3dfy s PHE 329 Ca -0.00 0.94 0.11 0.00 -0.96 0.00 0.00 56.93 57.02 3dfy s PHE 329 Cb -0.02 -4.02 0.16 0.00 -0.34 0.00 0.00 43.02 38.80 3dfy s PHE 329 CO -0.00 -3.28 1.06 0.54 -1.46 0.00 0.00 175.22 172.09 3dfy n ARG 330 N 1.61 0.94 -3.79 10.12 1.74 -1.26 -5.05 116.66 120.97 3dfy n ARG 330 Ca 0.06 -1.91 -0.30 0.00 -0.77 0.00 0.00 57.85 54.93 3dfy n ARG 330 Cb 0.38 -1.10 -0.04 0.00 -1.02 0.00 0.00 32.46 30.68 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 -2.02 2.10 -0.81 -0.13 0.00 -1.26 -3.89 107.32 101.32 3dfy s GLY 331 Ca 0.18 -0.75 -0.03 0.00 0.00 0.00 0.00 44.72 44.12 3dfy s GLY 331 CO 0.02 -0.70 2.35 0.28 0.00 0.00 0.00 173.10 175.05 3dfy n LYS 332 N -0.03 3.34 -3.88 2.90 5.02 -1.26 -4.88 118.16 119.37 3dfy n LYS 332 Ca -0.04 -3.22 -0.09 0.00 -2.02 0.00 0.00 58.31 52.94 3dfy n LYS 332 Cb 0.52 -2.31 -0.04 0.00 -0.02 0.00 0.00 35.03 33.18 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 -2.69 0.05 -0.20 2.13 -0.12 -1.26 -4.77 117.98 111.13 3dfy s PHE 333 Ca 0.53 -0.44 -0.09 0.00 -0.05 0.00 0.00 56.93 56.89 3dfy s PHE 333 Cb 0.34 0.40 -0.05 0.00 -0.63 0.00 0.00 43.02 43.08 3dfy s PHE 333 CO -0.24 -1.04 0.10 0.42 -0.05 0.00 0.00 175.22 174.41 3dfy s ILE 334 N -3.94 5.09 -0.38 -4.49 1.01 0.13 -4.94 121.20 113.68 3dfy s ILE 334 Ca 0.15 0.08 -0.08 0.00 0.00 0.00 0.00 60.65 60.80 3dfy s ILE 334 Cb -0.02 -3.32 0.06 0.00 0.01 0.00 0.00 42.46 39.18 3dfy s ILE 334 CO 0.05 0.43 0.18 -1.58 0.00 0.00 0.00 174.94 174.02 3dfy s GLN 335 N 0.51 2.60 -0.49 2.79 2.00 -1.26 -1.27 119.66 124.54 3dfy s GLN 335 Ca 0.06 -1.32 0.03 0.00 -2.00 0.00 0.00 55.36 52.14 3dfy s GLN 335 Cb -0.12 -3.63 0.13 0.00 0.80 0.00 0.00 33.01 30.19 3dfy s GLN 335 CO 0.00 -0.81 0.24 0.34 -0.50 0.00 0.00 175.29 174.57 3dfy s ASP 336 N 1.73 4.17 0.59 6.67 2.15 -0.06 -5.02 116.67 126.89 3dfy s ASP 336 Ca 0.01 -2.86 0.00 0.00 0.43 0.00 0.00 52.55 50.13 3dfy s ASP 336 Cb -0.21 -1.48 0.00 0.00 -0.30 0.00 0.00 42.92 40.93 3dfy s ASP 336 CO 0.03 -0.25 0.00 0.61 -0.17 0.00 0.00 175.17 175.39 3dfy n GLY 337 N 3.29 1.55 0.00 2.66 0.00 -1.26 -2.38 105.19 109.05 3dfy n GLY 337 Ca 0.06 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.54 3dfy n GLY 337 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dfy n PRO 338 N 12.88 0.35 -4.01 1.61 -0.02 -1.26 -4.84 135.00 139.72 3dfy n PRO 338 Ca 0.00 0.07 -0.29 0.00 -2.02 0.00 0.00 63.50 61.25 3dfy n PRO 338 Cb 0.00 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 31.93 3dfy n PRO 338 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3dfy s ARG 339 N -2.53 3.10 -0.04 -0.52 0.52 -1.00 -0.06 118.95 118.42 3dfy s ARG 339 Ca 0.23 -0.65 0.03 0.00 -0.52 0.00 0.00 55.73 54.82 3dfy s ARG 339 Cb 0.15 -2.82 0.00 0.00 0.52 0.00 0.00 34.95 32.81 3dfy s ARG 339 CO 0.34 0.55 -0.13 -1.64 0.02 0.00 0.00 175.30 174.45 3dfy s MET 340 N -2.68 1.44 0.19 3.54 -1.94 0.62 -0.88 119.30 119.59 3dfy s MET 340 Ca 0.32 -0.43 0.01 0.00 -1.71 0.00 0.00 55.69 53.87 3dfy s MET 340 Cb -0.12 -1.26 -0.05 0.00 2.01 0.00 0.00 34.83 35.42 3dfy s MET 340 CO 0.25 0.13 0.06 1.03 -0.01 0.00 0.00 175.02 176.48 3dfy s ARG 341 N 0.28 1.17 -0.16 2.03 0.52 -0.40 -1.21 118.95 121.19 3dfy s ARG 341 Ca -0.07 -1.59 -0.07 0.00 -0.52 0.00 0.00 55.73 53.47 3dfy s ARG 341 Cb -0.12 -0.08 -0.04 0.00 0.52 0.00 0.00 34.95 35.24 3dfy s ARG 341 CO 0.02 -0.25 0.09 0.54 0.02 0.00 0.00 175.30 175.72 3dfy s VAL 342 N -3.85 5.05 -2.00 3.52 0.11 -1.24 0.18 120.40 122.17 3dfy s VAL 342 Ca 0.30 0.05 0.26 0.00 -2.93 0.00 0.00 61.98 59.67 3dfy s VAL 342 Cb 0.07 -3.25 0.75 0.00 -1.53 0.00 0.00 36.38 32.42 3dfy s VAL 342 CO 0.08 0.50 1.93 1.17 -3.33 0.00 0.00 175.10 175.45