#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 3.89 -0.05 0.55 1.01 -0.60 -0.74 121.20 125.25 3dfy s ILE 4 Ca 0.00 1.23 0.19 0.00 0.00 0.00 0.00 60.65 62.07 3dfy s ILE 4 Cb 0.00 -3.79 -0.28 0.00 0.01 0.00 0.00 42.46 38.40 3dfy s ILE 4 CO 0.00 -0.02 0.36 1.33 0.00 0.00 0.00 174.94 176.61 3dfy n VAL 5 N 4.78 0.21 -3.50 2.92 0.24 0.85 -0.13 118.33 123.70 3dfy n VAL 5 Ca 0.13 -0.49 -0.11 0.00 -2.04 0.00 0.00 64.34 61.83 3dfy n VAL 5 Cb 0.44 -0.04 -0.03 0.00 -1.47 0.00 0.00 33.84 32.74 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 -4.37 -0.44 -0.11 -1.34 2.47 -1.07 -4.91 114.94 105.17 3dfy s ASN 6 Ca -0.07 0.17 -0.08 0.00 0.42 0.00 0.00 52.86 53.29 3dfy s ASN 6 Cb 0.11 0.43 0.03 0.00 -1.45 0.00 0.00 41.25 40.37 3dfy s ASN 6 CO 0.78 -0.63 0.27 0.54 -3.72 0.00 0.00 177.10 174.35 3dfy s VAL 7 N -2.61 -0.01 0.01 -5.21 0.11 -1.26 -0.94 120.40 110.49 3dfy s VAL 7 Ca 0.01 0.04 -0.02 0.00 -2.93 0.00 0.00 61.98 59.08 3dfy s VAL 7 Cb -0.01 -0.40 -0.01 0.00 -1.53 0.00 0.00 36.38 34.43 3dfy s VAL 7 CO -0.05 0.02 0.03 -1.59 -3.33 0.00 0.00 175.10 170.17 3dfy s LYS 8 N 0.49 0.31 -0.02 1.54 -2.85 -0.36 -4.77 119.74 114.08 3dfy s LYS 8 Ca -0.03 -0.43 0.00 0.00 -1.00 0.00 0.00 55.97 54.51 3dfy s LYS 8 Cb -0.04 0.12 -0.04 0.00 -2.06 0.00 0.00 37.83 35.81 3dfy s LYS 8 CO -0.03 -0.06 0.02 -0.51 0.10 0.00 0.00 175.35 174.88 3dfy s LEU 9 N -1.17 3.63 -0.04 2.77 1.02 -1.26 -1.18 118.68 122.46 3dfy s LEU 9 Ca -0.13 0.06 -0.01 0.00 0.02 0.00 0.00 54.13 54.07 3dfy s LEU 9 Cb -0.08 -2.04 0.03 0.00 0.02 0.00 0.00 46.19 44.12 3dfy s LEU 9 CO -0.00 0.30 0.07 -0.44 0.02 0.00 0.00 176.35 176.29 3dfy s SER 10 N -1.47 0.40 0.08 2.29 0.01 -0.15 -4.94 113.70 109.91 3dfy s SER 10 Ca 0.19 0.12 -0.31 0.00 1.31 0.00 0.00 55.95 57.26 3dfy s SER 10 Cb -0.12 -0.02 -0.08 0.00 0.21 0.00 0.00 66.02 66.02 3dfy s SER 10 CO 0.10 -0.18 1.49 -0.22 0.41 0.00 0.00 173.24 174.84 3dfy s LEU 11 N 1.50 4.35 -0.13 2.44 2.96 -1.26 -0.64 118.68 127.91 3dfy s LEU 11 Ca -0.04 2.35 -0.00 0.00 -0.22 0.00 0.00 54.13 56.22 3dfy s LEU 11 Cb -0.12 -3.57 0.03 0.00 0.50 0.00 0.00 46.19 43.02 3dfy s LEU 11 CO -0.04 -0.76 -0.09 -0.54 -1.32 0.00 0.00 176.35 173.60 3dfy s LYS 12 N 1.90 1.73 -0.05 1.98 3.01 0.84 -4.92 119.74 124.23 3dfy s LYS 12 Ca 0.68 -0.36 -0.02 0.00 -1.01 0.00 0.00 55.97 55.26 3dfy s LYS 12 Cb -0.37 -1.77 -0.04 0.00 -1.01 0.00 0.00 37.83 34.64 3dfy s LYS 12 CO 0.30 -0.28 0.06 -0.98 0.51 0.00 0.00 175.35 174.96 3dfy s ARG 13 N 1.64 3.07 -0.09 1.68 3.03 -1.26 0.02 118.95 127.05 3dfy s ARG 13 Ca 0.05 -0.42 0.00 0.00 2.03 0.00 0.00 55.73 57.39 3dfy s ARG 13 Cb -0.13 -2.87 0.02 0.00 -1.03 0.00 0.00 34.95 30.94 3dfy s ARG 13 CO -0.09 0.68 -0.07 0.71 -1.13 0.00 0.00 175.30 175.40 3dfy s TYR 14 N -1.06 1.24 0.16 5.89 2.02 0.94 -4.95 117.35 121.59 3dfy s TYR 14 Ca 0.18 -0.53 -0.30 0.00 -0.37 0.00 0.00 57.07 56.06 3dfy s TYR 14 Cb -0.12 -1.04 -0.07 0.00 -0.40 0.00 0.00 41.96 40.33 3dfy s TYR 14 CO 0.08 -0.38 1.07 -2.00 -1.57 0.00 0.00 175.55 172.75 3dfy s GLU 15 N 1.38 4.62 0.39 -0.62 2.12 -1.26 0.07 118.70 125.40 3dfy s GLU 15 Ca -0.02 1.65 -0.07 0.00 0.36 0.00 0.00 54.97 56.90 3dfy s GLU 15 Cb -0.14 -3.30 0.09 0.00 0.26 0.00 0.00 34.13 31.04 3dfy s GLU 15 CO -0.04 0.12 0.49 0.66 -0.54 0.00 0.00 175.26 175.95 3dfy n TYR 16 N 2.46 -3.88 -2.31 5.30 4.01 -1.26 -1.95 117.16 119.52 3dfy n TYR 16 Ca 0.03 -0.43 -0.01 0.00 -0.16 0.00 0.00 57.90 57.33 3dfy n TYR 16 Cb 0.47 -0.40 -0.01 0.00 -0.31 0.00 0.00 39.34 39.09 3dfy n TYR 16 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 3dfy n GLU 17 N -2.19 0.09 -4.56 -0.72 2.13 -1.09 -4.69 120.64 109.61 3dfy n GLU 17 Ca 0.06 -1.63 -0.33 0.00 0.66 0.00 0.00 57.16 55.92 3dfy n GLU 17 Cb 0.22 0.16 -0.11 0.00 0.27 0.00 0.00 31.44 31.98 3dfy n GLU 17 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 3dfy s GLU 29 N -0.12 2.71 -0.27 5.31 2.12 -1.26 -5.14 118.70 122.05 3dfy s GLU 29 Ca 0.19 -0.59 -0.03 0.00 0.36 0.00 0.00 54.97 54.91 3dfy s GLU 29 Cb 0.23 -2.58 0.03 0.00 0.26 0.00 0.00 34.13 32.07 3dfy s GLU 29 CO -0.10 0.65 -0.01 0.45 -0.54 0.00 0.00 175.26 175.71 3dfy s SER 30 N -1.01 4.63 -0.46 -1.70 0.15 0.11 -4.93 113.70 110.49 3dfy s SER 30 Ca 0.14 -0.92 -0.14 0.00 0.70 0.00 0.00 55.95 55.74 3dfy s SER 30 Cb -0.11 -1.73 0.08 0.00 -1.71 0.00 0.00 66.02 62.55 3dfy s SER 30 CO 0.03 -0.17 0.36 -0.13 1.20 0.00 0.00 173.24 174.53 3dfy s ARG 31 N 1.35 2.86 0.43 5.44 0.52 -1.26 -0.04 118.95 128.25 3dfy s ARG 31 Ca -0.00 -1.40 0.07 0.00 -0.52 0.00 0.00 55.73 53.88 3dfy s ARG 31 Cb -0.17 -4.03 -0.03 0.00 0.52 0.00 0.00 34.95 31.24 3dfy s ARG 31 CO -0.02 -1.02 0.28 -0.80 0.02 0.00 0.00 175.30 173.76 3dfy s ASN 32 N 2.49 4.68 -0.21 0.23 0.01 0.10 -4.66 114.94 117.58 3dfy s ASN 32 Ca 0.04 -0.98 0.02 0.00 -0.71 0.00 0.00 52.86 51.22 3dfy s ASN 32 Cb -0.24 -0.40 0.04 0.00 0.41 0.00 0.00 41.25 41.06 3dfy s ASN 32 CO 0.05 -0.65 -0.13 -0.69 -1.51 0.00 0.00 177.10 174.17 3dfy s VAL 33 N -2.58 1.93 0.01 1.60 1.01 -0.22 -0.11 120.40 122.04 3dfy s VAL 33 Ca 0.42 -1.19 -0.20 0.00 0.00 0.00 0.00 61.98 61.01 3dfy s VAL 33 Cb 0.01 -1.94 -0.06 0.00 0.00 0.00 0.00 36.38 34.39 3dfy s VAL 33 CO 0.24 0.21 0.58 -0.70 0.00 0.00 0.00 175.10 175.43 3dfy s GLU 34 N 1.27 4.28 -0.16 2.72 2.12 0.19 -0.20 118.70 128.92 3dfy s GLU 34 Ca -0.02 0.72 -0.04 0.00 0.36 0.00 0.00 54.97 55.99 3dfy s GLU 34 Cb -0.17 -3.32 -0.03 0.00 0.26 0.00 0.00 34.13 30.88 3dfy s GLU 34 CO -0.09 0.42 -0.03 0.08 -0.54 0.00 0.00 175.26 175.11 3dfy s VAL 35 N -0.37 3.92 -0.14 3.70 1.01 0.76 -0.98 120.40 128.30 3dfy s VAL 35 Ca 0.30 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.96 3dfy s VAL 35 Cb -0.18 -2.73 0.01 0.00 0.00 0.00 0.00 36.38 33.48 3dfy s VAL 35 CO 0.17 0.48 -0.21 -0.70 0.00 0.00 0.00 175.10 174.85 3dfy s GLU 36 N 0.46 2.88 -0.11 2.72 2.12 -0.33 -1.16 118.70 125.29 3dfy s GLU 36 Ca -0.03 -0.80 0.01 0.00 0.36 0.00 0.00 54.97 54.50 3dfy s GLU 36 Cb -0.14 -2.37 -0.02 0.00 0.26 0.00 0.00 34.13 31.86 3dfy s GLU 36 CO 0.03 -0.06 -0.12 0.42 -0.54 0.00 0.00 175.26 174.99 3dfy s ILE 37 N 0.93 3.15 -0.13 -3.70 1.01 0.64 -1.22 121.20 121.87 3dfy s ILE 37 Ca -0.05 -0.65 0.02 0.00 0.00 0.00 0.00 60.65 59.98 3dfy s ILE 37 Cb -0.15 -2.30 0.00 0.00 0.01 0.00 0.00 42.46 40.02 3dfy s ILE 37 CO -0.04 0.54 -0.21 -0.69 0.00 0.00 0.00 174.94 174.55 3dfy s VAL 38 N 0.02 2.26 0.33 2.92 1.01 -0.11 0.13 120.40 126.96 3dfy s VAL 38 Ca -0.04 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.03 3dfy s VAL 38 Cb -0.14 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 3dfy s VAL 38 CO 0.04 0.54 0.52 -0.76 0.00 0.00 0.00 175.10 175.44 3dfy s LEU 39 N 0.63 4.05 0.65 3.92 1.02 0.06 -0.11 118.68 128.89 3dfy s LEU 39 Ca -0.11 0.37 0.43 0.00 0.02 0.00 0.00 54.13 54.84 3dfy s LEU 39 Cb -0.16 -3.23 2.25 0.00 0.02 0.00 0.00 46.19 45.07 3dfy s LEU 39 CO 0.03 -0.27 2.31 1.05 0.02 0.00 0.00 176.35 179.48 3dfy h GLU 40 N 0.81 0.00 -0.00 1.70 4.11 -1.26 0.24 114.58 120.18 3dfy h GLU 40 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 3dfy h GLU 40 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 3dfy h GLU 40 CO 0.61 0.00 -0.10 -1.13 0.07 0.00 0.00 179.01 178.46 3dfy n SER 41 N -3.09 0.35 0.00 3.06 3.41 -1.26 -4.90 113.62 111.19 3dfy n SER 41 Ca -0.02 -0.43 0.00 0.00 -0.26 0.00 0.00 58.87 58.15 3dfy n SER 41 Cb 0.11 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 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 1.30 0.92 3.77 5.00 0.00 0.07 -5.06 105.19 111.19 3dfy n GLY 42 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.25 2.93 -0.05 1.61 1.01 -1.26 -4.77 120.40 117.62 3dfy s VAL 43 Ca 0.00 0.74 0.04 0.00 0.00 0.00 0.00 61.98 62.76 3dfy s VAL 43 Cb 0.00 -3.40 -0.00 0.00 0.00 0.00 0.00 36.38 32.98 3dfy s VAL 43 CO 0.00 0.03 -0.17 -0.54 0.00 0.00 0.00 175.10 174.42 3dfy s LYS 44 N -2.53 1.96 0.00 2.72 1.02 -1.26 -0.77 119.74 120.90 3dfy s LYS 44 Ca 0.61 -0.62 0.04 0.00 0.02 0.00 0.00 55.97 56.02 3dfy s LYS 44 Cb -0.32 -1.65 -0.03 0.00 -0.52 0.00 0.00 37.83 35.31 3dfy s LYS 44 CO 0.40 0.20 -0.11 0.20 -0.92 0.00 0.00 175.35 175.12 3dfy s GLY 45 N 0.18 1.67 0.00 -3.33 0.00 0.12 -4.60 107.32 101.36 3dfy s GLY 45 Ca -0.08 -1.06 0.05 0.00 0.00 0.00 0.00 44.72 43.64 3dfy s GLY 45 CO 0.03 -0.92 -0.16 -0.19 0.00 0.00 0.00 173.10 171.86 3dfy s TYR 46 N -0.94 1.46 0.19 1.90 2.02 -1.26 -0.26 117.35 120.46 3dfy s TYR 46 Ca 0.15 -0.29 -0.03 0.00 -0.37 0.00 0.00 57.07 56.53 3dfy s TYR 46 Cb -0.11 -0.92 -0.03 0.00 -0.40 0.00 0.00 41.96 40.49 3dfy s TYR 46 CO 0.06 -0.00 0.16 0.20 -1.57 0.00 0.00 175.55 174.39 3dfy s GLY 47 N -0.56 1.23 -0.04 0.71 0.00 -0.31 -4.05 107.32 104.29 3dfy s GLY 47 Ca 0.06 -1.54 -0.02 0.00 0.00 0.00 0.00 44.72 43.22 3dfy s GLY 47 CO -0.00 -1.29 0.10 1.85 0.00 0.00 0.00 173.10 173.76 3dfy s GLU 48 N -4.12 0.05 -0.24 2.90 2.12 -1.26 -0.17 118.70 117.98 3dfy s GLU 48 Ca 0.34 0.26 -0.08 0.00 0.36 0.00 0.00 54.97 55.85 3dfy s GLU 48 Cb 0.06 -0.15 -0.04 0.00 0.26 0.00 0.00 34.13 34.26 3dfy s GLU 48 CO 0.09 -0.13 0.10 0.00 -0.54 0.00 0.00 175.26 174.78 3dfy s ALA 49 N 0.91 3.33 -0.53 6.30 0.00 0.72 -4.38 121.76 128.12 3dfy s ALA 49 Ca -0.07 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.87 3dfy s ALA 49 Cb -0.10 -2.16 0.14 0.00 0.00 0.00 0.00 23.12 21.00 3dfy s ALA 49 CO -0.04 -0.34 0.31 0.45 0.00 0.00 0.00 175.76 176.14 3dfy s SER 50 N 1.35 4.89 0.81 0.00 0.15 -1.26 -1.05 113.70 118.59 3dfy s SER 50 Ca 0.06 -2.73 -0.11 0.00 0.70 0.00 0.00 55.95 53.87 3dfy s SER 50 Cb -0.15 -1.76 0.08 0.00 -1.71 0.00 0.00 66.02 62.49 3dfy s SER 50 CO 0.05 -0.35 1.11 -2.16 1.20 0.00 0.00 173.24 173.10 3dfy s PRO 51 N 0.11 1.88 -0.07 5.44 0.04 -1.26 -4.62 135.00 136.52 3dfy s PRO 51 Ca 0.15 1.32 -0.03 0.00 0.04 0.00 0.00 61.00 62.49 3dfy s PRO 51 Cb -0.22 -1.84 0.04 0.00 0.04 0.00 0.00 34.50 32.51 3dfy s PRO 51 CO -0.03 -1.95 0.08 0.45 0.04 0.00 0.00 177.00 175.59 3dfy s SER 52 N -3.08 1.33 0.03 6.66 0.15 -1.26 -4.87 113.70 112.66 3dfy s SER 52 Ca 0.64 -0.03 -0.19 0.00 0.70 0.00 0.00 55.95 57.07 3dfy s SER 52 Cb -0.19 -0.11 -0.18 0.00 -1.71 0.00 0.00 66.02 63.82 3dfy s SER 52 CO 0.56 -0.27 1.22 0.15 1.20 0.00 0.00 173.24 176.09 3dfy h PHE 53 N 8.43 0.63 -0.59 3.44 3.57 -1.85 0.14 116.94 130.71 3dfy h PHE 53 Ca -0.13 -0.28 -0.10 0.00 3.53 0.00 0.00 57.97 61.00 3dfy h PHE 53 Cb 1.13 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.75 3dfy h PHE 53 CO 0.41 1.04 -0.01 -0.09 -2.23 0.00 0.00 178.31 177.43 3dfy h ARG 54 N 0.04 1.03 0.02 1.11 2.43 -1.94 -0.77 114.38 116.30 3dfy h ARG 54 Ca -0.03 -0.32 -0.32 0.00 -0.81 0.00 0.00 59.98 58.50 3dfy h ARG 54 Cb 1.10 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.51 3dfy h ARG 54 CO 0.09 1.01 -1.77 0.28 -1.51 0.00 0.00 179.97 178.08 3dfy n VAL 55 N -4.18 1.57 0.80 0.20 0.31 -1.25 -4.64 118.33 111.15 3dfy n VAL 55 Ca 0.03 -0.25 0.08 0.00 -0.01 0.00 0.00 64.34 64.19 3dfy n VAL 55 Cb 0.35 -1.91 -0.07 0.00 -0.91 0.00 0.00 33.84 31.29 3dfy n VAL 55 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3dfy n ASN 56 N -4.16 1.06 0.00 4.52 3.02 -0.07 -4.97 115.26 114.66 3dfy n ASN 56 Ca -0.38 -1.03 0.00 0.00 -0.03 0.00 0.00 54.58 53.13 3dfy n ASN 56 Cb 0.81 0.86 0.00 0.00 -0.61 0.00 0.00 39.78 40.84 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 1.36 0.56 3.85 7.41 0.00 -0.29 -4.94 105.19 113.14 3dfy n GLY 57 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.01 3.87 -0.06 1.61 2.02 -0.91 -4.84 118.70 120.38 3dfy s GLU 58 Ca 0.00 0.78 0.02 0.00 0.02 0.00 0.00 54.97 55.79 3dfy s GLU 58 Cb 0.00 -2.21 0.01 0.00 0.10 0.00 0.00 34.13 32.03 3dfy s GLU 58 CO 0.00 -0.22 -0.10 1.03 0.02 0.00 0.00 175.26 175.99 3dfy s ARG 59 N -4.08 1.40 0.43 1.61 1.81 -1.26 -2.88 118.95 115.97 3dfy s ARG 59 Ca 0.56 -0.32 0.13 0.00 -1.72 0.00 0.00 55.73 54.37 3dfy s ARG 59 Cb -0.10 -1.21 0.99 0.00 -0.45 0.00 0.00 34.95 34.19 3dfy s ARG 59 CO 0.33 0.01 1.99 -0.24 -0.68 0.00 0.00 175.30 176.71 3dfy h VAL 60 N 5.96 0.93 -0.22 3.52 3.04 -1.95 -0.58 116.25 126.96 3dfy h VAL 60 Ca -0.33 -0.15 -0.09 0.00 -1.01 0.00 0.00 66.70 65.12 3dfy h VAL 60 Cb 1.18 0.45 -0.01 0.00 -2.01 0.00 0.00 31.29 30.89 3dfy h VAL 60 CO 0.48 0.08 -0.24 -0.33 -1.01 0.00 0.00 177.57 176.54 3dfy h GLU 61 N 0.44 0.40 -0.36 4.17 3.07 -1.98 -2.71 114.58 117.62 3dfy h GLU 61 Ca 0.26 -0.14 -0.09 0.00 -0.50 0.00 0.00 59.36 58.89 3dfy h GLU 61 Cb 0.45 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 3dfy h GLU 61 CO -0.07 0.62 -0.12 0.00 -1.40 0.00 0.00 179.01 178.05 3dfy h ALA 62 N 1.39 0.49 -0.59 3.43 0.00 -1.54 -2.35 119.26 120.09 3dfy h ALA 62 Ca 0.06 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.69 3dfy h ALA 62 Cb 0.63 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 3dfy h ALA 62 CO 0.04 0.37 0.33 -0.07 0.00 0.00 0.00 179.25 179.93 3dfy h LEU 63 N 0.50 0.51 -1.02 0.00 4.07 -1.26 -2.37 115.31 115.74 3dfy h LEU 63 Ca 0.09 0.02 -0.04 0.00 0.08 0.00 0.00 57.88 58.03 3dfy h LEU 63 Cb 0.64 -0.09 -0.03 0.00 1.08 0.00 0.00 40.66 42.26 3dfy h LEU 63 CO 0.04 0.35 0.27 -0.07 -1.08 0.00 0.00 178.44 177.95 3dfy h LEU 64 N 0.64 0.89 -1.16 1.67 3.38 -1.41 -2.92 115.31 116.39 3dfy h LEU 64 Ca 0.25 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3dfy h LEU 64 Cb 0.11 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.63 3dfy h LEU 64 CO -0.14 0.79 0.00 0.00 0.09 0.00 0.00 178.44 179.18 3dfy h ALA 65 N 1.34 1.00 -0.54 1.53 0.00 -0.87 -2.86 119.26 118.86 3dfy h ALA 65 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3dfy h ALA 65 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3dfy h ALA 65 CO -0.02 0.00 0.00 0.44 0.00 0.00 0.00 179.25 179.67 3dfy n ILE 66 N -2.45 1.61 -0.24 0.00 -5.35 -1.10 -4.64 119.36 107.19 3dfy n ILE 66 Ca 0.01 -1.23 0.03 0.00 -0.27 0.00 0.00 62.75 61.29 3dfy n ILE 66 Cb 0.19 0.21 0.12 0.00 -1.74 0.00 0.00 39.64 38.41 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 3.33 0.07 -0.87 6.28 4.81 -1.62 -0.57 114.58 126.01 3dfy h GLU 67 Ca 0.00 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 3dfy h GLU 67 Cb 1.23 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.56 3dfy h GLU 67 CO 0.15 0.05 0.49 -0.97 -0.73 0.00 0.00 179.01 178.00 3dfy h ASN 68 N 0.07 1.07 -0.57 1.04 -0.00 -1.87 -1.05 115.58 114.27 3dfy h ASN 68 Ca 0.37 -0.09 -0.03 0.00 -0.00 0.00 0.00 56.30 56.54 3dfy h ASN 68 Cb 0.61 -0.27 -0.03 0.00 -0.00 0.00 0.00 38.32 38.64 3dfy h ASN 68 CO -0.65 0.85 0.23 0.00 -0.00 0.00 0.00 177.43 177.87 3dfy h ALA 69 N 1.26 0.75 -0.38 1.57 0.00 -1.48 -1.84 119.26 119.14 3dfy h ALA 69 Ca 0.31 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3dfy h ALA 69 Cb 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3dfy h ALA 69 CO -0.05 0.36 0.20 0.28 0.00 0.00 0.00 179.25 180.03 3dfy h VAL 70 N 0.79 1.16 -0.41 0.00 2.07 -0.72 -1.90 116.25 117.25 3dfy h VAL 70 Ca 0.19 -0.44 0.02 0.00 0.82 0.00 0.00 66.70 67.29 3dfy h VAL 70 Cb 0.20 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 3dfy h VAL 70 CO -0.02 0.17 0.24 -0.09 0.02 0.00 0.00 177.57 177.90 3dfy h ARG 71 N 0.48 0.48 0.00 1.57 2.43 -1.00 -2.32 114.38 116.02 3dfy h ARG 71 Ca 0.13 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 3dfy h ARG 71 Cb 0.09 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.53 3dfy h ARG 71 CO -0.02 0.32 -0.16 1.49 -1.51 0.00 0.00 179.97 180.08 3dfy h GLU 72 N 0.49 0.00 -0.18 0.20 4.22 -1.15 -0.79 114.58 117.37 3dfy h GLU 72 Ca 0.16 0.00 -0.15 0.00 0.08 0.00 0.00 59.36 59.45 3dfy h GLU 72 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3dfy h GLU 72 CO -0.07 0.16 -0.51 0.52 -2.18 0.00 0.00 179.01 176.93 3dfy h MET 73 N 0.00 0.51 0.00 1.92 2.86 -0.77 -3.38 114.93 116.07 3dfy h MET 73 Ca -0.00 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 3dfy h MET 73 Cb 0.40 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.08 3dfy h MET 73 CO 0.02 0.90 -0.01 0.44 1.06 0.00 0.00 176.91 179.32 3dfy n ILE 74 N -3.97 0.00 -1.76 -1.22 -5.35 -1.13 -5.01 119.36 100.92 3dfy n ILE 74 Ca -0.03 -0.49 -0.41 0.00 -0.27 0.00 0.00 62.75 61.55 3dfy n ILE 74 Cb 0.58 1.00 -0.01 0.00 -1.74 0.00 0.00 39.64 39.47 3dfy n ILE 74 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 3dfy n THR 75 N -1.01 1.54 0.00 7.28 -1.04 -0.31 -2.12 114.28 118.63 3dfy n THR 75 Ca 0.00 -0.39 0.00 0.00 -2.04 0.00 0.00 64.05 61.62 3dfy n THR 75 Cb 0.00 -1.98 0.00 0.00 -1.82 0.00 0.00 70.33 66.53 3dfy n THR 75 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dfy n GLY 76 N 1.25 1.74 3.75 3.41 0.00 0.82 -4.96 105.19 111.19 3dfy n GLY 76 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.34 4.89 0.10 -0.61 1.01 -0.90 -4.61 121.20 118.73 3dfy s ILE 77 Ca 0.00 1.41 -0.30 0.00 0.00 0.00 0.00 60.65 61.76 3dfy s ILE 77 Cb 0.00 -4.01 -0.06 0.00 0.01 0.00 0.00 42.46 38.39 3dfy s ILE 77 CO 0.00 0.36 1.20 -0.62 0.00 0.00 0.00 174.94 175.88 3dfy s ASP 78 N 0.10 7.08 0.10 3.58 -1.08 -1.26 -1.56 116.67 123.62 3dfy s ASP 78 Ca 0.35 2.08 0.12 0.00 -0.52 0.00 0.00 52.55 54.58 3dfy s ASP 78 Cb -0.19 -2.59 0.56 0.00 -1.46 0.00 0.00 42.92 39.24 3dfy s ASP 78 CO 0.19 -0.45 1.37 1.33 0.52 0.00 0.00 175.17 178.14 3dfy n VAL 79 N 3.55 1.35 0.76 1.11 0.24 -1.26 -0.89 118.33 123.19 3dfy n VAL 79 Ca 0.08 0.44 0.12 0.00 -2.04 0.00 0.00 64.34 62.94 3dfy n VAL 79 Cb 0.46 -1.36 0.50 0.00 -1.47 0.00 0.00 33.84 31.97 3dfy n VAL 79 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 3dfy n ARG 80 N -1.77 0.08 -1.79 7.34 1.85 -1.26 -2.17 116.66 118.95 3dfy n ARG 80 Ca 0.01 0.14 -0.32 0.00 -1.00 0.00 0.00 57.85 56.68 3dfy n ARG 80 Cb 0.09 -1.61 0.05 0.00 -1.05 0.00 0.00 32.46 29.93 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 -1.76 6.54 0.20 2.89 3.02 -0.07 -4.81 115.26 121.28 3dfy n ASN 81 Ca 0.06 -3.78 0.17 0.00 -0.03 0.00 0.00 54.58 51.00 3dfy n ASN 81 Cb 0.32 -0.76 0.83 0.00 -0.61 0.00 0.00 39.78 39.56 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 2.33 0.00 0.00 3.10 -0.00 -1.58 0.15 116.97 120.97 3dfy h TYR 82 Ca 0.50 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 59.19 3dfy h TYR 82 Cb 0.86 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.58 3dfy h TYR 82 CO 1.15 0.00 -0.18 0.00 -0.00 0.00 0.00 178.16 179.13 3dfy h ALA 83 N 1.74 1.34 -0.18 0.10 0.00 -1.88 0.11 119.26 120.48 3dfy h ALA 83 Ca 0.09 -0.16 -0.20 0.00 0.00 0.00 0.00 54.91 54.64 3dfy h ALA 83 Cb 0.53 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.30 3dfy h ALA 83 CO -0.00 0.23 -0.67 0.00 0.00 0.00 0.00 179.25 178.81 3dfy h ARG 84 N 0.00 0.78 -0.68 0.00 3.08 -1.35 -1.84 114.38 114.37 3dfy h ARG 84 Ca -0.00 -0.59 -0.08 0.00 0.07 0.00 0.00 59.98 59.38 3dfy h ARG 84 Cb 0.42 0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.56 3dfy h ARG 84 CO 0.02 1.21 0.11 0.82 -1.07 0.00 0.00 179.97 181.06 3dfy h ILE 85 N 0.51 1.26 -0.46 2.04 2.04 -1.38 -1.64 117.51 119.89 3dfy h ILE 85 Ca -0.03 -1.05 -0.01 0.00 1.00 0.00 0.00 64.86 64.77 3dfy h ILE 85 Cb 1.30 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 3dfy h ILE 85 CO 0.14 0.39 0.25 -0.26 0.00 0.00 0.00 178.15 178.68 3dfy h PHE 86 N 1.05 0.63 -0.58 1.37 -1.00 -0.93 0.30 116.94 117.78 3dfy h PHE 86 Ca 0.21 -0.01 -0.10 0.00 2.81 0.00 0.00 57.97 60.87 3dfy h PHE 86 Cb 0.45 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 39.79 3dfy h PHE 86 CO 0.03 0.47 -0.02 1.49 -1.61 0.00 0.00 178.31 178.68 3dfy h GLU 87 N 0.60 1.03 -0.30 1.51 4.81 -1.12 -1.42 114.58 119.68 3dfy h GLU 87 Ca 0.16 -0.34 -0.03 0.00 -0.13 0.00 0.00 59.36 59.03 3dfy h GLU 87 Cb 0.05 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 3dfy h GLU 87 CO -0.03 1.02 0.08 0.82 -0.73 0.00 0.00 179.01 180.18 3dfy h ILE 88 N 0.92 1.21 0.00 2.32 2.04 -1.10 -2.67 117.51 120.23 3dfy h ILE 88 Ca 0.16 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.32 3dfy h ILE 88 Cb 0.57 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 3dfy h ILE 88 CO 0.03 0.23 0.00 0.35 0.00 0.00 0.00 178.15 178.77 3dfy n THR 89 N -4.67 0.79 0.31 -0.27 -2.24 0.08 -2.01 114.28 106.26 3dfy n THR 89 Ca -0.02 0.19 0.17 0.00 -2.27 0.00 0.00 64.05 62.11 3dfy n THR 89 Cb 0.18 -0.91 0.71 0.00 -2.10 0.00 0.00 70.33 68.21 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 0.69 3.42 3.32 -0.89 -1.49 116.42 121.48 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 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 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 -2.85 0.17 -0.92 3.56 1.74 -0.85 -3.04 116.66 114.47 3dfy n ARG 91 Ca 0.00 0.41 -0.17 0.00 -0.77 0.00 0.00 57.85 57.32 3dfy n ARG 91 Cb 0.24 -1.83 0.03 0.00 -1.02 0.00 0.00 32.46 29.88 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 -2.15 6.46 0.07 0.55 4.77 -0.56 -4.55 117.00 121.58 3dfy n LEU 92 Ca 0.02 -3.34 0.06 0.00 -0.03 0.00 0.00 56.01 52.73 3dfy n LEU 92 Cb 0.22 -1.07 0.31 0.00 -2.33 0.00 0.00 43.42 40.55 3dfy n LEU 92 CO 0.19 1.26 0.70 2.22 -1.33 0.00 0.00 177.39 180.42 3dfy n PHE 93 N 0.40 0.33 1.15 -1.77 1.16 -1.17 -0.29 117.46 117.27 3dfy n PHE 93 Ca 0.31 0.16 0.12 0.00 -1.87 0.00 0.00 57.45 56.17 3dfy n PHE 93 Cb 0.58 -0.75 0.23 0.00 -1.61 0.00 0.00 39.48 37.92 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 -0.87 -0.38 2.52 4.97 0.00 -1.26 -4.14 105.19 106.03 3dfy n GLY 94 Ca 0.01 -0.50 -0.15 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.43 1.33 -0.33 1.61 3.72 0.60 -4.75 117.46 119.20 3dfy n PHE 95 Ca 0.11 -3.20 0.16 0.00 -0.05 0.00 0.00 57.45 54.47 3dfy n PHE 95 Cb 0.39 -0.36 0.39 0.00 -0.94 0.00 0.00 39.48 38.96 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 2.95 0.61 -0.64 -1.08 0.13 -1.67 -0.78 132.00 131.52 3dfy h PRO 96 Ca 0.02 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 65.08 3dfy h PRO 96 Cb 1.05 -0.14 -0.03 0.00 0.13 0.00 0.00 31.00 32.01 3dfy h PRO 96 CO 0.56 0.40 0.25 0.66 -0.23 0.00 0.00 178.00 179.65 3dfy h SER 97 N 0.63 0.86 0.36 1.44 4.64 -1.84 -0.06 113.55 119.58 3dfy h SER 97 Ca 0.58 -0.12 -0.16 0.00 -0.47 0.00 0.00 61.79 61.62 3dfy h SER 97 Cb 1.09 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.95 3dfy h SER 97 CO -0.36 0.77 -0.66 0.25 -0.87 0.00 0.00 176.83 175.96 3dfy h LEU 98 N 0.92 0.32 -0.31 5.97 5.85 -1.54 -2.15 115.31 124.37 3dfy h LEU 98 Ca 0.22 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.75 3dfy h LEU 98 Cb 0.18 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3dfy h LEU 98 CO -0.02 0.89 0.19 0.50 -0.34 0.00 0.00 178.44 179.66 3dfy h LYS 99 N 0.19 0.39 -0.04 1.25 3.64 -0.34 -0.45 116.57 121.20 3dfy h LYS 99 Ca -0.01 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3dfy h LYS 99 Cb 1.20 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.93 3dfy h LYS 99 CO 0.10 0.26 0.03 0.00 -2.27 0.00 0.00 179.45 177.57 3dfy h ALA 100 N 1.12 0.06 -0.12 5.00 0.00 -0.89 -1.61 119.26 122.82 3dfy h ALA 100 Ca 0.12 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3dfy h ALA 100 Cb -0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3dfy h ALA 100 CO -0.04 -0.43 -0.02 0.00 0.00 0.00 0.00 179.25 178.77 3dfy h ALA 101 N 0.97 0.09 -0.63 0.00 0.00 -1.08 0.16 119.26 118.77 3dfy h ALA 101 Ca 0.02 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3dfy h ALA 101 Cb 0.04 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3dfy h ALA 101 CO -0.00 -0.48 0.20 0.28 0.00 0.00 0.00 179.25 179.25 3dfy h VAL 102 N 0.01 1.25 -0.57 0.00 2.07 -1.06 0.48 116.25 118.43 3dfy h VAL 102 Ca 0.06 -0.83 -0.08 0.00 0.82 0.00 0.00 66.70 66.66 3dfy h VAL 102 Cb 0.08 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 3dfy h VAL 102 CO -0.12 0.32 0.02 1.56 0.02 0.00 0.00 177.57 179.37 3dfy h GLN 103 N 0.90 0.96 -0.13 1.57 4.20 -1.04 -0.86 115.11 120.71 3dfy h GLN 103 Ca 0.20 -0.28 -0.19 0.00 0.06 0.00 0.00 58.65 58.45 3dfy h GLN 103 Cb 0.28 -0.10 0.01 0.00 0.30 0.00 0.00 27.48 27.97 3dfy h GLN 103 CO -0.01 0.94 -0.65 0.35 -0.67 0.00 0.00 178.83 178.79 3dfy h PHE 104 N 0.89 0.90 -0.85 2.96 3.57 -0.81 -2.46 116.94 121.15 3dfy h PHE 104 Ca 0.17 -0.40 0.10 0.00 3.53 0.00 0.00 57.97 61.37 3dfy h PHE 104 Cb 0.49 -0.14 -0.06 0.00 2.79 0.00 0.00 35.95 39.03 3dfy h PHE 104 CO 0.03 1.21 0.55 0.00 -2.23 0.00 0.00 178.31 177.87 3dfy h ALA 105 N 0.51 1.70 -0.53 2.41 0.00 -0.74 0.54 119.26 123.15 3dfy h ALA 105 Ca -0.04 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 3dfy h ALA 105 Cb 1.29 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 3dfy h ALA 105 CO 0.13 0.12 0.15 1.15 0.00 0.00 0.00 179.25 180.80 3dfy h THR 106 N 0.81 1.24 -0.13 0.00 2.02 -0.97 -1.34 112.91 114.53 3dfy h THR 106 Ca 0.40 -0.83 -0.16 0.00 0.77 0.00 0.00 66.41 66.59 3dfy h THR 106 Cb 0.45 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 3dfy h THR 106 CO -0.16 0.31 -0.58 -0.07 0.37 0.00 0.00 175.52 175.39 3dfy h LEU 107 N 0.75 0.48 -0.40 2.58 3.38 -0.43 -0.95 115.31 120.71 3dfy h LEU 107 Ca 0.17 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3dfy h LEU 107 Cb 0.31 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3dfy h LEU 107 CO -0.00 0.95 0.24 -0.78 0.09 0.00 0.00 178.44 178.94 3dfy h ASP 108 N 0.32 0.49 -0.32 -0.43 3.58 0.20 0.17 116.42 120.43 3dfy h ASP 108 Ca 0.00 -0.06 -0.10 0.00 0.42 0.00 0.00 57.03 57.29 3dfy h ASP 108 Cb 1.10 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 42.02 3dfy h ASP 108 CO 0.10 0.41 -0.18 0.00 -2.88 0.00 0.00 179.24 176.69 3dfy h ALA 109 N 1.10 0.45 0.01 -0.78 0.00 -1.17 -2.99 119.26 115.88 3dfy h ALA 109 Ca 0.14 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.72 3dfy h ALA 109 Cb 0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3dfy h ALA 109 CO -0.03 0.38 -0.09 1.25 0.00 0.00 0.00 179.25 180.76 3dfy h LEU 110 N 0.44 -0.26 -1.47 0.00 5.85 -0.80 -2.16 115.31 116.91 3dfy h LEU 110 Ca 0.07 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.92 3dfy h LEU 110 Cb 0.72 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.81 3dfy h LEU 110 CO 0.05 -0.13 0.47 0.77 -0.34 0.00 0.00 178.44 179.26 3dfy h SER 111 N -0.16 0.54 -0.22 1.25 4.64 -0.71 -1.00 113.55 117.89 3dfy h SER 111 Ca 0.03 0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.34 3dfy h SER 111 Cb 0.20 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 3dfy h SER 111 CO -0.09 0.32 0.03 1.56 -0.87 0.00 0.00 176.83 177.78 3dfy h GLN 112 N 0.60 0.37 0.00 4.77 4.20 -1.25 0.77 115.11 124.57 3dfy h GLN 112 Ca 0.33 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.92 3dfy h GLN 112 Cb 0.47 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.21 3dfy h GLN 112 CO -0.11 0.53 -0.03 0.93 -0.67 0.00 0.00 178.83 179.47 3dfy h GLU 113 N 0.16 0.00 -0.01 1.46 5.08 -0.79 -0.68 114.58 119.79 3dfy h GLU 113 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3dfy h GLU 113 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3dfy h GLU 113 CO 0.01 0.03 -0.17 1.28 -1.00 0.00 0.00 179.01 179.16 3dfy n LEU 114 N -3.23 1.58 -1.58 1.33 4.77 -0.46 -4.95 117.00 114.45 3dfy n LEU 114 Ca -0.01 -0.51 -0.12 0.00 -0.03 0.00 0.00 56.01 55.34 3dfy n LEU 114 Cb 0.20 -0.05 0.01 0.00 -2.33 0.00 0.00 43.42 41.25 3dfy n LEU 114 CO 0.25 0.28 -0.05 0.61 -1.33 0.00 0.00 177.39 177.15 3dfy n GLY 115 N 1.30 -0.02 0.00 -0.72 0.00 -0.26 -5.00 105.19 100.48 3dfy n GLY 115 Ca 0.14 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.96 0.00 -4.41 2.61 5.66 0.12 -5.03 114.28 109.27 3dfy n THR 116 Ca -0.09 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.67 3dfy n THR 116 Cb 0.58 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.27 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 -1.08 1.93 0.14 1.09 -0.21 -1.26 -3.96 119.66 116.31 3dfy s GLN 117 Ca 0.00 -1.69 -0.18 0.00 0.02 0.00 0.00 55.36 53.51 3dfy s GLN 117 Cb 0.00 -1.90 0.01 0.00 1.00 0.00 0.00 33.01 32.13 3dfy s GLN 117 CO 0.00 0.28 1.74 0.28 -2.12 0.00 0.00 175.29 175.47 3dfy h VAL 118 N 2.06 0.88 -0.88 1.09 2.07 -1.93 -0.82 116.25 118.72 3dfy h VAL 118 Ca -0.42 -0.06 0.17 0.00 0.82 0.00 0.00 66.70 67.21 3dfy h VAL 118 Cb 1.25 0.69 -0.07 0.00 -1.52 0.00 0.00 31.29 31.65 3dfy h VAL 118 CO 0.62 0.03 0.58 0.00 0.02 0.00 0.00 177.57 178.82 3dfy h TYR 120 N 0.55 0.49 -0.59 0.00 0.05 -1.71 0.41 116.97 116.17 3dfy h TYR 120 Ca 0.45 -0.29 -0.02 0.00 0.05 0.00 0.00 58.73 58.93 3dfy h TYR 120 Cb 0.92 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 38.59 3dfy h TYR 120 CO -0.00 1.13 0.28 1.25 -1.05 0.00 0.00 178.16 179.78 3dfy h LEU 121 N 0.15 0.74 -0.59 3.88 5.85 0.41 -1.94 115.31 123.81 3dfy h LEU 121 Ca -0.08 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.57 3dfy h LEU 121 Cb 1.66 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.50 3dfy h LEU 121 CO 0.16 0.63 0.00 0.18 -0.34 0.00 0.00 178.44 179.07 3dfy n LEU 122 N -4.36 0.88 0.00 2.25 4.77 0.19 -4.87 117.00 115.85 3dfy n LEU 122 Ca 0.05 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 3dfy n LEU 122 Cb 0.13 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 3dfy n LEU 122 CO 0.38 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 3dfy n GLY 123 N 0.94 1.46 4.03 -0.72 0.00 -0.73 -3.92 105.19 106.25 3dfy n GLY 123 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.28 0.19 -0.02 0.00 0.14 -4.88 105.19 100.34 3dfy n GLY 124 Ca 0.00 0.15 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.77 0.43 -5.83 1.61 3.64 -1.04 -3.46 116.57 110.14 3dfy h LYS 125 Ca -0.62 -0.32 -0.50 0.00 -1.27 0.00 0.00 60.65 57.94 3dfy h LYS 125 Cb 1.38 0.06 -0.21 0.00 -0.41 0.00 0.00 32.23 33.04 3dfy h LYS 125 CO 0.66 0.94 -0.80 1.03 -2.27 0.00 0.00 179.45 179.01 3dfy s ARG 126 N -3.74 1.02 -0.01 1.90 0.52 -0.43 -4.96 118.95 113.25 3dfy s ARG 126 Ca -0.06 -1.11 0.22 0.00 -0.52 0.00 0.00 55.73 54.26 3dfy s ARG 126 Cb 0.11 -1.17 -0.27 0.00 0.52 0.00 0.00 34.95 34.14 3dfy s ARG 126 CO 0.84 0.26 0.65 -0.25 0.02 0.00 0.00 175.30 176.82 3dfy n ASP 127 N 1.08 0.34 -3.73 0.23 8.00 -1.26 -4.64 116.55 116.56 3dfy n ASP 127 Ca -0.20 -0.27 -0.14 0.00 0.71 0.00 0.00 54.79 54.90 3dfy n ASP 127 Cb 0.54 1.60 -0.09 0.00 -0.02 0.00 0.00 41.12 43.15 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 -3.35 0.65 0.08 -1.24 2.12 -1.26 -3.77 118.70 111.92 3dfy s GLU 128 Ca -0.03 0.07 0.01 0.00 0.36 0.00 0.00 54.97 55.38 3dfy s GLU 128 Cb 0.14 0.30 -0.04 0.00 0.26 0.00 0.00 34.13 34.79 3dfy s GLU 128 CO 0.89 -0.16 -0.06 0.96 -0.54 0.00 0.00 175.26 176.35 3dfy s ILE 129 N -0.87 0.60 -0.08 -3.70 -4.36 -0.72 -4.99 121.20 107.08 3dfy s ILE 129 Ca -0.09 -1.83 0.04 0.00 -0.26 0.00 0.00 60.65 58.50 3dfy s ILE 129 Cb -0.04 -1.55 0.00 0.00 1.25 0.00 0.00 42.46 42.13 3dfy s ILE 129 CO 0.04 -0.85 -0.20 -0.70 0.24 0.00 0.00 174.94 173.47 3dfy s GLU 130 N -3.63 2.49 0.20 0.37 2.12 -1.26 -1.07 118.70 117.92 3dfy s GLU 130 Ca 0.09 -0.72 0.05 0.00 0.36 0.00 0.00 54.97 54.75 3dfy s GLU 130 Cb 0.04 -1.95 -0.03 0.00 0.26 0.00 0.00 34.13 32.45 3dfy s GLU 130 CO -0.05 0.15 0.24 -0.08 -0.54 0.00 0.00 175.26 174.98 3dfy s THR 131 N 0.37 4.86 0.08 -1.70 -1.32 0.13 -3.69 115.64 114.37 3dfy s THR 131 Ca -0.15 -1.06 -0.00 0.00 -1.21 0.00 0.00 61.69 59.27 3dfy s THR 131 Cb -0.16 -3.56 0.02 0.00 -1.51 0.00 0.00 72.50 67.28 3dfy s THR 131 CO 0.06 -0.22 0.11 -0.90 -2.21 0.00 0.00 174.62 171.46 3dfy n ASP 132 N -0.88 0.11 -3.91 8.08 5.68 0.12 -4.78 116.55 120.98 3dfy n ASP 132 Ca -0.08 -1.10 -0.11 0.00 -0.50 0.00 0.00 54.79 53.00 3dfy n ASP 132 Cb 0.56 -0.07 -0.12 0.00 -1.14 0.00 0.00 41.12 40.34 3dfy n ASP 132 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 3dfy s LYS 133 N -2.78 0.17 -0.13 0.11 2.47 -1.13 -4.53 119.74 113.92 3dfy s LYS 133 Ca 0.07 -0.27 -0.10 0.00 -1.56 0.00 0.00 55.97 54.11 3dfy s LYS 133 Cb -0.00 0.06 -0.05 0.00 -1.46 0.00 0.00 37.83 36.38 3dfy s LYS 133 CO 0.05 -0.03 0.20 0.99 0.16 0.00 0.00 175.35 176.72 3dfy s THR 134 N -0.69 5.38 -0.43 3.43 2.01 -1.26 -1.65 115.64 122.44 3dfy s THR 134 Ca -0.08 0.36 -0.12 0.00 0.31 0.00 0.00 61.69 62.16 3dfy s THR 134 Cb -0.05 -3.51 0.06 0.00 0.01 0.00 0.00 72.50 69.02 3dfy s THR 134 CO -0.00 0.52 0.30 -0.69 -0.69 0.00 0.00 174.62 174.06 3dfy s VAL 135 N -0.38 4.71 1.07 3.82 1.01 0.69 -4.97 120.40 126.35 3dfy s VAL 135 Ca 0.15 -1.12 -0.18 0.00 0.00 0.00 0.00 61.98 60.83 3dfy s VAL 135 Cb -0.13 -3.79 0.24 0.00 0.00 0.00 0.00 36.38 32.71 3dfy s VAL 135 CO 0.04 -0.46 1.23 -0.83 0.00 0.00 0.00 175.10 175.07 3dfy s GLY 136 N 2.13 1.69 0.07 4.51 0.00 -1.26 -2.12 107.32 112.35 3dfy s GLY 136 Ca 0.03 -1.09 -0.31 0.00 0.00 0.00 0.00 44.72 43.35 3dfy s GLY 136 CO 0.05 -0.26 1.35 -0.42 0.00 0.00 0.00 173.10 173.82 3dfy s ILE 137 N -3.48 3.56 0.12 0.90 -1.09 -1.26 -4.78 121.20 115.17 3dfy s ILE 137 Ca 0.73 1.09 -0.22 0.00 -2.23 0.00 0.00 60.65 60.02 3dfy s ILE 137 Cb -0.06 -3.70 0.07 0.00 -1.58 0.00 0.00 42.46 37.19 3dfy s ILE 137 CO 0.54 0.06 1.01 -0.67 -1.23 0.00 0.00 174.94 174.66 3dfy n ASP 138 N 4.30 -1.49 -4.70 3.58 -0.08 -1.26 -5.06 116.55 111.85 3dfy n ASP 138 Ca 0.11 -1.70 -0.34 0.00 -1.51 0.00 0.00 54.79 51.36 3dfy n ASP 138 Cb 0.43 2.40 0.12 0.00 2.34 0.00 0.00 41.12 46.42 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 -2.08 2.01 0.28 5.18 -4.23 -1.26 -4.69 115.64 110.85 3dfy s THR 139 Ca 0.23 0.01 0.02 0.00 -1.18 0.00 0.00 61.69 60.76 3dfy s THR 139 Cb -0.02 -2.47 0.27 0.00 1.34 0.00 0.00 72.50 71.62 3dfy s THR 139 CO 0.04 -0.00 1.79 0.58 -0.54 0.00 0.00 174.62 176.49 3dfy h VAL 140 N -0.78 0.79 -0.67 2.29 2.07 -2.00 -1.09 116.25 116.87 3dfy h VAL 140 Ca -0.47 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 66.72 3dfy h VAL 140 Cb 1.30 -0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 3dfy h VAL 140 CO 0.47 0.15 0.19 1.05 0.02 0.00 0.00 177.57 179.44 3dfy h GLU 141 N 0.80 1.06 0.00 1.57 4.11 -2.00 -2.63 114.58 117.48 3dfy h GLU 141 Ca 0.51 -0.24 -0.12 0.00 0.07 0.00 0.00 59.36 59.57 3dfy h GLU 141 Cb 0.66 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 3dfy h GLU 141 CO -0.33 0.93 -0.59 -0.91 0.07 0.00 0.00 179.01 178.18 3dfy h ASN 142 N 0.99 0.00 -0.43 3.06 2.35 -1.61 -2.80 115.58 117.14 3dfy h ASN 142 Ca 0.21 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.87 3dfy h ASN 142 Cb 0.33 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 3dfy h ASN 142 CO -0.00 0.59 -0.07 0.03 -1.65 0.00 0.00 177.43 176.32 3dfy h ARG 143 N 0.00 0.81 -0.19 0.81 3.08 -1.07 -2.13 114.38 115.68 3dfy h ARG 143 Ca -0.01 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 59.72 3dfy h ARG 143 Cb 1.04 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.03 3dfy h ARG 143 CO 0.08 0.92 -0.02 0.28 -1.07 0.00 0.00 179.97 180.15 3dfy h VAL 144 N 0.64 1.14 -0.20 2.04 2.07 -1.36 -1.30 116.25 119.28 3dfy h VAL 144 Ca 0.11 -0.55 -0.14 0.00 0.82 0.00 0.00 66.70 66.94 3dfy h VAL 144 Cb 0.60 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 3dfy h VAL 144 CO 0.04 0.18 -0.44 0.50 0.02 0.00 0.00 177.57 177.87 3dfy h LYS 145 N 0.28 0.65 -0.42 1.57 1.63 -1.22 -1.58 116.57 117.48 3dfy h LYS 145 Ca 0.06 -0.43 -0.01 0.00 -0.85 0.00 0.00 60.65 59.42 3dfy h LYS 145 Cb 0.23 0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.90 3dfy h LYS 145 CO 0.01 1.05 0.21 0.93 -3.45 0.00 0.00 179.45 178.20 3dfy h GLU 146 N 0.33 0.60 0.00 1.90 5.08 -1.08 -1.42 114.58 119.99 3dfy h GLU 146 Ca 0.00 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 58.31 3dfy h GLU 146 Cb 1.05 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.15 3dfy h GLU 146 CO 0.10 0.51 -0.20 0.00 -1.00 0.00 0.00 179.01 178.41 3dfy h ALA 147 N 1.06 -0.26 -0.67 3.43 0.00 -1.19 0.21 119.26 121.84 3dfy h ALA 147 Ca 0.15 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.08 3dfy h ALA 147 Cb 0.10 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 3dfy h ALA 147 CO -0.02 -0.70 0.43 0.87 0.00 0.00 0.00 179.25 179.83 3dfy h LYS 148 N -0.32 0.84 -0.65 0.00 1.57 -1.14 0.15 116.57 117.00 3dfy h LYS 148 Ca 0.06 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dfy h LYS 148 Cb 0.40 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 3dfy h LYS 148 CO -0.19 0.55 0.39 -0.22 -0.57 0.00 0.00 179.45 179.42 3dfy h LYS 149 N 0.86 0.88 -0.28 3.15 3.64 -0.82 0.48 116.57 124.48 3dfy h LYS 149 Ca 0.26 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 3dfy h LYS 149 Cb -0.04 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.59 3dfy h LYS 149 CO -0.08 0.63 0.01 0.82 -2.27 0.00 0.00 179.45 178.56 3dfy h ILE 150 N 0.88 1.25 -0.88 2.00 2.04 0.08 -1.83 117.51 121.06 3dfy h ILE 150 Ca 0.23 -0.91 -0.00 0.00 1.00 0.00 0.00 64.86 65.19 3dfy h ILE 150 Cb -0.02 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.31 3dfy h ILE 150 CO -0.04 0.29 0.54 0.15 0.00 0.00 0.00 178.15 179.09 3dfy h PHE 151 N 0.29 1.14 -0.45 1.37 3.57 -0.48 -1.76 116.94 120.62 3dfy h PHE 151 Ca 0.08 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 3dfy h PHE 151 Cb 0.41 -0.38 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 3dfy h PHE 151 CO 0.03 0.75 0.18 1.49 -2.23 0.00 0.00 178.31 178.54 3dfy h GLU 152 N 1.20 0.64 0.00 1.11 4.81 -0.71 -1.49 114.58 120.14 3dfy h GLU 152 Ca 0.32 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 3dfy h GLU 152 Cb -0.07 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.19 3dfy h GLU 152 CO -0.06 0.53 0.00 0.39 -0.73 0.00 0.00 179.01 179.14 3dfy n GLU 153 N -4.37 0.17 0.00 1.92 1.02 -0.68 -4.87 120.64 113.83 3dfy n GLU 153 Ca 0.03 0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 3dfy n GLU 153 Cb 0.15 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 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 0.28 0.57 3.75 0.62 0.00 -0.56 -4.76 105.19 105.09 3dfy n GLY 154 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 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 3.24 -0.01 1.61 0.08 -1.13 -4.79 117.98 114.98 3dfy s PHE 155 Ca 0.00 1.30 0.01 0.00 0.12 0.00 0.00 56.93 58.36 3dfy s PHE 155 Cb 0.00 -3.59 0.02 0.00 -0.57 0.00 0.00 43.02 38.88 3dfy s PHE 155 CO 0.00 -1.77 0.99 0.54 -0.10 0.00 0.00 175.22 174.88 3dfy n ARG 156 N 2.15 2.75 -3.77 0.44 5.12 -1.26 -4.44 116.66 117.64 3dfy n ARG 156 Ca 0.04 -1.54 -0.25 0.00 -1.93 0.00 0.00 57.85 54.18 3dfy n ARG 156 Cb 0.43 -1.01 -0.17 0.00 -1.16 0.00 0.00 32.46 30.54 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 -1.09 0.48 -0.17 1.55 1.01 -1.26 -0.37 120.40 120.55 3dfy s VAL 157 Ca 0.02 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 61.88 3dfy s VAL 157 Cb 0.02 -0.74 0.02 0.00 0.00 0.00 0.00 36.38 35.68 3dfy s VAL 157 CO 0.00 0.12 -0.18 -0.63 0.00 0.00 0.00 175.10 174.41 3dfy s ILE 158 N 1.91 1.92 -0.14 2.22 1.01 -0.15 -2.83 121.20 125.15 3dfy s ILE 158 Ca 0.03 -0.86 -0.23 0.00 0.00 0.00 0.00 60.65 59.59 3dfy s ILE 158 Cb -0.14 -1.76 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 3dfy s ILE 158 CO -0.06 0.51 0.70 -0.75 0.00 0.00 0.00 174.94 175.34 3dfy s LYS 159 N 1.34 4.33 -0.20 2.79 2.20 -0.66 -2.03 119.74 127.52 3dfy s LYS 159 Ca 0.05 0.82 -0.02 0.00 -0.36 0.00 0.00 55.97 56.45 3dfy s LYS 159 Cb -0.13 -3.52 -0.00 0.00 -1.51 0.00 0.00 37.83 32.67 3dfy s LYS 159 CO -0.12 -0.13 -0.09 0.42 -0.36 0.00 0.00 175.35 175.07 3dfy s ILE 160 N 1.49 3.01 0.02 5.43 1.01 0.16 -0.22 121.20 132.10 3dfy s ILE 160 Ca 0.35 -0.62 -0.22 0.00 0.00 0.00 0.00 60.65 60.15 3dfy s ILE 160 Cb -0.17 -2.34 -0.05 0.00 0.01 0.00 0.00 42.46 39.91 3dfy s ILE 160 CO 0.14 0.46 0.67 -0.54 0.00 0.00 0.00 174.94 175.67 3dfy s LYS 161 N 1.31 4.39 0.09 2.79 1.02 -0.90 -1.62 119.74 126.82 3dfy s LYS 161 Ca 0.04 0.88 0.01 0.00 0.02 0.00 0.00 55.97 56.91 3dfy s LYS 161 Cb -0.14 -3.35 -0.00 0.00 -0.52 0.00 0.00 37.83 33.82 3dfy s LYS 161 CO -0.05 0.34 0.10 1.33 -0.92 0.00 0.00 175.35 176.15 3dfy n VAL 162 N 2.72 0.00 0.00 3.17 0.24 -0.61 -4.51 118.33 119.33 3dfy n VAL 162 Ca -0.05 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 61.65 3dfy n VAL 162 Cb 0.51 0.32 0.00 0.00 -1.47 0.00 0.00 33.84 33.20 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 -0.17 1.64 0.02 7.63 0.00 -1.26 -4.21 105.19 108.85 3dfy n GLY 163 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.14 3dfy n GLY 163 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dfy n GLU 164 N 0.00 0.55 -3.29 1.61 1.02 -1.26 -4.39 120.64 114.88 3dfy n GLU 164 Ca 0.00 -0.12 -0.09 0.00 -0.02 0.00 0.00 57.16 56.93 3dfy n GLU 164 Cb 0.00 -1.56 -0.05 0.00 -0.02 0.00 0.00 31.44 29.81 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 -4.41 -0.02 0.26 1.62 3.84 -1.26 -5.03 114.94 109.94 3dfy s ASN 165 Ca -0.04 -1.10 -0.11 0.00 0.21 0.00 0.00 52.86 51.82 3dfy s ASN 165 Cb 0.14 1.19 0.40 0.00 -0.55 0.00 0.00 41.25 42.43 3dfy s ASN 165 CO 0.88 -0.24 1.56 0.25 -2.79 0.00 0.00 177.10 176.77 3dfy h LEU 166 N 7.18 -1.02 0.08 3.21 5.85 -1.98 0.47 115.31 129.09 3dfy h LEU 166 Ca 0.03 0.29 0.02 0.00 0.84 0.00 0.00 57.88 59.07 3dfy h LEU 166 Cb 1.11 0.64 -0.03 0.00 0.37 0.00 0.00 40.66 42.75 3dfy h LEU 166 CO 0.17 -0.31 -0.23 0.50 -0.34 0.00 0.00 178.44 178.23 3dfy h LYS 167 N -0.00 -0.39 -0.04 1.25 3.11 -2.00 -1.35 116.57 117.15 3dfy h LYS 167 Ca 0.44 0.03 -0.16 0.00 -2.81 0.00 0.00 60.65 58.15 3dfy h LYS 167 Cb 0.68 0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.99 3dfy h LYS 167 CO -0.99 -0.26 -0.68 0.93 -2.81 0.00 0.00 179.45 175.64 3dfy h GLU 168 N -0.40 0.17 -0.91 1.90 5.08 -1.64 -2.90 114.58 115.87 3dfy h GLU 168 Ca 0.04 -0.13 0.03 0.00 -1.00 0.00 0.00 59.36 58.30 3dfy h GLU 168 Cb 0.44 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 3dfy h GLU 168 CO -0.15 0.78 0.59 -0.44 -1.00 0.00 0.00 179.01 178.79 3dfy h ASP 169 N 0.12 0.99 -0.12 1.42 3.32 0.17 0.42 116.42 122.73 3dfy h ASP 169 Ca -0.01 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 3dfy h ASP 169 Cb 1.21 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.53 3dfy h ASP 169 CO 0.10 0.68 0.01 0.40 -1.72 0.00 0.00 179.24 178.71 3dfy h ILE 170 N 1.16 1.24 -0.47 0.35 2.04 -1.18 -1.87 117.51 118.78 3dfy h ILE 170 Ca 0.36 -0.77 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 3dfy h ILE 170 Cb -0.01 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 3dfy h ILE 170 CO -0.12 0.22 0.28 -0.08 0.00 0.00 0.00 178.15 178.46 3dfy h GLU 171 N -0.04 0.64 -0.28 2.37 4.81 -1.22 -1.64 114.58 119.22 3dfy h GLU 171 Ca 0.04 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.25 3dfy h GLU 171 Cb 0.34 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.54 3dfy h GLU 171 CO 0.00 0.48 -0.02 0.00 -0.73 0.00 0.00 179.01 178.74 3dfy h ALA 172 N 1.13 0.23 -0.77 2.92 0.00 -0.11 0.23 119.26 122.88 3dfy h ALA 172 Ca 0.17 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.18 3dfy h ALA 172 Cb 0.01 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 3dfy h ALA 172 CO -0.03 -0.43 0.50 0.28 0.00 0.00 0.00 179.25 179.57 3dfy h VAL 173 N 0.06 1.17 -0.05 0.00 2.07 -1.06 0.13 116.25 118.56 3dfy h VAL 173 Ca 0.13 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3dfy h VAL 173 Cb 0.19 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.02 3dfy h VAL 173 CO -0.24 0.18 0.01 -0.08 0.02 0.00 0.00 177.57 177.47 3dfy h GLU 174 N 1.01 0.08 -0.70 1.57 4.81 -0.66 -1.57 114.58 119.13 3dfy h GLU 174 Ca 0.29 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.51 3dfy h GLU 174 Cb -0.08 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.26 3dfy h GLU 174 CO -0.08 0.27 0.46 0.93 -0.73 0.00 0.00 179.01 179.86 3dfy h GLU 175 N -0.13 0.91 -0.51 1.92 4.39 -0.67 -2.07 114.58 118.43 3dfy h GLU 175 Ca 0.02 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.61 3dfy h GLU 175 Cb 0.22 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 3dfy h GLU 175 CO -0.00 0.60 0.09 0.82 -1.16 0.00 0.00 179.01 179.36 3dfy h ILE 176 N 0.93 1.22 -0.20 3.13 2.04 -0.69 -2.86 117.51 121.09 3dfy h ILE 176 Ca 0.26 -0.84 -0.00 0.00 1.00 0.00 0.00 64.86 65.28 3dfy h ILE 176 Cb -0.10 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 3dfy h ILE 176 CO -0.06 0.31 0.11 0.00 0.00 0.00 0.00 178.15 178.51 3dfy h ALA 177 N 1.35 0.25 -0.97 1.87 0.00 -0.63 -2.67 119.26 118.46 3dfy h ALA 177 Ca 0.16 -0.05 0.14 0.00 0.00 0.00 0.00 54.91 55.17 3dfy h ALA 177 Cb 0.32 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.94 3dfy h ALA 177 CO 0.00 -0.23 0.59 0.87 0.00 0.00 0.00 179.25 180.48 3dfy h LYS 178 N 0.23 0.83 -0.21 0.00 1.57 -1.18 -1.87 116.57 115.94 3dfy h LYS 178 Ca 0.07 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3dfy h LYS 178 Cb 0.04 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.16 3dfy h LYS 178 CO -0.01 0.55 0.00 1.33 -0.57 0.00 0.00 179.45 180.75 3dfy n VAL 179 N -4.71 0.27 -2.58 0.50 0.24 -1.14 -4.18 118.33 106.74 3dfy n VAL 179 Ca 0.20 -0.44 -0.06 0.00 -2.04 0.00 0.00 64.34 62.00 3dfy n VAL 179 Cb 0.43 0.52 0.04 0.00 -1.47 0.00 0.00 33.84 33.37 3dfy n VAL 179 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3dfy n THR 180 N 0.60 1.57 -1.69 3.34 -2.24 -0.71 -4.74 114.28 110.40 3dfy n THR 180 Ca 0.17 -3.20 -0.43 0.00 -2.27 0.00 0.00 64.05 58.32 3dfy n THR 180 Cb 0.39 0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 69.20 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 -0.59 2.75 0.00 -0.78 1.74 -1.15 -1.72 116.66 116.91 3dfy n ARG 181 Ca 0.17 1.00 0.00 0.00 -0.77 0.00 0.00 57.85 58.25 3dfy n ARG 181 Cb 0.86 -2.88 0.00 0.00 -1.02 0.00 0.00 32.46 29.42 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 4.18 1.20 3.94 -0.13 0.00 -1.26 -5.10 105.19 108.01 3dfy n GLY 182 Ca 0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.03 3.96 0.11 4.61 0.00 -0.70 -4.98 121.76 122.73 3dfy s ALA 183 Ca 0.00 -0.97 -0.01 0.00 0.00 0.00 0.00 51.96 50.98 3dfy s ALA 183 Cb 0.00 -1.82 -0.05 0.00 0.00 0.00 0.00 23.12 21.26 3dfy s ALA 183 CO 0.00 0.58 0.29 0.15 0.00 0.00 0.00 175.76 176.79 3dfy s LYS 184 N -3.10 3.51 -0.01 0.00 1.02 0.50 -4.97 119.74 116.69 3dfy s LYS 184 Ca 0.35 -0.32 0.08 0.00 0.02 0.00 0.00 55.97 56.10 3dfy s LYS 184 Cb -0.11 -2.94 -0.02 0.00 -0.52 0.00 0.00 37.83 34.23 3dfy s LYS 184 CO 0.28 0.53 -0.25 0.71 -0.92 0.00 0.00 175.35 175.71 3dfy s TYR 185 N -1.62 2.20 -0.15 3.18 2.02 -1.26 -0.98 117.35 120.73 3dfy s TYR 185 Ca 0.37 -0.41 0.01 0.00 -0.37 0.00 0.00 57.07 56.67 3dfy s TYR 185 Cb -0.12 -1.40 0.02 0.00 -0.40 0.00 0.00 41.96 40.06 3dfy s TYR 185 CO 0.27 -0.01 -0.18 0.42 -1.57 0.00 0.00 175.55 174.49 3dfy s ILE 186 N -0.62 1.80 -0.20 2.71 1.01 -0.86 -0.42 121.20 124.63 3dfy s ILE 186 Ca 0.10 -0.79 -0.04 0.00 0.00 0.00 0.00 60.65 59.91 3dfy s ILE 186 Cb -0.09 -1.64 -0.02 0.00 0.01 0.00 0.00 42.46 40.71 3dfy s ILE 186 CO -0.00 0.50 -0.03 -0.69 0.00 0.00 0.00 174.94 174.72 3dfy s VAL 187 N 1.24 3.67 -0.34 2.92 1.01 -0.12 0.40 120.40 129.19 3dfy s VAL 187 Ca 0.01 -0.41 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 3dfy s VAL 187 Cb -0.14 -2.65 0.05 0.00 0.00 0.00 0.00 36.38 33.65 3dfy s VAL 187 CO -0.09 0.44 0.09 -0.62 0.00 0.00 0.00 175.10 174.92 3dfy s ASP 188 N 1.05 5.19 0.00 3.32 -1.08 -0.64 0.05 116.67 124.56 3dfy s ASP 188 Ca 0.01 -1.29 0.30 0.00 -0.52 0.00 0.00 52.55 51.05 3dfy s ASP 188 Cb -0.15 -1.82 1.42 0.00 -1.46 0.00 0.00 42.92 40.91 3dfy s ASP 188 CO 0.01 -0.34 1.97 0.00 0.52 0.00 0.00 175.17 177.33 3dfy n ALA 189 N 4.74 2.68 -4.21 3.66 0.00 -0.78 -1.57 120.51 125.03 3dfy n ALA 189 Ca -0.12 -0.26 -0.36 0.00 0.00 0.00 0.00 53.44 52.71 3dfy n ALA 189 Cb 0.44 -1.38 -0.06 0.00 0.00 0.00 0.00 19.45 18.45 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 -0.85 -0.72 -1.06 0.00 4.13 -1.21 -0.76 115.26 114.79 3dfy n ASN 190 Ca 0.18 -1.25 -0.13 0.00 1.68 0.00 0.00 54.58 55.05 3dfy n ASN 190 Cb 0.24 -1.54 -0.06 0.00 -1.54 0.00 0.00 39.78 36.88 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 -4.65 -1.60 0.13 3.52 2.81 0.47 -4.87 117.12 112.93 3dfy n MET 191 Ca -0.25 0.90 0.13 0.00 -1.81 0.00 0.00 57.70 56.67 3dfy n MET 191 Cb 0.63 -5.24 0.34 0.00 -0.71 0.00 0.00 33.22 28.25 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 -3.64 3.03 0.00 -0.96 -3.36 103.07 98.14 3dfy h GLY 192 Ca -0.26 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.54 3dfy h GLY 192 CO 0.39 0.00 -0.48 -0.19 0.00 0.00 0.00 176.54 176.25 3dfy s TYR 193 N -3.13 3.36 0.68 5.60 2.02 -0.29 -4.84 117.35 120.76 3dfy s TYR 193 Ca 0.10 0.03 -0.07 0.00 -0.37 0.00 0.00 57.07 56.76 3dfy s TYR 193 Cb 0.11 -1.58 0.05 0.00 -0.40 0.00 0.00 41.96 40.14 3dfy s TYR 193 CO 0.62 0.50 1.00 0.95 -1.57 0.00 0.00 175.55 177.04 3dfy s THR 194 N -1.85 2.55 0.19 -0.71 -4.23 -1.26 -4.12 115.64 106.21 3dfy s THR 194 Ca 0.33 -0.20 -0.12 0.00 -1.18 0.00 0.00 61.69 60.53 3dfy s THR 194 Cb -0.10 -3.10 0.10 0.00 1.34 0.00 0.00 72.50 70.75 3dfy s THR 194 CO 0.27 -0.10 1.75 1.56 -0.54 0.00 0.00 174.62 177.56 3dfy h GLN 195 N -0.53 0.38 -0.19 3.99 4.20 -1.92 0.13 115.11 121.18 3dfy h GLN 195 Ca -0.45 -0.02 -0.15 0.00 0.06 0.00 0.00 58.65 58.09 3dfy h GLN 195 Cb 1.30 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.99 3dfy h GLN 195 CO 0.60 0.25 -0.51 0.87 -0.67 0.00 0.00 178.83 179.37 3dfy h LYS 196 N 0.39 0.52 -0.35 1.46 1.79 -1.97 -2.08 116.57 116.32 3dfy h LYS 196 Ca 0.25 -0.31 -0.14 0.00 -2.18 0.00 0.00 60.65 58.27 3dfy h LYS 196 Cb 0.26 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 3dfy h LYS 196 CO -0.25 0.91 -0.34 0.93 -1.08 0.00 0.00 179.45 179.62 3dfy h GLU 197 N 0.41 0.79 -0.82 3.15 5.08 -1.83 -1.76 114.58 119.60 3dfy h GLU 197 Ca 0.02 -0.38 -0.04 0.00 -1.00 0.00 0.00 59.36 57.96 3dfy h GLU 197 Cb 1.04 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.25 3dfy h GLU 197 CO 0.10 1.01 0.37 0.00 -1.00 0.00 0.00 179.01 179.48 3dfy h ALA 198 N 0.95 1.11 -0.25 3.43 0.00 -0.59 -0.84 119.26 123.06 3dfy h ALA 198 Ca 0.07 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 3dfy h ALA 198 Cb 0.89 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 3dfy h ALA 198 CO 0.08 0.66 -0.23 0.28 0.00 0.00 0.00 179.25 180.04 3dfy h VAL 199 N 1.17 1.31 -0.92 0.00 2.07 -1.25 -2.99 116.25 115.65 3dfy h VAL 199 Ca 0.28 -1.39 0.03 0.00 0.82 0.00 0.00 66.70 66.44 3dfy h VAL 199 Cb 0.16 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.51 3dfy h VAL 199 CO -0.03 0.44 0.60 -0.08 0.02 0.00 0.00 177.57 178.51 3dfy h GLU 200 N 0.32 1.15 0.14 1.57 4.57 -1.01 -0.80 114.58 120.52 3dfy h GLU 200 Ca 0.04 -0.07 0.02 0.00 -1.18 0.00 0.00 59.36 58.17 3dfy h GLU 200 Cb 0.79 -0.26 -0.03 0.00 -0.16 0.00 0.00 28.75 29.09 3dfy h GLU 200 CO 0.06 0.76 -0.26 0.35 -1.18 0.00 0.00 179.01 178.74 3dfy h PHE 201 N 1.18 -0.69 -0.72 0.92 3.57 -1.12 0.47 116.94 120.55 3dfy h PHE 201 Ca 0.36 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.89 3dfy h PHE 201 Cb -0.04 0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.95 3dfy h PHE 201 CO -0.01 -0.36 0.47 0.00 -2.23 0.00 0.00 178.31 176.18 3dfy h ALA 202 N 0.25 0.93 -0.00 2.41 0.00 -1.31 -1.62 119.26 119.92 3dfy h ALA 202 Ca 0.03 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dfy h ALA 202 Cb 0.49 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3dfy h ALA 202 CO -0.14 0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.41 3dfy h ARG 203 N 0.94 0.00 -0.16 0.00 3.08 -0.88 -0.94 114.38 116.43 3dfy h ARG 203 Ca 0.27 -0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.36 3dfy h ARG 203 Cb -0.06 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 3dfy h ARG 203 CO -0.08 0.15 -0.10 0.00 -1.07 0.00 0.00 179.97 178.87 3dfy h ALA 204 N 0.85 0.02 -0.91 0.04 0.00 -0.74 -0.38 119.26 118.14 3dfy h ALA 204 Ca 0.00 0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.99 3dfy h ALA 204 Cb 0.15 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 3dfy h ALA 204 CO -0.00 -0.54 0.60 0.28 0.00 0.00 0.00 179.25 179.59 3dfy h VAL 205 N -0.10 1.20 -0.77 0.00 2.07 -1.25 -2.53 116.25 114.87 3dfy h VAL 205 Ca 0.09 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 3dfy h VAL 205 Cb 0.24 -0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 29.87 3dfy h VAL 205 CO -0.22 0.22 0.35 0.22 0.02 0.00 0.00 177.57 178.16 3dfy h TYR 206 N 1.20 1.12 0.00 1.57 3.20 -0.43 -2.32 116.97 121.31 3dfy h TYR 206 Ca 0.35 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 62.16 3dfy h TYR 206 Cb -0.08 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 37.84 3dfy h TYR 206 CO -0.01 0.82 0.00 1.96 -1.64 0.00 0.00 178.16 179.29 3dfy h GLN 207 N 1.10 0.00 -0.53 1.82 1.08 -0.65 -1.94 115.11 115.98 3dfy h GLN 207 Ca 0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.46 3dfy h GLN 207 Cb 0.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 3dfy h GLN 207 CO -0.03 0.00 0.00 1.63 -0.95 0.00 0.00 178.83 179.48 3dfy n LYS 208 N -2.34 2.23 -1.19 1.46 5.02 -0.89 -4.91 118.16 117.54 3dfy n LYS 208 Ca 0.01 -1.91 -0.07 0.00 -2.02 0.00 0.00 58.31 54.33 3dfy n LYS 208 Cb 0.21 -1.41 -0.03 0.00 -0.02 0.00 0.00 35.03 33.78 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 1.35 0.89 3.84 0.72 0.00 -0.73 -5.02 105.19 106.24 3dfy n GLY 209 Ca 0.18 -0.64 -0.37 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.21 5.42 -0.11 -0.61 1.01 -1.12 -5.05 121.20 118.53 3dfy s ILE 210 Ca 0.00 0.30 -0.01 0.00 0.00 0.00 0.00 60.65 60.94 3dfy s ILE 210 Cb 0.00 -3.46 -0.03 0.00 0.01 0.00 0.00 42.46 38.98 3dfy s ILE 210 CO 0.00 0.57 -0.07 -0.62 0.00 0.00 0.00 174.94 174.83 3dfy s ASP 211 N -0.73 4.62 -0.23 3.58 2.15 -1.26 -4.20 116.67 120.61 3dfy s ASP 211 Ca 0.15 -0.10 -0.04 0.00 0.43 0.00 0.00 52.55 53.00 3dfy s ASP 211 Cb -0.12 -1.45 -0.00 0.00 -0.30 0.00 0.00 42.92 41.04 3dfy s ASP 211 CO 0.04 0.27 -0.04 -0.63 -0.17 0.00 0.00 175.17 174.64 3dfy s ILE 212 N -0.24 3.31 0.21 4.11 1.01 -1.26 -4.33 121.20 124.00 3dfy s ILE 212 Ca 0.03 -0.57 -0.03 0.00 0.00 0.00 0.00 60.65 60.09 3dfy s ILE 212 Cb -0.13 -2.53 -0.02 0.00 0.01 0.00 0.00 42.46 39.80 3dfy s ILE 212 CO 0.03 0.39 1.57 0.00 0.00 0.00 0.00 174.94 176.92 3dfy h ALA 213 N 8.10 0.80 -2.99 9.38 0.00 -1.12 -3.40 119.26 130.03 3dfy h ALA 213 Ca -0.40 -0.45 -0.23 0.00 0.00 0.00 0.00 54.91 53.82 3dfy h ALA 213 Cb 1.15 -0.10 -0.33 0.00 0.00 0.00 0.00 17.79 18.51 3dfy h ALA 213 CO 0.60 0.66 -0.55 0.08 0.00 0.00 0.00 179.25 180.03 3dfy s VAL 214 N -4.21 -0.26 -0.48 0.00 1.01 -1.20 -4.33 120.40 110.93 3dfy s VAL 214 Ca -0.08 0.26 -0.11 0.00 0.00 0.00 0.00 61.98 62.06 3dfy s VAL 214 Cb 0.12 -0.37 0.12 0.00 0.00 0.00 0.00 36.38 36.25 3dfy s VAL 214 CO 0.83 0.11 0.38 -0.47 0.00 0.00 0.00 175.10 175.95 3dfy s TYR 215 N 2.00 3.39 -0.07 5.22 5.04 0.09 -0.95 117.35 132.07 3dfy s TYR 215 Ca -0.02 -1.74 -0.24 0.00 -2.44 0.00 0.00 57.07 52.63 3dfy s TYR 215 Cb -0.12 -3.55 -0.03 0.00 0.35 0.00 0.00 41.96 38.61 3dfy s TYR 215 CO -0.08 -1.00 0.74 -2.00 -1.34 0.00 0.00 175.55 171.88 3dfy s GLU 216 N 1.41 4.44 -0.21 4.97 2.12 0.11 -0.81 118.70 130.73 3dfy s GLU 216 Ca 0.05 0.95 -0.00 0.00 0.36 0.00 0.00 54.97 56.33 3dfy s GLU 216 Cb -0.27 -3.46 0.00 0.00 0.26 0.00 0.00 34.13 30.66 3dfy s GLU 216 CO 0.00 0.02 0.15 0.94 -0.54 0.00 0.00 175.26 175.83 3dfy n GLN 217 N 3.91 -0.40 0.23 4.30 -0.06 0.12 -1.87 117.38 123.62 3dfy n GLN 217 Ca 0.00 0.16 0.10 0.00 -2.00 0.00 0.00 57.00 55.27 3dfy n GLN 217 Cb 0.51 -0.52 0.55 0.00 -4.06 0.00 0.00 30.24 26.72 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 0.72 0.00 -5.48 3.69 0.13 -1.84 0.14 132.00 129.36 3dfy h PRO 218 Ca -0.16 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.33 3dfy h PRO 218 Cb 0.35 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.37 3dfy h PRO 218 CO 0.09 0.20 -0.46 0.14 -0.23 0.00 0.00 178.00 177.75 3dfy s VAL 219 N -3.86 1.42 0.64 1.56 -7.23 -1.26 -1.13 120.40 110.53 3dfy s VAL 219 Ca -0.01 -1.84 -0.18 0.00 -1.81 0.00 0.00 61.98 58.14 3dfy s VAL 219 Cb 0.11 -2.25 -0.01 0.00 0.56 0.00 0.00 36.38 34.79 3dfy s VAL 219 CO 0.62 0.00 1.31 -0.13 -0.31 0.00 0.00 175.10 176.59 3dfy s ARG 220 N -3.99 2.60 0.35 4.82 0.52 -1.26 -4.10 118.95 117.90 3dfy s ARG 220 Ca 0.17 2.10 0.09 0.00 -0.52 0.00 0.00 55.73 57.57 3dfy s ARG 220 Cb 0.01 -1.89 0.82 0.00 0.52 0.00 0.00 34.95 34.41 3dfy s ARG 220 CO 0.10 -1.57 1.86 0.07 0.02 0.00 0.00 175.30 175.78 3dfy h ARG 221 N 0.63 0.67 0.00 3.54 0.11 -1.93 -1.63 114.38 115.78 3dfy h ARG 221 Ca -0.51 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 59.53 3dfy h ARG 221 Cb 1.34 -0.15 0.00 0.00 1.11 0.00 0.00 29.97 32.26 3dfy h ARG 221 CO 0.53 0.44 -0.09 0.39 0.10 0.00 0.00 179.97 181.35 3dfy n GLU 222 N -4.57 0.11 -2.01 0.08 -0.58 -1.26 -4.50 120.64 107.91 3dfy n GLU 222 Ca 0.18 0.08 -0.42 0.00 -0.42 0.00 0.00 57.16 56.58 3dfy n GLU 222 Cb 0.48 -1.61 -0.00 0.00 -0.57 0.00 0.00 31.44 29.73 3dfy n GLU 222 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 3dfy n ASP 223 N -1.79 5.70 -0.33 1.62 2.03 -0.61 -4.73 116.55 118.43 3dfy n ASP 223 Ca 0.06 -2.99 -0.03 0.00 0.52 0.00 0.00 54.79 52.35 3dfy n ASP 223 Cb 0.38 -1.51 0.09 0.00 -0.72 0.00 0.00 41.12 39.35 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 3.52 1.23 -0.30 5.18 1.08 -1.82 -1.28 117.51 125.13 3dfy h ILE 224 Ca 0.55 -0.43 -0.06 0.00 -0.39 0.00 0.00 64.86 64.53 3dfy h ILE 224 Cb 0.54 -0.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.18 3dfy h ILE 224 CO 1.69 0.23 -0.05 -0.33 -0.69 0.00 0.00 178.15 178.99 3dfy h GLU 225 N 1.22 0.47 -0.31 2.37 4.39 -1.98 -1.65 114.58 119.10 3dfy h GLU 225 Ca 0.33 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.89 3dfy h GLU 225 Cb -0.13 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.44 3dfy h GLU 225 CO -0.07 0.54 0.08 0.78 -1.16 0.00 0.00 179.01 179.19 3dfy h GLY 226 N 0.84 0.53 0.83 -3.84 0.00 -1.65 0.15 103.07 99.92 3dfy h GLY 226 Ca 0.09 -0.33 0.04 0.00 0.00 0.00 0.00 47.33 47.14 3dfy h GLY 226 CO 0.02 0.30 0.57 1.41 0.00 0.00 0.00 176.54 178.84 3dfy h LEU 227 N 0.34 0.93 -0.46 3.11 3.38 -0.95 0.13 115.31 121.80 3dfy h LEU 227 Ca 0.10 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 3dfy h LEU 227 Cb 0.28 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3dfy h LEU 227 CO -0.00 0.63 -0.14 0.50 0.09 0.00 0.00 178.44 179.52 3dfy h LYS 228 N 1.09 0.91 0.07 1.13 3.64 -0.96 0.15 116.57 122.60 3dfy h LYS 228 Ca 0.37 -0.36 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3dfy h LYS 228 Cb 0.06 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3dfy h LYS 228 CO -0.14 1.02 -0.03 0.35 -2.27 0.00 0.00 179.45 178.38 3dfy h PHE 229 N 0.76 -0.09 -0.58 1.91 3.57 0.00 -0.94 116.94 121.57 3dfy h PHE 229 Ca 0.11 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.61 3dfy h PHE 229 Cb 0.70 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.44 3dfy h PHE 229 CO 0.05 -0.04 0.37 0.28 -2.23 0.00 0.00 178.31 176.73 3dfy h VAL 230 N -0.11 1.16 -0.67 1.41 2.07 -0.61 -2.26 116.25 117.25 3dfy h VAL 230 Ca -0.01 -0.33 0.11 0.00 0.82 0.00 0.00 66.70 67.30 3dfy h VAL 230 Cb 0.08 0.34 -0.08 0.00 -1.52 0.00 0.00 31.29 30.11 3dfy h VAL 230 CO 0.02 0.16 0.25 -0.09 0.02 0.00 0.00 177.57 177.93 3dfy h ARG 231 N 0.78 0.41 -0.62 1.57 2.43 -0.44 0.44 114.38 118.96 3dfy h ARG 231 Ca 0.21 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.28 3dfy h ARG 231 Cb -0.06 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 3dfy h ARG 231 CO -0.04 0.27 0.10 0.35 -1.51 0.00 0.00 179.97 179.14 3dfy h PHE 232 N 0.42 1.07 0.00 2.20 3.57 -0.61 -3.20 116.94 120.40 3dfy h PHE 232 Ca 0.35 -0.14 -0.08 0.00 3.53 0.00 0.00 57.97 61.63 3dfy h PHE 232 Cb 0.47 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 3dfy h PHE 232 CO -0.17 0.90 -1.27 0.72 -2.23 0.00 0.00 178.31 176.27 3dfy n HIS 233 N -4.22 0.91 -2.47 0.41 8.25 -0.91 -4.92 115.22 112.26 3dfy n HIS 233 Ca 0.04 0.28 -0.41 0.00 -0.26 0.00 0.00 57.72 57.37 3dfy n HIS 233 Cb 0.28 -0.99 -0.04 0.00 1.12 0.00 0.00 29.99 30.36 3dfy n HIS 233 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3dfy s SER 234 N -5.50 7.19 0.00 0.41 0.15 0.15 -4.91 113.70 111.19 3dfy s SER 234 Ca -0.02 2.07 0.29 0.00 0.70 0.00 0.00 55.95 58.99 3dfy s SER 234 Cb 0.09 -2.60 1.20 0.00 -1.71 0.00 0.00 66.02 63.01 3dfy s SER 234 CO 0.81 -0.32 1.88 -0.81 1.20 0.00 0.00 173.24 176.00 3dfy n PRO 235 N 2.93 0.20 -4.11 5.44 -0.04 -1.26 -4.80 135.00 133.36 3dfy n PRO 235 Ca 0.05 -0.03 -0.29 0.00 -0.04 0.00 0.00 63.50 63.19 3dfy n PRO 235 Cb 0.46 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.35 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 -2.82 3.05 0.28 0.54 0.08 -1.26 -5.03 117.98 112.81 3dfy s PHE 236 Ca 0.19 -0.02 -0.30 0.00 0.12 0.00 0.00 56.93 56.93 3dfy s PHE 236 Cb 0.19 -1.53 -0.11 0.00 -0.57 0.00 0.00 43.02 41.01 3dfy s PHE 236 CO 0.53 0.50 1.49 -2.14 -0.10 0.00 0.00 175.22 175.50 3dfy s PRO 237 N -2.59 4.21 -0.14 0.24 0.02 -1.26 -4.84 135.00 130.64 3dfy s PRO 237 Ca 0.28 2.42 -0.05 0.00 0.02 0.00 0.00 61.00 63.67 3dfy s PRO 237 Cb -0.11 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.31 3dfy s PRO 237 CO 0.20 -0.49 0.04 0.08 -0.33 0.00 0.00 177.00 176.51 3dfy s VAL 238 N -0.20 4.63 0.05 3.83 1.01 -1.26 -0.73 120.40 127.72 3dfy s VAL 238 Ca 0.59 -0.11 0.09 0.00 0.00 0.00 0.00 61.98 62.55 3dfy s VAL 238 Cb -0.44 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 3dfy s VAL 238 CO 0.48 0.54 -0.23 0.00 0.00 0.00 0.00 175.10 175.88 3dfy s ALA 239 N -0.28 2.40 -0.14 5.51 0.00 0.01 -0.55 121.76 128.70 3dfy s ALA 239 Ca 0.08 -1.26 -0.09 0.00 0.00 0.00 0.00 51.96 50.68 3dfy s ALA 239 Cb -0.12 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 3dfy s ALA 239 CO 0.02 0.55 0.17 0.00 0.00 0.00 0.00 175.76 176.49 3dfy s ALA 240 N -0.88 3.78 0.00 0.00 0.00 -0.58 0.12 121.76 124.20 3dfy s ALA 240 Ca 0.13 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 51.48 3dfy s ALA 240 Cb -0.10 -2.10 0.00 0.00 0.00 0.00 0.00 23.12 20.92 3dfy s ALA 240 CO 0.04 0.41 0.00 -3.47 0.00 0.00 0.00 175.76 172.74 3dfy n ASP 241 N 2.62 0.00 0.20 0.00 -0.08 -1.26 -0.61 116.55 117.42 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 0.54 0.00 0.76 0.00 2.34 0.00 0.00 41.12 44.76 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 -1.93 0.58 114.58 115.62 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 -4.14 0.59 -3.96 1.42 7.64 -1.26 -4.43 113.62 109.47 3dfy n SER 243 Ca 0.01 0.57 -0.30 0.00 1.01 0.00 0.00 58.87 60.16 3dfy n SER 243 Cb 0.26 -0.73 -0.14 0.00 -1.01 0.00 0.00 64.21 62.60 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 -3.11 3.30 -0.19 -0.43 0.00 0.19 -4.74 121.76 116.78 3dfy s ALA 244 Ca 0.10 -3.23 -0.02 0.00 0.00 0.00 0.00 51.96 48.81 3dfy s ALA 244 Cb 0.13 -2.18 -0.11 0.00 0.00 0.00 0.00 23.12 20.96 3dfy s ALA 244 CO 0.53 -2.00 -0.19 0.54 0.00 0.00 0.00 175.76 174.64 3dfy n ARG 245 N 3.20 0.45 -4.35 0.00 1.74 -1.26 -4.81 116.66 111.63 3dfy n ARG 245 Ca 0.05 0.13 -0.25 0.00 -0.77 0.00 0.00 57.85 57.01 3dfy n ARG 245 Cb 0.33 -1.32 -0.09 0.00 -1.02 0.00 0.00 32.46 30.36 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 -2.37 2.47 0.51 0.55 -4.23 -1.26 -3.11 115.64 108.20 3dfy s THR 246 Ca -0.26 -1.94 0.25 0.00 -1.18 0.00 0.00 61.69 58.56 3dfy s THR 246 Cb 0.08 -2.85 0.30 0.00 1.34 0.00 0.00 72.50 71.37 3dfy s THR 246 CO 0.41 -0.14 2.15 0.07 -0.54 0.00 0.00 174.62 176.57 3dfy h LYS 247 N 1.75 0.00 -0.08 3.99 2.10 -1.94 -1.24 116.57 121.14 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 -0.01 0.00 -0.90 0.00 0.00 32.23 32.57 3dfy h LYS 247 CO 0.69 0.06 -0.68 0.74 -2.00 0.00 0.00 179.45 178.26 3dfy h PHE 248 N 0.00 0.48 -0.46 0.07 0.04 -1.97 -1.35 116.94 113.76 3dfy h PHE 248 Ca -0.00 -0.20 -0.05 0.00 2.80 0.00 0.00 57.97 60.51 3dfy h PHE 248 Cb 0.14 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 38.20 3dfy h PHE 248 CO 0.00 0.93 0.07 -0.44 -0.60 0.00 0.00 178.31 178.27 3dfy h ASP 249 N 0.25 0.72 -0.57 2.17 3.32 -1.57 -2.21 116.42 118.53 3dfy h ASP 249 Ca -0.02 -0.26 -0.10 0.00 0.02 0.00 0.00 57.03 56.67 3dfy h ASP 249 Cb 1.24 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.58 3dfy h ASP 249 CO 0.11 0.80 -0.02 0.58 -1.72 0.00 0.00 179.24 179.00 3dfy h VAL 250 N 0.62 1.27 -0.68 -1.35 2.07 -1.31 -0.59 116.25 116.28 3dfy h VAL 250 Ca 0.14 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 3dfy h VAL 250 Cb 0.38 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 3dfy h VAL 250 CO 0.01 0.42 0.39 -0.03 0.02 0.00 0.00 177.57 178.38 3dfy h MET 251 N 0.92 0.92 -0.39 1.57 1.85 -1.11 -0.40 114.93 118.30 3dfy h MET 251 Ca 0.16 -0.09 -0.09 0.00 -0.61 0.00 0.00 59.70 59.08 3dfy h MET 251 Cb 0.57 -0.19 -0.01 0.00 0.43 0.00 0.00 31.60 32.40 3dfy h MET 251 CO 0.03 0.66 -0.10 -0.09 -0.40 0.00 0.00 176.91 177.01 3dfy h ARG 252 N 0.94 0.75 -0.94 0.39 2.43 -1.00 -0.80 114.38 116.14 3dfy h ARG 252 Ca 0.24 -0.29 0.02 0.00 -0.81 0.00 0.00 59.98 59.14 3dfy h ARG 252 Cb -0.01 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.45 3dfy h ARG 252 CO -0.04 0.89 0.62 -0.07 -1.51 0.00 0.00 179.97 179.86 3dfy h LEU 253 N 0.56 1.06 -0.24 3.80 3.38 -0.31 -1.16 115.31 122.40 3dfy h LEU 253 Ca 0.10 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 3dfy h LEU 253 Cb 0.62 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 3dfy h LEU 253 CO 0.04 0.75 -0.14 0.58 0.09 0.00 0.00 178.44 179.77 3dfy h VAL 254 N 1.24 1.31 -0.40 1.22 2.07 -0.83 -0.50 116.25 120.36 3dfy h VAL 254 Ca 0.35 -1.24 -0.00 0.00 0.82 0.00 0.00 66.70 66.63 3dfy h VAL 254 Cb -0.10 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 3dfy h VAL 254 CO -0.09 0.38 0.23 0.11 0.02 0.00 0.00 177.57 178.23 3dfy h LYS 255 N 0.24 0.53 -0.00 1.57 1.57 -0.81 -1.73 116.57 117.93 3dfy h LYS 255 Ca 0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3dfy h LYS 255 Cb 0.65 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.85 3dfy h LYS 255 CO 0.04 0.38 -0.28 0.39 -0.57 0.00 0.00 179.45 179.40 3dfy n GLU 256 N -4.45 0.47 -3.78 3.15 -0.58 -0.47 -4.94 120.64 110.04 3dfy n GLU 256 Ca 0.03 -0.24 -0.25 0.00 -0.42 0.00 0.00 57.16 56.28 3dfy n GLU 256 Cb 0.08 -1.50 0.04 0.00 -0.57 0.00 0.00 31.44 29.49 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 -1.06 -5.54 0.09 3.49 1.02 -0.27 -4.91 120.64 113.46 3dfy n GLU 257 Ca 0.10 0.64 -0.17 0.00 -0.02 0.00 0.00 57.16 57.71 3dfy n GLU 257 Cb 0.33 -5.41 -0.14 0.00 -0.02 0.00 0.00 31.44 26.20 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 0.93 0.14 -2.32 0.62 0.00 -1.65 -3.46 119.26 113.52 3dfy h ALA 258 Ca -0.59 -0.96 -0.32 0.00 0.00 0.00 0.00 54.91 53.03 3dfy h ALA 258 Cb 1.37 0.11 -0.15 0.00 0.00 0.00 0.00 17.79 19.12 3dfy h ALA 258 CO 0.61 1.01 -0.63 0.14 0.00 0.00 0.00 179.25 180.38 3dfy s VAL 259 N -2.64 0.58 -0.13 0.00 -7.23 -1.26 -3.19 120.40 106.53 3dfy s VAL 259 Ca -0.06 -1.99 0.18 0.00 -1.81 0.00 0.00 61.98 58.30 3dfy s VAL 259 Cb 0.07 -2.45 -0.24 0.00 0.56 0.00 0.00 36.38 34.32 3dfy s VAL 259 CO 0.88 -0.17 0.40 0.47 -0.31 0.00 0.00 175.10 176.37 3dfy n ASP 260 N -0.38 0.30 -4.22 4.85 8.00 0.28 -4.97 116.55 120.42 3dfy n ASP 260 Ca -0.02 0.13 -0.13 0.00 0.71 0.00 0.00 54.79 55.48 3dfy n ASP 260 Cb 0.65 0.90 -0.10 0.00 -0.02 0.00 0.00 41.12 42.55 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 -2.83 1.12 -0.05 1.24 1.51 -0.22 -1.31 117.35 116.81 3dfy s TYR 261 Ca -0.07 -0.83 0.01 0.00 -1.01 0.00 0.00 57.07 55.17 3dfy s TYR 261 Cb 0.09 -0.60 0.02 0.00 -0.11 0.00 0.00 41.96 41.35 3dfy s TYR 261 CO 0.84 -0.02 -0.07 0.08 -1.11 0.00 0.00 175.55 175.27 3dfy s VAL 262 N -3.46 0.75 -0.43 0.71 1.01 -0.83 -1.53 120.40 116.61 3dfy s VAL 262 Ca 0.15 -0.24 -0.17 0.00 0.00 0.00 0.00 61.98 61.72 3dfy s VAL 262 Cb 0.04 -0.74 0.03 0.00 0.00 0.00 0.00 36.38 35.71 3dfy s VAL 262 CO -0.01 0.27 0.45 0.21 0.00 0.00 0.00 175.10 176.02 3dfy s ASN 263 N 0.87 6.19 0.10 3.32 2.47 0.22 -2.04 114.94 126.07 3dfy s ASN 263 Ca -0.12 -0.76 -0.22 0.00 0.42 0.00 0.00 52.86 52.18 3dfy s ASN 263 Cb -0.15 -2.23 -0.07 0.00 -1.45 0.00 0.00 41.25 37.36 3dfy s ASN 263 CO 0.01 -0.62 0.67 -0.63 -3.72 0.00 0.00 177.10 172.82 3dfy s ILE 264 N 2.14 4.59 -0.06 -5.21 1.01 0.15 -4.66 121.20 119.16 3dfy s ILE 264 Ca 0.12 1.46 -0.01 0.00 0.00 0.00 0.00 60.65 62.22 3dfy s ILE 264 Cb -0.18 -4.02 0.03 0.00 0.01 0.00 0.00 42.46 38.30 3dfy s ILE 264 CO 0.13 0.52 -0.01 -0.54 0.00 0.00 0.00 174.94 175.03 3dfy s LYS 265 N -0.97 0.69 0.55 2.79 1.02 -1.26 -0.70 119.74 121.86 3dfy s LYS 265 Ca 0.33 0.03 0.23 0.00 0.02 0.00 0.00 55.97 56.58 3dfy s LYS 265 Cb -0.21 -0.93 1.47 0.00 -0.52 0.00 0.00 37.83 37.64 3dfy s LYS 265 CO 0.22 -0.23 2.12 -0.07 -0.92 0.00 0.00 175.35 176.47 3dfy h LEU 266 N 7.96 0.00 -0.47 3.17 3.38 -1.86 0.38 115.31 127.86 3dfy h LEU 266 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 3dfy h LEU 266 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 3dfy h LEU 266 CO 0.33 0.00 0.00 0.23 0.09 0.00 0.00 178.44 179.09 3dfy n MET 267 N -4.23 0.14 -0.13 1.13 2.81 -1.26 0.18 117.12 115.75 3dfy n MET 267 Ca 0.01 0.36 -0.21 0.00 -1.81 0.00 0.00 57.70 56.05 3dfy n MET 267 Cb 0.25 -1.76 -0.11 0.00 -0.71 0.00 0.00 33.22 30.89 3dfy n MET 267 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3dfy n LYS 268 N -2.02 0.62 -0.03 0.03 5.02 0.05 -3.09 118.16 118.75 3dfy n LYS 268 Ca 0.03 0.18 0.06 0.00 -2.02 0.00 0.00 58.31 56.55 3dfy n LYS 268 Cb 0.22 -1.50 -0.16 0.00 -0.02 0.00 0.00 35.03 33.57 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 -3.51 0.20 -0.13 4.39 7.64 -0.76 -4.69 113.62 116.76 3dfy n SER 269 Ca -0.48 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.42 3dfy n SER 269 Cb 0.96 1.72 -0.00 0.00 -1.01 0.00 0.00 64.21 65.87 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 1.43 -1.42 0.21 0.23 0.00 0.13 -3.30 105.19 102.47 3dfy n GLY 270 Ca -0.11 -1.50 -0.18 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.12 1.28 0.70 -0.61 1.08 -1.83 -2.91 117.51 115.11 3dfy h ILE 271 Ca 0.00 -2.09 -0.03 0.00 -0.39 0.00 0.00 64.86 62.35 3dfy h ILE 271 Cb 0.12 2.14 -0.00 0.00 -3.07 0.00 0.00 36.82 36.01 3dfy h ILE 271 CO 0.00 0.66 -0.41 0.77 -0.69 0.00 0.00 178.15 178.48 3dfy h SER 272 N 0.47 -1.03 -0.22 1.72 4.64 -1.94 -1.53 113.55 115.67 3dfy h SER 272 Ca -0.08 0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.25 3dfy h SER 272 Cb 1.52 0.30 -0.02 0.00 -0.31 0.00 0.00 62.40 63.89 3dfy h SER 272 CO 0.18 -0.65 0.02 0.44 -0.87 0.00 0.00 176.83 175.94 3dfy h ASP 273 N -1.04 0.45 -0.71 4.97 5.19 -1.69 -2.27 116.42 121.33 3dfy h ASP 273 Ca -0.09 -0.08 -0.01 0.00 -0.62 0.00 0.00 57.03 56.24 3dfy h ASP 273 Cb 0.83 -0.12 -0.03 0.00 0.18 0.00 0.00 39.33 40.19 3dfy h ASP 273 CO 0.10 0.51 0.41 0.00 -3.12 0.00 0.00 179.24 177.14 3dfy h ALA 274 N 1.55 0.90 -0.68 3.45 0.00 -1.33 0.18 119.26 123.35 3dfy h ALA 274 Ca 0.11 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3dfy h ALA 274 Cb 0.29 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3dfy h ALA 274 CO 0.01 0.39 0.19 -0.07 0.00 0.00 0.00 179.25 179.77 3dfy h LEU 275 N 0.97 0.99 -0.33 0.00 3.38 -0.86 -1.88 115.31 117.57 3dfy h LEU 275 Ca 0.25 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 3dfy h LEU 275 Cb -0.00 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 3dfy h LEU 275 CO -0.04 0.93 0.05 0.00 0.09 0.00 0.00 178.44 179.47 3dfy h ALA 276 N 1.19 0.44 -0.64 1.53 0.00 -0.77 -2.66 119.26 118.36 3dfy h ALA 276 Ca 0.22 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3dfy h ALA 276 Cb 0.32 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3dfy h ALA 276 CO -0.00 0.14 0.30 0.82 0.00 0.00 0.00 179.25 180.51 3dfy h ILE 277 N 0.38 1.21 -0.26 0.00 2.04 -0.42 0.00 117.51 120.46 3dfy h ILE 277 Ca 0.10 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 3dfy h ILE 277 Cb 0.35 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 3dfy h ILE 277 CO 0.01 0.25 0.13 0.58 0.00 0.00 0.00 178.15 179.12 3dfy h VAL 278 N 0.90 1.13 -0.25 1.67 2.07 -1.22 0.81 116.25 121.36 3dfy h VAL 278 Ca 0.22 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 3dfy h VAL 278 Cb 0.10 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 3dfy h VAL 278 CO -0.03 0.13 0.10 -0.33 0.02 0.00 0.00 177.57 177.47 3dfy h GLU 279 N 0.30 0.37 -0.32 1.57 4.39 -1.08 -1.40 114.58 118.41 3dfy h GLU 279 Ca 0.09 -0.06 0.02 0.00 0.34 0.00 0.00 59.36 59.75 3dfy h GLU 279 Cb 0.09 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 3dfy h GLU 279 CO -0.01 0.40 0.16 0.82 -1.16 0.00 0.00 179.01 179.22 3dfy h ILE 280 N 0.26 0.99 -0.19 3.13 2.04 -0.82 -2.06 117.51 120.85 3dfy h ILE 280 Ca 0.08 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.85 3dfy h ILE 280 Cb 0.16 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 3dfy h ILE 280 CO -0.01 0.06 0.07 0.00 0.00 0.00 0.00 178.15 178.27 3dfy h ALA 281 N 1.17 0.21 0.00 1.87 0.00 -0.69 -1.71 119.26 120.11 3dfy h ALA 281 Ca 0.13 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3dfy h ALA 281 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3dfy h ALA 281 CO -0.09 -0.36 0.00 0.39 0.00 0.00 0.00 179.25 179.19 3dfy n GLU 282 N -5.04 0.14 -0.07 0.00 1.02 -0.54 -1.68 120.64 114.46 3dfy n GLU 282 Ca -0.03 0.44 0.11 0.00 -0.02 0.00 0.00 57.16 57.66 3dfy n GLU 282 Cb 0.07 -1.79 0.14 0.00 -0.02 0.00 0.00 31.44 29.83 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 -2.06 3.10 -0.13 1.62 7.64 -0.69 -4.48 113.62 118.62 3dfy n SER 283 Ca 0.02 -1.96 0.01 0.00 1.01 0.00 0.00 58.87 57.94 3dfy n SER 283 Cb 0.17 -0.10 0.01 0.00 -1.01 0.00 0.00 64.21 63.28 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 1.34 0.48 -0.16 6.43 3.41 -0.68 -5.01 113.62 119.43 3dfy n SER 284 Ca 0.15 -1.56 -0.02 0.00 -0.26 0.00 0.00 58.87 57.18 3dfy n SER 284 Cb 0.58 -0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 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 -0.18 0.56 3.81 5.00 0.00 -1.05 -5.02 105.19 108.30 3dfy n GLY 285 Ca 0.01 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.49 4.46 0.22 0.99 2.96 -0.92 -5.01 118.68 120.89 3dfy s LEU 286 Ca 0.00 1.42 0.03 0.00 -0.22 0.00 0.00 54.13 55.36 3dfy s LEU 286 Cb 0.00 -3.31 -0.03 0.00 0.50 0.00 0.00 46.19 43.34 3dfy s LEU 286 CO 0.00 0.15 0.36 -0.54 -1.32 0.00 0.00 176.35 175.00 3dfy s LYS 287 N -1.54 3.45 0.09 1.98 -0.14 -0.43 -4.47 119.74 118.69 3dfy s LYS 287 Ca 0.37 -0.61 0.06 0.00 -1.36 0.00 0.00 55.97 54.43 3dfy s LYS 287 Cb -0.19 -2.88 -0.03 0.00 -1.68 0.00 0.00 37.83 33.04 3dfy s LYS 287 CO 0.22 0.43 -0.16 -0.51 -0.76 0.00 0.00 175.35 174.57 3dfy s LEU 288 N -3.70 2.31 0.07 3.17 1.43 -1.26 -1.96 118.68 118.74 3dfy s LEU 288 Ca 0.35 -0.68 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 3dfy s LEU 288 Cb -0.10 -0.60 -0.04 0.00 0.03 0.00 0.00 46.19 45.48 3dfy s LEU 288 CO 0.30 -0.06 -0.05 0.00 0.23 0.00 0.00 176.35 176.76 3dfy s MET 289 N -1.99 0.71 -0.05 1.70 0.23 -0.87 -1.29 119.30 117.75 3dfy s MET 289 Ca 0.02 -1.20 0.04 0.00 -1.03 0.00 0.00 55.69 53.52 3dfy s MET 289 Cb -0.09 -0.08 0.00 0.00 -1.53 0.00 0.00 34.83 33.14 3dfy s MET 289 CO 0.03 -0.04 -0.15 -1.50 -2.03 0.00 0.00 175.02 171.32 3dfy s ILE 290 N -3.36 1.32 0.00 3.16 2.07 -0.97 -0.67 121.20 122.74 3dfy s ILE 290 Ca 0.07 -0.64 0.00 0.00 -1.41 0.00 0.00 60.65 58.67 3dfy s ILE 290 Cb 0.04 -1.15 0.00 0.00 0.13 0.00 0.00 42.46 41.48 3dfy s ILE 290 CO -0.06 0.39 0.00 0.61 -1.91 0.00 0.00 174.94 173.97 3dfy n GLY 291 N 3.29 7.09 2.91 1.50 0.00 0.12 -0.26 105.19 119.83 3dfy n GLY 291 Ca -0.19 -1.97 -0.10 0.00 0.00 0.00 0.00 46.02 43.77 3dfy n GLY 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dfy n MET 293 N -0.45 0.00 -1.91 0.00 2.81 -1.26 -5.00 117.12 111.31 3dfy n MET 293 Ca -0.03 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.73 3dfy n MET 293 Cb 0.48 0.00 0.06 0.00 -0.71 0.00 0.00 33.22 33.05 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 4.84 4.91 3.75 3.03 0.00 -1.26 -4.75 105.19 115.70 3dfy n GLY 294 Ca 0.00 -1.99 -0.38 0.00 0.00 0.00 0.00 46.02 43.65 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 -3.35 2.97 0.07 1.61 8.01 -1.26 -4.90 118.70 121.84 3dfy s GLU 295 Ca 0.43 2.11 -0.00 0.00 0.01 0.00 0.00 54.97 57.51 3dfy s GLU 295 Cb 0.38 -2.10 0.02 0.00 -4.31 0.00 0.00 34.13 28.12 3dfy s GLU 295 CO -0.01 -1.29 0.10 -1.13 0.01 0.00 0.00 175.26 172.94 3dfy n SER 296 N -1.34 0.09 -0.12 -0.19 3.41 -1.26 -2.74 113.62 111.46 3dfy n SER 296 Ca 0.12 -1.09 0.01 0.00 -0.26 0.00 0.00 58.87 57.66 3dfy n SER 296 Cb 0.47 -0.07 0.30 0.00 -0.26 0.00 0.00 64.21 64.65 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 -0.08 0.70 0.15 4.04 4.64 -1.92 -0.03 113.55 121.05 3dfy h SER 297 Ca -0.03 -0.03 -0.10 0.00 -0.47 0.00 0.00 61.79 61.15 3dfy h SER 297 Cb 0.11 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 3dfy h SER 297 CO 0.03 0.54 -0.36 0.25 -0.87 0.00 0.00 176.83 176.42 3dfy h LEU 298 N 0.81 0.30 0.19 5.97 6.46 -1.94 -2.39 115.31 124.72 3dfy h LEU 298 Ca 0.21 -0.11 -0.32 0.00 -0.12 0.00 0.00 57.88 57.54 3dfy h LEU 298 Cb -0.04 -0.08 0.02 0.00 -0.73 0.00 0.00 40.66 39.83 3dfy h LEU 298 CO -0.04 0.64 -1.48 1.23 -0.62 0.00 0.00 178.44 178.17 3dfy h GLY 299 N 1.13 0.47 2.00 3.75 0.00 -1.71 -3.25 103.07 105.46 3dfy h GLY 299 Ca 0.03 -1.21 -0.04 0.00 0.00 0.00 0.00 47.33 46.11 3dfy h GLY 299 CO 0.06 1.06 -0.19 1.19 0.00 0.00 0.00 176.54 178.66 3dfy h ILE 300 N 0.11 0.95 -0.81 2.60 6.09 -1.01 -1.54 117.51 123.91 3dfy h ILE 300 Ca -0.24 -0.69 0.17 0.00 -1.37 0.00 0.00 64.86 62.73 3dfy h ILE 300 Cb 2.09 1.39 -0.06 0.00 0.47 0.00 0.00 36.82 40.72 3dfy h ILE 300 CO 0.23 0.19 0.54 -1.13 -3.07 0.00 0.00 178.15 174.90 3dfy h ASN 301 N 0.00 0.39 -0.37 2.19 -1.24 -1.46 -0.30 115.58 114.79 3dfy h ASN 301 Ca -0.00 0.03 -0.01 0.00 0.71 0.00 0.00 56.30 57.03 3dfy h ASN 301 Cb 0.38 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.36 3dfy h ASN 301 CO 0.02 0.18 0.19 1.56 -1.29 0.00 0.00 177.43 178.10 3dfy h GLN 302 N 0.40 0.52 -0.05 6.67 4.20 -1.40 -1.98 115.11 123.48 3dfy h GLN 302 Ca 0.41 -0.07 -0.18 0.00 0.06 0.00 0.00 58.65 58.87 3dfy h GLN 302 Cb 0.98 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.65 3dfy h GLN 302 CO -0.14 0.45 -0.74 0.77 -0.67 0.00 0.00 178.83 178.50 3dfy h SER 303 N 0.47 0.36 0.12 1.46 0.02 -1.25 -2.35 113.55 112.38 3dfy h SER 303 Ca 0.13 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 3dfy h SER 303 Cb 0.09 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.52 3dfy h SER 303 CO -0.02 0.98 -0.06 0.58 -1.14 0.00 0.00 176.83 177.18 3dfy h VAL 304 N 0.20 0.88 -0.66 2.27 2.07 -0.95 0.24 116.25 120.31 3dfy h VAL 304 Ca -0.03 -0.01 -0.04 0.00 0.82 0.00 0.00 66.70 67.44 3dfy h VAL 304 Cb 1.31 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.95 3dfy h VAL 304 CO 0.12 0.00 0.23 0.45 0.02 0.00 0.00 177.57 178.39 3dfy h HIS 305 N -0.17 1.00 -0.52 1.57 -0.00 -1.40 0.40 115.15 116.04 3dfy h HIS 305 Ca -0.02 -0.08 -0.04 0.00 -0.00 0.00 0.00 60.37 60.23 3dfy h HIS 305 Cb 0.13 -0.30 -0.02 0.00 -0.00 0.00 0.00 27.41 27.22 3dfy h HIS 305 CO -0.07 0.79 0.16 0.35 -0.00 0.00 0.00 177.93 179.16 3dfy h PHE 306 N 0.96 0.83 -0.14 2.45 3.57 -1.00 0.04 116.94 123.66 3dfy h PHE 306 Ca 0.22 -0.08 -0.18 0.00 3.53 0.00 0.00 57.97 61.45 3dfy h PHE 306 Cb 0.24 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 38.73 3dfy h PHE 306 CO 0.02 0.72 -0.67 0.00 -2.23 0.00 0.00 178.31 176.15 3dfy h ALA 307 N 1.02 0.57 -0.06 2.41 0.00 -0.19 -1.98 119.26 121.04 3dfy h ALA 307 Ca 0.17 -0.57 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 3dfy h ALA 307 Cb 0.28 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3dfy h ALA 307 CO -0.01 0.72 -0.08 -0.07 0.00 0.00 0.00 179.25 179.82 3dfy h LEU 308 N 0.39 0.16 0.12 0.00 3.38 -0.84 -0.13 115.31 118.39 3dfy h LEU 308 Ca -0.02 -0.52 -0.01 0.00 0.09 0.00 0.00 57.88 57.42 3dfy h LEU 308 Cb 1.25 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.95 3dfy h LEU 308 CO 0.12 0.65 -0.06 1.23 0.09 0.00 0.00 178.44 180.48 3dfy h GLY 309 N -0.32 -0.17 1.43 0.83 0.00 -1.02 -1.09 103.07 102.73 3dfy h GLY 309 Ca 0.01 0.06 -0.23 0.00 0.00 0.00 0.00 47.33 47.17 3dfy h GLY 309 CO 0.02 -0.06 -0.93 -0.91 0.00 0.00 0.00 176.54 174.65 3dfy h THR 310 N -0.24 1.36 -1.48 4.70 1.35 -1.47 -1.24 112.91 115.88 3dfy h THR 310 Ca -0.02 -2.32 -0.39 0.00 -0.55 0.00 0.00 66.41 63.13 3dfy h THR 310 Cb 0.19 2.34 -0.11 0.00 -1.73 0.00 0.00 68.15 68.84 3dfy h THR 310 CO 0.03 0.70 -0.40 0.61 -0.25 0.00 0.00 175.52 176.21 3dfy n GLY 311 N 0.92 1.17 0.02 5.82 0.00 -0.06 -4.75 105.19 108.31 3dfy n GLY 311 Ca -0.08 -0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.00 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 0.35 2.63 -2.80 4.61 0.00 -1.26 -4.91 120.51 119.13 3dfy n ALA 312 Ca -0.20 -0.18 -0.36 0.00 0.00 0.00 0.00 53.44 52.70 3dfy n ALA 312 Cb 0.65 -1.39 -0.08 0.00 0.00 0.00 0.00 19.45 18.62 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 -2.81 3.38 0.07 0.00 0.08 -1.26 -4.39 117.98 113.05 3dfy s PHE 313 Ca 0.19 0.30 -0.11 0.00 0.12 0.00 0.00 56.93 57.43 3dfy s PHE 313 Cb 0.19 -1.98 -0.24 0.00 -0.57 0.00 0.00 43.02 40.42 3dfy s PHE 313 CO 0.53 0.45 1.16 0.93 -0.10 0.00 0.00 175.22 178.19 3dfy h GLU 314 N 5.77 0.55 -5.22 0.44 4.39 -1.54 -3.46 114.58 115.50 3dfy h GLU 314 Ca -0.47 -0.71 -0.40 0.00 0.34 0.00 0.00 59.36 58.13 3dfy h GLU 314 Cb 1.19 0.23 -0.22 0.00 -0.10 0.00 0.00 28.75 29.85 3dfy h GLU 314 CO 0.64 1.30 -0.77 -0.06 -1.16 0.00 0.00 179.01 178.95 3dfy s PHE 315 N -3.03 1.13 -0.14 4.33 0.08 -1.25 -5.05 117.98 114.04 3dfy s PHE 315 Ca -0.08 -0.45 0.01 0.00 0.12 0.00 0.00 56.93 56.53 3dfy s PHE 315 Cb 0.07 -0.65 0.02 0.00 -0.57 0.00 0.00 43.02 41.89 3dfy s PHE 315 CO 0.91 0.03 -0.14 -1.01 -0.10 0.00 0.00 175.22 174.92 3dfy s HIS 316 N -1.22 2.13 -0.76 0.36 3.76 -1.24 -2.30 115.29 116.02 3dfy s HIS 316 Ca -0.03 -1.17 0.03 0.00 -0.15 0.00 0.00 55.06 53.75 3dfy s HIS 316 Cb -0.10 -1.56 0.26 0.00 1.11 0.00 0.00 32.58 32.29 3dfy s HIS 316 CO 0.02 -0.64 0.90 -3.47 -0.85 0.00 0.00 174.74 170.70 3dfy n ASP 317 N 4.69 4.35 -3.58 1.40 2.03 0.63 -0.70 116.55 125.38 3dfy n ASP 317 Ca -0.17 -3.40 -0.28 0.00 0.52 0.00 0.00 54.79 51.46 3dfy n ASP 317 Cb 0.50 -0.84 -0.09 0.00 -0.72 0.00 0.00 41.12 39.98 3dfy n ASP 317 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3dfy n LEU 318 N 1.13 3.69 -0.02 -2.67 4.77 -1.26 -3.30 117.00 119.34 3dfy n LEU 318 Ca 0.28 -5.37 0.00 0.00 -0.03 0.00 0.00 56.01 50.89 3dfy n LEU 318 Cb 0.38 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 3dfy n LEU 318 CO 0.47 1.96 0.30 -0.90 -1.33 0.00 0.00 177.39 177.88 3dfy n ASP 319 N 1.18 1.20 -0.34 -1.43 5.75 -1.26 -4.77 116.55 116.88 3dfy n ASP 319 Ca 0.27 -1.18 0.08 0.00 -0.01 0.00 0.00 54.79 53.95 3dfy n ASP 319 Cb 0.39 -0.00 0.24 0.00 -1.03 0.00 0.00 41.12 40.72 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 0.09 0.81 0.65 -1.12 4.64 -1.85 0.23 113.55 116.99 3dfy h SER 320 Ca 0.00 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3dfy h SER 320 Cb 0.10 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3dfy h SER 320 CO 0.00 0.39 0.00 1.12 -0.87 0.00 0.00 176.83 177.47 3dfy h HIS 321 N 0.86 0.00 0.00 4.77 2.07 -1.78 -1.34 115.15 119.74 3dfy h HIS 321 Ca 0.50 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.02 3dfy h HIS 321 Cb 0.58 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.56 3dfy h HIS 321 CO -0.02 0.00 -0.37 1.28 -3.07 0.00 0.00 177.93 175.74 3dfy n LEU 322 N -2.35 0.40 0.01 6.12 4.77 0.80 -3.43 117.00 123.32 3dfy n LEU 322 Ca 0.01 0.17 0.11 0.00 -0.03 0.00 0.00 56.01 56.27 3dfy n LEU 322 Cb 0.21 -0.31 0.02 0.00 -2.33 0.00 0.00 43.42 41.01 3dfy n LEU 322 CO 0.19 0.06 0.07 0.23 -1.33 0.00 0.00 177.39 176.62 3dfy n MET 323 N -1.60 0.10 -3.56 3.23 2.81 -0.51 -4.95 117.12 112.65 3dfy n MET 323 Ca 0.06 -0.01 -0.20 0.00 -1.81 0.00 0.00 57.70 55.73 3dfy n MET 323 Cb 0.35 -1.53 -0.02 0.00 -0.71 0.00 0.00 33.22 31.31 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 -3.31 3.55 -0.18 4.03 1.43 -1.17 -2.66 118.68 120.37 3dfy s LEU 324 Ca 0.07 -0.57 -0.01 0.00 -1.03 0.00 0.00 54.13 52.59 3dfy s LEU 324 Cb 0.16 -2.25 -0.00 0.00 0.03 0.00 0.00 46.19 44.12 3dfy s LEU 324 CO 0.81 -0.55 -0.12 -1.59 0.23 0.00 0.00 176.35 175.12 3dfy s LYS 325 N -4.12 3.25 -0.05 1.70 -2.85 -0.82 -4.92 119.74 111.92 3dfy s LYS 325 Ca 0.46 -0.71 -0.01 0.00 -1.00 0.00 0.00 55.97 54.71 3dfy s LYS 325 Cb -0.06 -2.75 0.03 0.00 -2.06 0.00 0.00 37.83 32.99 3dfy s LYS 325 CO 0.28 -0.08 0.00 -1.21 0.10 0.00 0.00 175.35 174.45 3dfy s GLU 326 N 1.08 0.49 0.37 1.78 2.02 -1.26 -4.57 118.70 118.60 3dfy s GLU 326 Ca -0.00 0.10 0.08 0.00 0.02 0.00 0.00 54.97 55.18 3dfy s GLU 326 Cb -0.15 -0.80 0.71 0.00 0.10 0.00 0.00 34.13 34.00 3dfy s GLU 326 CO -0.03 -0.24 1.88 1.05 0.02 0.00 0.00 175.26 177.94 3dfy h GLU 327 N 7.96 0.28 -4.70 1.61 4.11 -2.03 -3.40 114.58 118.40 3dfy h GLU 327 Ca -0.26 -0.07 -0.62 0.00 0.07 0.00 0.00 59.36 58.48 3dfy h GLU 327 Cb 1.13 -0.03 -0.36 0.00 0.50 0.00 0.00 28.75 29.98 3dfy h GLU 327 CO 0.32 0.44 -0.83 0.54 0.07 0.00 0.00 179.01 179.55 3dfy s VAL 328 N -4.68 1.67 0.21 -1.06 0.11 -1.26 -5.10 120.40 110.30 3dfy s VAL 328 Ca -0.06 -0.81 -0.31 0.00 -2.93 0.00 0.00 61.98 57.87 3dfy s VAL 328 Cb 0.15 -1.62 -0.11 0.00 -1.53 0.00 0.00 36.38 33.27 3dfy s VAL 328 CO 0.74 0.37 1.61 0.12 -3.33 0.00 0.00 175.10 174.62 3dfy s PHE 329 N 1.42 2.95 -0.13 1.54 5.36 -1.26 -4.90 117.98 122.96 3dfy s PHE 329 Ca 0.03 0.59 0.18 0.00 -0.96 0.00 0.00 56.93 56.77 3dfy s PHE 329 Cb -0.14 -4.02 0.28 0.00 -0.34 0.00 0.00 43.02 38.81 3dfy s PHE 329 CO -0.10 -3.69 1.15 0.54 -1.46 0.00 0.00 175.22 171.66 3dfy n ARG 330 N 3.50 1.25 -3.16 10.12 1.74 -1.26 -5.04 116.66 123.80 3dfy n ARG 330 Ca 0.13 -2.55 -0.28 0.00 -0.77 0.00 0.00 57.85 54.38 3dfy n ARG 330 Cb 0.37 -1.47 -0.02 0.00 -1.02 0.00 0.00 32.46 30.32 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 -2.83 1.74 -0.82 -0.13 0.00 -1.25 -3.99 107.32 100.03 3dfy s GLY 331 Ca 0.31 -0.55 -0.01 0.00 0.00 0.00 0.00 44.72 44.48 3dfy s GLY 331 CO 0.03 -0.43 1.83 0.28 0.00 0.00 0.00 173.10 174.81 3dfy n LYS 332 N -1.32 3.36 -3.91 2.90 5.02 -1.26 -4.92 118.16 118.02 3dfy n LYS 332 Ca -0.01 -3.92 -0.10 0.00 -2.02 0.00 0.00 58.31 52.26 3dfy n LYS 332 Cb 0.54 -2.30 -0.01 0.00 -0.02 0.00 0.00 35.03 33.24 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 -4.03 0.33 -0.19 2.13 -0.12 -1.26 -4.84 117.98 109.99 3dfy s PHE 333 Ca 0.49 -0.81 -0.03 0.00 -0.05 0.00 0.00 56.93 56.52 3dfy s PHE 333 Cb 0.38 0.50 -0.02 0.00 -0.63 0.00 0.00 43.02 43.25 3dfy s PHE 333 CO -0.33 -1.32 -0.05 0.42 -0.05 0.00 0.00 175.22 173.89 3dfy s ILE 334 N -3.03 3.49 -0.31 -4.49 1.01 0.43 -4.97 121.20 113.34 3dfy s ILE 334 Ca 0.19 -0.47 -0.13 0.00 0.00 0.00 0.00 60.65 60.24 3dfy s ILE 334 Cb -0.03 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.85 3dfy s ILE 334 CO 0.12 0.45 0.26 -1.58 0.00 0.00 0.00 174.94 174.19 3dfy s GLN 335 N 1.03 3.75 -0.48 2.79 2.00 -1.26 -1.43 119.66 126.05 3dfy s GLN 335 Ca 0.01 -0.40 0.03 0.00 -2.00 0.00 0.00 55.36 52.99 3dfy s GLN 335 Cb -0.15 -3.73 0.14 0.00 0.80 0.00 0.00 33.01 30.08 3dfy s GLN 335 CO 0.00 -0.33 0.28 0.34 -0.50 0.00 0.00 175.29 175.08 3dfy s ASP 336 N 1.73 3.60 1.06 6.67 2.15 0.12 -5.01 116.67 127.00 3dfy s ASP 336 Ca 0.08 -2.86 0.00 0.00 0.43 0.00 0.00 52.55 50.21 3dfy s ASP 336 Cb -0.17 -1.08 0.00 0.00 -0.30 0.00 0.00 42.92 41.37 3dfy s ASP 336 CO 0.11 -0.23 0.00 0.61 -0.17 0.00 0.00 175.17 175.49 3dfy n GLY 337 N 3.24 2.23 0.00 2.66 0.00 -1.26 -1.67 105.19 110.39 3dfy n GLY 337 Ca 0.12 -0.46 0.12 0.00 0.00 0.00 0.00 46.02 45.81 3dfy n GLY 337 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dfy n PRO 338 N 13.30 0.93 -4.04 1.61 -0.04 -1.26 -4.85 135.00 140.66 3dfy n PRO 338 Ca 0.00 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.16 3dfy n PRO 338 Cb 0.00 -1.41 -0.06 0.00 -0.04 0.00 0.00 33.50 31.98 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 -2.00 2.93 -0.03 0.54 0.52 -0.67 -0.70 118.95 119.54 3dfy s ARG 339 Ca 0.37 -0.67 0.03 0.00 -0.52 0.00 0.00 55.73 54.94 3dfy s ARG 339 Cb 0.17 -2.75 0.00 0.00 0.52 0.00 0.00 34.95 32.89 3dfy s ARG 339 CO 0.28 0.57 -0.12 -1.64 0.02 0.00 0.00 175.30 174.41 3dfy s MET 340 N -2.43 1.25 0.23 3.54 -1.94 -0.24 0.16 119.30 119.86 3dfy s MET 340 Ca 0.30 -0.40 0.00 0.00 -1.71 0.00 0.00 55.69 53.88 3dfy s MET 340 Cb -0.12 -1.13 -0.04 0.00 2.01 0.00 0.00 34.83 35.55 3dfy s MET 340 CO 0.23 0.15 0.14 1.03 -0.01 0.00 0.00 175.02 176.56 3dfy s ARG 341 N 0.17 1.30 0.18 2.03 0.52 -0.52 -1.76 118.95 120.88 3dfy s ARG 341 Ca -0.04 -1.70 0.04 0.00 -0.52 0.00 0.00 55.73 53.51 3dfy s ARG 341 Cb -0.10 0.19 -0.03 0.00 0.52 0.00 0.00 34.95 35.53 3dfy s ARG 341 CO 0.01 -0.41 0.28 0.54 0.02 0.00 0.00 175.30 175.74 3dfy s VAL 342 N -4.01 5.13 -1.18 3.52 0.11 -1.25 -0.43 120.40 122.30 3dfy s VAL 342 Ca 0.39 -0.86 0.09 0.00 -2.93 0.00 0.00 61.98 58.67 3dfy s VAL 342 Cb 0.07 -3.68 0.07 0.00 -1.53 0.00 0.00 36.38 31.31 3dfy s VAL 342 CO 0.14 -0.17 0.80 1.17 -3.33 0.00 0.00 175.10 173.71