#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eup s LEU 4 N 0.00 4.19 -0.04 -4.42 0.20 -1.26 -5.03 118.68 112.32 2eup s LEU 4 Ca 0.00 1.70 0.07 0.00 0.69 0.00 0.00 54.13 56.58 2eup s LEU 4 Cb 0.00 -3.54 -0.02 0.00 -0.43 0.00 0.00 46.19 42.20 2eup s LEU 4 CO 0.00 -0.73 -0.24 -0.69 -0.29 0.00 0.00 176.35 174.40 2eup s VAL 5 N 3.32 2.21 -0.34 1.68 1.01 -1.26 -4.80 120.40 122.21 2eup s VAL 5 Ca 0.54 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 61.53 2eup s VAL 5 Cb -0.22 -1.79 0.10 0.00 0.00 0.00 0.00 36.38 34.47 2eup s VAL 5 CO 0.15 0.58 0.06 -1.00 0.00 0.00 0.00 175.10 174.89 2eup s HIS 6 N -0.44 3.54 -0.17 5.22 3.76 -1.26 -5.06 115.29 120.89 2eup s HIS 6 Ca 0.05 -2.87 -0.20 0.00 -0.15 0.00 0.00 55.06 51.89 2eup s HIS 6 Cb -0.12 -2.80 -0.03 0.00 1.11 0.00 0.00 32.58 30.74 2eup s HIS 6 CO 0.01 -0.94 0.56 0.08 -0.85 0.00 0.00 174.74 173.60 2eup s VAL 7 N 0.97 5.09 0.26 -0.90 1.01 -1.26 -0.59 120.40 124.98 2eup s VAL 7 Ca 0.11 1.08 -0.31 0.00 0.00 0.00 0.00 61.98 62.86 2eup s VAL 7 Cb -0.19 -3.89 -0.12 0.00 0.00 0.00 0.00 36.38 32.19 2eup s VAL 7 CO -0.10 0.20 1.63 0.00 0.00 0.00 0.00 175.10 176.83 2eup n ALA 8 N 4.50 2.58 -3.73 5.51 0.00 -0.12 -4.88 120.51 124.37 2eup n ALA 8 Ca -0.04 0.38 -0.28 0.00 0.00 0.00 0.00 53.44 53.50 2eup n ALA 8 Cb 0.51 -2.48 -0.16 0.00 0.00 0.00 0.00 19.45 17.32 2eup n ALA 8 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2eup s SER 9 N 0.70 3.07 0.22 0.00 0.15 -0.20 -4.64 113.70 112.99 2eup s SER 9 Ca 0.68 -0.93 -0.32 0.00 0.70 0.00 0.00 55.95 56.07 2eup s SER 9 Cb -0.51 -0.62 -0.13 0.00 -1.71 0.00 0.00 66.02 63.06 2eup s SER 9 CO 0.44 -0.32 1.57 0.52 1.20 0.00 0.00 173.24 176.64 2eup n VAL 10 N 5.03 0.45 -1.65 4.45 0.31 -1.26 -4.29 118.33 121.38 2eup n VAL 10 Ca -0.08 -0.11 -0.48 0.00 -0.01 0.00 0.00 64.34 63.66 2eup n VAL 10 Cb 0.46 -1.70 -0.05 0.00 -0.91 0.00 0.00 33.84 31.65 2eup n VAL 10 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2eup n GLU 11 N 2.91 1.91 -1.75 5.55 4.71 -1.26 -4.70 120.64 128.00 2eup n GLU 11 Ca 0.14 0.69 -0.42 0.00 -0.01 0.00 0.00 57.16 57.56 2eup n GLU 11 Cb 0.32 -2.43 -0.03 0.00 -1.01 0.00 0.00 31.44 28.29 2eup n GLU 11 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 2eup s LYS 12 N 1.09 4.15 0.00 3.49 2.20 -1.26 -1.58 119.74 127.83 2eup s LYS 12 Ca 0.81 2.55 0.00 0.00 -0.36 0.00 0.00 55.97 58.97 2eup s LYS 12 Cb -0.75 -3.61 0.00 0.00 -1.51 0.00 0.00 37.83 31.96 2eup s LYS 12 CO 0.41 -0.83 0.00 0.41 -0.36 0.00 0.00 175.35 174.99 2eup n GLY 13 N 4.20 0.83 3.89 5.54 0.00 -1.26 -5.04 105.19 113.36 2eup n GLY 13 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 2eup n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2eup s ARG 14 N -0.19 3.60 0.31 1.61 1.81 -0.61 -5.09 118.95 120.38 2eup s ARG 14 Ca 0.00 -0.09 0.04 0.00 -1.72 0.00 0.00 55.73 53.96 2eup s ARG 14 Cb 0.00 -3.01 -0.01 0.00 -0.45 0.00 0.00 34.95 31.48 2eup s ARG 14 CO 0.00 0.59 0.14 -1.13 -0.68 0.00 0.00 175.30 174.22 2eup n SER 15 N 0.74 0.80 -0.25 0.23 3.41 -1.26 -4.88 113.62 112.41 2eup n SER 15 Ca -0.08 -2.73 0.02 0.00 -0.26 0.00 0.00 58.87 55.82 2eup n SER 15 Cb 0.52 0.93 0.09 0.00 -0.26 0.00 0.00 64.21 65.49 2eup n SER 15 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2eup h TYR 16 N 1.60 -0.35 -0.87 7.33 3.20 -2.00 -0.74 116.97 125.15 2eup h TYR 16 Ca -0.24 0.06 0.06 0.00 3.14 0.00 0.00 58.73 61.76 2eup h TYR 16 Cb 0.96 0.27 -0.06 0.00 1.54 0.00 0.00 36.73 39.44 2eup h TYR 16 CO 0.00 -0.31 0.57 0.93 -1.64 0.00 0.00 178.16 177.71 2eup h GLU 17 N 0.01 0.96 -0.55 1.82 3.07 -1.98 -0.02 114.58 117.88 2eup h GLU 17 Ca 0.36 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 59.15 2eup h GLU 17 Cb 0.56 -0.22 -0.03 0.00 -0.84 0.00 0.00 28.75 28.23 2eup h GLU 17 CO -0.74 0.63 0.29 -0.44 -1.40 0.00 0.00 179.01 177.35 2eup h ASP 18 N 0.99 0.70 0.31 1.42 3.32 -1.54 -2.07 116.42 119.54 2eup h ASP 18 Ca 0.37 -0.11 -0.14 0.00 0.02 0.00 0.00 57.03 57.17 2eup h ASP 18 Cb 0.19 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 2eup h ASP 18 CO -0.13 0.61 -0.57 -0.26 -1.72 0.00 0.00 179.24 177.17 2eup h PHE 19 N 0.74 0.34 -0.49 4.55 0.04 -1.08 -2.64 116.94 118.40 2eup h PHE 19 Ca 0.19 -0.12 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 2eup h PHE 19 Cb 0.08 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.14 2eup h PHE 19 CO -0.01 0.77 0.27 0.37 -0.60 0.00 0.00 178.31 179.11 2eup h GLN 20 N 0.21 0.67 -0.40 1.51 5.75 -0.84 0.04 115.11 122.05 2eup h GLN 20 Ca -0.00 -0.06 -0.08 0.00 -0.15 0.00 0.00 58.65 58.36 2eup h GLN 20 Cb 1.06 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 29.45 2eup h GLN 20 CO 0.09 0.49 -0.07 0.87 -2.65 0.00 0.00 178.83 177.56 2eup h LYS 21 N 0.68 0.68 -0.09 1.69 1.57 -1.02 0.07 116.57 120.14 2eup h LYS 21 Ca 0.18 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 2eup h LYS 21 Cb 0.02 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 2eup h LYS 21 CO -0.03 0.74 -0.07 0.28 -0.57 0.00 0.00 179.45 179.80 2eup h VAL 22 N 0.62 1.35 -0.53 0.50 2.07 -1.13 -1.41 116.25 117.73 2eup h VAL 22 Ca 0.12 -1.18 0.11 0.00 0.82 0.00 0.00 66.70 66.56 2eup h VAL 22 Cb 0.50 1.93 -0.10 0.00 -1.52 0.00 0.00 31.29 32.09 2eup h VAL 22 CO 0.03 0.33 -0.17 0.22 0.02 0.00 0.00 177.57 178.00 2eup h TYR 23 N -0.18 -0.40 -0.84 1.57 5.03 -0.87 -1.40 116.97 119.89 2eup h TYR 23 Ca 0.02 0.05 -0.03 0.00 2.58 0.00 0.00 58.73 61.35 2eup h TYR 23 Cb 0.57 0.26 -0.04 0.00 1.55 0.00 0.00 36.73 39.07 2eup h TYR 23 CO 0.08 -0.27 0.39 -0.91 -1.32 0.00 0.00 178.16 176.14 2eup h ASN 24 N -0.04 1.11 -0.61 -2.11 -0.26 -0.73 0.19 115.58 113.13 2eup h ASN 24 Ca 0.25 -0.14 -0.04 0.00 -0.56 0.00 0.00 56.30 55.81 2eup h ASN 24 Cb 0.43 -0.29 -0.03 0.00 -1.06 0.00 0.00 38.32 37.38 2eup h ASN 24 CO -0.57 0.94 0.22 0.00 -1.06 0.00 0.00 177.43 176.96 2eup h ALA 25 N 1.22 0.79 -0.16 -0.83 0.00 -0.59 0.11 119.26 119.81 2eup h ALA 25 Ca 0.29 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2eup h ALA 25 Cb 0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2eup h ALA 25 CO -0.03 0.43 0.10 0.82 0.00 0.00 0.00 179.25 180.57 2eup h ILE 26 N 0.86 1.05 -0.62 0.00 2.04 -0.82 -1.79 117.51 118.23 2eup h ILE 26 Ca 0.20 -0.10 -0.07 0.00 1.00 0.00 0.00 64.86 65.89 2eup h ILE 26 Cb 0.24 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 2eup h ILE 26 CO -0.01 0.05 0.12 0.00 0.00 0.00 0.00 178.15 178.30 2eup h ALA 27 N 1.05 1.04 -0.54 1.87 0.00 -0.67 -0.17 119.26 121.84 2eup h ALA 27 Ca 0.06 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 2eup h ALA 27 Cb -0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2eup h ALA 27 CO -0.01 0.62 -0.12 -0.07 0.00 0.00 0.00 179.25 179.67 2eup h LEU 28 N 0.94 1.03 -0.76 0.00 3.38 -0.65 -1.99 115.31 117.27 2eup h LEU 28 Ca 0.19 -0.35 -0.11 0.00 0.09 0.00 0.00 57.88 57.69 2eup h LEU 28 Cb 0.38 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2eup h LEU 28 CO 0.01 1.15 -0.29 0.50 0.09 0.00 0.00 178.44 179.89 2eup h LYS 29 N 0.90 0.61 -0.61 1.13 3.64 -1.02 -1.45 116.57 119.77 2eup h LYS 29 Ca 0.14 -0.26 0.04 0.00 -1.27 0.00 0.00 60.65 59.30 2eup h LYS 29 Cb 0.69 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.44 2eup h LYS 29 CO 0.05 0.83 0.35 -0.07 -2.27 0.00 0.00 179.45 178.34 2eup h LEU 30 N 0.52 0.54 -0.48 5.20 3.38 -0.88 -0.33 115.31 123.26 2eup h LEU 30 Ca 0.07 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 2eup h LEU 30 Cb 0.77 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 2eup h LEU 30 CO 0.06 0.36 0.15 -0.09 0.09 0.00 0.00 178.44 179.01 2eup h ARG 31 N 0.67 0.75 -0.43 1.13 2.43 -1.09 -3.25 114.38 114.59 2eup h ARG 31 Ca 0.26 -0.16 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 2eup h ARG 31 Cb 0.10 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 2eup h ARG 31 CO -0.14 0.71 -0.05 1.49 -1.51 0.00 0.00 179.97 180.47 2eup h GLU 32 N 0.64 0.79 -2.44 0.20 4.81 -0.95 -3.34 114.58 114.29 2eup h GLU 32 Ca 0.15 -0.28 -0.72 0.00 -0.13 0.00 0.00 59.36 58.39 2eup h GLU 32 Cb 0.28 -0.06 -0.16 0.00 0.63 0.00 0.00 28.75 29.44 2eup h GLU 32 CO -0.00 0.88 1.84 -0.25 -0.73 0.00 0.00 179.01 180.75 2eup n ASP 33 N -4.36 7.69 -0.17 1.04 8.00 -0.16 -4.69 116.55 123.90 2eup n ASP 33 Ca -0.00 -3.27 0.14 0.00 0.71 0.00 0.00 54.79 52.37 2eup n ASP 33 Cb 0.33 -1.30 0.57 0.00 -0.02 0.00 0.00 41.12 40.70 2eup n ASP 33 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2eup n ASP 34 N 1.22 0.66 0.07 -2.24 5.75 -1.26 -3.60 116.55 117.15 2eup n ASP 34 Ca 0.58 -0.75 0.12 0.00 -0.01 0.00 0.00 54.79 54.73 2eup n ASP 34 Cb 0.29 -0.02 0.11 0.00 -1.03 0.00 0.00 41.12 40.48 2eup n ASP 34 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2eup h GLU 35 N 0.84 0.00 -6.54 0.11 5.08 -1.89 -3.35 114.58 108.84 2eup h GLU 35 Ca 0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 2eup h GLU 35 Cb 0.39 0.00 0.08 0.00 0.50 0.00 0.00 28.75 29.71 2eup h GLU 35 CO 0.00 0.00 0.61 0.98 -1.00 0.00 0.00 179.01 179.60 2eup n TYR 36 N -2.27 2.09 -3.28 4.33 9.36 -1.24 -1.61 117.16 124.55 2eup n TYR 36 Ca 0.02 0.43 -0.15 0.00 3.32 0.00 0.00 57.90 61.52 2eup n TYR 36 Cb 0.47 -2.46 0.07 0.00 -0.63 0.00 0.00 39.34 36.80 2eup n TYR 36 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 2eup n ASP 37 N 2.39 -5.90 -3.97 2.98 2.03 -1.26 -1.26 116.55 111.55 2eup n ASP 37 Ca 0.13 -0.70 -0.28 0.00 0.52 0.00 0.00 54.79 54.46 2eup n ASP 37 Cb 0.30 -5.20 -0.02 0.00 -0.72 0.00 0.00 41.12 35.48 2eup n ASP 37 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2eup n ASN 38 N -3.21 -1.00 -0.22 1.67 3.02 -1.19 -2.52 115.26 111.81 2eup n ASN 38 Ca -0.11 -1.06 -0.03 0.00 -0.03 0.00 0.00 54.58 53.35 2eup n ASN 38 Cb 0.63 -2.82 -0.01 0.00 -0.61 0.00 0.00 39.78 36.97 2eup n ASN 38 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2eup n TYR 39 N -4.44 0.00 0.03 3.10 4.02 -0.63 -4.90 117.16 114.34 2eup n TYR 39 Ca -0.27 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.51 2eup n TYR 39 Cb 0.67 -0.96 0.04 0.00 -0.02 0.00 0.00 39.34 39.07 2eup n TYR 39 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 2eup h ILE 40 N 0.00 1.35 0.00 -0.72 2.04 -1.06 -3.46 117.51 115.65 2eup h ILE 40 Ca -0.06 -1.98 0.00 0.00 1.00 0.00 0.00 64.86 63.82 2eup h ILE 40 Cb 0.35 1.96 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 2eup h ILE 40 CO 0.09 0.60 0.00 0.61 0.00 0.00 0.00 178.15 179.45 2eup n GLY 41 N 0.43 -1.09 0.18 5.37 0.00 -0.39 -4.65 105.19 105.04 2eup n GLY 41 Ca -0.04 -1.63 0.15 0.00 0.00 0.00 0.00 46.02 44.50 2eup n GLY 41 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2eup n TYR 42 N -1.20 0.00 0.19 1.61 4.02 -1.26 -4.42 117.16 116.09 2eup n TYR 42 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.74 2eup n TYR 42 Cb 0.00 -0.04 -0.07 0.00 -0.02 0.00 0.00 39.34 39.21 2eup n TYR 42 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2eup h GLY 43 N 4.94 -0.82 0.63 2.72 0.00 -1.93 -2.23 103.07 106.37 2eup h GLY 43 Ca 0.00 0.44 0.06 0.00 0.00 0.00 0.00 47.33 47.82 2eup h GLY 43 CO 0.00 -0.29 0.21 -2.55 0.00 0.00 0.00 176.54 173.91 2eup h PRO 44 N -0.70 0.40 0.00 4.80 0.11 -1.89 -2.09 132.00 132.63 2eup h PRO 44 Ca -0.01 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.02 2eup h PRO 44 Cb 0.67 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.68 2eup h PRO 44 CO -0.13 0.26 -0.29 -0.24 -0.21 0.00 0.00 178.00 177.39 2eup h VAL 45 N 0.41 1.10 -0.18 3.15 3.04 -1.81 -0.91 116.25 121.05 2eup h VAL 45 Ca 0.23 -1.05 -0.14 0.00 -1.01 0.00 0.00 66.70 64.73 2eup h VAL 45 Cb 0.19 1.58 -0.01 0.00 -2.01 0.00 0.00 31.29 31.05 2eup h VAL 45 CO -0.20 0.29 -0.47 -0.07 -1.01 0.00 0.00 177.57 176.11 2eup h LEU 46 N 0.00 0.49 -0.34 3.16 3.38 -0.99 -0.33 115.31 120.68 2eup h LEU 46 Ca -0.00 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 2eup h LEU 46 Cb 0.56 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2eup h LEU 46 CO 0.04 0.89 0.02 0.58 0.09 0.00 0.00 178.44 180.06 2eup h VAL 47 N 0.37 1.25 -0.69 1.22 2.07 -0.70 -2.17 116.25 117.59 2eup h VAL 47 Ca 0.02 -0.93 -0.04 0.00 0.82 0.00 0.00 66.70 66.57 2eup h VAL 47 Cb 0.97 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 2eup h VAL 47 CO 0.08 0.31 0.26 -0.09 0.02 0.00 0.00 177.57 178.15 2eup h ARG 48 N 0.41 1.03 -0.25 1.57 2.43 -0.99 -1.98 114.38 116.61 2eup h ARG 48 Ca 0.10 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 2eup h ARG 48 Cb 0.42 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 2eup h ARG 48 CO 0.01 0.85 0.13 1.25 -1.51 0.00 0.00 179.97 180.71 2eup h LEU 49 N 1.01 0.31 -1.15 3.80 5.85 -0.95 0.12 115.31 124.30 2eup h LEU 49 Ca 0.23 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 2eup h LEU 49 Cb 0.22 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 2eup h LEU 49 CO -0.02 0.31 0.35 0.00 -0.34 0.00 0.00 178.44 178.74 2eup h ALA 50 N 1.01 1.34 -0.18 1.25 0.00 -1.15 -0.83 119.26 120.70 2eup h ALA 50 Ca 0.09 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2eup h ALA 50 Cb 0.07 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2eup h ALA 50 CO -0.01 0.53 -0.22 2.35 0.00 0.00 0.00 179.25 181.89 2eup h TRP 51 N 0.94 0.57 0.00 0.00 2.91 -0.99 -3.07 115.95 116.32 2eup h TRP 51 Ca 0.24 -0.18 -0.08 0.00 1.13 0.00 0.00 58.89 59.99 2eup h TRP 51 Cb 0.06 -0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 28.58 2eup h TRP 51 CO 0.01 0.85 -0.39 0.45 -1.03 0.00 0.00 178.44 178.33 2eup h HIS 52 N 0.13 0.00 0.00 2.65 3.86 -0.28 0.19 115.15 121.70 2eup h HIS 52 Ca 0.03 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.17 2eup h HIS 52 Cb 0.77 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.23 2eup h HIS 52 CO 0.08 0.39 -0.29 -0.84 0.86 0.00 0.00 177.93 178.14 2eup h ILE 53 N 0.00 0.60 0.03 2.45 -0.00 -1.23 -3.23 117.51 116.13 2eup h ILE 53 Ca -0.00 -1.44 -0.30 0.00 -0.00 0.00 0.00 64.86 63.12 2eup h ILE 53 Cb 0.74 1.98 -0.04 0.00 -0.00 0.00 0.00 36.82 39.50 2eup h ILE 53 CO 0.05 0.28 -1.72 0.28 -0.00 0.00 0.00 178.15 177.05 2eup h SER 54 N 0.00 0.10 0.36 2.16 0.02 -1.31 -3.06 113.55 111.82 2eup h SER 54 Ca -0.00 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 2eup h SER 54 Cb 0.96 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.47 2eup h SER 54 CO 0.04 1.19 0.00 0.61 -1.14 0.00 0.00 176.83 177.52 2eup n GLY 55 N 1.63 -1.13 0.00 -3.77 0.00 0.62 -2.49 105.19 100.05 2eup n GLY 55 Ca -0.19 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 45.80 2eup n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2eup n THR 56 N -1.19 0.28 -1.77 2.61 -2.24 -1.25 -4.63 114.28 106.09 2eup n THR 56 Ca 0.17 0.07 -0.41 0.00 -2.27 0.00 0.00 64.05 61.61 2eup n THR 56 Cb 0.19 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.75 2eup n THR 56 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 2eup n TRP 57 N -1.38 2.90 -4.01 4.78 -0.00 -1.04 -4.13 117.44 114.57 2eup n TRP 57 Ca 0.09 0.45 -0.31 0.00 -0.00 0.00 0.00 57.50 57.73 2eup n TRP 57 Cb 0.23 -2.51 -0.16 0.00 -0.00 0.00 0.00 31.31 28.87 2eup n TRP 57 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 2eup s ASP 58 N -0.20 3.68 0.62 5.87 -1.08 -0.51 -4.62 116.67 120.43 2eup s ASP 58 Ca 0.55 -1.03 0.39 0.00 -0.52 0.00 0.00 52.55 51.93 2eup s ASP 58 Cb -0.48 -1.30 2.09 0.00 -1.46 0.00 0.00 42.92 41.77 2eup s ASP 58 CO 0.63 -0.16 2.27 0.07 0.52 0.00 0.00 175.17 178.50 2eup h LYS 59 N 7.93 0.00 0.00 4.34 2.10 -1.80 0.56 116.57 129.70 2eup h LYS 59 Ca -0.25 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.22 2eup h LYS 59 Cb 1.08 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.39 2eup h LYS 59 CO 0.47 0.01 -0.81 0.45 -2.00 0.00 0.00 179.45 177.57 2eup h HIS 60 N 0.00 0.07 0.00 0.07 3.86 -1.95 -3.36 115.15 113.84 2eup h HIS 60 Ca -0.00 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 2eup h HIS 60 Cb 0.10 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.56 2eup h HIS 60 CO 0.00 0.84 0.00 -0.40 0.86 0.00 0.00 177.93 179.23 2eup n ASP 61 N -3.61 0.62 -2.00 2.45 5.68 -1.10 -5.02 116.55 113.57 2eup n ASP 61 Ca -0.01 -1.28 -0.20 0.00 -0.50 0.00 0.00 54.79 52.80 2eup n ASP 61 Cb 0.78 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.71 2eup n ASP 61 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 2eup n ASN 62 N -0.14 -5.47 -4.89 -1.12 5.15 0.17 -4.47 115.26 104.49 2eup n ASN 62 Ca 0.00 0.24 -0.29 0.00 -0.60 0.00 0.00 54.58 53.93 2eup n ASN 62 Cb 0.36 -4.70 -0.01 0.00 -0.53 0.00 0.00 39.78 34.91 2eup n ASN 62 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2eup s THR 63 N -2.84 4.83 0.00 -0.44 -4.23 -1.24 -4.89 115.64 106.83 2eup s THR 63 Ca 0.00 0.47 0.00 0.00 -1.18 0.00 0.00 61.69 60.98 2eup s THR 63 Cb 0.00 -3.83 0.00 0.00 1.34 0.00 0.00 72.50 70.01 2eup s THR 63 CO 0.00 -0.84 0.00 0.61 -0.54 0.00 0.00 174.62 173.85 2eup n GLY 64 N -2.14 -0.00 0.00 3.99 0.00 -1.26 -1.42 105.19 104.35 2eup n GLY 64 Ca 0.02 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.07 2eup n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eup n GLY 65 N 0.00 -1.40 0.25 -0.02 0.00 -1.26 -4.61 105.19 98.15 2eup n GLY 65 Ca 0.00 -1.55 0.14 0.00 0.00 0.00 0.00 46.02 44.60 2eup n GLY 65 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2eup h SER 66 N 0.00 0.00 -0.39 1.61 4.64 -1.75 -3.37 113.55 114.29 2eup h SER 66 Ca 0.00 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.38 2eup h SER 66 Cb 0.00 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.03 2eup h SER 66 CO 0.00 0.10 0.06 0.22 -0.87 0.00 0.00 176.83 176.34 2eup h TYR 67 N 0.00 0.09 -0.00 4.77 3.20 -1.86 -3.01 116.97 120.16 2eup h TYR 67 Ca -0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2eup h TYR 67 Cb 0.65 0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.94 2eup h TYR 67 CO 0.00 -0.01 -0.11 0.41 -1.64 0.00 0.00 178.16 176.81 2eup n GLY 68 N -1.25 -1.17 2.34 1.82 0.00 -1.26 -2.60 105.19 103.06 2eup n GLY 68 Ca 0.02 -0.21 -0.18 0.00 0.00 0.00 0.00 46.02 45.65 2eup n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eup n GLY 69 N 1.36 -0.33 0.00 -0.02 0.00 -1.14 -1.74 105.19 103.32 2eup n GLY 69 Ca 0.12 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.11 2eup n GLY 69 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2eup n THR 70 N -4.00 0.29 0.24 2.61 -2.24 -1.26 -2.64 114.28 107.28 2eup n THR 70 Ca -0.21 0.07 0.18 0.00 -2.27 0.00 0.00 64.05 61.82 2eup n THR 70 Cb 0.66 -0.66 0.88 0.00 -2.10 0.00 0.00 70.33 69.10 2eup n THR 70 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2eup h TYR 71 N 0.00 0.00 0.00 4.78 3.20 -1.94 -0.97 116.97 122.04 2eup h TYR 71 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2eup h TYR 71 Cb 0.34 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.61 2eup h TYR 71 CO 0.00 0.00 0.00 2.89 -1.64 0.00 0.00 178.16 179.41 2eup n ARG 72 N -3.53 0.11 -3.63 1.82 1.85 -1.08 -3.50 116.66 108.70 2eup n ARG 72 Ca 0.01 0.41 -0.34 0.00 -1.00 0.00 0.00 57.85 56.92 2eup n ARG 72 Cb 0.33 -1.74 -0.05 0.00 -1.05 0.00 0.00 32.46 29.94 2eup n ARG 72 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2eup s PHE 73 N -3.23 3.58 0.33 2.89 0.08 -0.37 -4.95 117.98 116.32 2eup s PHE 73 Ca 0.04 0.71 0.05 0.00 0.12 0.00 0.00 56.93 57.85 2eup s PHE 73 Cb 0.08 -2.10 0.69 0.00 -0.57 0.00 0.00 43.02 41.12 2eup s PHE 73 CO 0.29 0.54 1.90 1.57 -0.10 0.00 0.00 175.22 179.42 2eup h LYS 74 N 3.76 0.81 -0.63 0.44 2.10 -1.86 -1.15 116.57 120.04 2eup h LYS 74 Ca -0.49 -0.05 0.06 0.00 -2.00 0.00 0.00 60.65 58.17 2eup h LYS 74 Cb 1.19 -0.18 -0.05 0.00 -0.90 0.00 0.00 32.23 32.29 2eup h LYS 74 CO 0.67 0.54 0.34 -0.22 -2.00 0.00 0.00 179.45 178.78 2eup h LYS 75 N 0.84 0.62 0.17 0.07 3.64 -1.94 -0.70 116.57 119.27 2eup h LYS 75 Ca 0.41 -0.04 -0.26 0.00 -1.27 0.00 0.00 60.65 59.49 2eup h LYS 75 Cb 0.44 -0.14 0.02 0.00 -0.41 0.00 0.00 32.23 32.14 2eup h LYS 75 CO -0.17 0.41 -1.22 1.49 -2.27 0.00 0.00 179.45 177.68 2eup h GLU 76 N 0.64 0.36 -0.88 1.90 4.81 -1.66 -2.97 114.58 116.78 2eup h GLU 76 Ca 0.28 -0.61 0.16 0.00 -0.13 0.00 0.00 59.36 59.06 2eup h GLU 76 Cb 0.18 0.23 -0.07 0.00 0.63 0.00 0.00 28.75 29.72 2eup h GLU 76 CO -0.18 1.29 0.57 0.35 -0.73 0.00 0.00 179.01 180.31 2eup h PHE 77 N -0.18 0.73 -0.28 0.92 3.57 -1.11 -2.11 116.94 118.47 2eup h PHE 77 Ca -0.23 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.29 2eup h PHE 77 Cb 1.85 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 40.36 2eup h PHE 77 CO 0.15 0.25 0.00 0.09 -2.23 0.00 0.00 178.31 176.57 2eup n ASN 78 N -4.55 2.72 -4.65 0.41 5.03 -0.28 -4.80 115.26 109.13 2eup n ASN 78 Ca 0.18 -1.89 -0.51 0.00 0.87 0.00 0.00 54.58 53.23 2eup n ASN 78 Cb 0.53 -0.18 -0.06 0.00 -1.02 0.00 0.00 39.78 39.05 2eup n ASN 78 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 2eup n ASP 79 N 1.02 2.49 -0.13 6.41 -0.08 -0.80 -4.85 116.55 120.61 2eup n ASP 79 Ca 0.18 1.07 0.21 0.00 -1.51 0.00 0.00 54.79 54.74 2eup n ASP 79 Cb 0.50 -1.27 0.62 0.00 2.34 0.00 0.00 41.12 43.30 2eup n ASP 79 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2eup h PRO 80 N 6.34 0.18 0.00 -0.67 0.11 -1.91 0.01 132.00 136.06 2eup h PRO 80 Ca -0.47 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 2eup h PRO 80 Cb 1.30 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 2eup h PRO 80 CO 0.88 0.12 -0.02 0.77 -0.21 0.00 0.00 178.00 179.53 2eup h SER 81 N 0.18 0.00 -0.63 -2.05 0.02 -1.94 -2.68 113.55 106.46 2eup h SER 81 Ca 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 2eup h SER 81 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2eup h SER 81 CO -0.07 0.02 0.00 0.59 -1.14 0.00 0.00 176.83 176.24 2eup n ASN 82 N -3.44 3.58 -4.68 3.07 3.02 -0.01 -4.98 115.26 111.81 2eup n ASN 82 Ca -0.02 -1.99 -0.45 0.00 -0.03 0.00 0.00 54.58 52.09 2eup n ASN 82 Cb 0.13 -0.42 -0.04 0.00 -0.61 0.00 0.00 39.78 38.84 2eup n ASN 82 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2eup n ALA 83 N 1.47 1.74 0.00 5.41 0.00 -1.01 -1.10 120.51 127.02 2eup n ALA 83 Ca 0.22 0.36 0.00 0.00 0.00 0.00 0.00 53.44 54.02 2eup n ALA 83 Cb 0.58 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.53 2eup n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2eup n GLY 84 N 3.98 2.97 0.21 0.00 0.00 -1.26 -4.83 105.19 106.26 2eup n GLY 84 Ca 0.18 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.35 2eup n GLY 84 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2eup h LEU 85 N 0.00 0.00 -1.93 0.99 3.38 -1.50 -2.54 115.31 113.70 2eup h LEU 85 Ca 0.00 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.17 2eup h LEU 85 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2eup h LEU 85 CO 0.00 0.00 0.51 1.56 0.09 0.00 0.00 178.44 180.60 2eup h GLN 86 N 0.00 0.06 -0.67 1.13 7.50 -1.91 0.21 115.11 121.43 2eup h GLN 86 Ca 0.00 -0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.14 2eup h GLN 86 Cb 0.45 -0.01 -0.03 0.00 0.05 0.00 0.00 27.48 27.93 2eup h GLN 86 CO 0.00 0.04 0.39 -0.91 -1.50 0.00 0.00 178.83 176.85 2eup h ASN 87 N 0.06 0.81 -0.48 1.46 2.35 -1.85 -0.61 115.58 117.32 2eup h ASN 87 Ca 0.34 -0.08 -0.09 0.00 -0.55 0.00 0.00 56.30 55.93 2eup h ASN 87 Cb 1.28 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.43 2eup h ASN 87 CO -0.02 0.65 -0.06 1.23 -1.65 0.00 0.00 177.43 177.58 2eup h GLY 88 N 0.91 0.96 0.98 2.83 0.00 -1.18 -1.93 103.07 105.63 2eup h GLY 88 Ca 0.24 -0.75 0.01 0.00 0.00 0.00 0.00 47.33 46.82 2eup h GLY 88 CO -0.04 0.69 0.19 -2.75 0.00 0.00 0.00 176.54 174.62 2eup h PHE 89 N 0.74 0.35 -0.70 5.60 3.57 -1.15 -1.89 116.94 123.46 2eup h PHE 89 Ca 0.13 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 2eup h PHE 89 Cb 0.59 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.18 2eup h PHE 89 CO 0.04 0.22 0.30 0.87 -2.23 0.00 0.00 178.31 177.51 2eup h LYS 90 N 0.38 1.02 -0.60 1.11 1.57 -1.02 -1.68 116.57 117.35 2eup h LYS 90 Ca 0.11 -0.16 0.05 0.00 -1.87 0.00 0.00 60.65 58.78 2eup h LYS 90 Cb -0.03 -0.18 -0.05 0.00 0.08 0.00 0.00 32.23 32.05 2eup h LYS 90 CO -0.03 0.81 0.33 0.35 -0.57 0.00 0.00 179.45 180.34 2eup h PHE 91 N 1.00 0.60 0.00 -1.35 3.04 -1.03 -2.84 116.94 116.37 2eup h PHE 91 Ca 0.24 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.21 2eup h PHE 91 Cb 0.16 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 38.49 2eup h PHE 91 CO 0.01 0.30 0.00 -0.07 -2.02 0.00 0.00 178.31 176.54 2eup h LEU 92 N 0.62 0.00 -0.07 0.59 3.38 -0.76 -3.36 115.31 115.72 2eup h LEU 92 Ca 0.26 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.27 2eup h LEU 92 Cb 0.14 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 2eup h LEU 92 CO -0.16 0.00 -0.20 -0.33 0.09 0.00 0.00 178.44 177.84 2eup h GLU 93 N 0.00 -0.27 0.00 1.13 5.08 -1.06 -0.63 114.58 118.82 2eup h GLU 93 Ca 0.00 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2eup h GLU 93 Cb 0.67 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 2eup h GLU 93 CO 0.00 -0.18 -0.12 -1.00 -1.00 0.00 0.00 179.01 176.71 2eup h PRO 94 N -0.29 0.00 -0.24 2.33 0.13 -1.75 -1.44 132.00 130.74 2eup h PRO 94 Ca 0.08 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.15 2eup h PRO 94 Cb 0.40 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.52 2eup h PRO 94 CO -0.24 0.12 -0.11 0.82 -0.23 0.00 0.00 178.00 178.36 2eup h ILE 95 N 0.00 1.30 -0.45 -3.56 1.08 -1.49 -2.01 117.51 112.38 2eup h ILE 95 Ca -0.00 -1.17 -0.04 0.00 -0.39 0.00 0.00 64.86 63.25 2eup h ILE 95 Cb 0.25 1.57 -0.02 0.00 -3.07 0.00 0.00 36.82 35.55 2eup h ILE 95 CO 0.02 0.36 0.10 -0.74 -0.69 0.00 0.00 178.15 177.20 2eup h HIS 96 N 0.21 0.70 -0.55 1.37 2.76 -0.66 -1.48 115.15 117.50 2eup h HIS 96 Ca 0.05 -0.06 -0.05 0.00 -2.20 0.00 0.00 60.37 58.11 2eup h HIS 96 Cb 0.60 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.33 2eup h HIS 96 CO 0.06 0.61 0.13 -0.22 -1.30 0.00 0.00 177.93 177.21 2eup h LYS 97 N 0.67 0.85 -0.05 5.26 3.64 -1.12 -1.88 116.57 123.95 2eup h LYS 97 Ca 0.15 -0.18 -0.15 0.00 -1.27 0.00 0.00 60.65 59.20 2eup h LYS 97 Cb 0.27 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 2eup h LYS 97 CO -0.00 0.77 -0.64 1.49 -2.27 0.00 0.00 179.45 178.80 2eup h GLU 98 N 0.82 0.19 -2.12 1.90 4.81 -0.78 -3.36 114.58 116.04 2eup h GLU 98 Ca 0.18 -0.14 -0.58 0.00 -0.13 0.00 0.00 59.36 58.69 2eup h GLU 98 Cb 0.30 0.02 -0.41 0.00 0.63 0.00 0.00 28.75 29.30 2eup h GLU 98 CO -0.00 0.76 -0.81 1.19 -0.73 0.00 0.00 179.01 179.42 2eup n PHE 99 N -3.83 2.07 0.31 0.92 3.72 -0.61 -4.95 117.46 115.08 2eup n PHE 99 Ca -0.02 -3.92 0.12 0.00 -0.05 0.00 0.00 57.45 53.59 2eup n PHE 99 Cb 0.64 -0.47 0.56 0.00 -0.94 0.00 0.00 39.48 39.27 2eup n PHE 99 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 2eup h PRO 100 N 3.97 0.00 0.00 -1.08 0.11 -1.51 -2.75 132.00 130.74 2eup h PRO 100 Ca 0.14 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.24 2eup h PRO 100 Cb 0.74 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.85 2eup h PRO 100 CO 0.68 0.00 -0.08 0.11 -0.21 0.00 0.00 178.00 178.50 2eup h TRP 101 N 0.00 0.00 -3.84 0.65 5.08 -1.93 -3.45 115.95 112.47 2eup h TRP 101 Ca 0.00 0.00 -0.50 0.00 1.08 0.00 0.00 58.89 59.47 2eup h TRP 101 Cb 0.25 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.42 2eup h TRP 101 CO 0.00 0.08 0.44 -1.50 -1.28 0.00 0.00 178.44 176.18 2eup s ILE 102 N -3.62 3.66 0.69 0.12 2.07 -1.04 -4.93 121.20 118.14 2eup s ILE 102 Ca 0.01 1.56 -0.13 0.00 -1.41 0.00 0.00 60.65 60.68 2eup s ILE 102 Cb 0.09 -3.95 0.01 0.00 0.13 0.00 0.00 42.46 38.74 2eup s ILE 102 CO 0.59 0.29 1.08 -0.94 -1.91 0.00 0.00 174.94 174.05 2eup s SER 103 N -1.11 5.10 0.13 4.50 1.04 -1.26 -4.87 113.70 117.22 2eup s SER 103 Ca 0.47 1.84 -0.18 0.00 0.48 0.00 0.00 55.95 58.56 2eup s SER 103 Cb -0.28 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.27 2eup s SER 103 CO 0.36 -1.63 1.76 0.28 0.98 0.00 0.00 173.24 174.98 2eup h SER 104 N -0.39 0.35 -0.77 7.02 0.02 -1.91 -0.86 113.55 117.01 2eup h SER 104 Ca -0.45 -0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 60.45 2eup h SER 104 Cb 1.23 -0.09 -0.04 0.00 0.14 0.00 0.00 62.40 63.64 2eup h SER 104 CO 0.54 0.30 0.48 1.23 -1.14 0.00 0.00 176.83 178.24 2eup h GLY 105 N 0.38 1.11 1.02 -3.77 0.00 -1.80 0.04 103.07 100.04 2eup h GLY 105 Ca 0.11 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 2eup h GLY 105 CO -0.02 0.44 0.33 -0.55 0.00 0.00 0.00 176.54 176.73 2eup h ASP 106 N 1.05 0.95 -0.21 0.19 3.32 -1.80 -1.72 116.42 118.20 2eup h ASP 106 Ca 0.28 -0.14 -0.04 0.00 0.02 0.00 0.00 57.03 57.15 2eup h ASP 106 Cb -0.06 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 2eup h ASP 106 CO -0.05 0.83 -0.01 0.25 -1.72 0.00 0.00 179.24 178.53 2eup h LEU 107 N 1.00 0.37 -0.40 1.55 5.85 -0.57 -0.23 115.31 122.88 2eup h LEU 107 Ca 0.24 -0.32 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 2eup h LEU 107 Cb 0.14 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2eup h LEU 107 CO -0.03 0.60 0.07 -0.26 -0.34 0.00 0.00 178.44 178.48 2eup h PHE 108 N 0.13 0.70 -0.41 1.25 0.04 -0.96 -0.49 116.94 117.20 2eup h PHE 108 Ca 0.06 -0.09 -0.07 0.00 2.80 0.00 0.00 57.97 60.66 2eup h PHE 108 Cb 0.41 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.35 2eup h PHE 108 CO 0.04 0.69 -0.01 0.66 -0.60 0.00 0.00 178.31 179.08 2eup h SER 109 N 0.51 0.73 -0.44 2.17 4.64 -1.30 -2.97 113.55 116.89 2eup h SER 109 Ca 0.12 -0.31 -0.01 0.00 -0.47 0.00 0.00 61.79 61.12 2eup h SER 109 Cb 0.36 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.23 2eup h SER 109 CO 0.01 0.87 0.25 0.25 -0.87 0.00 0.00 176.83 177.33 2eup h LEU 110 N 0.57 0.56 -0.84 5.97 5.85 -0.86 -1.99 115.31 124.57 2eup h LEU 110 Ca 0.12 -0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.86 2eup h LEU 110 Cb 0.50 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 2eup h LEU 110 CO 0.02 0.46 0.51 1.23 -0.34 0.00 0.00 178.44 180.32 2eup h GLY 111 N 0.71 1.26 0.95 3.75 0.00 -0.92 0.53 103.07 109.35 2eup h GLY 111 Ca 0.16 -0.37 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 2eup h GLY 111 CO -0.03 0.25 0.05 -1.33 0.00 0.00 0.00 176.54 175.48 2eup h GLY 112 N 0.93 0.75 0.99 4.60 0.00 -1.32 -0.88 103.07 108.14 2eup h GLY 112 Ca 0.37 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 47.18 2eup h GLY 112 CO -0.18 0.47 0.25 -2.08 0.00 0.00 0.00 176.54 175.00 2eup h VAL 113 N 0.55 1.13 -0.37 4.60 2.07 -1.12 -1.60 116.25 121.50 2eup h VAL 113 Ca 0.12 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 2eup h VAL 113 Cb 0.40 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 2eup h VAL 113 CO 0.01 0.13 0.23 0.74 0.02 0.00 0.00 177.57 178.69 2eup h THR 114 N 0.53 1.12 -0.29 2.57 2.02 -0.80 -2.13 112.91 115.93 2eup h THR 114 Ca 0.14 -0.27 0.03 0.00 0.77 0.00 0.00 66.41 67.08 2eup h THR 114 Cb -0.01 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 2eup h THR 114 CO -0.03 0.12 0.12 0.00 0.37 0.00 0.00 175.52 176.11 2eup h ALA 115 N 1.10 0.34 -0.40 6.16 0.00 -0.93 -0.23 119.26 125.31 2eup h ALA 115 Ca 0.13 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2eup h ALA 115 Cb -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2eup h ALA 115 CO -0.03 -0.27 0.24 0.28 0.00 0.00 0.00 179.25 179.48 2eup h VAL 116 N 0.27 1.06 -0.47 0.00 2.07 -1.08 -1.29 116.25 116.80 2eup h VAL 116 Ca 0.13 -0.17 -0.12 0.00 0.82 0.00 0.00 66.70 67.36 2eup h VAL 116 Cb 0.07 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 2eup h VAL 116 CO -0.11 0.09 -0.16 1.56 0.02 0.00 0.00 177.57 178.97 2eup h GLN 117 N 0.50 0.95 0.00 1.57 4.20 -1.16 -0.36 115.11 120.81 2eup h GLN 117 Ca 0.16 -0.38 -0.03 0.00 0.06 0.00 0.00 58.65 58.45 2eup h GLN 117 Cb -0.01 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 27.72 2eup h GLN 117 CO -0.06 1.05 -0.13 0.93 -0.67 0.00 0.00 178.83 179.95 2eup h GLU 118 N 0.80 0.00 -0.78 1.46 4.39 -0.84 -1.82 114.58 117.78 2eup h GLU 118 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 2eup h GLU 118 Cb 0.73 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 2eup h GLU 118 CO 0.06 0.13 0.00 -1.33 -1.16 0.00 0.00 179.01 176.70 2eup n MET 119 N -3.26 2.45 -1.60 2.33 2.81 -0.51 -4.88 117.12 114.46 2eup n MET 119 Ca 0.00 -1.22 -0.09 0.00 -1.81 0.00 0.00 57.70 54.58 2eup n MET 119 Cb 0.39 -1.74 -0.02 0.00 -0.71 0.00 0.00 33.22 31.13 2eup n MET 119 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2eup n GLN 120 N 0.26 -0.65 -0.90 0.03 1.13 -0.69 -0.62 117.38 115.95 2eup n GLN 120 Ca 0.11 0.66 -0.12 0.00 -1.94 0.00 0.00 57.00 55.71 2eup n GLN 120 Cb 0.59 -4.58 0.09 0.00 0.11 0.00 0.00 30.24 26.44 2eup n GLN 120 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2eup n GLY 121 N -1.56 -1.08 3.75 1.08 0.00 -0.16 -4.72 105.19 102.49 2eup n GLY 121 Ca -0.09 -1.72 -0.32 0.00 0.00 0.00 0.00 46.02 43.88 2eup n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eup s PRO 122 N -4.19 2.32 0.28 1.61 0.04 -1.26 -4.66 135.00 129.14 2eup s PRO 122 Ca 0.32 1.42 -0.30 0.00 0.04 0.00 0.00 61.00 62.49 2eup s PRO 122 Cb -0.01 -1.89 -0.11 0.00 0.04 0.00 0.00 34.50 32.53 2eup s PRO 122 CO 0.23 -1.63 1.54 0.15 0.04 0.00 0.00 177.00 177.32 2eup s LYS 123 N -4.34 4.17 -0.29 4.56 -0.14 -1.26 -4.39 119.74 118.04 2eup s LYS 123 Ca 0.67 2.49 -0.00 0.00 -1.36 0.00 0.00 55.97 57.76 2eup s LYS 123 Cb -0.21 -3.05 0.05 0.00 -1.68 0.00 0.00 37.83 32.94 2eup s LYS 123 CO 0.48 -0.56 -0.02 0.42 -0.76 0.00 0.00 175.35 174.91 2eup s ILE 124 N -0.06 2.78 0.47 2.17 -1.09 -1.26 -4.81 121.20 119.39 2eup s ILE 124 Ca 0.61 -1.47 -0.24 0.00 -2.23 0.00 0.00 60.65 57.32 2eup s ILE 124 Cb -0.46 -2.62 -0.08 0.00 -1.58 0.00 0.00 42.46 37.73 2eup s ILE 124 CO 0.47 -0.10 1.33 -2.65 -1.23 0.00 0.00 174.94 172.76 2eup n PRO 125 N 4.57 1.93 -3.81 2.79 -0.02 -1.26 -4.78 135.00 134.43 2eup n PRO 125 Ca -0.13 0.69 -0.14 0.00 -2.02 0.00 0.00 63.50 61.91 2eup n PRO 125 Cb 0.43 -2.51 -0.15 0.00 -0.02 0.00 0.00 33.50 31.25 2eup n PRO 125 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 2eup s TRP 126 N -1.23 -0.02 -0.08 6.00 -0.00 -0.21 -4.77 118.94 118.63 2eup s TRP 126 Ca 0.64 0.15 0.00 0.00 -0.00 0.00 0.00 56.10 56.89 2eup s TRP 126 Cb -0.46 -0.12 -0.03 0.00 -0.00 0.00 0.00 33.47 32.86 2eup s TRP 126 CO 0.55 -0.07 -0.07 1.03 -0.00 0.00 0.00 176.95 178.39 2eup s ARG 127 N 0.65 2.87 0.73 5.86 0.52 -1.26 -0.36 118.95 127.96 2eup s ARG 127 Ca -0.05 -0.55 -0.07 0.00 -0.52 0.00 0.00 55.73 54.54 2eup s ARG 127 Cb -0.08 -2.62 0.09 0.00 0.52 0.00 0.00 34.95 32.86 2eup s ARG 127 CO -0.02 0.60 1.04 0.00 0.02 0.00 0.00 175.30 176.94 2eup n GLY 129 N -3.00 1.20 3.77 0.00 0.00 -1.26 -4.73 105.19 101.16 2eup n GLY 129 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 2eup n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2eup s ARG 130 N -0.24 3.79 -0.09 1.61 0.52 -1.26 -1.03 118.95 122.25 2eup s ARG 130 Ca 0.00 2.20 0.03 0.00 -0.52 0.00 0.00 55.73 57.44 2eup s ARG 130 Cb 0.00 -2.65 0.01 0.00 0.52 0.00 0.00 34.95 32.83 2eup s ARG 130 CO 0.00 -0.65 -0.17 0.08 0.02 0.00 0.00 175.30 174.58 2eup s VAL 131 N -1.27 1.55 0.24 3.52 1.01 -1.07 -4.66 120.40 119.72 2eup s VAL 131 Ca 0.60 -0.71 -0.31 0.00 0.00 0.00 0.00 61.98 61.55 2eup s VAL 131 Cb -0.39 -1.38 -0.12 0.00 0.00 0.00 0.00 36.38 34.49 2eup s VAL 131 CO 0.49 0.45 1.58 0.47 0.00 0.00 0.00 175.10 178.10 2eup n ASP 132 N 3.77 3.54 -4.56 3.32 9.92 -1.26 -4.03 116.55 127.25 2eup n ASP 132 Ca -0.21 1.12 -0.24 0.00 -0.53 0.00 0.00 54.79 54.93 2eup n ASP 132 Cb 0.52 -1.53 -0.09 0.00 -0.64 0.00 0.00 41.12 39.38 2eup n ASP 132 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2eup s THR 133 N 0.40 2.72 0.97 -3.53 -4.23 -0.71 -5.01 115.64 106.25 2eup s THR 133 Ca 0.70 -2.16 -0.12 0.00 -1.18 0.00 0.00 61.69 58.92 2eup s THR 133 Cb -0.56 -2.59 0.17 0.00 1.34 0.00 0.00 72.50 70.86 2eup s THR 133 CO 0.43 -0.32 1.10 -2.84 -0.54 0.00 0.00 174.62 172.45 2eup s PRO 134 N -3.61 0.67 0.46 3.99 0.02 -1.26 -4.85 135.00 130.42 2eup s PRO 134 Ca 0.32 0.51 0.12 0.00 0.02 0.00 0.00 61.00 61.97 2eup s PRO 134 Cb -0.03 -1.77 1.07 0.00 0.02 0.00 0.00 34.50 33.79 2eup s PRO 134 CO 0.17 -2.57 2.08 1.49 -0.33 0.00 0.00 177.00 177.85 2eup h GLU 135 N -1.77 0.28 0.00 5.54 4.81 -1.98 -0.47 114.58 120.98 2eup h GLU 135 Ca -0.53 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 2eup h GLU 135 Cb 1.32 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.64 2eup h GLU 135 CO 0.58 0.19 0.00 -0.40 -0.73 0.00 0.00 179.01 178.65 2eup n ASP 136 N -4.50 0.00 -0.56 1.04 5.75 -1.26 -2.11 116.55 114.91 2eup n ASP 136 Ca 0.02 -0.09 0.13 0.00 -0.01 0.00 0.00 54.79 54.84 2eup n ASP 136 Cb 0.13 -0.24 0.40 0.00 -1.03 0.00 0.00 41.12 40.38 2eup n ASP 136 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2eup n THR 137 N -1.24 0.00 -2.04 2.12 -2.24 -0.19 -4.94 114.28 105.76 2eup n THR 137 Ca 0.10 -0.29 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 2eup n THR 137 Cb 0.14 0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 69.07 2eup n THR 137 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2eup s THR 138 N -2.07 3.11 0.48 4.28 2.01 -0.90 -4.65 115.64 117.90 2eup s THR 138 Ca 0.34 0.69 -0.22 0.00 0.31 0.00 0.00 61.69 62.81 2eup s THR 138 Cb 0.20 -3.44 -0.07 0.00 0.01 0.00 0.00 72.50 69.20 2eup s THR 138 CO 0.36 0.03 1.16 -2.16 -0.69 0.00 0.00 174.62 173.31 2eup s PRO 139 N 1.81 3.64 0.75 4.92 0.04 -1.26 -5.00 135.00 139.90 2eup s PRO 139 Ca 0.69 1.75 -0.14 0.00 0.04 0.00 0.00 61.00 63.33 2eup s PRO 139 Cb -0.39 -2.30 0.05 0.00 0.04 0.00 0.00 34.50 31.90 2eup s PRO 139 CO 0.30 -0.64 1.20 -0.51 0.04 0.00 0.00 177.00 177.39 2eup s ASP 140 N -1.45 4.03 0.79 6.66 1.01 -1.26 -4.71 116.67 121.74 2eup s ASP 140 Ca 0.66 2.33 -0.14 0.00 0.71 0.00 0.00 52.55 56.12 2eup s ASP 140 Cb -0.28 -2.59 0.07 0.00 1.01 0.00 0.00 42.92 41.14 2eup s ASP 140 CO 0.33 -2.37 1.21 0.20 0.21 0.00 0.00 175.17 174.75 2eup s ASN 141 N -2.13 3.70 0.00 0.27 0.01 -1.26 -4.27 114.94 111.27 2eup s ASN 141 Ca 0.73 2.36 0.00 0.00 -0.71 0.00 0.00 52.86 55.25 2eup s ASN 141 Cb -0.28 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 38.79 2eup s ASN 141 CO 0.47 -2.59 0.00 0.61 -1.51 0.00 0.00 177.10 174.08 2eup n GLY 142 N 0.46 0.91 0.02 0.66 0.00 -1.26 -4.98 105.19 101.00 2eup n GLY 142 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.27 2eup n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eup n ARG 143 N -1.53 0.05 -3.54 1.61 1.74 -1.26 -4.92 116.66 108.80 2eup n ARG 143 Ca 0.00 -0.03 -0.27 0.00 -0.77 0.00 0.00 57.85 56.77 2eup n ARG 143 Cb 0.00 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 29.91 2eup n ARG 143 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2eup s LEU 144 N -2.98 4.15 0.35 0.55 1.43 -1.26 -4.68 118.68 116.24 2eup s LEU 144 Ca 0.11 0.51 -0.22 0.00 -1.03 0.00 0.00 54.13 53.50 2eup s LEU 144 Cb 0.17 -3.31 -0.10 0.00 0.03 0.00 0.00 46.19 42.98 2eup s LEU 144 CO 0.74 -0.12 0.89 -2.16 0.23 0.00 0.00 176.35 175.93 2eup s PRO 145 N -3.50 4.33 0.45 1.29 0.04 -1.26 -5.06 135.00 131.29 2eup s PRO 145 Ca 0.40 1.10 -0.21 0.00 0.04 0.00 0.00 61.00 62.34 2eup s PRO 145 Cb -0.11 -2.51 -0.10 0.00 0.04 0.00 0.00 34.50 31.83 2eup s PRO 145 CO 0.30 0.15 1.00 -0.51 0.04 0.00 0.00 177.00 177.98 2eup s ASP 146 N -1.93 6.64 0.00 6.66 1.01 -1.26 -5.01 116.67 122.78 2eup s ASP 146 Ca 0.55 1.84 0.20 0.00 0.71 0.00 0.00 52.55 55.85 2eup s ASP 146 Cb -0.13 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.20 2eup s ASP 146 CO 0.18 -0.57 0.98 0.00 0.21 0.00 0.00 175.17 175.98 2eup n ALA 147 N -0.73 3.61 1.14 5.23 0.00 -1.26 -4.46 120.51 124.04 2eup n ALA 147 Ca 0.08 -0.60 0.05 0.00 0.00 0.00 0.00 53.44 52.97 2eup n ALA 147 Cb 0.53 -0.72 0.15 0.00 0.00 0.00 0.00 19.45 19.41 2eup n ALA 147 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2eup n ASP 148 N -0.27 1.47 -4.44 0.00 5.75 -1.26 -2.25 116.55 115.55 2eup n ASP 148 Ca 0.08 -1.97 -0.20 0.00 -0.01 0.00 0.00 54.79 52.69 2eup n ASP 148 Cb 0.41 -0.18 0.03 0.00 -1.03 0.00 0.00 41.12 40.35 2eup n ASP 148 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2eup n LYS 149 N 0.29 0.74 -2.90 0.11 4.76 -1.26 -4.87 118.16 115.03 2eup n LYS 149 Ca 0.10 -2.79 -0.16 0.00 -2.87 0.00 0.00 58.31 52.59 2eup n LYS 149 Cb 0.24 0.08 0.00 0.00 -1.84 0.00 0.00 35.03 33.51 2eup n LYS 149 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2eup n ASP 150 N -2.12 2.04 -0.18 4.39 5.75 -1.26 -3.28 116.55 121.90 2eup n ASP 150 Ca 0.05 -2.17 -0.03 0.00 -0.01 0.00 0.00 54.79 52.63 2eup n ASP 150 Cb 0.52 -0.05 0.17 0.00 -1.03 0.00 0.00 41.12 40.74 2eup n ASP 150 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2eup h ALA 151 N 0.67 1.21 -0.93 2.12 0.00 -1.91 -2.07 119.26 118.35 2eup h ALA 151 Ca -0.22 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2eup h ALA 151 Cb 0.80 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2eup h ALA 151 CO 0.34 0.56 0.56 0.78 0.00 0.00 0.00 179.25 181.49 2eup h GLY 152 N 1.02 1.36 0.95 0.00 0.00 -1.96 -0.72 103.07 103.71 2eup h GLY 152 Ca 0.21 -0.57 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 2eup h GLY 152 CO -0.01 0.55 0.15 -1.82 0.00 0.00 0.00 176.54 175.41 2eup h TYR 153 N 1.29 0.69 -0.30 5.60 3.20 -1.82 -1.57 116.97 124.05 2eup h TYR 153 Ca 0.33 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 62.14 2eup h TYR 153 Cb -0.05 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.01 2eup h TYR 153 CO 0.01 0.62 0.20 0.28 -1.64 0.00 0.00 178.16 177.62 2eup h VAL 154 N 0.57 1.08 -0.57 1.81 2.07 -0.82 0.59 116.25 120.98 2eup h VAL 154 Ca 0.14 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 2eup h VAL 154 Cb 0.24 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2eup h VAL 154 CO -0.01 0.08 0.28 -0.09 0.02 0.00 0.00 177.57 177.85 2eup h ARG 155 N 0.41 0.81 -0.48 1.57 2.43 -1.05 -1.40 114.38 116.67 2eup h ARG 155 Ca 0.11 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 59.04 2eup h ARG 155 Cb -0.04 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 2eup h ARG 155 CO -0.02 0.65 -0.19 1.15 -1.51 0.00 0.00 179.97 180.05 2eup h THR 156 N 0.77 1.27 0.28 0.20 2.02 -1.09 -2.02 112.91 114.34 2eup h THR 156 Ca 0.20 -1.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.02 2eup h THR 156 Cb 0.10 1.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 2eup h THR 156 CO -0.03 0.46 -0.14 0.15 0.37 0.00 0.00 175.52 176.34 2eup h PHE 157 N 0.82 -0.37 0.00 3.16 3.57 -0.67 -3.08 116.94 120.38 2eup h PHE 157 Ca 0.11 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 2eup h PHE 157 Cb 0.76 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.63 2eup h PHE 157 CO 0.05 -0.23 -0.00 0.74 -2.23 0.00 0.00 178.31 176.64 2eup h PHE 158 N -0.39 0.00 0.00 0.41 0.04 -1.14 -1.97 116.94 113.90 2eup h PHE 158 Ca -0.04 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 2eup h PHE 158 Cb 0.30 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.45 2eup h PHE 158 CO -0.06 0.00 -0.11 1.96 -0.60 0.00 0.00 178.31 179.50 2eup h GLN 159 N 0.00 0.00 0.00 1.51 1.08 -1.27 -1.22 115.11 115.20 2eup h GLN 159 Ca -0.00 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.17 2eup h GLN 159 Cb 0.62 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.04 2eup h GLN 159 CO 0.00 0.11 -0.14 -0.09 -0.95 0.00 0.00 178.83 177.76 2eup h ARG 160 N 0.00 0.00 -0.64 1.46 2.43 -1.39 -1.90 114.38 114.33 2eup h ARG 160 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2eup h ARG 160 Cb 0.35 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2eup h ARG 160 CO 0.01 0.14 0.00 1.28 -1.51 0.00 0.00 179.97 179.90 2eup n LEU 161 N -3.81 4.04 -2.92 3.80 4.77 -0.56 -2.45 117.00 119.87 2eup n LEU 161 Ca -0.02 -2.03 -0.19 0.00 -0.03 0.00 0.00 56.01 53.74 2eup n LEU 161 Cb 0.24 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 2eup n LEU 161 CO 0.32 0.76 -0.08 0.59 -1.33 0.00 0.00 177.39 177.65 2eup n ASN 162 N 1.10 -4.42 -4.80 -1.43 4.13 -0.72 -4.98 115.26 104.14 2eup n ASN 162 Ca 0.22 -0.14 -0.36 0.00 1.68 0.00 0.00 54.58 55.98 2eup n ASN 162 Cb 0.73 -3.66 -0.07 0.00 -1.54 0.00 0.00 39.78 35.24 2eup n ASN 162 CO 0.00 0.00 0.00 -0.04 0.28 0.00 0.00 177.26 177.50 2eup s MET 163 N -5.55 3.76 0.51 3.52 -1.94 -0.63 -5.00 119.30 113.96 2eup s MET 163 Ca 0.22 -0.19 0.07 0.00 -1.71 0.00 0.00 55.69 54.08 2eup s MET 163 Cb -0.11 -3.27 0.09 0.00 2.01 0.00 0.00 34.83 33.55 2eup s MET 163 CO 0.27 0.56 0.70 0.27 -0.01 0.00 0.00 175.02 176.81 2eup n ASN 164 N 2.69 1.69 -0.20 3.03 0.23 -1.26 -3.87 115.26 117.57 2eup n ASN 164 Ca -0.18 -2.25 -0.05 0.00 -0.53 0.00 0.00 54.58 51.57 2eup n ASN 164 Cb 0.54 -0.38 0.05 0.00 -2.08 0.00 0.00 39.78 37.90 2eup n ASN 164 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2eup h ASP 165 N 0.00 0.60 -0.73 0.53 5.19 -1.99 -0.63 116.42 119.39 2eup h ASP 165 Ca -0.24 -0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.11 2eup h ASP 165 Cb 1.05 -0.13 -0.03 0.00 0.18 0.00 0.00 39.33 40.40 2eup h ASP 165 CO 0.32 0.42 0.21 0.03 -3.12 0.00 0.00 179.24 177.10 2eup h ARG 166 N 0.72 1.14 -0.53 3.56 3.08 -1.97 -1.43 114.38 118.96 2eup h ARG 166 Ca 0.23 -0.26 -0.09 0.00 0.07 0.00 0.00 59.98 59.94 2eup h ARG 166 Cb 0.00 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 2eup h ARG 166 CO -0.09 0.99 -0.02 0.93 -1.07 0.00 0.00 179.97 180.70 2eup h GLU 167 N 1.09 0.94 0.18 0.04 5.08 -1.78 -0.53 114.58 119.60 2eup h GLU 167 Ca 0.23 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2eup h GLU 167 Cb 0.33 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2eup h GLU 167 CO -0.00 0.97 -0.09 0.28 -1.00 0.00 0.00 179.01 179.17 2eup h VAL 168 N 0.81 0.85 -0.48 3.13 2.07 -0.94 0.41 116.25 122.11 2eup h VAL 168 Ca 0.15 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.50 2eup h VAL 168 Cb 0.56 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 2eup h VAL 168 CO 0.03 0.03 0.15 0.58 0.02 0.00 0.00 177.57 178.38 2eup h VAL 169 N -0.30 1.23 -0.29 2.57 2.07 -1.16 -1.68 116.25 118.69 2eup h VAL 169 Ca -0.02 -0.76 0.01 0.00 0.82 0.00 0.00 66.70 66.75 2eup h VAL 169 Cb 0.23 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 2eup h VAL 169 CO 0.04 0.28 0.18 0.00 0.02 0.00 0.00 177.57 178.08 2eup h ALA 170 N 1.00 0.36 -0.73 1.67 0.00 -1.01 -2.96 119.26 117.60 2eup h ALA 170 Ca 0.15 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2eup h ALA 170 Cb 0.27 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2eup h ALA 170 CO -0.00 -0.19 0.43 -0.07 0.00 0.00 0.00 179.25 179.41 2eup h LEU 171 N 0.36 0.88 -1.56 0.00 3.38 -0.63 -2.17 115.31 115.57 2eup h LEU 171 Ca 0.11 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2eup h LEU 171 Cb -0.02 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.51 2eup h LEU 171 CO -0.04 0.68 0.00 -0.03 0.09 0.00 0.00 178.44 179.14 2eup h MET 172 N 1.01 0.00 -0.03 1.13 4.05 -1.14 -2.31 114.93 117.63 2eup h MET 172 Ca 0.26 0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.69 2eup h MET 172 Cb -0.02 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 30.78 2eup h MET 172 CO -0.05 0.00 0.14 0.78 0.23 0.00 0.00 176.91 178.01 2eup h GLY 173 N 1.57 0.00 2.00 1.39 0.00 -1.34 -0.51 103.07 106.18 2eup h GLY 173 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2eup h GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 2eup h ALA 174 N 1.75 1.00 0.00 3.60 0.00 -1.60 -2.50 119.26 121.51 2eup h ALA 174 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2eup h ALA 174 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2eup h ALA 174 CO -0.00 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.97 2eup n HIS 175 N -2.36 0.00 0.42 0.00 8.25 -0.20 -1.27 115.22 120.06 2eup n HIS 175 Ca -0.01 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.56 2eup n HIS 175 Cb 0.06 -0.07 0.48 0.00 1.12 0.00 0.00 29.99 31.57 2eup n HIS 175 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2eup n ALA 176 N -1.07 1.71 -2.52 -1.41 0.00 -0.94 -4.25 120.51 112.03 2eup n ALA 176 Ca 0.13 0.07 -0.33 0.00 0.00 0.00 0.00 53.44 53.31 2eup n ALA 176 Cb 0.09 -1.39 -0.05 0.00 0.00 0.00 0.00 19.45 18.10 2eup n ALA 176 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2eup s LEU 177 N -4.41 4.28 0.00 0.00 1.43 -0.40 -4.11 118.68 115.47 2eup s LEU 177 Ca 0.05 0.83 0.00 0.00 -1.03 0.00 0.00 54.13 53.98 2eup s LEU 177 Cb 0.10 -3.28 0.00 0.00 0.03 0.00 0.00 46.19 43.04 2eup s LEU 177 CO 0.40 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.66 2eup n GLY 178 N 0.45 1.58 3.53 -3.19 0.00 0.27 -4.87 105.19 102.97 2eup n GLY 178 Ca -0.04 -0.58 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 2eup n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eup s LYS 179 N 0.00 1.32 0.29 1.61 -2.85 -1.26 -4.46 119.74 114.39 2eup s LYS 179 Ca 0.00 -0.56 -0.22 0.00 -1.00 0.00 0.00 55.97 54.19 2eup s LYS 179 Cb 0.00 0.56 -0.09 0.00 -2.06 0.00 0.00 37.83 36.24 2eup s LYS 179 CO 0.00 -0.59 0.84 0.95 0.10 0.00 0.00 175.35 176.65 2eup s THR 180 N -3.69 4.41 -0.15 3.79 -4.23 -0.46 -4.94 115.64 110.38 2eup s THR 180 Ca 0.04 1.51 0.01 0.00 -1.18 0.00 0.00 61.69 62.07 2eup s THR 180 Cb -0.02 -3.88 0.02 0.00 1.34 0.00 0.00 72.50 69.96 2eup s THR 180 CO -0.08 0.10 -0.16 -1.00 -0.54 0.00 0.00 174.62 172.94 2eup s HIS 181 N -1.66 2.28 0.26 3.99 0.09 -0.93 -1.91 115.29 117.42 2eup s HIS 181 Ca 0.49 -1.25 -0.01 0.00 -0.00 0.00 0.00 55.06 54.28 2eup s HIS 181 Cb -0.16 -1.64 0.51 0.00 -0.00 0.00 0.00 32.58 31.29 2eup s HIS 181 CO 0.21 -0.66 1.78 1.25 -0.00 0.00 0.00 174.74 177.33 2eup h LEU 182 N 7.86 0.63 -1.30 0.89 5.85 -1.38 -0.86 115.31 127.00 2eup h LEU 182 Ca -0.38 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.38 2eup h LEU 182 Cb 1.15 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.14 2eup h LEU 182 CO 0.54 0.30 -0.16 0.11 -0.34 0.00 0.00 178.44 178.89 2eup h LYS 183 N 0.72 0.00 0.01 1.25 1.57 -1.97 -0.56 116.57 117.59 2eup h LYS 183 Ca 0.46 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.21 2eup h LYS 183 Cb 0.57 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 2eup h LYS 183 CO -0.32 0.16 -0.13 -0.91 -0.57 0.00 0.00 179.45 177.69 2eup h ASN 184 N 0.00 0.02 0.00 0.86 2.35 -1.50 -3.44 115.58 113.86 2eup h ASN 184 Ca -0.00 -0.96 0.00 0.00 -0.55 0.00 0.00 56.30 54.79 2eup h ASN 184 Cb 0.64 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.01 2eup h ASN 184 CO 0.02 1.05 0.00 -1.54 -1.65 0.00 0.00 177.43 175.31 2eup n SER 185 N -4.58 0.25 -0.19 5.81 3.41 -0.91 -4.74 113.62 112.68 2eup n SER 185 Ca -0.12 -0.60 -0.02 0.00 -0.26 0.00 0.00 58.87 57.86 2eup n SER 185 Cb 0.51 0.32 -0.01 0.00 -0.26 0.00 0.00 64.21 64.77 2eup n SER 185 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eup n GLY 186 N 0.32 0.58 3.17 5.00 0.00 -0.22 -5.04 105.19 109.01 2eup n GLY 186 Ca 0.00 -0.87 -0.18 0.00 0.00 0.00 0.00 46.02 44.98 2eup n GLY 186 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2eup s TYR 187 N -2.08 1.19 -0.04 1.61 2.02 -1.26 -4.62 117.35 114.17 2eup s TYR 187 Ca 0.00 -0.49 0.00 0.00 -0.37 0.00 0.00 57.07 56.22 2eup s TYR 187 Cb 0.00 -0.66 0.03 0.00 -0.40 0.00 0.00 41.96 40.92 2eup s TYR 187 CO 0.00 0.05 -0.01 -2.00 -1.57 0.00 0.00 175.55 172.03 2eup s GLU 188 N -1.90 0.42 0.00 -0.62 2.56 -1.26 -0.89 118.70 117.01 2eup s GLU 188 Ca -0.01 0.06 0.00 0.00 0.00 0.00 0.00 54.97 55.02 2eup s GLU 188 Cb -0.09 -0.60 0.00 0.00 2.00 0.00 0.00 34.13 35.44 2eup s GLU 188 CO 0.02 -0.15 0.00 0.41 -0.56 0.00 0.00 175.26 174.98 2eup n GLY 189 N 4.27 3.26 3.91 -1.50 0.00 -0.80 -4.85 105.19 109.47 2eup n GLY 189 Ca -0.23 -1.92 -0.27 0.00 0.00 0.00 0.00 46.02 43.60 2eup n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eup s PRO 190 N -2.65 3.21 0.00 1.61 0.04 -1.26 -1.35 135.00 134.60 2eup s PRO 190 Ca 0.00 0.09 0.27 0.00 0.04 0.00 0.00 61.00 61.40 2eup s PRO 190 Cb 0.00 -2.32 0.91 0.00 0.04 0.00 0.00 34.50 33.13 2eup s PRO 190 CO 0.00 -0.47 1.69 0.41 0.04 0.00 0.00 177.00 178.67 2eup n GLY 191 N -2.43 -1.31 0.00 0.56 0.00 -1.26 -0.69 105.19 100.06 2eup n GLY 191 Ca 0.03 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2eup n GLY 191 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eup n GLY 192 N 1.47 0.48 0.12 -0.02 0.00 -1.26 -4.69 105.19 101.29 2eup n GLY 192 Ca 0.07 -0.78 -0.17 0.00 0.00 0.00 0.00 46.02 45.14 2eup n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2eup h ALA 193 N 2.00 0.49 -2.07 4.61 0.00 -1.95 -3.42 119.26 118.93 2eup h ALA 193 Ca 0.00 -1.36 -0.79 0.00 0.00 0.00 0.00 54.91 52.76 2eup h ALA 193 Cb 0.00 0.57 -0.29 0.00 0.00 0.00 0.00 17.79 18.06 2eup h ALA 193 CO 0.00 1.35 0.60 0.00 0.00 0.00 0.00 179.25 181.21 2eup n ALA 194 N -2.81 4.91 0.13 0.00 0.00 -1.26 -4.87 120.51 116.61 2eup n ALA 194 Ca -0.25 -4.78 0.08 0.00 0.00 0.00 0.00 53.44 48.49 2eup n ALA 194 Cb 1.05 -2.24 0.25 0.00 0.00 0.00 0.00 19.45 18.51 2eup n ALA 194 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2eup n ASN 195 N 1.53 3.24 -0.58 0.00 6.94 -1.26 -3.31 115.26 121.82 2eup n ASN 195 Ca 0.26 -2.16 0.05 0.00 -0.02 0.00 0.00 54.58 52.71 2eup n ASN 195 Cb 0.35 -0.43 0.09 0.00 -2.36 0.00 0.00 39.78 37.43 2eup n ASN 195 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 2eup n ASN 196 N 0.92 1.26 -4.09 0.53 0.23 -1.26 -0.56 115.26 112.29 2eup n ASN 196 Ca 0.18 -2.72 -0.25 0.00 -0.53 0.00 0.00 54.58 51.26 2eup n ASN 196 Cb 0.57 -0.36 -0.16 0.00 -2.08 0.00 0.00 39.78 37.75 2eup n ASN 196 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2eup s VAL 197 N -1.53 1.32 -0.45 3.53 1.01 -1.21 -4.73 120.40 118.33 2eup s VAL 197 Ca 0.24 -0.63 -0.27 0.00 0.00 0.00 0.00 61.98 61.32 2eup s VAL 197 Cb 0.24 -1.16 0.03 0.00 0.00 0.00 0.00 36.38 35.48 2eup s VAL 197 CO -0.04 0.39 1.03 0.12 0.00 0.00 0.00 175.10 176.61 2eup s PHE 198 N 0.28 2.90 0.30 5.22 5.36 0.21 -4.87 117.98 127.37 2eup s PHE 198 Ca -0.08 0.62 0.06 0.00 -0.96 0.00 0.00 56.93 56.56 2eup s PHE 198 Cb -0.13 -4.15 -0.02 0.00 -0.34 0.00 0.00 43.02 38.38 2eup s PHE 198 CO 0.03 -1.14 0.28 0.25 -1.46 0.00 0.00 175.22 173.17 2eup n THR 199 N 6.56 0.00 -0.18 0.12 -2.24 -1.26 -4.45 114.28 112.83 2eup n THR 199 Ca 0.09 -2.07 -0.05 0.00 -2.27 0.00 0.00 64.05 59.76 2eup n THR 199 Cb 0.49 1.06 0.17 0.00 -2.10 0.00 0.00 70.33 69.95 2eup n THR 199 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2eup n ASN 200 N -1.82 3.59 0.15 3.42 6.94 -1.26 -4.59 115.26 121.70 2eup n ASN 200 Ca 0.06 -2.72 0.04 0.00 -0.02 0.00 0.00 54.58 51.94 2eup n ASN 200 Cb 0.53 -0.65 0.47 0.00 -2.36 0.00 0.00 39.78 37.77 2eup n ASN 200 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 2eup h GLU 201 N 1.47 0.20 -0.77 -3.83 4.81 -1.95 -2.58 114.58 111.94 2eup h GLU 201 Ca 0.18 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.45 2eup h GLU 201 Cb 1.71 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 30.99 2eup h GLU 201 CO 0.46 0.25 0.44 0.35 -0.73 0.00 0.00 179.01 179.78 2eup h PHE 202 N 0.19 0.81 -0.06 0.92 3.57 -1.84 0.37 116.94 120.91 2eup h PHE 202 Ca 0.05 0.03 -0.21 0.00 3.53 0.00 0.00 57.97 61.36 2eup h PHE 202 Cb 0.20 -0.25 0.01 0.00 2.79 0.00 0.00 35.95 38.71 2eup h PHE 202 CO 0.00 0.38 -0.79 1.88 -2.23 0.00 0.00 178.31 177.55 2eup h TYR 203 N 0.79 0.91 -0.54 0.41 0.05 -1.81 -1.13 116.97 115.65 2eup h TYR 203 Ca 0.35 -0.45 0.03 0.00 0.05 0.00 0.00 58.73 58.70 2eup h TYR 203 Cb 0.23 -0.12 -0.04 0.00 1.01 0.00 0.00 36.73 37.82 2eup h TYR 203 CO -0.06 1.28 0.32 -0.07 -1.05 0.00 0.00 178.16 178.57 2eup h LEU 204 N 0.29 0.51 -0.46 3.88 3.38 -1.37 -2.12 115.31 119.42 2eup h LEU 204 Ca -0.08 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.75 2eup h LEU 204 Cb 1.45 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 2eup h LEU 204 CO 0.16 0.35 -0.33 0.78 0.09 0.00 0.00 178.44 179.49 2eup h ASN 205 N 0.63 0.97 -0.66 -0.43 2.35 -0.84 -0.62 115.58 116.98 2eup h ASN 205 Ca 0.22 -0.42 0.09 0.00 -0.55 0.00 0.00 56.30 55.64 2eup h ASN 205 Cb 0.04 -0.27 -0.07 0.00 0.05 0.00 0.00 38.32 38.07 2eup h ASN 205 CO -0.11 1.21 0.30 -0.07 -1.65 0.00 0.00 177.43 177.11 2eup h LEU 206 N 0.77 0.37 0.01 1.61 3.38 -1.00 -2.11 115.31 118.34 2eup h LEU 206 Ca 0.08 0.06 -0.22 0.00 0.09 0.00 0.00 57.88 57.89 2eup h LEU 206 Cb 0.91 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 2eup h LEU 206 CO 0.08 0.22 -1.05 -0.07 0.09 0.00 0.00 178.44 177.71 2eup h LEU 207 N 0.53 0.03 0.00 1.67 3.38 -1.14 -3.40 115.31 116.37 2eup h LEU 207 Ca 0.32 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.26 2eup h LEU 207 Cb 0.35 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2eup h LEU 207 CO -0.27 1.02 -1.36 0.59 0.09 0.00 0.00 178.44 178.51 2eup n ASN 208 N -3.35 2.15 -4.87 -0.43 5.03 -0.26 -4.99 115.26 108.54 2eup n ASN 208 Ca -0.01 -0.12 -0.31 0.00 0.87 0.00 0.00 54.58 55.02 2eup n ASN 208 Cb 0.95 1.43 -0.02 0.00 -1.02 0.00 0.00 39.78 41.13 2eup n ASN 208 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2eup s GLU 209 N -2.66 3.75 -0.65 3.52 0.41 -0.81 -5.02 118.70 117.24 2eup s GLU 209 Ca -0.03 0.65 -0.19 0.00 -0.41 0.00 0.00 54.97 54.99 2eup s GLU 209 Cb 0.07 -2.23 0.11 0.00 -1.78 0.00 0.00 34.13 30.30 2eup s GLU 209 CO 0.46 -0.27 0.79 0.34 -0.49 0.00 0.00 175.26 176.09 2eup s ASP 210 N -3.54 6.26 -0.02 -0.19 2.15 -1.26 -4.99 116.67 115.08 2eup s ASP 210 Ca 0.54 -1.50 -0.19 0.00 0.43 0.00 0.00 52.55 51.83 2eup s ASP 210 Cb -0.10 -2.32 -0.05 0.00 -0.30 0.00 0.00 42.92 40.14 2eup s ASP 210 CO 0.39 -1.13 0.53 0.26 -0.17 0.00 0.00 175.17 175.05 2eup s TRP 211 N 2.75 3.67 -0.13 -5.34 0.52 -1.26 -3.73 118.94 115.42 2eup s TRP 211 Ca 0.15 1.10 0.02 0.00 0.02 0.00 0.00 56.10 57.39 2eup s TRP 211 Cb -0.20 -2.52 0.01 0.00 -1.15 0.00 0.00 33.47 29.61 2eup s TRP 211 CO 0.04 0.40 -0.18 0.21 0.02 0.00 0.00 176.95 177.45 2eup s LYS 212 N -0.32 2.57 0.04 4.98 2.20 0.32 -4.89 119.74 124.63 2eup s LYS 212 Ca 0.28 -0.68 -0.30 0.00 -0.36 0.00 0.00 55.97 54.91 2eup s LYS 212 Cb -0.17 -2.17 -0.07 0.00 -1.51 0.00 0.00 37.83 33.91 2eup s LYS 212 CO 0.15 -0.09 1.44 -1.17 -0.36 0.00 0.00 175.35 175.32 2eup s LEU 213 N 1.05 4.34 0.05 5.43 2.96 -1.26 -0.76 118.68 130.48 2eup s LEU 213 Ca -0.04 2.23 -0.02 0.00 -0.22 0.00 0.00 54.13 56.08 2eup s LEU 213 Cb -0.15 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 42.95 2eup s LEU 213 CO -0.04 -0.73 -0.00 -1.61 -1.32 0.00 0.00 176.35 172.64 2eup s GLU 214 N 2.14 0.59 0.26 1.98 2.02 -0.25 -4.97 118.70 120.47 2eup s GLU 214 Ca 0.66 -1.10 -0.19 0.00 0.02 0.00 0.00 54.97 54.37 2eup s GLU 214 Cb -0.34 0.21 -0.09 0.00 0.10 0.00 0.00 34.13 34.02 2eup s GLU 214 CO 0.28 -0.12 0.74 0.15 0.02 0.00 0.00 175.26 176.33 2eup s LYS 215 N -3.54 4.19 0.34 1.61 1.02 -1.26 -1.14 119.74 120.96 2eup s LYS 215 Ca 0.03 0.84 0.05 0.00 0.02 0.00 0.00 55.97 56.91 2eup s LYS 215 Cb 0.05 -2.74 0.06 0.00 -0.52 0.00 0.00 37.83 34.68 2eup s LYS 215 CO -0.09 0.32 0.47 0.27 -0.92 0.00 0.00 175.35 175.40 2eup n ASN 216 N 0.39 1.16 0.00 2.83 0.23 -0.30 -4.94 115.26 114.64 2eup n ASN 216 Ca -0.00 -1.85 0.10 0.00 -0.53 0.00 0.00 54.58 52.29 2eup n ASN 216 Cb 0.52 -0.26 0.43 0.00 -2.08 0.00 0.00 39.78 38.38 2eup n ASN 216 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2eup n ASP 217 N -2.66 0.00 -1.17 0.53 8.00 -1.26 -1.24 116.55 118.75 2eup n ASP 217 Ca 0.09 0.47 0.10 0.00 0.71 0.00 0.00 54.79 56.16 2eup n ASP 217 Cb 0.34 -0.49 0.28 0.00 -0.02 0.00 0.00 41.12 41.23 2eup n ASP 217 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2eup n ALA 218 N -1.49 2.45 -1.57 2.24 0.00 -1.26 -4.96 120.51 115.92 2eup n ALA 218 Ca 0.05 -1.12 -0.15 0.00 0.00 0.00 0.00 53.44 52.22 2eup n ALA 218 Cb 0.23 -0.96 -0.06 0.00 0.00 0.00 0.00 19.45 18.67 2eup n ALA 218 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2eup n ASN 219 N 1.29 -4.77 -4.87 0.00 5.15 -0.37 -5.03 115.26 106.66 2eup n ASN 219 Ca 0.21 0.31 -0.32 0.00 -0.60 0.00 0.00 54.58 54.18 2eup n ASN 219 Cb 0.55 -3.64 -0.05 0.00 -0.53 0.00 0.00 39.78 36.10 2eup n ASN 219 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2eup s ASN 220 N -2.76 6.14 0.17 1.20 0.02 -1.26 -4.79 114.94 113.66 2eup s ASN 220 Ca 0.00 0.25 -0.30 0.00 -1.02 0.00 0.00 52.86 51.79 2eup s ASN 220 Cb 0.00 -1.86 -0.07 0.00 0.02 0.00 0.00 41.25 39.33 2eup s ASN 220 CO 0.00 0.23 1.07 -1.61 0.02 0.00 0.00 177.10 176.81 2eup s GLU 221 N -2.10 4.62 0.12 -0.60 2.02 -1.26 -1.15 118.70 120.36 2eup s GLU 221 Ca 0.29 1.65 -0.10 0.00 0.02 0.00 0.00 54.97 56.83 2eup s GLU 221 Cb -0.13 -3.30 0.00 0.00 0.10 0.00 0.00 34.13 30.81 2eup s GLU 221 CO 0.21 0.12 0.26 1.14 0.02 0.00 0.00 175.26 177.00 2eup s GLN 222 N -0.31 0.98 -0.23 1.61 -2.07 -0.29 -4.56 119.66 114.79 2eup s GLN 222 Ca 0.49 -0.97 -0.11 0.00 -1.82 0.00 0.00 55.36 52.95 2eup s GLN 222 Cb -0.28 0.38 -0.05 0.00 -1.09 0.00 0.00 33.01 31.97 2eup s GLN 222 CO 0.34 -0.34 0.16 -1.58 -1.32 0.00 0.00 175.29 172.55 2eup s TRP 223 N -3.88 3.34 -0.03 9.60 0.52 -0.51 -1.09 118.94 126.89 2eup s TRP 223 Ca 0.08 0.27 0.06 0.00 0.02 0.00 0.00 56.10 56.53 2eup s TRP 223 Cb 0.04 -2.25 -0.01 0.00 -1.15 0.00 0.00 33.47 30.09 2eup s TRP 223 CO -0.08 0.12 -0.21 -0.51 0.02 0.00 0.00 176.95 176.28 2eup s ASP 224 N 0.89 2.57 0.27 2.95 1.01 0.06 -0.18 116.67 124.24 2eup s ASP 224 Ca 0.08 -0.41 0.07 0.00 0.71 0.00 0.00 52.55 53.00 2eup s ASP 224 Cb -0.13 -0.43 -0.03 0.00 1.01 0.00 0.00 42.92 43.34 2eup s ASP 224 CO 0.03 0.24 0.25 -0.94 0.21 0.00 0.00 175.17 174.97 2eup s SER 225 N -0.36 5.61 0.58 0.27 1.04 -0.12 -0.52 113.70 120.21 2eup s SER 225 Ca 0.04 -0.25 0.27 0.00 0.48 0.00 0.00 55.95 56.50 2eup s SER 225 Cb -0.10 -1.37 1.73 0.00 0.10 0.00 0.00 66.02 66.38 2eup s SER 225 CO 0.00 -0.13 2.24 0.07 0.98 0.00 0.00 173.24 176.40 2eup h LYS 226 N 1.37 0.00 0.00 4.02 5.09 -1.89 -1.71 116.57 123.44 2eup h LYS 226 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.26 2eup h LYS 226 Cb 1.24 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.57 2eup h LYS 226 CO 0.60 0.00 0.00 0.43 -2.09 0.00 0.00 179.45 178.39 2eup n SER 227 N -3.96 0.00 0.00 7.07 7.64 -1.26 -4.89 113.62 118.22 2eup n SER 227 Ca -0.03 -0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.84 2eup n SER 227 Cb 0.09 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.00 2eup n SER 227 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eup n GLY 228 N 0.58 0.72 3.87 0.23 0.00 -0.64 -5.07 105.19 104.89 2eup n GLY 228 Ca 0.10 -0.66 -0.21 0.00 0.00 0.00 0.00 46.02 45.25 2eup n GLY 228 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2eup s TYR 229 N -2.00 3.03 0.08 1.61 2.02 -1.26 -4.53 117.35 116.30 2eup s TYR 229 Ca 0.00 -0.22 0.02 0.00 -0.37 0.00 0.00 57.07 56.50 2eup s TYR 229 Cb 0.00 -1.71 -0.04 0.00 -0.40 0.00 0.00 41.96 39.82 2eup s TYR 229 CO 0.00 0.26 -0.07 0.00 -1.57 0.00 0.00 175.55 174.17 2eup s MET 230 N -3.98 0.72 -0.04 -0.62 0.23 0.13 -0.94 119.30 114.80 2eup s MET 230 Ca 0.39 -1.12 0.04 0.00 -1.03 0.00 0.00 55.69 53.97 2eup s MET 230 Cb -0.07 -0.24 -0.00 0.00 -1.53 0.00 0.00 34.83 32.99 2eup s MET 230 CO 0.27 0.01 -0.16 -1.64 -2.03 0.00 0.00 175.02 171.47 2eup s MET 231 N -3.00 1.62 0.66 3.16 -1.94 0.75 -4.22 119.30 116.33 2eup s MET 231 Ca 0.04 -0.56 -0.16 0.00 -1.71 0.00 0.00 55.69 53.30 2eup s MET 231 Cb -0.00 -1.43 0.00 0.00 2.01 0.00 0.00 34.83 35.41 2eup s MET 231 CO -0.03 0.23 1.14 -0.51 -0.01 0.00 0.00 175.02 175.84 2eup s LEU 232 N 0.04 3.42 0.34 -0.03 1.43 -1.26 -1.43 118.68 121.20 2eup s LEU 232 Ca -0.03 2.12 0.08 0.00 -1.03 0.00 0.00 54.13 55.27 2eup s LEU 232 Cb -0.11 -4.57 0.80 0.00 0.03 0.00 0.00 46.19 42.35 2eup s LEU 232 CO 0.02 -1.73 1.84 -0.65 0.23 0.00 0.00 176.35 176.05 2eup h PRO 233 N 0.12 0.69 -0.02 1.29 0.11 -1.79 -0.38 132.00 132.02 2eup h PRO 233 Ca -0.47 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.50 2eup h PRO 233 Cb 1.26 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2eup h PRO 233 CO 0.53 0.46 -0.43 1.79 -0.21 0.00 0.00 178.00 180.14 2eup h THR 234 N 0.71 1.31 -0.02 -1.15 1.35 -1.43 -0.90 112.91 112.78 2eup h THR 234 Ca 0.49 -1.50 -0.00 0.00 -0.55 0.00 0.00 66.41 64.85 2eup h THR 234 Cb 0.80 1.78 -0.00 0.00 -1.73 0.00 0.00 68.15 69.00 2eup h THR 234 CO -0.25 0.43 0.00 0.44 -0.25 0.00 0.00 175.52 175.89 2eup h ASP 235 N 0.04 0.03 0.28 5.36 3.32 -1.45 -3.17 116.42 120.84 2eup h ASP 235 Ca 0.00 -0.27 -0.03 0.00 0.02 0.00 0.00 57.03 56.75 2eup h ASP 235 Cb 0.78 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.32 2eup h ASP 235 CO 0.06 0.29 -0.14 0.22 -1.72 0.00 0.00 179.24 177.95 2eup h TYR 236 N -0.23 0.00 -0.03 4.55 3.20 -0.87 -1.93 116.97 121.66 2eup h TYR 236 Ca 0.01 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.88 2eup h TYR 236 Cb 0.28 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.54 2eup h TYR 236 CO 0.02 0.14 0.04 0.66 -1.64 0.00 0.00 178.16 177.37 2eup h SER 237 N 0.00 0.00 0.81 -2.11 4.64 -1.14 -1.46 113.55 114.30 2eup h SER 237 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2eup h SER 237 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2eup h SER 237 CO 0.02 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.91 2eup h LEU 238 N 0.00 0.00 -1.10 5.97 3.38 -1.46 -1.98 115.31 120.12 2eup h LEU 238 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2eup h LEU 238 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2eup h LEU 238 CO -0.00 0.00 -0.30 2.30 0.09 0.00 0.00 178.44 180.53 2eup n ILE 239 N -2.71 0.00 0.01 1.22 -5.35 -0.56 -1.76 119.36 110.21 2eup n ILE 239 Ca 0.01 -0.35 -0.12 0.00 -0.27 0.00 0.00 62.75 62.01 2eup n ILE 239 Cb 0.25 1.25 -0.14 0.00 -1.74 0.00 0.00 39.64 39.27 2eup n ILE 239 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 2eup h GLN 240 N 2.37 0.10 -5.99 6.28 4.20 -1.31 -3.46 115.11 117.31 2eup h GLN 240 Ca 0.00 -0.17 -0.57 0.00 0.06 0.00 0.00 58.65 57.97 2eup h GLN 240 Cb 0.65 0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.44 2eup h GLN 240 CO 0.00 0.81 0.14 0.34 -0.67 0.00 0.00 178.83 179.45 2eup s ASP 241 N -6.51 6.96 0.32 1.46 -1.08 -0.81 -4.98 116.67 112.04 2eup s ASP 241 Ca -0.08 1.16 0.02 0.00 -0.52 0.00 0.00 52.55 53.13 2eup s ASP 241 Cb 0.08 -2.42 0.55 0.00 -1.46 0.00 0.00 42.92 39.67 2eup s ASP 241 CO 0.82 -0.18 1.92 -0.65 0.52 0.00 0.00 175.17 177.60 2eup h PRO 242 N 6.92 0.76 -0.15 4.34 0.11 -1.91 -0.21 132.00 141.86 2eup h PRO 242 Ca -0.38 -0.10 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2eup h PRO 242 Cb 1.18 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 2eup h PRO 242 CO 0.77 0.61 -0.07 0.87 -0.21 0.00 0.00 178.00 179.98 2eup h LYS 243 N 0.76 0.31 -0.76 1.05 1.57 -1.94 -2.64 116.57 114.92 2eup h LYS 243 Ca 0.19 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 2eup h LYS 243 Cb 0.13 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 2eup h LYS 243 CO -0.02 0.63 0.27 1.88 -0.57 0.00 0.00 179.45 181.64 2eup h TYR 244 N -0.01 1.18 -0.80 -1.35 0.05 -1.74 -2.97 116.97 111.33 2eup h TYR 244 Ca 0.03 -0.10 -0.01 0.00 0.05 0.00 0.00 58.73 58.71 2eup h TYR 244 Cb 0.53 -0.35 -0.04 0.00 1.01 0.00 0.00 36.73 37.88 2eup h TYR 244 CO 0.06 0.91 0.48 1.25 -1.05 0.00 0.00 178.16 179.82 2eup h LEU 245 N 1.12 0.96 -0.85 3.88 5.85 -0.19 -0.58 115.31 125.50 2eup h LEU 245 Ca 0.25 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.96 2eup h LEU 245 Cb 0.26 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 40.98 2eup h LEU 245 CO -0.01 0.75 0.52 -1.28 -0.34 0.00 0.00 178.44 178.08 2eup h SER 246 N 1.10 0.82 -0.06 1.25 0.87 -1.31 -1.54 113.55 114.67 2eup h SER 246 Ca 0.29 0.02 -0.21 0.00 -1.23 0.00 0.00 61.79 60.65 2eup h SER 246 Cb -0.04 -0.16 0.01 0.00 -0.44 0.00 0.00 62.40 61.77 2eup h SER 246 CO -0.05 0.53 -0.76 0.40 -0.53 0.00 0.00 176.83 176.42 2eup h ILE 247 N 0.96 1.30 -0.62 2.23 2.04 -1.34 -2.49 117.51 119.58 2eup h ILE 247 Ca 0.37 -1.99 0.09 0.00 1.00 0.00 0.00 64.86 64.33 2eup h ILE 247 Cb 0.16 1.99 -0.07 0.00 -0.74 0.00 0.00 36.82 38.16 2eup h ILE 247 CO -0.17 0.63 0.25 0.58 0.00 0.00 0.00 178.15 179.43 2eup h VAL 248 N 0.49 0.78 -0.82 1.67 2.07 -0.77 -1.63 116.25 118.04 2eup h VAL 248 Ca -0.04 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 2eup h VAL 248 Cb 1.37 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.41 2eup h VAL 248 CO 0.15 0.08 0.44 0.11 0.02 0.00 0.00 177.57 178.37 2eup h LYS 249 N 0.44 1.15 -0.59 1.57 1.57 -1.19 -0.10 116.57 119.42 2eup h LYS 249 Ca 0.31 -0.14 0.02 0.00 -1.87 0.00 0.00 60.65 58.98 2eup h LYS 249 Cb 0.38 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.43 2eup h LYS 249 CO -0.30 0.85 0.37 1.49 -0.57 0.00 0.00 179.45 181.29 2eup h GLU 250 N 1.15 0.71 0.01 3.15 4.81 -0.87 -1.52 114.58 122.02 2eup h GLU 250 Ca 0.29 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 59.28 2eup h GLU 250 Cb 0.04 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 2eup h GLU 250 CO -0.05 0.47 -0.93 1.88 -0.73 0.00 0.00 179.01 179.65 2eup h TYR 251 N 0.73 0.09 -0.53 0.92 0.05 -1.05 -1.81 116.97 115.36 2eup h TYR 251 Ca 0.23 -0.05 -0.05 0.00 0.05 0.00 0.00 58.73 58.91 2eup h TYR 251 Cb 0.00 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 37.71 2eup h TYR 251 CO -0.05 0.95 0.13 0.00 -1.05 0.00 0.00 178.16 178.14 2eup h ALA 252 N 1.03 1.24 0.00 3.88 0.00 -0.83 -3.01 119.26 121.57 2eup h ALA 252 Ca -0.02 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 2eup h ALA 252 Cb 1.62 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2eup h ALA 252 CO 0.13 0.53 -0.30 -0.97 0.00 0.00 0.00 179.25 178.64 2eup h ASN 253 N 0.78 0.00 -2.21 0.00 -1.24 -1.07 -3.44 115.58 108.40 2eup h ASN 253 Ca 0.17 0.00 -0.41 0.00 0.71 0.00 0.00 56.30 56.77 2eup h ASN 253 Cb 0.28 0.00 -0.34 0.00 0.73 0.00 0.00 38.32 38.99 2eup h ASN 253 CO -0.00 0.30 -0.71 -0.62 -1.29 0.00 0.00 177.43 175.10 2eup s ASP 254 N -6.32 1.90 0.34 1.15 -1.08 -0.70 -4.99 116.67 106.96 2eup s ASP 254 Ca 0.04 -1.44 0.05 0.00 -0.52 0.00 0.00 52.55 50.68 2eup s ASP 254 Cb 0.07 0.27 0.61 0.00 -1.46 0.00 0.00 42.92 42.41 2eup s ASP 254 CO 0.70 -0.32 1.87 -0.61 0.52 0.00 0.00 175.17 177.32 2eup h GLN 255 N 7.52 0.48 -0.77 4.34 4.15 -1.85 -2.33 115.11 126.65 2eup h GLN 255 Ca -0.02 -0.11 -0.05 0.00 0.77 0.00 0.00 58.65 59.24 2eup h GLN 255 Cb 1.04 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.63 2eup h GLN 255 CO 0.27 0.54 0.29 -0.44 -1.93 0.00 0.00 178.83 177.57 2eup h ASP 256 N 0.45 1.07 -0.34 -0.69 3.32 -1.94 0.30 116.42 118.59 2eup h ASP 256 Ca 0.09 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 56.86 2eup h ASP 256 Cb 0.37 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2eup h ASP 256 CO 0.02 0.96 -0.21 0.50 -1.72 0.00 0.00 179.24 178.78 2eup h LYS 257 N 1.13 0.75 -0.40 3.56 1.63 -1.87 -1.91 116.57 119.45 2eup h LYS 257 Ca 0.26 -0.35 0.07 0.00 -0.85 0.00 0.00 60.65 59.78 2eup h LYS 257 Cb 0.23 -0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 31.80 2eup h LYS 257 CO -0.02 0.96 0.06 0.35 -3.45 0.00 0.00 179.45 177.35 2eup h PHE 258 N 0.52 0.09 -0.44 1.91 3.57 -1.11 -0.96 116.94 120.53 2eup h PHE 258 Ca 0.07 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.62 2eup h PHE 258 Cb 0.76 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.49 2eup h PHE 258 CO 0.06 -0.01 0.25 0.74 -2.23 0.00 0.00 178.31 177.12 2eup h PHE 259 N 0.18 0.46 -0.40 0.41 -1.00 -0.74 0.22 116.94 116.07 2eup h PHE 259 Ca 0.20 0.02 0.00 0.00 2.81 0.00 0.00 57.97 61.00 2eup h PHE 259 Cb 0.25 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 39.65 2eup h PHE 259 CO -0.22 0.26 0.26 -0.22 -1.61 0.00 0.00 178.31 176.78 2eup h LYS 260 N 0.50 0.53 -0.07 1.51 3.64 -1.07 -1.33 116.57 120.28 2eup h LYS 260 Ca 0.18 -0.04 -0.19 0.00 -1.27 0.00 0.00 60.65 59.33 2eup h LYS 260 Cb 0.04 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 31.74 2eup h LYS 260 CO -0.10 0.36 -0.77 -0.44 -2.27 0.00 0.00 179.45 176.23 2eup h ASP 261 N 0.54 0.50 -0.37 4.20 3.32 -0.85 -2.84 116.42 120.93 2eup h ASP 261 Ca 0.15 -0.34 -0.03 0.00 0.02 0.00 0.00 57.03 56.82 2eup h ASP 261 Cb -0.05 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 2eup h ASP 261 CO -0.03 1.10 0.12 0.15 -1.72 0.00 0.00 179.24 178.86 2eup h PHE 262 N 0.27 0.58 -0.46 4.55 3.57 -0.47 -1.55 116.94 123.44 2eup h PHE 262 Ca -0.04 -0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.44 2eup h PHE 262 Cb 1.36 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.89 2eup h PHE 262 CO 0.05 0.55 0.24 1.03 -2.23 0.00 0.00 178.31 177.95 2eup h SER 263 N 0.44 0.36 -0.20 0.41 0.87 -1.18 0.65 113.55 114.90 2eup h SER 263 Ca 0.12 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.68 2eup h SER 263 Cb 0.24 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.14 2eup h SER 263 CO -0.01 0.25 0.06 0.11 -0.53 0.00 0.00 176.83 176.72 2eup h LYS 264 N 0.48 0.31 -0.64 2.24 1.57 -1.43 -1.92 116.57 117.19 2eup h LYS 264 Ca 0.20 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.84 2eup h LYS 264 Cb 0.09 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 2eup h LYS 264 CO -0.13 0.42 0.12 0.00 -0.57 0.00 0.00 179.45 179.28 2eup h ALA 265 N 0.88 0.84 -0.38 3.86 0.00 -0.90 -1.24 119.26 122.32 2eup h ALA 265 Ca 0.06 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 2eup h ALA 265 Cb 0.24 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2eup h ALA 265 CO -0.00 0.59 -0.15 0.35 0.00 0.00 0.00 179.25 180.04 2eup h PHE 266 N 0.96 0.89 -0.48 0.00 3.57 -0.87 -0.09 116.94 120.92 2eup h PHE 266 Ca 0.19 -0.21 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2eup h PHE 266 Cb 0.41 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 2eup h PHE 266 CO 0.03 0.94 0.31 1.49 -2.23 0.00 0.00 178.31 178.85 2eup h GLU 267 N 0.58 0.63 -0.40 1.11 4.81 -1.24 -1.50 114.58 118.56 2eup h GLU 267 Ca 0.09 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 2eup h GLU 267 Cb 0.69 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 2eup h GLU 267 CO 0.05 0.43 0.25 -0.22 -0.73 0.00 0.00 179.01 178.79 2eup h LYS 268 N 0.64 0.50 -0.33 1.92 3.64 -0.95 -1.23 116.57 120.77 2eup h LYS 268 Ca 0.17 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.58 2eup h LYS 268 Cb -0.06 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.60 2eup h LYS 268 CO -0.04 0.33 0.04 1.25 -2.27 0.00 0.00 179.45 178.76 2eup h LEU 269 N 0.51 -0.05 -0.73 5.20 5.85 -0.77 -0.72 115.31 124.61 2eup h LEU 269 Ca 0.15 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.93 2eup h LEU 269 Cb -0.03 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.09 2eup h LEU 269 CO -0.05 0.01 0.00 -0.07 -0.34 0.00 0.00 178.44 177.99 2eup h LEU 270 N 0.14 0.00 -0.97 2.25 4.07 -0.90 -3.09 115.31 116.81 2eup h LEU 270 Ca 0.16 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.12 2eup h LEU 270 Cb 0.19 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.93 2eup h LEU 270 CO -0.23 0.00 -0.27 -0.62 -1.08 0.00 0.00 178.44 176.24 2eup n GLU 271 N -2.43 1.66 -1.71 1.13 1.02 -0.50 -4.69 120.64 115.13 2eup n GLU 271 Ca 0.02 -0.88 -0.43 0.00 -0.02 0.00 0.00 57.16 55.85 2eup n GLU 271 Cb 0.28 -1.26 -0.02 0.00 -0.02 0.00 0.00 31.44 30.42 2eup n GLU 271 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2eup n ASN 272 N 0.01 3.26 0.00 1.62 3.02 -0.33 -1.92 115.26 120.91 2eup n ASN 272 Ca 0.07 1.15 0.00 0.00 -0.03 0.00 0.00 54.58 55.77 2eup n ASN 272 Cb 0.33 -1.51 0.00 0.00 -0.61 0.00 0.00 39.78 37.99 2eup n ASN 272 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2eup n GLY 273 N 1.99 1.17 3.67 7.41 0.00 -1.26 -4.44 105.19 113.73 2eup n GLY 273 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 2eup n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2eup s ILE 274 N -2.44 5.07 -0.30 -0.61 1.01 -0.81 -4.22 121.20 118.91 2eup s ILE 274 Ca 0.00 0.07 -0.15 0.00 0.00 0.00 0.00 60.65 60.57 2eup s ILE 274 Cb 0.00 -3.31 -0.03 0.00 0.01 0.00 0.00 42.46 39.14 2eup s ILE 274 CO 0.00 0.44 0.39 -0.89 0.00 0.00 0.00 174.94 174.88 2eup s THR 275 N 0.47 5.15 -0.28 2.92 2.01 0.24 -4.96 115.64 121.18 2eup s THR 275 Ca 0.05 0.40 -0.15 0.00 0.31 0.00 0.00 61.69 62.31 2eup s THR 275 Cb -0.12 -3.77 -0.03 0.00 0.01 0.00 0.00 72.50 68.59 2eup s THR 275 CO -0.00 0.04 0.36 -0.36 -0.69 0.00 0.00 174.62 173.96 2eup s PHE 276 N 2.11 3.24 0.52 4.92 0.08 -1.26 -0.95 117.98 126.63 2eup s PHE 276 Ca 0.15 0.31 -0.21 0.00 0.12 0.00 0.00 56.93 57.30 2eup s PHE 276 Cb -0.16 -2.58 -0.07 0.00 -0.57 0.00 0.00 43.02 39.64 2eup s PHE 276 CO 0.11 -0.26 1.00 -2.30 -0.10 0.00 0.00 175.22 173.67 2eup n PRO 277 N 5.33 1.16 0.32 0.24 -0.02 -1.26 -4.84 135.00 135.93 2eup n PRO 277 Ca -0.09 0.43 0.21 0.00 -2.02 0.00 0.00 63.50 62.03 2eup n PRO 277 Cb 0.51 -2.14 1.08 0.00 -0.02 0.00 0.00 33.50 32.93 2eup n PRO 277 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2eup h LYS 278 N 1.02 0.00 -0.63 -0.52 1.79 -2.01 -1.14 116.57 115.08 2eup h LYS 278 Ca -0.47 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 2eup h LYS 278 Cb 1.35 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.00 2eup h LYS 278 CO 0.54 0.00 0.00 -0.40 -1.08 0.00 0.00 179.45 178.51 2eup n ASP 279 N -3.13 3.92 -4.67 0.86 5.75 -1.26 -4.99 116.55 113.02 2eup n ASP 279 Ca -0.02 -2.11 -0.32 0.00 -0.01 0.00 0.00 54.79 52.32 2eup n ASP 279 Cb 0.13 -0.46 0.15 0.00 -1.03 0.00 0.00 41.12 39.91 2eup n ASP 279 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2eup n ALA 280 N 1.28 -0.49 -1.68 2.12 0.00 -0.43 -4.96 120.51 116.35 2eup n ALA 280 Ca 0.22 -0.45 -0.38 0.00 0.00 0.00 0.00 53.44 52.84 2eup n ALA 280 Cb 0.64 -2.21 0.05 0.00 0.00 0.00 0.00 19.45 17.94 2eup n ALA 280 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2eup n PRO 281 N -3.68 1.13 -1.01 0.00 -0.02 -1.26 -4.97 135.00 125.20 2eup n PRO 281 Ca 0.13 0.43 -0.33 0.00 -2.02 0.00 0.00 63.50 61.71 2eup n PRO 281 Cb 0.51 -2.36 0.14 0.00 -0.02 0.00 0.00 33.50 31.77 2eup n PRO 281 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2eup n SER 282 N -1.13 0.80 -4.63 2.55 7.64 -1.26 -4.94 113.62 112.65 2eup n SER 282 Ca 0.14 0.55 -0.44 0.00 1.01 0.00 0.00 58.87 60.12 2eup n SER 282 Cb 0.47 -1.49 -0.01 0.00 -1.01 0.00 0.00 64.21 62.16 2eup n SER 282 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2eup n PRO 283 N -3.44 1.63 -3.13 1.43 -0.02 -1.26 -4.94 135.00 125.26 2eup n PRO 283 Ca 0.13 0.57 -0.39 0.00 -2.02 0.00 0.00 63.50 61.80 2eup n PRO 283 Cb 0.51 -2.03 -0.06 0.00 -0.02 0.00 0.00 33.50 31.90 2eup n PRO 283 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2eup s PHE 284 N -0.98 3.84 -0.32 6.00 0.08 0.52 -4.82 117.98 122.30 2eup s PHE 284 Ca 0.59 1.44 0.00 0.00 0.12 0.00 0.00 56.93 59.08 2eup s PHE 284 Cb -0.66 -2.63 0.07 0.00 -0.57 0.00 0.00 43.02 39.23 2eup s PHE 284 CO 0.60 0.54 0.02 0.42 -0.10 0.00 0.00 175.22 176.70 2eup s ILE 285 N -1.16 2.74 0.28 0.64 1.01 -1.26 -1.05 121.20 122.40 2eup s ILE 285 Ca 0.33 -1.71 -0.29 0.00 0.00 0.00 0.00 60.65 58.98 2eup s ILE 285 Cb -0.21 -2.70 -0.09 0.00 0.01 0.00 0.00 42.46 39.46 2eup s ILE 285 CO 0.22 -0.27 1.01 -0.36 0.00 0.00 0.00 174.94 175.54 2eup s PHE 286 N 1.14 3.74 0.34 3.97 0.08 -1.26 -5.04 117.98 120.95 2eup s PHE 286 Ca -0.01 1.80 -0.27 0.00 0.12 0.00 0.00 56.93 58.57 2eup s PHE 286 Cb -0.20 -3.09 -0.09 0.00 -0.57 0.00 0.00 43.02 39.06 2eup s PHE 286 CO -0.04 -0.03 1.10 0.15 -0.10 0.00 0.00 175.22 176.30 2eup s LYS 287 N -1.52 4.36 0.91 0.44 1.02 -1.26 -5.00 119.74 118.69 2eup s LYS 287 Ca 0.45 1.72 -0.12 0.00 0.02 0.00 0.00 55.97 58.05 2eup s LYS 287 Cb -0.27 -2.87 0.14 0.00 -0.52 0.00 0.00 37.83 34.31 2eup s LYS 287 CO 0.34 -0.02 1.09 0.95 -0.92 0.00 0.00 175.35 176.79 2eup s THR 288 N -1.37 2.56 0.20 2.17 -4.23 -1.26 -4.92 115.64 108.78 2eup s THR 288 Ca 0.51 0.18 -0.11 0.00 -1.18 0.00 0.00 61.69 61.10 2eup s THR 288 Cb -0.29 -2.68 0.12 0.00 1.34 0.00 0.00 72.50 70.99 2eup s THR 288 CO 0.36 -0.24 1.80 -0.07 -0.54 0.00 0.00 174.62 175.93 2eup h LEU 289 N -1.59 0.46 -0.89 4.79 3.38 -1.97 -2.44 115.31 117.05 2eup h LEU 289 Ca -0.50 0.03 0.04 0.00 0.09 0.00 0.00 57.88 57.54 2eup h LEU 289 Cb 1.29 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.93 2eup h LEU 289 CO 0.55 0.30 0.57 -0.08 0.09 0.00 0.00 178.44 179.88 2eup h GLU 290 N 0.60 1.06 0.00 1.13 4.81 -1.93 -1.14 114.58 119.11 2eup h GLU 290 Ca 0.27 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 2eup h GLU 290 Cb 0.17 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.31 2eup h GLU 290 CO -0.18 0.70 -0.04 0.93 -0.73 0.00 0.00 179.01 179.70 2eup h GLU 291 N 1.09 0.00 -0.02 1.92 5.08 -1.80 -2.37 114.58 118.48 2eup h GLU 291 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 2eup h GLU 291 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2eup h GLU 291 CO -0.13 0.04 -0.33 1.04 -1.00 0.00 0.00 179.01 178.63 2eup n GLN 292 N -3.28 1.48 -1.93 2.33 6.02 -0.53 -4.97 117.38 116.50 2eup n GLN 292 Ca -0.02 -1.20 -0.10 0.00 -0.01 0.00 0.00 57.00 55.68 2eup n GLN 292 Cb 0.19 -1.48 -0.02 0.00 1.02 0.00 0.00 30.24 29.96 2eup n GLN 292 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2eup n GLY 293 N 1.39 0.30 0.59 1.08 0.00 -0.77 -5.09 105.19 102.68 2eup n GLY 293 Ca 0.11 -0.50 0.07 0.00 0.00 0.00 0.00 46.02 45.71 2eup n GLY 293 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36