#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u74 s THR 2 N 0.00 0.01 0.83 4.28 -1.32 -1.26 -5.17 115.64 113.01 1u74 s THR 2 Ca 0.00 -0.06 -0.11 0.00 -1.21 0.00 0.00 61.69 60.31 1u74 s THR 2 Cb 0.00 -0.93 0.09 0.00 -1.51 0.00 0.00 72.50 70.15 1u74 s THR 2 CO 0.00 -0.03 1.09 -2.16 -2.21 0.00 0.00 174.62 171.31 1u74 s PRO 3 N -0.78 1.80 0.06 7.08 0.04 -1.26 -4.96 135.00 136.98 1u74 s PRO 3 Ca -0.08 1.04 -0.31 0.00 0.04 0.00 0.00 61.00 61.69 1u74 s PRO 3 Cb -0.02 -1.85 -0.10 0.00 0.04 0.00 0.00 34.50 32.56 1u74 s PRO 3 CO 0.07 -1.92 1.90 1.28 0.04 0.00 0.00 177.00 178.36 1u74 n LEU 4 N -3.70 4.00 -4.13 -3.56 4.32 -1.26 -5.01 117.00 107.66 1u74 n LEU 4 Ca 0.08 0.95 -0.33 0.00 -0.02 0.00 0.00 56.01 56.69 1u74 n LEU 4 Cb 0.54 -1.51 -0.16 0.00 -1.62 0.00 0.00 43.42 40.67 1u74 n LEU 4 CO 0.54 0.14 -0.50 -0.69 -1.22 0.00 0.00 177.39 175.66 1u74 s VAL 5 N 3.61 2.21 -0.57 4.08 1.01 -1.26 -4.89 120.40 124.60 1u74 s VAL 5 Ca 0.86 -1.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.69 1u74 s VAL 5 Cb -0.50 -2.01 0.14 0.00 0.00 0.00 0.00 36.38 34.02 1u74 s VAL 5 CO 0.41 0.43 0.49 -1.00 0.00 0.00 0.00 175.10 175.43 1u74 s HIS 6 N 1.28 3.39 -0.09 5.22 3.76 -1.26 -5.05 115.29 122.54 1u74 s HIS 6 Ca 0.03 -1.64 -0.22 0.00 -0.15 0.00 0.00 55.06 53.07 1u74 s HIS 6 Cb -0.14 -3.69 -0.04 0.00 1.11 0.00 0.00 32.58 29.83 1u74 s HIS 6 CO -0.11 -1.00 0.66 0.08 -0.85 0.00 0.00 174.74 173.52 1u74 s VAL 7 N 1.23 5.06 -0.18 -0.90 1.01 -1.26 0.42 120.40 125.78 1u74 s VAL 7 Ca 0.07 1.34 -0.29 0.00 0.00 0.00 0.00 61.98 63.09 1u74 s VAL 7 Cb -0.25 -3.99 -0.01 0.00 0.00 0.00 0.00 36.38 32.13 1u74 s VAL 7 CO -0.00 0.24 1.17 0.00 0.00 0.00 0.00 175.10 176.51 1u74 s ALA 8 N 0.93 3.66 -0.20 5.51 0.00 0.31 -4.84 121.76 127.13 1u74 s ALA 8 Ca 0.35 0.37 0.01 0.00 0.00 0.00 0.00 51.96 52.68 1u74 s ALA 8 Cb -0.17 -3.58 0.05 0.00 0.00 0.00 0.00 23.12 19.41 1u74 s ALA 8 CO 0.16 -1.09 -0.09 0.45 0.00 0.00 0.00 175.76 175.19 1u74 s SER 9 N 1.65 3.44 0.30 0.00 0.15 -0.70 -4.62 113.70 113.92 1u74 s SER 9 Ca 0.51 -0.93 -0.29 0.00 0.70 0.00 0.00 55.95 55.93 1u74 s SER 9 Cb -0.19 -1.18 -0.11 0.00 -1.71 0.00 0.00 66.02 62.82 1u74 s SER 9 CO 0.12 -0.17 1.53 -0.69 1.20 0.00 0.00 173.24 175.23 1u74 s VAL 10 N 1.42 2.19 0.14 4.45 1.01 -1.26 -4.24 120.40 124.11 1u74 s VAL 10 Ca -0.02 0.17 -0.33 0.00 0.00 0.00 0.00 61.98 61.80 1u74 s VAL 10 Cb -0.17 -3.11 -0.12 0.00 0.00 0.00 0.00 36.38 32.98 1u74 s VAL 10 CO -0.08 0.03 1.73 -0.62 0.00 0.00 0.00 175.10 176.16 1u74 n GLU 11 N 1.77 2.53 -0.92 2.72 4.71 -1.26 -4.77 120.64 125.42 1u74 n GLU 11 Ca 0.06 0.92 -0.39 0.00 -0.01 0.00 0.00 57.16 57.73 1u74 n GLU 11 Cb 0.38 -2.75 -0.09 0.00 -1.01 0.00 0.00 31.44 27.97 1u74 n GLU 11 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1u74 n LYS 12 N 4.55 0.00 -3.54 3.49 5.02 -1.26 -1.85 118.16 124.57 1u74 n LYS 12 Ca 0.18 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.26 1u74 n LYS 12 Cb 0.33 -1.06 0.08 0.00 -0.02 0.00 0.00 35.03 34.36 1u74 n LYS 12 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u74 n GLY 13 N 5.12 -0.41 3.52 0.72 0.00 -1.26 -5.06 105.19 107.82 1u74 n GLY 13 Ca 0.41 0.15 -0.28 0.00 0.00 0.00 0.00 46.02 46.30 1u74 n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u74 s ARG 14 N -5.77 1.87 0.10 1.61 1.81 -0.77 -5.11 118.95 112.69 1u74 s ARG 14 Ca 0.20 -1.28 -0.01 0.00 -1.72 0.00 0.00 55.73 52.92 1u74 s ARG 14 Cb -0.09 -2.09 0.00 0.00 -0.45 0.00 0.00 34.95 32.32 1u74 s ARG 14 CO 0.75 0.44 0.14 -1.13 -0.68 0.00 0.00 175.30 174.82 1u74 n SER 15 N 0.34 -0.39 -0.16 0.23 3.41 -1.26 -4.90 113.62 110.88 1u74 n SER 15 Ca -0.13 -1.54 -0.03 0.00 -0.26 0.00 0.00 58.87 56.91 1u74 n SER 15 Cb 0.55 0.73 0.03 0.00 -0.26 0.00 0.00 64.21 65.26 1u74 n SER 15 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1u74 h TYR 16 N 1.29 -0.30 -0.14 7.33 -0.00 -2.00 -2.25 116.97 120.90 1u74 h TYR 16 Ca -0.08 0.05 0.00 0.00 -0.00 0.00 0.00 58.73 58.70 1u74 h TYR 16 Cb 0.34 0.21 -0.01 0.00 -0.00 0.00 0.00 36.73 37.27 1u74 h TYR 16 CO 0.00 -0.23 0.09 0.93 -0.00 0.00 0.00 178.16 178.96 1u74 h GLU 17 N -0.02 0.18 -0.27 1.82 3.07 -1.98 0.14 114.58 117.53 1u74 h GLU 17 Ca 0.24 -0.01 -0.10 0.00 -0.50 0.00 0.00 59.36 58.99 1u74 h GLU 17 Cb 0.38 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 28.24 1u74 h GLU 17 CO -0.52 0.12 -0.22 -0.44 -1.40 0.00 0.00 179.01 176.55 1u74 h ASP 18 N 0.19 0.66 1.28 1.42 3.45 -1.82 -3.05 116.42 118.55 1u74 h ASP 18 Ca 0.05 -0.46 -0.10 0.00 0.43 0.00 0.00 57.03 56.95 1u74 h ASP 18 Cb -0.02 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.55 1u74 h ASP 18 CO -0.01 0.98 -0.48 -0.26 -1.57 0.00 0.00 179.24 177.89 1u74 h PHE 19 N 0.34 0.00 0.00 4.55 0.04 -1.11 -3.15 116.94 117.62 1u74 h PHE 19 Ca 0.05 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.74 1u74 h PHE 19 Cb 0.77 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.91 1u74 h PHE 19 CO 0.07 0.48 -0.37 0.37 -0.60 0.00 0.00 178.31 178.26 1u74 h GLN 20 N 0.00 0.00 -0.04 1.51 5.75 -0.75 -2.38 115.11 119.20 1u74 h GLN 20 Ca -0.00 0.00 -0.19 0.00 -0.15 0.00 0.00 58.65 58.31 1u74 h GLN 20 Cb 1.25 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.80 1u74 h GLN 20 CO 0.06 0.37 -0.79 0.87 -2.65 0.00 0.00 178.83 176.70 1u74 h LYS 21 N 0.00 0.33 -0.11 1.69 1.57 -1.49 -1.78 116.57 116.78 1u74 h LYS 21 Ca -0.00 -0.30 -0.18 0.00 -1.87 0.00 0.00 60.65 58.29 1u74 h LYS 21 Cb 0.85 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.23 1u74 h LYS 21 CO 0.05 0.97 -0.69 0.28 -0.57 0.00 0.00 179.45 179.48 1u74 h VAL 22 N 0.21 1.35 -0.06 0.50 2.07 -1.56 -2.20 116.25 116.57 1u74 h VAL 22 Ca -0.04 -2.03 -0.01 0.00 0.82 0.00 0.00 66.70 65.44 1u74 h VAL 22 Cb 1.38 2.01 -0.00 0.00 -1.52 0.00 0.00 31.29 33.16 1u74 h VAL 22 CO 0.13 0.62 0.00 0.22 0.02 0.00 0.00 177.57 178.56 1u74 h TYR 23 N 0.35 0.10 -0.62 1.57 5.03 -1.39 -2.22 116.97 119.78 1u74 h TYR 23 Ca -0.02 -0.02 0.06 0.00 2.58 0.00 0.00 58.73 61.33 1u74 h TYR 23 Cb 1.26 -0.03 -0.06 0.00 1.55 0.00 0.00 36.73 39.46 1u74 h TYR 23 CO 0.05 0.36 0.32 -0.91 -1.32 0.00 0.00 178.16 176.66 1u74 h ASN 24 N -0.18 0.45 -0.34 -2.11 -0.26 -1.33 0.91 115.58 112.73 1u74 h ASN 24 Ca 0.02 0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.80 1u74 h ASN 24 Cb 0.32 -0.04 -0.02 0.00 -1.06 0.00 0.00 38.32 37.52 1u74 h ASN 24 CO 0.00 0.29 0.22 0.00 -1.06 0.00 0.00 177.43 176.88 1u74 h ALA 25 N 1.35 0.43 -0.13 -0.83 0.00 -1.34 0.68 119.26 119.42 1u74 h ALA 25 Ca 0.29 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1u74 h ALA 25 Cb 0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1u74 h ALA 25 CO -0.20 -0.09 0.02 0.82 0.00 0.00 0.00 179.25 179.80 1u74 h ILE 26 N 0.45 1.22 -0.53 0.00 2.04 -1.05 -2.56 117.51 117.09 1u74 h ILE 26 Ca 0.12 -0.71 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 1u74 h ILE 26 Cb -0.03 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 1u74 h ILE 26 CO -0.03 0.21 0.31 0.00 0.00 0.00 0.00 178.15 178.64 1u74 h ALA 27 N 0.79 1.55 -0.05 1.87 0.00 -0.64 -1.84 119.26 120.95 1u74 h ALA 27 Ca 0.04 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 1u74 h ALA 27 Cb 0.30 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1u74 h ALA 27 CO 0.00 0.39 -0.79 -0.07 0.00 0.00 0.00 179.25 178.78 1u74 h LEU 28 N 0.73 0.45 -1.05 0.00 3.38 -0.79 -2.91 115.31 115.11 1u74 h LEU 28 Ca 0.19 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1u74 h LEU 28 Cb -0.01 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1u74 h LEU 28 CO -0.03 1.08 -0.16 0.50 0.09 0.00 0.00 178.44 179.92 1u74 h LYS 29 N 0.24 0.00 -0.08 1.13 3.64 -1.04 -1.20 116.57 119.25 1u74 h LYS 29 Ca -0.04 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.15 1u74 h LYS 29 Cb 1.38 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.20 1u74 h LYS 29 CO 0.13 0.16 -0.74 1.25 -2.27 0.00 0.00 179.45 177.98 1u74 h LEU 30 N 0.00 0.53 0.01 5.20 5.85 -1.25 -1.15 115.31 124.50 1u74 h LEU 30 Ca -0.00 -0.35 -0.26 0.00 0.84 0.00 0.00 57.88 58.10 1u74 h LEU 30 Cb 0.74 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.62 1u74 h LEU 30 CO 0.02 1.10 -1.14 0.03 -0.34 0.00 0.00 178.44 178.12 1u74 h ARG 31 N 0.30 0.39 0.18 1.25 3.08 -1.28 -3.37 114.38 114.93 1u74 h ARG 31 Ca -0.04 -0.53 -0.33 0.00 0.07 0.00 0.00 59.98 59.15 1u74 h ARG 31 Cb 1.33 0.18 0.01 0.00 0.08 0.00 0.00 29.97 31.57 1u74 h ARG 31 CO 0.13 1.21 -1.62 0.93 -1.07 0.00 0.00 179.97 179.55 1u74 h GLU 32 N 0.17 0.38 -1.91 0.04 3.07 -1.20 -3.35 114.58 111.77 1u74 h GLU 32 Ca -0.13 -0.65 -0.49 0.00 -0.50 0.00 0.00 59.36 57.59 1u74 h GLU 32 Cb 1.82 0.24 -0.18 0.00 -0.84 0.00 0.00 28.75 29.79 1u74 h GLU 32 CO 0.20 1.28 0.43 -0.25 -1.40 0.00 0.00 179.01 179.27 1u74 n ASP 33 N -3.57 6.55 0.00 1.42 9.92 -0.44 -4.70 116.55 125.72 1u74 n ASP 33 Ca -0.20 -3.23 0.10 0.00 -0.53 0.00 0.00 54.79 50.93 1u74 n ASP 33 Cb 1.07 -1.20 0.56 0.00 -0.64 0.00 0.00 41.12 40.91 1u74 n ASP 33 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1u74 n ASP 34 N 0.70 0.00 0.12 -2.24 5.75 -1.26 -3.77 116.55 115.85 1u74 n ASP 34 Ca 0.47 -0.18 -0.02 0.00 -0.01 0.00 0.00 54.79 55.05 1u74 n ASP 34 Cb 0.54 -0.22 0.08 0.00 -1.03 0.00 0.00 41.12 40.50 1u74 n ASP 34 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1u74 h GLU 35 N 0.00 0.00 -6.27 0.11 5.08 -1.92 -3.38 114.58 108.20 1u74 h GLU 35 Ca 0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 1u74 h GLU 35 Cb 0.15 0.00 0.10 0.00 0.50 0.00 0.00 28.75 29.50 1u74 h GLU 35 CO 0.00 0.71 -0.08 0.98 -1.00 0.00 0.00 179.01 179.62 1u74 n TYR 36 N -3.58 0.64 -3.82 4.33 9.36 -1.25 -1.65 117.16 121.19 1u74 n TYR 36 Ca -0.00 0.81 -0.25 0.00 3.32 0.00 0.00 57.90 61.77 1u74 n TYR 36 Cb 0.72 -2.15 0.01 0.00 -0.63 0.00 0.00 39.34 37.29 1u74 n TYR 36 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1u74 n ASP 37 N 1.63 -1.63 -3.78 2.98 4.64 -1.26 -1.18 116.55 117.95 1u74 n ASP 37 Ca 0.14 -0.96 -0.23 0.00 -1.38 0.00 0.00 54.79 52.36 1u74 n ASP 37 Cb 0.27 -3.41 0.02 0.00 -1.04 0.00 0.00 41.12 36.96 1u74 n ASP 37 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 1u74 n ASN 38 N -2.94 -1.04 -0.98 1.67 5.03 -1.18 -2.89 115.26 112.94 1u74 n ASN 38 Ca -0.26 -0.87 -0.09 0.00 0.87 0.00 0.00 54.58 54.22 1u74 n ASN 38 Cb 0.66 -3.76 -0.01 0.00 -1.02 0.00 0.00 39.78 35.65 1u74 n ASN 38 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1u74 n TYR 39 N -4.32 -0.33 0.06 3.10 4.01 -0.66 -4.91 117.16 114.11 1u74 n TYR 39 Ca -0.29 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.26 1u74 n TYR 39 Cb 0.67 -2.21 -0.14 0.00 -0.31 0.00 0.00 39.34 37.35 1u74 n TYR 39 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 1u74 h ILE 40 N 0.00 1.03 0.00 -0.72 2.04 -1.18 -3.48 117.51 115.19 1u74 h ILE 40 Ca -0.22 -2.66 0.00 0.00 1.00 0.00 0.00 64.86 62.98 1u74 h ILE 40 Cb 1.02 2.73 0.00 0.00 -0.74 0.00 0.00 36.82 39.82 1u74 h ILE 40 CO 0.27 0.82 0.00 0.61 0.00 0.00 0.00 178.15 179.85 1u74 n GLY 41 N 1.75 -3.04 0.11 5.37 0.00 -0.32 -4.61 105.19 104.45 1u74 n GLY 41 Ca -0.20 -1.83 0.14 0.00 0.00 0.00 0.00 46.02 44.13 1u74 n GLY 41 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1u74 n TYR 42 N -0.34 0.00 0.13 1.61 4.01 -1.26 -4.44 117.16 116.87 1u74 n TYR 42 Ca 0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.58 1u74 n TYR 42 Cb 0.00 -0.16 -0.09 0.00 -0.31 0.00 0.00 39.34 38.78 1u74 n TYR 42 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1u74 h GLY 43 N 4.97 -1.12 0.75 2.72 0.00 -1.92 -2.15 103.07 106.33 1u74 h GLY 43 Ca 0.00 0.62 0.05 0.00 0.00 0.00 0.00 47.33 48.00 1u74 h GLY 43 CO 0.00 -0.28 0.50 -2.55 0.00 0.00 0.00 176.54 174.21 1u74 h PRO 44 N -0.76 0.89 0.00 4.80 0.11 -1.88 -2.73 132.00 132.44 1u74 h PRO 44 Ca -0.00 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.99 1u74 h PRO 44 Cb 0.76 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1u74 h PRO 44 CO -0.27 0.59 -0.29 -0.24 -0.21 0.00 0.00 178.00 177.59 1u74 h VAL 45 N 0.92 0.74 0.00 3.15 3.04 -1.81 -2.37 116.25 119.92 1u74 h VAL 45 Ca 0.35 -1.25 -0.20 0.00 -1.01 0.00 0.00 66.70 64.59 1u74 h VAL 45 Cb 0.13 1.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.19 1u74 h VAL 45 CO -0.16 0.28 -0.88 -0.07 -1.01 0.00 0.00 177.57 175.74 1u74 h LEU 46 N 0.00 0.23 -0.18 3.16 3.38 -1.08 -1.62 115.31 119.20 1u74 h LEU 46 Ca -0.00 -0.19 -0.17 0.00 0.09 0.00 0.00 57.88 57.61 1u74 h LEU 46 Cb 0.77 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 1u74 h LEU 46 CO 0.04 1.00 -0.80 -0.37 0.09 0.00 0.00 178.44 178.39 1u74 h VAL 47 N 0.10 1.46 -0.08 1.22 -1.51 -1.36 -1.81 116.25 114.27 1u74 h VAL 47 Ca -0.04 -2.87 -0.14 0.00 -1.23 0.00 0.00 66.70 62.41 1u74 h VAL 47 Cb 1.51 2.60 -0.01 0.00 -2.13 0.00 0.00 31.29 33.25 1u74 h VAL 47 CO 0.13 0.79 -0.58 -0.09 -1.23 0.00 0.00 177.57 176.59 1u74 h ARG 48 N 0.00 0.25 -0.37 5.19 2.43 -1.41 -1.65 114.38 118.82 1u74 h ARG 48 Ca -0.01 -0.16 -0.16 0.00 -0.81 0.00 0.00 59.98 58.84 1u74 h ARG 48 Cb 1.54 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 31.10 1u74 h ARG 48 CO 0.10 0.76 -0.39 1.25 -1.51 0.00 0.00 179.97 180.18 1u74 h LEU 49 N 0.19 0.99 -1.10 3.80 6.46 -1.18 0.49 115.31 124.96 1u74 h LEU 49 Ca -0.00 -0.47 -0.06 0.00 -0.12 0.00 0.00 57.88 57.23 1u74 h LEU 49 Cb 1.07 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.70 1u74 h LEU 49 CO 0.09 1.26 -0.02 0.00 -0.62 0.00 0.00 178.44 179.15 1u74 h ALA 50 N 0.76 1.26 0.06 1.25 0.00 -1.05 -2.44 119.26 119.10 1u74 h ALA 50 Ca 0.06 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.55 1u74 h ALA 50 Cb 0.99 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 18.63 1u74 h ALA 50 CO 0.10 0.49 -0.74 2.35 0.00 0.00 0.00 179.25 181.45 1u74 h TRP 51 N 0.58 0.63 0.00 0.00 -0.00 -1.07 -3.21 115.95 112.88 1u74 h TRP 51 Ca 0.12 -0.38 -0.05 0.00 -0.00 0.00 0.00 58.89 58.58 1u74 h TRP 51 Cb 0.39 -0.05 -0.01 0.00 -0.00 0.00 0.00 29.16 29.49 1u74 h TRP 51 CO 0.02 1.24 -0.22 0.45 -0.00 0.00 0.00 178.44 179.92 1u74 h HIS 52 N -0.16 0.00 0.00 2.65 3.86 -0.75 0.67 115.15 121.42 1u74 h HIS 52 Ca -0.11 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 58.99 1u74 h HIS 52 Cb 1.48 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.94 1u74 h HIS 52 CO 0.16 0.22 -0.56 -0.84 0.86 0.00 0.00 177.93 177.78 1u74 h ILE 53 N 0.00 0.82 0.00 2.45 -0.00 -1.56 -3.29 117.51 115.93 1u74 h ILE 53 Ca -0.00 -2.17 -0.25 0.00 -0.00 0.00 0.00 64.86 62.43 1u74 h ILE 53 Cb 0.62 2.39 -0.04 0.00 -0.00 0.00 0.00 36.82 39.78 1u74 h ILE 53 CO 0.03 0.47 -1.67 -1.20 -0.00 0.00 0.00 178.15 175.78 1u74 n SER 54 N -3.20 0.78 0.06 2.16 7.64 -0.94 -3.05 113.62 117.07 1u74 n SER 54 Ca 0.01 0.36 0.08 0.00 1.01 0.00 0.00 58.87 60.33 1u74 n SER 54 Cb 0.74 0.14 0.36 0.00 -1.01 0.00 0.00 64.21 64.43 1u74 n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1u74 n GLY 55 N 1.51 -1.01 0.00 0.23 0.00 0.23 -2.69 105.19 103.46 1u74 n GLY 55 Ca -0.15 0.03 0.15 0.00 0.00 0.00 0.00 46.02 46.04 1u74 n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1u74 n THR 56 N -1.82 0.03 -2.02 2.61 -2.24 -1.26 -4.65 114.28 104.92 1u74 n THR 56 Ca 0.02 0.01 -0.36 0.00 -2.27 0.00 0.00 64.05 61.45 1u74 n THR 56 Cb 0.15 -0.52 0.03 0.00 -2.10 0.00 0.00 70.33 67.89 1u74 n THR 56 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1u74 s TRP 57 N -2.43 2.44 -0.21 4.78 -0.00 -1.10 -4.10 118.94 118.33 1u74 s TRP 57 Ca 0.32 1.53 -0.05 0.00 -0.00 0.00 0.00 56.10 57.91 1u74 s TRP 57 Cb 0.20 -3.43 0.08 0.00 -0.00 0.00 0.00 33.47 30.32 1u74 s TRP 57 CO 0.43 -2.08 0.12 0.34 -0.00 0.00 0.00 176.95 175.76 1u74 s ASP 58 N -1.70 2.53 0.49 5.86 -1.08 -0.85 -4.65 116.67 117.26 1u74 s ASP 58 Ca 0.76 -0.75 0.18 0.00 -0.52 0.00 0.00 52.55 52.21 1u74 s ASP 58 Cb -0.28 -0.19 1.21 0.00 -1.46 0.00 0.00 42.92 42.20 1u74 s ASP 58 CO 0.33 -0.37 2.05 0.07 0.52 0.00 0.00 175.17 177.76 1u74 h LYS 59 N 8.40 0.16 -0.76 4.34 2.10 -1.73 -0.35 116.57 128.73 1u74 h LYS 59 Ca -0.16 -0.01 0.03 0.00 -2.00 0.00 0.00 60.65 58.50 1u74 h LYS 59 Cb 1.11 -0.04 -0.04 0.00 -0.90 0.00 0.00 32.23 32.36 1u74 h LYS 59 CO 0.33 0.10 0.49 0.45 -2.00 0.00 0.00 179.45 178.82 1u74 h HIS 60 N 0.16 0.91 0.00 0.07 -0.00 -1.97 -3.20 115.15 111.13 1u74 h HIS 60 Ca 0.17 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.56 1u74 h HIS 60 Cb 0.46 -0.30 0.00 0.00 -0.00 0.00 0.00 27.41 27.57 1u74 h HIS 60 CO -0.00 0.53 0.00 -0.40 -0.00 0.00 0.00 177.93 178.06 1u74 n ASP 61 N -4.61 0.97 -1.50 2.45 5.75 -1.21 -5.04 116.55 113.37 1u74 n ASP 61 Ca 0.08 -1.00 -0.17 0.00 -0.01 0.00 0.00 54.79 53.69 1u74 n ASP 61 Cb 0.07 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.11 1u74 n ASP 61 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1u74 n ASN 62 N -0.00 -4.99 -4.87 -1.12 2.85 -0.15 -4.49 115.26 102.49 1u74 n ASN 62 Ca 0.00 0.26 -0.31 0.00 -0.11 0.00 0.00 54.58 54.42 1u74 n ASN 62 Cb 0.01 -4.01 -0.05 0.00 1.24 0.00 0.00 39.78 36.97 1u74 n ASN 62 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 1u74 s THR 63 N -2.70 4.87 0.00 -0.44 -4.23 -1.22 -4.90 115.64 107.03 1u74 s THR 63 Ca 0.00 0.55 0.00 0.00 -1.18 0.00 0.00 61.69 61.06 1u74 s THR 63 Cb 0.00 -3.64 0.00 0.00 1.34 0.00 0.00 72.50 70.20 1u74 s THR 63 CO 0.00 -0.18 0.00 0.61 -0.54 0.00 0.00 174.62 174.51 1u74 n GLY 64 N -0.42 -1.46 0.00 3.99 0.00 -1.26 -2.01 105.19 104.03 1u74 n GLY 64 Ca 0.01 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1u74 n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u74 n GLY 65 N 0.00 -0.63 0.25 -0.02 0.00 -1.25 -4.66 105.19 98.88 1u74 n GLY 65 Ca 0.00 -1.76 -0.08 0.00 0.00 0.00 0.00 46.02 44.18 1u74 n GLY 65 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1u74 h SER 66 N 0.00 0.79 -0.04 1.61 4.64 -1.76 -3.39 113.55 115.41 1u74 h SER 66 Ca 0.00 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1u74 h SER 66 Cb 0.00 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 61.88 1u74 h SER 66 CO 0.00 0.80 -0.02 0.00 -0.87 0.00 0.00 176.83 176.74 1u74 n TYR 67 N -4.45 -0.02 0.22 4.77 9.36 -1.26 -1.91 117.16 123.86 1u74 n TYR 67 Ca 0.02 0.04 0.12 0.00 3.32 0.00 0.00 57.90 61.41 1u74 n TYR 67 Cb 0.21 -0.27 0.61 0.00 -0.63 0.00 0.00 39.34 39.26 1u74 n TYR 67 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 1u74 h GLY 68 N 0.00 0.00 -1.12 2.98 0.00 -1.76 -3.23 103.07 99.94 1u74 h GLY 68 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.96 1u74 h GLY 68 CO -0.03 0.00 -0.34 0.61 0.00 0.00 0.00 176.54 176.78 1u74 n GLY 69 N -1.04 1.74 0.00 4.60 0.00 -0.80 -2.77 105.19 106.91 1u74 n GLY 69 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1u74 n GLY 69 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1u74 n THR 70 N -2.21 0.00 0.19 2.61 -2.24 -1.26 -2.95 114.28 108.41 1u74 n THR 70 Ca -0.18 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.66 1u74 n THR 70 Cb 0.60 -0.39 0.30 0.00 -2.10 0.00 0.00 70.33 68.74 1u74 n THR 70 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1u74 h TYR 71 N 0.00 0.00 0.00 4.78 3.20 -1.94 -3.17 116.97 119.84 1u74 h TYR 71 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1u74 h TYR 71 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 1u74 h TYR 71 CO 0.00 0.34 0.00 0.07 -1.64 0.00 0.00 178.16 176.93 1u74 h ARG 72 N 0.00 0.00 -6.19 1.82 0.11 -1.93 -3.21 114.38 104.98 1u74 h ARG 72 Ca -0.00 0.00 -0.57 0.00 0.10 0.00 0.00 59.98 59.51 1u74 h ARG 72 Cb 0.97 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 32.01 1u74 h ARG 72 CO 0.04 0.00 -0.01 -0.06 0.10 0.00 0.00 179.97 180.05 1u74 s PHE 73 N -3.60 3.76 0.60 4.08 0.08 -1.20 -4.94 117.98 116.75 1u74 s PHE 73 Ca 0.01 1.27 0.29 0.00 0.12 0.00 0.00 56.93 58.62 1u74 s PHE 73 Cb 0.09 -2.57 1.47 0.00 -0.57 0.00 0.00 43.02 41.44 1u74 s PHE 73 CO 0.42 0.47 1.88 1.57 -0.10 0.00 0.00 175.22 179.46 1u74 h LYS 74 N 5.05 0.00 -0.14 0.44 2.10 -1.89 -1.55 116.57 120.57 1u74 h LYS 74 Ca -0.47 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.16 1u74 h LYS 74 Cb 1.21 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.53 1u74 h LYS 74 CO 0.67 0.00 0.03 -0.22 -2.00 0.00 0.00 179.45 177.92 1u74 h LYS 75 N 0.00 0.22 0.13 0.07 3.64 -1.92 -0.88 116.57 117.82 1u74 h LYS 75 Ca 0.20 -0.06 -0.28 0.00 -1.27 0.00 0.00 60.65 59.24 1u74 h LYS 75 Cb 1.18 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1u74 h LYS 75 CO -0.00 0.40 -1.32 1.49 -2.27 0.00 0.00 179.45 177.75 1u74 h GLU 76 N 0.01 0.27 -0.73 1.90 4.81 -1.70 -3.25 114.58 115.90 1u74 h GLU 76 Ca 0.04 -0.46 0.01 0.00 -0.13 0.00 0.00 59.36 58.82 1u74 h GLU 76 Cb 0.28 0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.80 1u74 h GLU 76 CO 0.00 1.19 0.48 0.35 -0.73 0.00 0.00 179.01 180.30 1u74 h PHE 77 N 0.07 0.90 -0.33 0.92 3.57 -1.30 -2.69 116.94 118.09 1u74 h PHE 77 Ca -0.16 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.36 1u74 h PHE 77 Cb 1.99 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 40.42 1u74 h PHE 77 CO 0.06 0.56 0.00 0.09 -2.23 0.00 0.00 178.31 176.79 1u74 n ASN 78 N -4.59 2.93 -4.69 0.41 3.02 -0.34 -4.85 115.26 107.16 1u74 n ASN 78 Ca 0.07 -2.30 -0.42 0.00 -0.03 0.00 0.00 54.58 51.90 1u74 n ASN 78 Cb 0.03 -0.47 -0.03 0.00 -0.61 0.00 0.00 39.78 38.71 1u74 n ASN 78 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1u74 s ASP 79 N -0.63 6.59 0.53 6.41 -1.08 -1.02 -4.88 116.67 122.59 1u74 s ASP 79 Ca 0.27 2.49 0.32 0.00 -0.52 0.00 0.00 52.55 55.11 1u74 s ASP 79 Cb 0.19 -2.56 1.47 0.00 -1.46 0.00 0.00 42.92 40.55 1u74 s ASP 79 CO 0.12 -0.90 1.87 -0.65 0.52 0.00 0.00 175.17 176.13 1u74 h PRO 80 N 8.46 0.03 -0.01 4.34 0.11 -1.91 0.15 132.00 143.16 1u74 h PRO 80 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1u74 h PRO 80 Cb 1.20 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1u74 h PRO 80 CO 0.93 0.02 0.00 -1.13 -0.21 0.00 0.00 178.00 177.61 1u74 n SER 81 N -4.27 0.87 -1.43 -2.05 3.41 -1.26 -3.30 113.62 105.59 1u74 n SER 81 Ca 0.20 -1.30 0.08 0.00 -0.26 0.00 0.00 58.87 57.59 1u74 n SER 81 Cb 1.00 -0.00 0.34 0.00 -0.26 0.00 0.00 64.21 65.29 1u74 n SER 81 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1u74 n ASN 82 N -0.31 4.85 -4.69 4.04 3.02 0.51 -5.00 115.26 117.68 1u74 n ASN 82 Ca 0.21 -2.93 -0.42 0.00 -0.03 0.00 0.00 54.58 51.41 1u74 n ASN 82 Cb 0.25 -0.61 -0.03 0.00 -0.61 0.00 0.00 39.78 38.78 1u74 n ASN 82 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1u74 s ALA 83 N -2.72 3.59 0.00 5.41 0.00 -1.21 -2.50 121.76 124.33 1u74 s ALA 83 Ca 0.49 0.95 0.00 0.00 0.00 0.00 0.00 51.96 53.40 1u74 s ALA 83 Cb 0.38 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.91 1u74 s ALA 83 CO 0.13 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.44 1u74 n GLY 84 N 3.64 1.83 0.05 0.00 0.00 -1.26 -4.83 105.19 104.62 1u74 n GLY 84 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.28 1u74 n GLY 84 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u74 n LEU 85 N 0.00 0.33 0.03 0.99 4.77 -1.04 -3.35 117.00 118.73 1u74 n LEU 85 Ca 0.00 0.54 0.01 0.00 -0.03 0.00 0.00 56.01 56.53 1u74 n LEU 85 Cb 0.00 -0.45 0.35 0.00 -2.33 0.00 0.00 43.42 40.99 1u74 n LEU 85 CO 0.00 -0.14 0.97 1.56 -1.33 0.00 0.00 177.39 178.45 1u74 h GLN 86 N 0.00 0.45 -0.24 3.23 7.50 -1.92 -1.46 115.11 122.66 1u74 h GLN 86 Ca 0.00 -0.08 -0.05 0.00 0.50 0.00 0.00 58.65 59.02 1u74 h GLN 86 Cb 0.54 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 27.98 1u74 h GLN 86 CO 0.00 0.46 -0.06 -0.91 -1.50 0.00 0.00 178.83 176.82 1u74 h ASN 87 N 0.44 0.36 -0.03 1.46 -0.26 -1.97 0.15 115.58 115.73 1u74 h ASN 87 Ca 0.10 -0.07 -0.24 0.00 -0.56 0.00 0.00 56.30 55.53 1u74 h ASN 87 Cb 0.26 -0.09 0.01 0.00 -1.06 0.00 0.00 38.32 37.44 1u74 h ASN 87 CO 0.00 0.47 -0.91 1.23 -1.06 0.00 0.00 177.43 177.16 1u74 h GLY 88 N 0.78 0.79 1.34 2.83 0.00 -1.49 -2.78 103.07 104.55 1u74 h GLY 88 Ca 0.08 -1.25 -0.10 0.00 0.00 0.00 0.00 47.33 46.05 1u74 h GLY 88 CO 0.02 1.11 -0.16 -2.75 0.00 0.00 0.00 176.54 174.76 1u74 h PHE 89 N 0.45 0.86 -0.40 5.60 3.57 -0.76 -2.83 116.94 123.43 1u74 h PHE 89 Ca -0.09 -0.17 -0.09 0.00 3.53 0.00 0.00 57.97 61.14 1u74 h PHE 89 Cb 1.55 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 40.06 1u74 h PHE 89 CO 0.09 0.88 -0.14 0.87 -2.23 0.00 0.00 178.31 177.78 1u74 h LYS 90 N 0.69 0.73 -0.43 1.11 1.57 -0.73 -2.33 116.57 117.18 1u74 h LYS 90 Ca 0.11 -0.25 -0.07 0.00 -1.87 0.00 0.00 60.65 58.57 1u74 h LYS 90 Cb 0.65 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 1u74 h LYS 90 CO 0.05 0.83 -0.01 0.35 -0.57 0.00 0.00 179.45 180.10 1u74 h PHE 91 N 0.65 0.75 0.00 -1.35 3.04 -1.31 -3.08 116.94 115.65 1u74 h PHE 91 Ca 0.11 -0.10 0.00 0.00 3.98 0.00 0.00 57.97 61.96 1u74 h PHE 91 Cb 0.61 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 38.91 1u74 h PHE 91 CO 0.03 0.72 -0.53 -0.07 -2.02 0.00 0.00 178.31 176.43 1u74 h LEU 92 N 0.67 0.00 -1.23 0.59 3.38 -1.36 -3.38 115.31 113.98 1u74 h LEU 92 Ca 0.13 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 1u74 h LEU 92 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1u74 h LEU 92 CO 0.02 0.01 -0.10 1.05 0.09 0.00 0.00 178.44 179.50 1u74 h GLU 93 N 0.00 0.41 -0.12 1.13 4.11 -1.32 -1.71 114.58 117.08 1u74 h GLU 93 Ca 0.00 -0.10 -0.11 0.00 0.07 0.00 0.00 59.36 59.21 1u74 h GLU 93 Cb 0.98 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 1u74 h GLU 93 CO 0.00 0.52 -0.43 -1.35 0.07 0.00 0.00 179.01 177.82 1u74 h PRO 94 N 0.39 0.28 0.00 1.06 0.11 -1.74 -2.42 132.00 129.68 1u74 h PRO 94 Ca 0.08 -0.14 -0.08 0.00 0.11 0.00 0.00 66.00 65.97 1u74 h PRO 94 Cb 0.42 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 1u74 h PRO 94 CO 0.02 0.67 -0.38 0.82 -0.21 0.00 0.00 178.00 178.91 1u74 h ILE 95 N 0.23 0.95 0.00 4.15 2.04 -1.72 -2.72 117.51 120.45 1u74 h ILE 95 Ca 0.02 -1.51 -0.14 0.00 1.00 0.00 0.00 64.86 64.23 1u74 h ILE 95 Cb 0.86 1.90 -0.02 0.00 -0.74 0.00 0.00 36.82 38.81 1u74 h ILE 95 CO 0.07 0.38 -0.69 -0.74 0.00 0.00 0.00 178.15 177.17 1u74 h HIS 96 N 0.00 0.00 -0.00 1.37 2.76 -0.85 -2.05 115.15 116.38 1u74 h HIS 96 Ca -0.00 0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.03 1u74 h HIS 96 Cb 0.87 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.81 1u74 h HIS 96 CO 0.00 0.69 -0.67 0.87 -1.30 0.00 0.00 177.93 177.52 1u74 h LYS 97 N 0.00 0.00 -0.15 5.26 6.56 -1.17 -2.26 116.57 124.81 1u74 h LYS 97 Ca -0.01 -0.00 -0.19 0.00 -1.06 0.00 0.00 60.65 59.39 1u74 h LYS 97 Cb 1.40 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.07 1u74 h LYS 97 CO 0.09 0.67 -0.69 1.49 -2.06 0.00 0.00 179.45 178.95 1u74 h GLU 98 N 0.00 0.64 -2.34 3.15 4.81 -1.34 -3.36 114.58 116.14 1u74 h GLU 98 Ca -0.01 -0.48 -0.59 0.00 -0.13 0.00 0.00 59.36 58.15 1u74 h GLU 98 Cb 1.19 0.09 -0.41 0.00 0.63 0.00 0.00 28.75 30.25 1u74 h GLU 98 CO 0.09 1.10 -0.79 1.19 -0.73 0.00 0.00 179.01 179.86 1u74 n PHE 99 N -3.92 1.73 0.77 0.92 3.72 -0.78 -4.97 117.46 114.93 1u74 n PHE 99 Ca -0.05 -3.89 0.08 0.00 -0.05 0.00 0.00 57.45 53.54 1u74 n PHE 99 Cb 0.69 -0.39 0.40 0.00 -0.94 0.00 0.00 39.48 39.25 1u74 n PHE 99 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1u74 n PRO 100 N 1.52 0.27 0.10 -1.08 -0.04 -0.86 -3.15 135.00 131.77 1u74 n PRO 100 Ca 0.25 0.11 -0.16 0.00 -0.04 0.00 0.00 63.50 63.67 1u74 n PRO 100 Cb 0.44 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.27 1u74 n PRO 100 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 1u74 h TRP 101 N 0.00 0.53 -3.73 0.54 5.08 -1.93 -3.46 115.95 112.98 1u74 h TRP 101 Ca 0.00 -0.37 -0.52 0.00 1.08 0.00 0.00 58.89 59.07 1u74 h TRP 101 Cb 0.11 -0.03 0.06 0.00 -3.00 0.00 0.00 29.16 26.31 1u74 h TRP 101 CO 0.00 1.28 0.67 -1.50 -1.28 0.00 0.00 178.44 177.61 1u74 s ILE 102 N -2.72 2.73 0.66 0.12 2.07 -1.19 -4.97 121.20 117.91 1u74 s ILE 102 Ca -0.04 0.69 -0.12 0.00 -1.41 0.00 0.00 60.65 59.77 1u74 s ILE 102 Cb 0.07 -3.44 -0.01 0.00 0.13 0.00 0.00 42.46 39.21 1u74 s ILE 102 CO 0.89 0.15 1.05 -0.94 -1.91 0.00 0.00 174.94 174.18 1u74 s SER 103 N -0.22 5.57 0.18 4.50 1.04 -1.26 -4.93 113.70 118.58 1u74 s SER 103 Ca 0.52 1.64 -0.12 0.00 0.48 0.00 0.00 55.95 58.46 1u74 s SER 103 Cb -0.40 -2.50 0.09 0.00 0.10 0.00 0.00 66.02 63.31 1u74 s SER 103 CO 0.50 -1.31 1.80 0.28 0.98 0.00 0.00 173.24 175.49 1u74 h SER 104 N -0.41 0.75 -0.79 7.02 0.02 -1.90 -2.15 113.55 116.10 1u74 h SER 104 Ca -0.44 -0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 60.39 1u74 h SER 104 Cb 1.21 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 63.52 1u74 h SER 104 CO 0.57 0.62 0.39 1.23 -1.14 0.00 0.00 176.83 178.50 1u74 h GLY 105 N 0.83 1.23 1.77 -3.77 0.00 -1.77 -1.68 103.07 99.67 1u74 h GLY 105 Ca 0.22 -0.60 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 1u74 h GLY 105 CO -0.04 0.57 -0.34 -0.55 0.00 0.00 0.00 176.54 176.18 1u74 h ASP 106 N 1.14 0.27 -0.01 0.19 3.45 -1.79 -2.85 116.42 116.82 1u74 h ASP 106 Ca 0.28 -0.10 -0.16 0.00 0.43 0.00 0.00 57.03 57.47 1u74 h ASP 106 Cb 0.11 -0.07 0.01 0.00 -0.56 0.00 0.00 39.33 38.82 1u74 h ASP 106 CO -0.04 0.60 -0.64 0.25 -1.57 0.00 0.00 179.24 177.85 1u74 h LEU 107 N 0.23 0.57 -0.75 1.55 5.85 -0.76 -2.33 115.31 119.67 1u74 h LEU 107 Ca 0.03 -0.75 -0.09 0.00 0.84 0.00 0.00 57.88 57.91 1u74 h LEU 107 Cb 0.72 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1u74 h LEU 107 CO 0.05 1.25 -0.00 -0.26 -0.34 0.00 0.00 178.44 179.14 1u74 h PHE 108 N -0.05 1.03 -0.07 1.25 0.04 -1.35 -0.31 116.94 117.48 1u74 h PHE 108 Ca -0.08 -0.16 -0.22 0.00 2.80 0.00 0.00 57.97 60.30 1u74 h PHE 108 Cb 1.34 -0.27 0.01 0.00 2.20 0.00 0.00 35.95 39.22 1u74 h PHE 108 CO 0.14 0.92 -0.86 0.66 -0.60 0.00 0.00 178.31 178.58 1u74 h SER 109 N 0.88 0.75 -0.17 2.17 4.64 -1.61 -2.86 113.55 117.34 1u74 h SER 109 Ca 0.16 -0.53 -0.10 0.00 -0.47 0.00 0.00 61.79 60.85 1u74 h SER 109 Cb 0.52 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 1u74 h SER 109 CO 0.03 1.32 -0.21 0.25 -0.87 0.00 0.00 176.83 177.35 1u74 h LEU 110 N 0.39 0.61 -1.32 5.97 5.85 -1.28 -2.29 115.31 123.23 1u74 h LEU 110 Ca -0.07 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.45 1u74 h LEU 110 Cb 1.48 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.31 1u74 h LEU 110 CO 0.16 0.82 0.38 1.23 -0.34 0.00 0.00 178.44 180.69 1u74 h GLY 111 N 0.99 0.89 1.05 3.75 0.00 -0.96 0.15 103.07 108.95 1u74 h GLY 111 Ca 0.08 -0.36 -0.19 0.00 0.00 0.00 0.00 47.33 46.87 1u74 h GLY 111 CO 0.05 0.35 -0.64 -1.33 0.00 0.00 0.00 176.54 174.97 1u74 h GLY 112 N 0.88 0.77 0.92 4.60 0.00 -1.22 -2.09 103.07 106.93 1u74 h GLY 112 Ca 0.22 -1.06 -0.04 0.00 0.00 0.00 0.00 47.33 46.46 1u74 h GLY 112 CO -0.04 0.95 0.09 -2.08 0.00 0.00 0.00 176.54 175.45 1u74 h VAL 113 N 0.39 1.23 -0.62 4.60 2.07 -0.92 -2.31 116.25 120.69 1u74 h VAL 113 Ca -0.04 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.70 1u74 h VAL 113 Cb 1.27 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 1u74 h VAL 113 CO 0.13 0.26 0.35 0.74 0.02 0.00 0.00 177.57 179.07 1u74 h THR 114 N 0.43 1.20 -0.21 2.57 2.02 -0.75 -1.52 112.91 116.65 1u74 h THR 114 Ca 0.11 -0.48 -0.00 0.00 0.77 0.00 0.00 66.41 66.81 1u74 h THR 114 Cb 0.31 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 1u74 h THR 114 CO 0.00 0.21 0.12 0.00 0.37 0.00 0.00 175.52 176.23 1u74 h ALA 115 N 1.17 0.27 -0.04 6.16 0.00 -1.22 -0.95 119.26 124.64 1u74 h ALA 115 Ca 0.22 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1u74 h ALA 115 Cb 0.03 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1u74 h ALA 115 CO -0.04 -0.22 0.02 0.28 0.00 0.00 0.00 179.25 179.29 1u74 h VAL 116 N 0.25 1.12 -0.83 0.00 2.07 -1.20 -0.92 116.25 116.74 1u74 h VAL 116 Ca 0.07 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 1u74 h VAL 116 Cb 0.03 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1u74 h VAL 116 CO -0.01 0.09 0.52 1.56 0.02 0.00 0.00 177.57 179.75 1u74 h GLN 117 N -0.07 1.12 -0.19 1.57 4.20 -1.23 0.12 115.11 120.62 1u74 h GLN 117 Ca 0.01 -0.09 -0.09 0.00 0.06 0.00 0.00 58.65 58.54 1u74 h GLN 117 Cb 0.14 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1u74 h GLN 117 CO -0.00 0.77 -0.29 0.93 -0.67 0.00 0.00 178.83 179.57 1u74 h GLU 118 N 1.14 0.37 -0.97 1.46 4.39 -0.98 -2.48 114.58 117.50 1u74 h GLU 118 Ca 0.30 -0.15 -0.08 0.00 0.34 0.00 0.00 59.36 59.78 1u74 h GLU 118 Cb -0.07 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.51 1u74 h GLU 118 CO -0.06 0.64 0.10 -1.33 -1.16 0.00 0.00 179.01 177.20 1u74 n MET 119 N -4.11 1.45 -1.74 2.33 2.81 -0.36 -4.82 117.12 112.67 1u74 n MET 119 Ca -0.01 -0.66 -0.17 0.00 -1.81 0.00 0.00 57.70 55.06 1u74 n MET 119 Cb 0.42 -1.38 -0.05 0.00 -0.71 0.00 0.00 33.22 31.49 1u74 n MET 119 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1u74 n GLN 120 N 0.14 -1.21 -1.47 0.03 6.02 -0.94 -0.88 117.38 119.07 1u74 n GLN 120 Ca 0.11 1.00 -0.22 0.00 -0.01 0.00 0.00 57.00 57.88 1u74 n GLN 120 Cb 0.66 -5.28 0.15 0.00 1.02 0.00 0.00 30.24 26.80 1u74 n GLN 120 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1u74 n GLY 121 N -0.95 -1.33 3.79 1.08 0.00 0.38 -4.76 105.19 103.40 1u74 n GLY 121 Ca -0.18 -1.71 -0.31 0.00 0.00 0.00 0.00 46.02 43.82 1u74 n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1u74 s PRO 122 N -5.18 2.69 0.03 1.61 0.04 -1.26 -4.59 135.00 128.34 1u74 s PRO 122 Ca 0.57 1.13 -0.30 0.00 0.04 0.00 0.00 61.00 62.44 1u74 s PRO 122 Cb -0.02 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.52 1u74 s PRO 122 CO 0.40 -1.30 1.22 0.15 0.04 0.00 0.00 177.00 177.51 1u74 s LYS 123 N -4.73 4.39 -0.31 4.56 -0.14 -1.26 -4.41 119.74 117.84 1u74 s LYS 123 Ca 0.61 1.77 -0.05 0.00 -1.36 0.00 0.00 55.97 56.94 1u74 s LYS 123 Cb -0.16 -3.42 0.03 0.00 -1.68 0.00 0.00 37.83 32.60 1u74 s LYS 123 CO 0.51 -0.34 0.05 0.42 -0.76 0.00 0.00 175.35 175.24 1u74 s ILE 124 N 1.48 3.56 0.23 2.17 1.01 -1.26 -4.90 121.20 123.49 1u74 s ILE 124 Ca 0.59 -1.03 -0.31 0.00 0.00 0.00 0.00 60.65 59.89 1u74 s ILE 124 Cb -0.29 -2.94 -0.12 0.00 0.01 0.00 0.00 42.46 39.12 1u74 s ILE 124 CO 0.27 -0.04 1.67 -2.65 0.00 0.00 0.00 174.94 174.20 1u74 n PRO 125 N 4.77 2.71 -4.31 2.79 -0.02 -1.26 -4.80 135.00 134.88 1u74 n PRO 125 Ca -0.14 0.97 -0.23 0.00 -2.02 0.00 0.00 63.50 62.08 1u74 n PRO 125 Cb 0.46 -2.79 -0.13 0.00 -0.02 0.00 0.00 33.50 31.02 1u74 n PRO 125 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1u74 s TRP 126 N 0.75 1.71 0.05 6.00 -0.00 -0.32 -4.81 118.94 122.32 1u74 s TRP 126 Ca 0.71 -0.42 0.06 0.00 -0.00 0.00 0.00 56.10 56.45 1u74 s TRP 126 Cb -0.51 -0.95 -0.03 0.00 -0.00 0.00 0.00 33.47 31.98 1u74 s TRP 126 CO 0.38 0.17 -0.16 0.50 -0.00 0.00 0.00 176.95 177.85 1u74 s ARG 127 N -1.80 1.00 0.47 5.86 3.52 -1.26 -0.52 118.95 126.21 1u74 s ARG 127 Ca 0.05 -0.88 0.08 0.00 -0.13 0.00 0.00 55.73 54.86 1u74 s ARG 127 Cb -0.10 -1.06 0.03 0.00 -1.56 0.00 0.00 34.95 32.26 1u74 s ARG 127 CO 0.04 0.26 0.62 0.00 -0.81 0.00 0.00 175.30 175.40 1u74 n GLY 129 N -1.94 1.02 3.73 0.00 0.00 -1.26 -4.79 105.19 101.96 1u74 n GLY 129 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1u74 n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u74 s ARG 130 N 0.00 4.35 -0.06 1.61 0.52 -1.26 -1.73 118.95 122.38 1u74 s ARG 130 Ca 0.00 2.11 0.04 0.00 -0.52 0.00 0.00 55.73 57.36 1u74 s ARG 130 Cb 0.00 -3.19 -0.02 0.00 0.52 0.00 0.00 34.95 32.26 1u74 s ARG 130 CO 0.00 -0.32 -0.18 0.08 0.02 0.00 0.00 175.30 174.90 1u74 s VAL 131 N 0.30 2.72 0.11 3.52 1.01 -1.22 -4.61 120.40 122.23 1u74 s VAL 131 Ca 0.59 -0.83 -0.31 0.00 0.00 0.00 0.00 61.98 61.42 1u74 s VAL 131 Cb -0.38 -2.05 -0.08 0.00 0.00 0.00 0.00 36.38 33.87 1u74 s VAL 131 CO 0.37 0.57 1.45 -1.81 0.00 0.00 0.00 175.10 175.68 1u74 s ASP 132 N -0.41 6.76 0.20 3.32 -0.00 -1.26 -3.85 116.67 121.42 1u74 s ASP 132 Ca 0.04 2.38 0.09 0.00 -0.00 0.00 0.00 52.55 55.06 1u74 s ASP 132 Cb -0.12 -2.58 -0.04 0.00 -0.00 0.00 0.00 42.92 40.17 1u74 s ASP 132 CO 0.02 -0.71 -0.08 0.42 -0.00 0.00 0.00 175.17 174.81 1u74 s THR 133 N 1.34 3.21 1.14 -1.27 -4.23 -1.11 -5.03 115.64 109.69 1u74 s THR 133 Ca 0.66 -1.73 -0.18 0.00 -1.18 0.00 0.00 61.69 59.27 1u74 s THR 133 Cb -0.38 -2.62 0.15 0.00 1.34 0.00 0.00 72.50 70.99 1u74 s THR 133 CO 0.30 -0.17 0.18 -2.65 -0.54 0.00 0.00 174.62 171.74 1u74 n PRO 134 N -0.15 -2.00 0.30 3.99 -0.02 -1.26 -4.85 135.00 131.02 1u74 n PRO 134 Ca -0.10 -0.57 0.19 0.00 -2.02 0.00 0.00 63.50 61.00 1u74 n PRO 134 Cb 0.56 -1.73 0.86 0.00 -0.02 0.00 0.00 33.50 33.17 1u74 n PRO 134 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1u74 h GLU 135 N -2.31 0.00 0.00 -0.52 4.81 -2.00 -3.04 114.58 111.52 1u74 h GLU 135 Ca -0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1u74 h GLU 135 Cb 1.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.67 1u74 h GLU 135 CO 0.36 0.01 -0.06 -0.40 -0.73 0.00 0.00 179.01 178.20 1u74 n ASP 136 N -3.13 0.13 -1.44 1.04 5.68 -1.26 -3.31 116.55 114.25 1u74 n ASP 136 Ca -0.01 0.43 0.11 0.00 -0.50 0.00 0.00 54.79 54.82 1u74 n ASP 136 Cb 0.23 -0.44 0.34 0.00 -1.14 0.00 0.00 41.12 40.11 1u74 n ASP 136 CO 0.00 0.00 0.00 1.07 -1.33 0.00 0.00 177.20 176.94 1u74 n THR 137 N -1.57 1.22 -2.38 2.12 5.66 -1.15 -4.91 114.28 113.26 1u74 n THR 137 Ca 0.07 -1.05 -0.42 0.00 -3.05 0.00 0.00 64.05 59.60 1u74 n THR 137 Cb 0.35 0.40 -0.03 0.00 -1.55 0.00 0.00 70.33 69.50 1u74 n THR 137 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1u74 s THR 138 N -1.23 4.13 0.43 1.09 2.01 -1.21 -4.71 115.64 116.15 1u74 s THR 138 Ca 0.50 1.44 -0.24 0.00 0.31 0.00 0.00 61.69 63.70 1u74 s THR 138 Cb 0.28 -3.93 -0.08 0.00 0.01 0.00 0.00 72.50 68.78 1u74 s THR 138 CO 0.32 -0.05 1.19 -2.84 -0.69 0.00 0.00 174.62 172.54 1u74 s PRO 139 N 2.79 3.91 0.56 4.92 0.02 -1.26 -5.01 135.00 140.92 1u74 s PRO 139 Ca 0.58 1.86 -0.20 0.00 0.02 0.00 0.00 61.00 63.25 1u74 s PRO 139 Cb -0.25 -2.57 -0.05 0.00 0.02 0.00 0.00 34.50 31.65 1u74 s PRO 139 CO 0.21 -0.44 1.23 -0.51 -0.33 0.00 0.00 177.00 177.15 1u74 s ASP 140 N -1.17 5.39 0.54 2.53 -0.00 -1.26 -4.66 116.67 118.03 1u74 s ASP 140 Ca 0.60 2.45 -0.21 0.00 -0.00 0.00 0.00 52.55 55.39 1u74 s ASP 140 Cb -0.31 -2.61 -0.05 0.00 -0.00 0.00 0.00 42.92 39.95 1u74 s ASP 140 CO 0.38 -1.46 1.26 0.20 -0.00 0.00 0.00 175.17 175.55 1u74 s ASN 141 N -1.42 5.49 0.00 0.27 0.02 -1.26 -4.06 114.94 113.99 1u74 s ASN 141 Ca 0.74 2.52 0.00 0.00 -1.02 0.00 0.00 52.86 55.10 1u74 s ASN 141 Cb -0.32 -2.62 0.00 0.00 0.02 0.00 0.00 41.25 38.33 1u74 s ASN 141 CO 0.36 -1.40 0.00 0.61 0.02 0.00 0.00 177.10 176.70 1u74 n GLY 142 N 0.59 0.80 0.04 0.66 0.00 -1.26 -4.99 105.19 101.03 1u74 n GLY 142 Ca 0.11 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.26 1u74 n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u74 n ARG 143 N -1.36 0.26 -3.50 1.61 1.74 -1.26 -4.86 116.66 109.30 1u74 n ARG 143 Ca 0.00 -0.08 -0.29 0.00 -0.77 0.00 0.00 57.85 56.71 1u74 n ARG 143 Cb 0.00 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 29.90 1u74 n ARG 143 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1u74 s LEU 144 N -2.80 4.15 0.59 0.55 1.43 -1.26 -4.70 118.68 116.65 1u74 s LEU 144 Ca 0.19 0.64 -0.17 0.00 -1.03 0.00 0.00 54.13 53.77 1u74 s LEU 144 Cb 0.19 -3.42 -0.03 0.00 0.03 0.00 0.00 46.19 42.95 1u74 s LEU 144 CO 0.55 -0.10 1.09 -2.16 0.23 0.00 0.00 176.35 175.96 1u74 s PRO 145 N -3.23 3.21 -0.06 1.29 0.04 -1.26 -5.06 135.00 129.93 1u74 s PRO 145 Ca 0.43 1.36 -0.06 0.00 0.04 0.00 0.00 61.00 62.77 1u74 s PRO 145 Cb -0.11 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 1u74 s PRO 145 CO 0.27 -0.92 0.18 0.34 0.04 0.00 0.00 177.00 176.91 1u74 s ASP 146 N -2.44 6.41 0.35 6.66 3.68 -1.26 -5.03 116.67 125.04 1u74 s ASP 146 Ca 0.67 0.46 0.18 0.00 2.13 0.00 0.00 52.55 55.99 1u74 s ASP 146 Cb -0.19 -2.06 0.19 0.00 -1.45 0.00 0.00 42.92 39.42 1u74 s ASP 146 CO 0.35 0.34 1.52 0.00 0.13 0.00 0.00 175.17 177.50 1u74 h ALA 147 N 4.46 0.81 -0.28 3.66 0.00 -1.98 -3.38 119.26 122.55 1u74 h ALA 147 Ca -0.52 -0.27 -0.33 0.00 0.00 0.00 0.00 54.91 53.79 1u74 h ALA 147 Cb 1.21 -0.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.83 1u74 h ALA 147 CO 0.63 0.37 0.06 -3.47 0.00 0.00 0.00 179.25 176.84 1u74 n ASP 148 N -3.18 5.91 -3.71 0.00 2.03 -1.26 -3.17 116.55 113.17 1u74 n ASP 148 Ca 0.03 -2.85 -0.21 0.00 0.52 0.00 0.00 54.79 52.27 1u74 n ASP 148 Cb 0.65 -1.28 -0.08 0.00 -0.72 0.00 0.00 41.12 39.68 1u74 n ASP 148 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1u74 s LYS 149 N -0.54 1.78 0.34 -0.67 -0.14 -1.26 -5.02 119.74 114.22 1u74 s LYS 149 Ca 0.56 -2.05 0.04 0.00 -1.36 0.00 0.00 55.97 53.16 1u74 s LYS 149 Cb 0.32 -0.03 0.04 0.00 -1.68 0.00 0.00 37.83 36.48 1u74 s LYS 149 CO -0.10 -0.56 0.33 -0.40 -0.76 0.00 0.00 175.35 173.85 1u74 n ASP 150 N -1.35 1.81 -0.10 2.83 3.85 -1.26 -3.20 116.55 119.13 1u74 n ASP 150 Ca 0.02 -2.08 0.09 0.00 -0.71 0.00 0.00 54.79 52.10 1u74 n ASP 150 Cb 0.64 -0.10 0.43 0.00 -1.35 0.00 0.00 41.12 40.74 1u74 n ASP 150 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1u74 h ALA 151 N 0.56 1.85 -0.41 2.12 0.00 -1.89 -2.34 119.26 119.14 1u74 h ALA 151 Ca -0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1u74 h ALA 151 Cb 0.77 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1u74 h ALA 151 CO 0.30 0.04 0.23 0.78 0.00 0.00 0.00 179.25 180.61 1u74 h GLY 152 N 0.56 0.61 0.95 0.00 0.00 -1.96 -0.34 103.07 102.88 1u74 h GLY 152 Ca 0.27 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1u74 h GLY 152 CO -0.08 0.26 0.14 -1.82 0.00 0.00 0.00 176.54 175.04 1u74 h TYR 153 N 0.53 0.35 -0.86 5.60 5.03 -1.83 -2.32 116.97 123.47 1u74 h TYR 153 Ca 0.14 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.44 1u74 h TYR 153 Cb 0.04 -0.11 -0.04 0.00 1.55 0.00 0.00 36.73 38.17 1u74 h TYR 153 CO -0.03 0.30 0.50 0.28 -1.32 0.00 0.00 178.16 177.90 1u74 h VAL 154 N 0.29 1.24 -0.21 1.81 2.07 -1.15 0.41 116.25 120.71 1u74 h VAL 154 Ca 0.09 -0.55 -0.04 0.00 0.82 0.00 0.00 66.70 67.02 1u74 h VAL 154 Cb 0.07 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.88 1u74 h VAL 154 CO -0.01 0.26 -0.04 -0.09 0.02 0.00 0.00 177.57 177.71 1u74 h ARG 155 N 1.19 0.40 0.00 1.57 2.43 -0.85 -2.73 114.38 116.39 1u74 h ARG 155 Ca 0.31 -0.15 -0.12 0.00 -0.81 0.00 0.00 59.98 59.21 1u74 h ARG 155 Cb -0.03 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 1u74 h ARG 155 CO -0.06 0.63 -0.58 1.79 -1.51 0.00 0.00 179.97 180.25 1u74 h THR 156 N 0.14 1.06 -0.18 0.20 1.35 -1.28 -2.88 112.91 111.33 1u74 h THR 156 Ca 0.06 -2.33 -0.02 0.00 -0.55 0.00 0.00 66.41 63.56 1u74 h THR 156 Cb 0.48 2.41 -0.01 0.00 -1.73 0.00 0.00 68.15 69.30 1u74 h THR 156 CO 0.02 0.57 0.01 0.15 -0.25 0.00 0.00 175.52 176.02 1u74 h PHE 157 N 0.00 0.32 0.00 4.73 3.04 -0.18 -3.02 116.94 121.83 1u74 h PHE 157 Ca -0.01 -0.05 0.00 0.00 3.98 0.00 0.00 57.97 61.89 1u74 h PHE 157 Cb 1.36 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 39.78 1u74 h PHE 157 CO 0.00 0.48 0.00 1.19 -2.02 0.00 0.00 178.31 177.96 1u74 n PHE 158 N -4.75 0.42 0.13 0.41 3.72 -1.03 -2.55 117.46 113.81 1u74 n PHE 158 Ca -0.05 0.15 0.01 0.00 -0.05 0.00 0.00 57.45 57.51 1u74 n PHE 158 Cb 0.20 -0.74 0.31 0.00 -0.94 0.00 0.00 39.48 38.31 1u74 n PHE 158 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1u74 h GLN 159 N 0.00 0.15 0.00 -1.08 4.20 -1.37 0.61 115.11 117.63 1u74 h GLN 159 Ca 0.00 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.61 1u74 h GLN 159 Cb 0.39 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 1u74 h GLN 159 CO 0.00 0.47 -0.19 -0.09 -0.67 0.00 0.00 178.83 178.35 1u74 h ARG 160 N 0.13 0.00 -0.35 1.46 2.43 -1.59 -0.47 114.38 115.99 1u74 h ARG 160 Ca 0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1u74 h ARG 160 Cb 0.65 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1u74 h ARG 160 CO 0.05 0.19 0.00 1.28 -1.51 0.00 0.00 179.97 179.97 1u74 n LEU 161 N -3.75 3.23 -2.84 3.80 4.77 -0.96 -2.04 117.00 119.22 1u74 n LEU 161 Ca -0.02 -1.37 -0.19 0.00 -0.03 0.00 0.00 56.01 54.40 1u74 n LEU 161 Cb 0.30 -0.22 0.06 0.00 -2.33 0.00 0.00 43.42 41.22 1u74 n LEU 161 CO 0.33 0.69 0.15 -3.20 -1.33 0.00 0.00 177.39 174.02 1u74 n ASN 162 N 1.35 -5.45 -4.57 -1.43 5.15 -0.19 -5.00 115.26 105.13 1u74 n ASN 162 Ca 0.19 -0.38 -0.34 0.00 -0.60 0.00 0.00 54.58 53.45 1u74 n ASN 162 Cb 0.58 -4.11 -0.11 0.00 -0.53 0.00 0.00 39.78 35.61 1u74 n ASN 162 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 1u74 s MET 163 N -5.90 3.63 0.73 1.20 -1.94 0.17 -5.01 119.30 112.17 1u74 s MET 163 Ca 0.41 -0.45 -0.05 0.00 -1.71 0.00 0.00 55.69 53.90 1u74 s MET 163 Cb -0.18 -2.97 0.11 0.00 2.01 0.00 0.00 34.83 33.79 1u74 s MET 163 CO 0.51 0.34 1.02 0.54 -0.01 0.00 0.00 175.02 177.43 1u74 s ASN 164 N 0.12 4.42 0.28 3.03 2.20 -1.26 -4.25 114.94 119.47 1u74 s ASN 164 Ca 0.01 0.04 0.02 0.00 -0.94 0.00 0.00 52.86 51.99 1u74 s ASN 164 Cb -0.13 -0.52 0.66 0.00 -2.00 0.00 0.00 41.25 39.26 1u74 s ASN 164 CO 0.02 -1.83 1.71 0.44 -2.94 0.00 0.00 177.10 174.51 1u74 h ASP 165 N -0.65 0.38 -0.54 3.54 5.19 -1.99 -1.26 116.42 121.08 1u74 h ASP 165 Ca -0.41 0.14 -0.10 0.00 -0.62 0.00 0.00 57.03 56.04 1u74 h ASP 165 Cb 1.28 0.10 -0.02 0.00 0.18 0.00 0.00 39.33 40.87 1u74 h ASP 165 CO 0.48 0.06 -0.04 -0.09 -3.12 0.00 0.00 179.24 176.53 1u74 h ARG 166 N 0.46 1.01 -0.26 3.56 2.43 -1.96 -2.86 114.38 116.76 1u74 h ARG 166 Ca 0.53 -0.33 -0.10 0.00 -0.81 0.00 0.00 59.98 59.27 1u74 h ARG 166 Cb 0.93 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.39 1u74 h ARG 166 CO -0.48 1.01 -0.23 0.93 -1.51 0.00 0.00 179.97 179.69 1u74 h GLU 167 N 0.91 0.61 -0.17 0.20 5.08 -1.63 -2.61 114.58 116.97 1u74 h GLU 167 Ca 0.16 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 58.10 1u74 h GLU 167 Cb 0.58 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1u74 h GLU 167 CO 0.03 0.91 -0.34 -0.39 -1.00 0.00 0.00 179.01 178.22 1u74 h VAL 168 N 0.33 1.29 -0.15 3.13 -1.51 -1.36 0.14 116.25 118.11 1u74 h VAL 168 Ca 0.04 -1.40 -0.19 0.00 -1.23 0.00 0.00 66.70 63.93 1u74 h VAL 168 Cb 0.78 1.53 -0.00 0.00 -2.13 0.00 0.00 31.29 31.48 1u74 h VAL 168 CO 0.06 0.43 -0.67 0.58 -1.23 0.00 0.00 177.57 176.74 1u74 h VAL 169 N 0.31 1.32 -0.29 7.19 2.07 -1.57 -2.43 116.25 122.85 1u74 h VAL 169 Ca 0.04 -1.95 -0.07 0.00 0.82 0.00 0.00 66.70 65.53 1u74 h VAL 169 Cb 0.75 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.44 1u74 h VAL 169 CO 0.06 0.60 -0.11 0.00 0.02 0.00 0.00 177.57 178.15 1u74 h ALA 170 N 0.83 0.41 -0.18 1.67 0.00 -1.10 -3.02 119.26 117.87 1u74 h ALA 170 Ca -0.02 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 1u74 h ALA 170 Cb 1.25 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1u74 h ALA 170 CO 0.13 0.27 -0.25 -0.07 0.00 0.00 0.00 179.25 179.32 1u74 h LEU 171 N 0.35 0.33 -1.35 0.00 3.38 -0.99 -2.55 115.31 114.48 1u74 h LEU 171 Ca 0.07 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1u74 h LEU 171 Cb 0.61 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1u74 h LEU 171 CO 0.04 0.59 -0.20 -0.03 0.09 0.00 0.00 178.44 178.92 1u74 h MET 172 N 0.30 0.00 0.00 1.13 4.05 -1.39 -2.80 114.93 116.21 1u74 h MET 172 Ca 0.05 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.47 1u74 h MET 172 Cb 0.61 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.41 1u74 h MET 172 CO 0.04 0.20 0.00 0.41 0.23 0.00 0.00 176.91 177.79 1u74 n GLY 173 N -0.08 -0.48 0.07 1.39 0.00 -0.96 -1.16 105.19 103.97 1u74 n GLY 173 Ca -0.00 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.10 1u74 n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u74 n ALA 174 N -1.32 1.86 1.68 4.61 0.00 -1.06 -2.54 120.51 123.73 1u74 n ALA 174 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1u74 n ALA 174 Cb 0.04 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.12 1u74 n ALA 174 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1u74 n HIS 175 N -1.95 0.00 0.60 0.00 8.25 -0.31 -1.76 115.22 120.06 1u74 n HIS 175 Ca 0.04 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.63 1u74 n HIS 175 Cb 0.26 -0.00 0.38 0.00 1.12 0.00 0.00 29.99 31.75 1u74 n HIS 175 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1u74 h ALA 176 N 2.68 0.98 -2.91 -1.41 0.00 -1.74 -3.41 119.26 113.45 1u74 h ALA 176 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 1u74 h ALA 176 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.71 1u74 h ALA 176 CO 0.00 0.00 -0.32 -0.51 0.00 0.00 0.00 179.25 178.42 1u74 s LEU 177 N -4.62 4.33 0.00 0.00 1.43 -0.72 -4.06 118.68 115.04 1u74 s LEU 177 Ca 0.10 0.62 0.00 0.00 -1.03 0.00 0.00 54.13 53.82 1u74 s LEU 177 Cb 0.12 -2.38 0.00 0.00 0.03 0.00 0.00 46.19 43.96 1u74 s LEU 177 CO 0.61 0.21 0.00 0.61 0.23 0.00 0.00 176.35 178.00 1u74 n GLY 178 N 2.75 1.38 3.77 -3.19 0.00 0.84 -4.96 105.19 105.80 1u74 n GLY 178 Ca -0.14 -0.64 -0.09 0.00 0.00 0.00 0.00 46.02 45.16 1u74 n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1u74 s LYS 179 N 0.00 1.92 -0.10 1.61 -2.85 -1.26 -4.26 119.74 114.80 1u74 s LYS 179 Ca 0.00 -1.24 -0.10 0.00 -1.00 0.00 0.00 55.97 53.62 1u74 s LYS 179 Cb 0.00 0.58 -0.05 0.00 -2.06 0.00 0.00 37.83 36.31 1u74 s LYS 179 CO 0.00 -0.87 0.23 0.95 0.10 0.00 0.00 175.35 175.76 1u74 s THR 180 N -3.30 5.35 -0.20 3.79 -4.23 -0.17 -4.97 115.64 111.91 1u74 s THR 180 Ca 0.16 0.42 -0.02 0.00 -1.18 0.00 0.00 61.69 61.07 1u74 s THR 180 Cb -0.05 -3.52 0.00 0.00 1.34 0.00 0.00 72.50 70.28 1u74 s THR 180 CO 0.10 0.56 -0.11 -1.00 -0.54 0.00 0.00 174.62 173.62 1u74 s HIS 181 N -0.67 2.87 0.55 3.99 0.09 -1.03 -1.42 115.29 119.68 1u74 s HIS 181 Ca 0.17 -1.23 0.25 0.00 -0.00 0.00 0.00 55.06 54.25 1u74 s HIS 181 Cb -0.13 -2.02 1.47 0.00 -0.00 0.00 0.00 32.58 31.90 1u74 s HIS 181 CO 0.06 -0.65 2.06 1.25 -0.00 0.00 0.00 174.74 177.45 1u74 h LEU 182 N 7.99 0.00 -0.40 0.89 5.85 -1.68 -0.77 115.31 127.19 1u74 h LEU 182 Ca -0.43 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.24 1u74 h LEU 182 Cb 1.15 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 1u74 h LEU 182 CO 0.62 0.00 -0.26 0.07 -0.34 0.00 0.00 178.44 178.52 1u74 h LYS 183 N 0.00 0.00 0.04 1.25 2.10 -1.95 -2.79 116.57 115.22 1u74 h LYS 183 Ca 0.15 0.00 -0.38 0.00 -2.00 0.00 0.00 60.65 58.42 1u74 h LYS 183 Cb 0.66 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.94 1u74 h LYS 183 CO -0.00 0.26 -2.19 0.09 -2.00 0.00 0.00 179.45 175.61 1u74 n ASN 184 N -3.23 2.02 0.00 7.07 3.02 -0.50 -4.85 115.26 118.79 1u74 n ASN 184 Ca 0.02 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 1u74 n ASN 184 Cb 0.57 -0.69 0.00 0.00 -0.61 0.00 0.00 39.78 39.06 1u74 n ASN 184 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1u74 n SER 185 N -3.59 0.22 0.00 6.41 3.41 -0.42 -4.70 113.62 114.95 1u74 n SER 185 Ca -0.41 -0.57 0.00 0.00 -0.26 0.00 0.00 58.87 57.63 1u74 n SER 185 Cb 0.96 0.32 0.00 0.00 -0.26 0.00 0.00 64.21 65.23 1u74 n SER 185 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u74 n GLY 186 N 0.32 0.85 3.29 5.00 0.00 -1.05 -5.00 105.19 108.59 1u74 n GLY 186 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1u74 n GLY 186 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1u74 s TYR 187 N -2.93 2.04 -0.04 1.61 2.02 -1.26 -4.51 117.35 114.28 1u74 s TYR 187 Ca 0.00 -0.39 0.02 0.00 -0.37 0.00 0.00 57.07 56.33 1u74 s TYR 187 Cb 0.00 -1.22 0.01 0.00 -0.40 0.00 0.00 41.96 40.35 1u74 s TYR 187 CO 0.00 0.10 -0.07 -2.00 -1.57 0.00 0.00 175.55 172.01 1u74 s GLU 188 N -1.18 0.95 0.00 -0.62 2.56 -1.26 -1.71 118.70 117.44 1u74 s GLU 188 Ca 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 54.97 54.84 1u74 s GLU 188 Cb -0.09 -0.89 0.00 0.00 2.00 0.00 0.00 34.13 35.14 1u74 s GLU 188 CO 0.02 0.02 0.00 0.41 -0.56 0.00 0.00 175.26 175.15 1u74 n GLY 189 N 3.64 2.61 3.94 -1.50 0.00 -0.50 -4.89 105.19 108.49 1u74 n GLY 189 Ca -0.22 -2.09 -0.24 0.00 0.00 0.00 0.00 46.02 43.47 1u74 n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1u74 s PRO 190 N -2.27 3.41 0.20 1.61 0.04 -1.26 -1.00 135.00 135.73 1u74 s PRO 190 Ca 0.00 -0.30 0.23 0.00 0.04 0.00 0.00 61.00 60.97 1u74 s PRO 190 Cb 0.00 -2.61 0.22 0.00 0.04 0.00 0.00 34.50 32.16 1u74 s PRO 190 CO 0.00 0.02 1.27 -1.49 0.04 0.00 0.00 177.00 176.84 1u74 h TRP 191 N 0.62 0.00 -2.64 0.56 6.55 -1.74 0.11 115.95 119.41 1u74 h TRP 191 Ca -0.49 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.35 1u74 h TRP 191 Cb 1.22 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.53 1u74 h TRP 191 CO 0.51 0.00 0.22 0.41 -1.05 0.00 0.00 178.44 178.52 1u74 n GLY 192 N 1.24 1.23 0.12 1.49 0.00 -1.26 -4.72 105.19 103.30 1u74 n GLY 192 Ca 0.02 -1.17 -0.18 0.00 0.00 0.00 0.00 46.02 44.69 1u74 n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u74 h ALA 193 N 2.00 0.24 -1.03 4.61 0.00 -1.94 -3.39 119.26 119.75 1u74 h ALA 193 Ca -0.23 -1.11 -0.78 0.00 0.00 0.00 0.00 54.91 52.78 1u74 h ALA 193 Cb 0.85 0.32 -0.22 0.00 0.00 0.00 0.00 17.79 18.74 1u74 h ALA 193 CO 0.29 1.11 1.51 0.00 0.00 0.00 0.00 179.25 182.16 1u74 n ALA 194 N -2.71 6.34 0.33 0.00 0.00 -1.26 -4.84 120.51 118.38 1u74 n ALA 194 Ca -0.18 -4.41 0.15 0.00 0.00 0.00 0.00 53.44 49.00 1u74 n ALA 194 Cb 1.05 -2.39 0.80 0.00 0.00 0.00 0.00 19.45 18.91 1u74 n ALA 194 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1u74 h ASN 195 N 4.32 0.00 -0.02 0.00 7.08 -1.77 -2.35 115.58 122.83 1u74 h ASN 195 Ca 0.60 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.82 1u74 h ASN 195 Cb 0.31 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.55 1u74 h ASN 195 CO 1.28 0.00 0.00 -0.46 -2.08 0.00 0.00 177.43 176.17 1u74 n ASN 196 N -2.86 2.38 -3.76 6.14 0.23 -1.26 -0.11 115.26 116.02 1u74 n ASN 196 Ca -0.02 -2.80 -0.20 0.00 -0.53 0.00 0.00 54.58 51.03 1u74 n ASN 196 Cb 0.39 -0.33 -0.17 0.00 -2.08 0.00 0.00 39.78 37.58 1u74 n ASN 196 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1u74 s VAL 197 N -2.39 0.17 -0.39 3.53 0.11 -0.89 -4.69 120.40 115.86 1u74 s VAL 197 Ca 0.25 0.19 -0.28 0.00 -2.93 0.00 0.00 61.98 59.21 1u74 s VAL 197 Cb 0.21 -0.33 -0.02 0.00 -1.53 0.00 0.00 36.38 34.71 1u74 s VAL 197 CO 0.03 0.20 1.77 0.12 -3.33 0.00 0.00 175.10 173.89 1u74 s PHE 198 N 1.66 1.84 0.11 1.54 2.19 -0.06 -4.87 117.98 120.39 1u74 s PHE 198 Ca -0.01 0.67 0.02 0.00 0.33 0.00 0.00 56.93 57.95 1u74 s PHE 198 Cb -0.13 -4.14 -0.01 0.00 -1.31 0.00 0.00 43.02 37.44 1u74 s PHE 198 CO -0.03 -2.72 0.10 0.25 1.83 0.00 0.00 175.22 174.64 1u74 n THR 199 N 7.35 0.00 -1.08 0.12 -2.24 -1.26 -4.60 114.28 112.57 1u74 n THR 199 Ca 0.22 -0.81 -0.10 0.00 -2.27 0.00 0.00 64.05 61.09 1u74 n THR 199 Cb 0.48 0.41 0.29 0.00 -2.10 0.00 0.00 70.33 69.41 1u74 n THR 199 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1u74 n ASN 200 N -2.52 4.70 -0.24 3.42 2.04 -1.26 -4.61 115.26 116.79 1u74 n ASN 200 Ca 0.02 -3.30 0.12 0.00 -0.44 0.00 0.00 54.58 50.99 1u74 n ASN 200 Cb 0.20 -0.77 0.40 0.00 -2.53 0.00 0.00 39.78 37.09 1u74 n ASN 200 CO 0.00 0.00 0.00 -0.08 -0.44 0.00 0.00 177.26 176.74 1u74 h GLU 201 N 2.41 0.62 -0.33 -3.83 4.81 -1.95 -2.54 114.58 113.77 1u74 h GLU 201 Ca 0.34 -0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.61 1u74 h GLU 201 Cb 2.47 -0.14 -0.08 0.00 0.63 0.00 0.00 28.75 31.63 1u74 h GLU 201 CO 0.82 0.41 -0.29 0.35 -0.73 0.00 0.00 179.01 179.57 1u74 h PHE 202 N 0.64 -0.80 -0.30 0.92 3.57 -1.87 0.21 116.94 119.32 1u74 h PHE 202 Ca 0.42 0.05 -0.18 0.00 3.53 0.00 0.00 57.97 61.80 1u74 h PHE 202 Cb 0.72 0.40 -0.00 0.00 2.79 0.00 0.00 35.95 39.86 1u74 h PHE 202 CO -0.00 -0.36 -0.51 1.88 -2.23 0.00 0.00 178.31 177.09 1u74 h TYR 203 N -0.26 1.05 -0.69 0.41 0.05 -1.80 -1.18 116.97 114.55 1u74 h TYR 203 Ca 0.16 -0.36 -0.04 0.00 0.05 0.00 0.00 58.73 58.54 1u74 h TYR 203 Cb 0.51 -0.20 -0.03 0.00 1.01 0.00 0.00 36.73 38.02 1u74 h TYR 203 CO -0.48 1.17 0.27 -0.07 -1.05 0.00 0.00 178.16 178.01 1u74 h LEU 204 N 0.66 0.96 -0.44 3.88 3.38 -1.21 -2.89 115.31 119.64 1u74 h LEU 204 Ca 0.03 -0.17 -0.17 0.00 0.09 0.00 0.00 57.88 57.65 1u74 h LEU 204 Cb 1.10 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 1u74 h LEU 204 CO 0.11 0.87 -0.53 0.78 0.09 0.00 0.00 178.44 179.76 1u74 h ASN 205 N 0.99 0.77 -0.64 -0.43 2.35 -0.47 -1.41 115.58 116.74 1u74 h ASN 205 Ca 0.23 -0.41 0.06 0.00 -0.55 0.00 0.00 56.30 55.64 1u74 h ASN 205 Cb 0.21 -0.22 -0.06 0.00 0.05 0.00 0.00 38.32 38.30 1u74 h ASN 205 CO -0.02 1.15 0.33 -0.07 -1.65 0.00 0.00 177.43 177.18 1u74 h LEU 206 N 0.54 0.47 0.00 1.61 3.38 -1.04 -2.67 115.31 117.60 1u74 h LEU 206 Ca 0.01 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1u74 h LEU 206 Cb 1.10 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1u74 h LEU 206 CO 0.11 0.30 -1.29 0.00 0.09 0.00 0.00 178.44 177.65 1u74 n LEU 207 N -4.84 0.39 -0.02 1.67 -0.00 -1.11 -4.58 117.00 108.52 1u74 n LEU 207 Ca 0.08 -0.25 -0.07 0.00 -0.00 0.00 0.00 56.01 55.77 1u74 n LEU 207 Cb 0.19 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.48 1u74 n LEU 207 CO 0.28 0.10 -0.51 0.59 -0.00 0.00 0.00 177.39 177.84 1u74 n ASN 208 N -1.75 0.84 -4.92 1.45 5.03 -0.53 -4.97 115.26 110.41 1u74 n ASN 208 Ca -0.00 0.40 -0.27 0.00 0.87 0.00 0.00 54.58 55.58 1u74 n ASN 208 Cb 0.35 0.01 0.05 0.00 -1.02 0.00 0.00 39.78 39.17 1u74 n ASN 208 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1u74 s GLU 209 N -2.64 2.53 -0.47 3.52 0.41 -1.01 -5.05 118.70 115.99 1u74 s GLU 209 Ca -0.05 -0.04 -0.17 0.00 -0.41 0.00 0.00 54.97 54.31 1u74 s GLU 209 Cb 0.08 -2.17 0.06 0.00 -1.78 0.00 0.00 34.13 30.32 1u74 s GLU 209 CO 0.82 -1.04 0.48 0.34 -0.49 0.00 0.00 175.26 175.37 1u74 s ASP 210 N -4.42 6.18 -0.18 -0.19 2.15 -1.26 -4.98 116.67 113.96 1u74 s ASP 210 Ca 0.58 -1.04 -0.13 0.00 0.43 0.00 0.00 52.55 52.39 1u74 s ASP 210 Cb -0.11 -2.23 -0.05 0.00 -0.30 0.00 0.00 42.92 40.24 1u74 s ASP 210 CO 0.46 -0.71 0.25 0.26 -0.17 0.00 0.00 175.17 175.26 1u74 s TRP 211 N 2.08 3.42 -0.08 -5.34 0.52 -1.26 -4.07 118.94 114.21 1u74 s TRP 211 Ca 0.09 0.50 0.03 0.00 0.02 0.00 0.00 56.10 56.74 1u74 s TRP 211 Cb -0.21 -2.31 0.01 0.00 -1.15 0.00 0.00 33.47 29.81 1u74 s TRP 211 CO 0.10 0.21 -0.19 0.15 0.02 0.00 0.00 176.95 177.24 1u74 s LYS 212 N 0.59 2.47 0.03 4.98 3.01 -0.55 -4.92 119.74 125.35 1u74 s LYS 212 Ca 0.14 -0.68 -0.30 0.00 -1.01 0.00 0.00 55.97 54.12 1u74 s LYS 212 Cb -0.13 -1.92 -0.04 0.00 -1.01 0.00 0.00 37.83 34.73 1u74 s LYS 212 CO 0.03 0.12 1.06 -1.17 0.51 0.00 0.00 175.35 175.89 1u74 s LEU 213 N 0.48 4.38 0.25 3.17 0.20 -1.26 -0.16 118.68 125.73 1u74 s LEU 213 Ca -0.17 1.80 -0.08 0.00 0.69 0.00 0.00 54.13 56.38 1u74 s LEU 213 Cb -0.17 -3.58 -0.01 0.00 -0.43 0.00 0.00 46.19 42.00 1u74 s LEU 213 CO 0.07 -0.32 0.38 -1.61 -0.29 0.00 0.00 176.35 174.58 1u74 s GLU 214 N 0.91 1.51 -0.08 1.98 2.02 -0.45 -4.94 118.70 119.65 1u74 s GLU 214 Ca 0.54 -1.45 -0.02 0.00 0.02 0.00 0.00 54.97 54.06 1u74 s GLU 214 Cb -0.24 0.41 -0.03 0.00 0.10 0.00 0.00 34.13 34.36 1u74 s GLU 214 CO 0.29 -0.60 0.02 0.15 0.02 0.00 0.00 175.26 175.14 1u74 s LYS 215 N -3.90 3.01 0.00 1.61 1.02 -1.26 -0.61 119.74 119.61 1u74 s LYS 215 Ca 0.29 -0.40 0.00 0.00 0.02 0.00 0.00 55.97 55.87 1u74 s LYS 215 Cb 0.02 -2.83 0.00 0.00 -0.52 0.00 0.00 37.83 34.50 1u74 s LYS 215 CO 0.12 0.70 0.00 0.27 -0.92 0.00 0.00 175.35 175.52 1u74 n ASN 216 N 2.00 0.00 0.06 2.83 0.23 -0.95 -4.97 115.26 114.46 1u74 n ASN 216 Ca -0.18 0.00 0.11 0.00 -0.53 0.00 0.00 54.58 53.98 1u74 n ASN 216 Cb 0.54 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.25 1u74 n ASN 216 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1u74 n ASP 217 N 0.00 0.64 -0.62 0.53 8.00 -1.26 -4.03 116.55 119.80 1u74 n ASP 217 Ca 0.00 0.07 0.08 0.00 0.71 0.00 0.00 54.79 55.64 1u74 n ASP 217 Cb 0.00 0.73 0.24 0.00 -0.02 0.00 0.00 41.12 42.08 1u74 n ASP 217 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1u74 n ALA 218 N -2.02 2.47 -1.09 2.24 0.00 -1.26 -4.92 120.51 115.93 1u74 n ALA 218 Ca 0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 53.44 52.82 1u74 n ALA 218 Cb 0.50 -1.02 -0.01 0.00 0.00 0.00 0.00 19.45 18.92 1u74 n ALA 218 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1u74 n ASN 219 N 0.47 -3.87 -4.93 0.00 2.85 -1.26 -5.04 115.26 103.48 1u74 n ASN 219 Ca 0.14 0.08 -0.29 0.00 -0.11 0.00 0.00 54.58 54.40 1u74 n ASN 219 Cb 0.31 -1.65 -0.04 0.00 1.24 0.00 0.00 39.78 39.65 1u74 n ASN 219 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 1u74 s ASN 220 N -2.45 6.35 0.03 1.20 0.01 -1.26 -4.90 114.94 113.93 1u74 s ASN 220 Ca 0.00 0.23 -0.12 0.00 -0.71 0.00 0.00 52.86 52.26 1u74 s ASN 220 Cb 0.00 -1.94 -0.06 0.00 0.41 0.00 0.00 41.25 39.66 1u74 s ASN 220 CO 0.00 0.11 0.40 -1.61 -1.51 0.00 0.00 177.10 174.49 1u74 s GLU 221 N -2.87 3.83 0.05 -0.60 2.02 -1.26 -2.24 118.70 117.63 1u74 s GLU 221 Ca 0.35 0.29 -0.14 0.00 0.02 0.00 0.00 54.97 55.49 1u74 s GLU 221 Cb -0.12 -3.11 0.02 0.00 0.10 0.00 0.00 34.13 31.02 1u74 s GLU 221 CO 0.28 0.63 0.31 1.14 0.02 0.00 0.00 175.26 177.65 1u74 s GLN 222 N -1.46 0.83 -0.23 1.61 -2.07 0.22 -4.72 119.66 113.83 1u74 s GLN 222 Ca 0.28 -0.52 -0.23 0.00 -1.82 0.00 0.00 55.36 53.07 1u74 s GLN 222 Cb -0.15 0.36 -0.01 0.00 -1.09 0.00 0.00 33.01 32.12 1u74 s GLN 222 CO 0.15 -0.27 0.74 -1.58 -1.32 0.00 0.00 175.29 173.01 1u74 s TRP 223 N -2.67 3.32 -0.07 9.60 0.52 -0.61 -1.34 118.94 127.69 1u74 s TRP 223 Ca -0.04 1.01 0.03 0.00 0.02 0.00 0.00 56.10 57.12 1u74 s TRP 223 Cb -0.00 -2.94 -0.02 0.00 -1.15 0.00 0.00 33.47 29.35 1u74 s TRP 223 CO -0.04 -0.33 -0.16 -0.51 0.02 0.00 0.00 176.95 175.93 1u74 s ASP 224 N 1.35 3.87 0.27 2.95 1.01 0.77 -0.70 116.67 126.18 1u74 s ASP 224 Ca 0.31 -0.28 0.05 0.00 0.71 0.00 0.00 52.55 53.34 1u74 s ASP 224 Cb -0.16 -1.04 -0.03 0.00 1.01 0.00 0.00 42.92 42.71 1u74 s ASP 224 CO 0.09 0.28 0.40 -0.94 0.21 0.00 0.00 175.17 175.21 1u74 s SER 225 N -0.36 6.26 0.48 0.27 1.04 -0.41 -1.48 113.70 119.50 1u74 s SER 225 Ca 0.03 0.08 0.24 0.00 0.48 0.00 0.00 55.95 56.79 1u74 s SER 225 Cb -0.12 -1.79 1.19 0.00 0.10 0.00 0.00 66.02 65.39 1u74 s SER 225 CO 0.02 -0.15 1.97 0.50 0.98 0.00 0.00 173.24 176.56 1u74 h LYS 226 N 1.07 0.00 0.00 4.02 3.11 -1.88 -2.84 116.57 120.05 1u74 h LYS 226 Ca -0.51 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.33 1u74 h LYS 226 Cb 1.23 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.46 1u74 h LYS 226 CO 0.60 0.19 0.00 0.43 -2.81 0.00 0.00 179.45 177.86 1u74 n SER 227 N -3.64 0.00 0.00 4.20 7.64 -1.26 -4.86 113.62 115.69 1u74 n SER 227 Ca -0.01 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 59.26 1u74 n SER 227 Cb 0.32 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 1u74 n SER 227 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1u74 n GLY 228 N 0.51 0.50 3.92 0.23 0.00 -1.07 -5.08 105.19 104.20 1u74 n GLY 228 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 1u74 n GLY 228 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1u74 s TYR 229 N -2.18 3.36 0.16 1.61 2.02 -1.26 -4.58 117.35 116.50 1u74 s TYR 229 Ca 0.00 0.61 0.02 0.00 -0.37 0.00 0.00 57.07 57.34 1u74 s TYR 229 Cb 0.00 -2.47 -0.05 0.00 -0.40 0.00 0.00 41.96 39.04 1u74 s TYR 229 CO 0.00 -0.51 -0.02 0.00 -1.57 0.00 0.00 175.55 173.44 1u74 s MET 230 N -4.80 1.07 -0.05 -0.62 0.23 0.38 -1.29 119.30 114.22 1u74 s MET 230 Ca 0.50 -1.50 -0.04 0.00 -1.03 0.00 0.00 55.69 53.62 1u74 s MET 230 Cb -0.10 -0.33 0.02 0.00 -1.53 0.00 0.00 34.83 32.88 1u74 s MET 230 CO 0.43 -0.08 0.14 -1.64 -2.03 0.00 0.00 175.02 171.84 1u74 s MET 231 N -3.87 0.15 0.64 3.16 -1.94 0.12 -4.15 119.30 113.41 1u74 s MET 231 Ca 0.21 0.22 -0.13 0.00 -1.71 0.00 0.00 55.69 54.28 1u74 s MET 231 Cb 0.05 0.03 -0.02 0.00 2.01 0.00 0.00 34.83 36.91 1u74 s MET 231 CO 0.02 -0.04 1.05 -0.51 -0.01 0.00 0.00 175.02 175.53 1u74 s LEU 232 N 0.26 3.29 0.49 -0.03 1.43 -1.26 -1.57 118.68 121.29 1u74 s LEU 232 Ca -0.02 1.64 0.18 0.00 -1.03 0.00 0.00 54.13 54.91 1u74 s LEU 232 Cb -0.03 -4.50 1.21 0.00 0.03 0.00 0.00 46.19 42.90 1u74 s LEU 232 CO -0.01 -1.21 2.02 -0.65 0.23 0.00 0.00 176.35 176.73 1u74 h PRO 233 N -0.19 0.17 0.00 1.29 0.11 -1.83 -1.43 132.00 130.13 1u74 h PRO 233 Ca -0.45 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 1u74 h PRO 233 Cb 1.21 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1u74 h PRO 233 CO 0.58 0.12 -0.18 1.79 -0.21 0.00 0.00 178.00 180.10 1u74 h THR 234 N 0.18 0.33 0.06 -1.15 1.35 -1.51 -0.62 112.91 111.55 1u74 h THR 234 Ca 0.21 -1.30 -0.19 0.00 -0.55 0.00 0.00 66.41 64.57 1u74 h THR 234 Cb 0.58 2.02 0.02 0.00 -1.73 0.00 0.00 68.15 69.04 1u74 h THR 234 CO -0.03 0.17 -0.78 0.44 -0.25 0.00 0.00 175.52 175.07 1u74 h ASP 235 N 0.00 0.59 0.32 5.36 3.32 -1.67 -3.26 116.42 121.08 1u74 h ASP 235 Ca -0.00 -0.82 -0.09 0.00 0.02 0.00 0.00 57.03 56.14 1u74 h ASP 235 Cb 1.01 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 1u74 h ASP 235 CO 0.02 1.35 -0.38 0.22 -1.72 0.00 0.00 179.24 178.72 1u74 h TYR 236 N -0.10 0.11 0.00 4.55 3.20 -1.11 -2.51 116.97 121.11 1u74 h TYR 236 Ca -0.11 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.73 1u74 h TYR 236 Cb 1.52 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.76 1u74 h TYR 236 CO 0.15 0.47 0.00 0.66 -1.64 0.00 0.00 178.16 177.80 1u74 h SER 237 N 0.08 0.00 1.13 -2.11 4.64 -1.15 -1.24 113.55 114.90 1u74 h SER 237 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1u74 h SER 237 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1u74 h SER 237 CO 0.05 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.94 1u74 h LEU 238 N 0.00 0.00 -0.26 5.97 3.38 -1.54 -2.34 115.31 120.53 1u74 h LEU 238 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1u74 h LEU 238 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1u74 h LEU 238 CO 0.00 0.00 -0.56 2.30 0.09 0.00 0.00 178.44 180.27 1u74 n ILE 239 N -2.50 0.00 0.01 1.22 -5.35 -0.48 -2.05 119.36 110.20 1u74 n ILE 239 Ca 0.03 -0.22 -0.08 0.00 -0.27 0.00 0.00 62.75 62.21 1u74 n ILE 239 Cb 0.33 1.05 -0.13 0.00 -1.74 0.00 0.00 39.64 39.15 1u74 n ILE 239 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 1u74 h GLN 240 N 0.50 0.01 -5.73 6.28 4.20 -1.40 -3.45 115.11 115.52 1u74 h GLN 240 Ca 0.00 -0.01 -0.59 0.00 0.06 0.00 0.00 58.65 58.11 1u74 h GLN 240 Cb 0.39 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.08 1u74 h GLN 240 CO 0.00 0.67 0.30 0.34 -0.67 0.00 0.00 178.83 179.47 1u74 s ASP 241 N -6.31 6.77 0.41 1.46 -1.08 -0.91 -4.96 116.67 112.04 1u74 s ASP 241 Ca -0.03 0.94 0.13 0.00 -0.52 0.00 0.00 52.55 53.07 1u74 s ASP 241 Cb 0.09 -2.40 0.97 0.00 -1.46 0.00 0.00 42.92 40.12 1u74 s ASP 241 CO 0.82 -0.40 1.91 1.55 0.52 0.00 0.00 175.17 179.58 1u74 h PRO 242 N 7.60 0.49 0.07 4.34 0.13 -1.91 0.35 132.00 143.07 1u74 h PRO 242 Ca -0.27 -0.03 -0.28 0.00 -0.87 0.00 0.00 66.00 64.55 1u74 h PRO 242 Cb 1.12 -0.11 0.02 0.00 0.13 0.00 0.00 31.00 32.16 1u74 h PRO 242 CO 0.82 0.33 -1.15 0.87 -0.23 0.00 0.00 178.00 178.63 1u74 h LYS 243 N 0.51 0.58 -0.08 0.86 1.57 -1.94 -3.12 116.57 114.94 1u74 h LYS 243 Ca 0.38 -0.72 -0.19 0.00 -1.87 0.00 0.00 60.65 58.25 1u74 h LYS 243 Cb 0.76 0.23 -0.00 0.00 0.08 0.00 0.00 32.23 33.30 1u74 h LYS 243 CO -0.14 1.31 -0.75 1.88 -0.57 0.00 0.00 179.45 181.19 1u74 h TYR 244 N 0.28 0.62 -0.98 -1.35 0.05 -1.71 -3.31 116.97 110.57 1u74 h TYR 244 Ca -0.15 -0.28 0.01 0.00 0.05 0.00 0.00 58.73 58.36 1u74 h TYR 244 Cb 1.81 -0.09 -0.05 0.00 1.01 0.00 0.00 36.73 39.41 1u74 h TYR 244 CO 0.10 1.04 0.64 1.25 -1.05 0.00 0.00 178.16 180.14 1u74 h LEU 245 N 0.31 1.13 -0.11 3.88 7.12 -0.34 -2.21 115.31 125.09 1u74 h LEU 245 Ca -0.04 -0.04 0.00 0.00 0.13 0.00 0.00 57.88 57.94 1u74 h LEU 245 Cb 1.33 -0.28 0.00 0.00 -0.53 0.00 0.00 40.66 41.18 1u74 h LEU 245 CO 0.13 0.83 0.00 -1.54 -0.13 0.00 0.00 178.44 177.73 1u74 n SER 246 N -4.39 0.29 0.01 1.25 3.41 -1.18 -1.51 113.62 111.50 1u74 n SER 246 Ca 0.11 0.54 0.03 0.00 -0.26 0.00 0.00 58.87 59.30 1u74 n SER 246 Cb 0.02 -0.62 -0.11 0.00 -0.26 0.00 0.00 64.21 63.25 1u74 n SER 246 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1u74 n ILE 247 N -1.79 0.83 0.01 -1.33 5.41 -1.04 -3.13 119.36 118.31 1u74 n ILE 247 Ca 0.05 -0.65 -0.19 0.00 1.00 0.00 0.00 62.75 62.96 1u74 n ILE 247 Cb 0.30 -0.43 -0.09 0.00 -0.71 0.00 0.00 39.64 38.70 1u74 n ILE 247 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1u74 h VAL 248 N 0.00 1.30 0.00 1.39 2.07 -1.07 -2.82 116.25 117.12 1u74 h VAL 248 Ca -0.17 -2.10 -0.09 0.00 0.82 0.00 0.00 66.70 65.16 1u74 h VAL 248 Cb 1.46 2.26 -0.01 0.00 -1.52 0.00 0.00 31.29 33.48 1u74 h VAL 248 CO 0.02 0.65 -0.43 0.11 0.02 0.00 0.00 177.57 177.95 1u74 h LYS 249 N 0.37 0.00 -0.11 1.57 1.57 -1.40 -2.19 116.57 116.38 1u74 h LYS 249 Ca -0.09 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1u74 h LYS 249 Cb 1.52 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.83 1u74 h LYS 249 CO 0.17 0.43 -0.01 1.49 -0.57 0.00 0.00 179.45 180.96 1u74 h GLU 250 N 0.00 0.20 0.00 3.15 4.81 -1.52 -2.92 114.58 118.30 1u74 h GLU 250 Ca -0.00 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.07 1u74 h GLU 250 Cb 0.79 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 1u74 h GLU 250 CO 0.06 0.48 -0.40 1.88 -0.73 0.00 0.00 179.01 180.30 1u74 h TYR 251 N -0.09 0.00 0.00 0.92 0.05 -1.41 -1.54 116.97 114.90 1u74 h TYR 251 Ca 0.03 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.75 1u74 h TYR 251 Cb 0.40 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.13 1u74 h TYR 251 CO 0.04 0.40 -0.26 0.00 -1.05 0.00 0.00 178.16 177.29 1u74 h ALA 252 N 1.60 0.96 0.05 3.88 0.00 -1.37 -3.22 119.26 121.16 1u74 h ALA 252 Ca -0.00 -0.24 -0.34 0.00 0.00 0.00 0.00 54.91 54.33 1u74 h ALA 252 Cb 0.92 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 1u74 h ALA 252 CO 0.05 0.32 -1.96 0.09 0.00 0.00 0.00 179.25 177.75 1u74 n ASN 253 N -3.35 1.44 -3.83 0.00 3.02 -1.05 -4.85 115.26 106.64 1u74 n ASN 253 Ca 0.01 0.24 -0.29 0.00 -0.03 0.00 0.00 54.58 54.50 1u74 n ASN 253 Cb 0.48 -0.35 -0.16 0.00 -0.61 0.00 0.00 39.78 39.15 1u74 n ASN 253 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1u74 s ASP 254 N -6.49 3.59 0.19 6.41 -1.08 -0.60 -5.00 116.67 113.70 1u74 s ASP 254 Ca -0.16 -1.18 0.04 0.00 -0.52 0.00 0.00 52.55 50.74 1u74 s ASP 254 Cb 0.07 -0.94 0.09 0.00 -1.46 0.00 0.00 42.92 40.68 1u74 s ASP 254 CO 0.78 -0.30 1.44 -0.61 0.52 0.00 0.00 175.17 177.01 1u74 h GLN 255 N 8.07 0.17 -0.42 4.34 4.15 -1.87 -2.97 115.11 126.58 1u74 h GLN 255 Ca -0.16 -0.16 -0.00 0.00 0.77 0.00 0.00 58.65 59.10 1u74 h GLN 255 Cb 1.08 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.79 1u74 h GLN 255 CO 0.40 0.87 0.25 -0.44 -1.93 0.00 0.00 178.83 177.98 1u74 h ASP 256 N 0.10 0.50 -0.74 -0.69 5.19 -1.94 0.51 116.42 119.34 1u74 h ASP 256 Ca -0.03 -0.05 -0.02 0.00 -0.62 0.00 0.00 57.03 56.31 1u74 h ASP 256 Cb 1.38 -0.13 -0.03 0.00 0.18 0.00 0.00 39.33 40.73 1u74 h ASP 256 CO 0.12 0.40 0.38 0.50 -3.12 0.00 0.00 179.24 177.52 1u74 h LYS 257 N 0.55 1.06 -0.40 3.56 1.63 -1.96 0.58 116.57 121.60 1u74 h LYS 257 Ca 0.15 -0.14 -0.11 0.00 -0.85 0.00 0.00 60.65 59.69 1u74 h LYS 257 Cb -0.01 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 31.41 1u74 h LYS 257 CO -0.03 0.81 -0.20 0.35 -3.45 0.00 0.00 179.45 176.93 1u74 h PHE 258 N 1.04 0.88 0.00 1.91 3.57 -1.22 -1.92 116.94 121.20 1u74 h PHE 258 Ca 0.26 -0.19 -0.07 0.00 3.53 0.00 0.00 57.97 61.49 1u74 h PHE 258 Cb 0.09 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1u74 h PHE 258 CO 0.00 0.92 -0.33 0.74 -2.23 0.00 0.00 178.31 177.41 1u74 h PHE 259 N 0.69 0.00 0.10 0.41 -1.00 0.10 -3.01 116.94 114.23 1u74 h PHE 259 Ca 0.10 0.00 -0.31 0.00 2.81 0.00 0.00 57.97 60.57 1u74 h PHE 259 Cb 0.71 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.26 1u74 h PHE 259 CO 0.04 0.33 -1.56 0.87 -1.61 0.00 0.00 178.31 176.38 1u74 h LYS 260 N 0.00 0.22 0.02 1.51 1.57 -0.65 -3.23 116.57 116.01 1u74 h LYS 260 Ca -0.00 -0.37 -0.26 0.00 -1.87 0.00 0.00 60.65 58.15 1u74 h LYS 260 Cb 0.82 0.14 0.01 0.00 0.08 0.00 0.00 32.23 33.28 1u74 h LYS 260 CO 0.04 1.06 -1.04 -0.44 -0.57 0.00 0.00 179.45 178.50 1u74 h ASP 261 N 0.06 0.74 -0.03 0.86 3.32 -1.41 -2.81 116.42 117.16 1u74 h ASP 261 Ca -0.25 -0.61 -0.00 0.00 0.02 0.00 0.00 57.03 56.18 1u74 h ASP 261 Cb 2.01 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 41.33 1u74 h ASP 261 CO 0.15 1.42 0.01 0.15 -1.72 0.00 0.00 179.24 179.24 1u74 h PHE 262 N 0.31 0.04 -0.72 4.55 3.04 -1.70 0.16 116.94 122.61 1u74 h PHE 262 Ca -0.12 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.82 1u74 h PHE 262 Cb 1.69 -0.01 -0.04 0.00 2.56 0.00 0.00 35.95 40.15 1u74 h PHE 262 CO 0.09 0.25 0.41 0.66 -2.02 0.00 0.00 178.31 177.69 1u74 h SER 263 N -0.18 0.88 -0.12 0.41 4.64 -1.62 2.12 113.55 119.68 1u74 h SER 263 Ca 0.01 -0.06 -0.03 0.00 -0.47 0.00 0.00 61.79 61.24 1u74 h SER 263 Cb 0.23 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1u74 h SER 263 CO -0.00 0.70 -0.02 0.11 -0.87 0.00 0.00 176.83 176.75 1u74 h LYS 264 N 1.00 0.23 -0.29 4.77 1.57 -1.37 -2.10 116.57 120.39 1u74 h LYS 264 Ca 0.26 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 58.88 1u74 h LYS 264 Cb 0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1u74 h LYS 264 CO -0.04 0.52 -0.11 0.00 -0.57 0.00 0.00 179.45 179.24 1u74 h ALA 265 N 0.71 0.40 -0.58 3.86 0.00 -0.03 -2.04 119.26 121.59 1u74 h ALA 265 Ca 0.03 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 1u74 h ALA 265 Cb 0.43 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1u74 h ALA 265 CO 0.01 0.27 0.07 0.35 0.00 0.00 0.00 179.25 179.95 1u74 h PHE 266 N 0.34 1.01 -0.24 0.00 3.57 0.34 0.10 116.94 122.06 1u74 h PHE 266 Ca 0.07 -0.13 -0.03 0.00 3.53 0.00 0.00 57.97 61.40 1u74 h PHE 266 Cb 0.62 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 1u74 h PHE 266 CO 0.06 0.87 0.03 1.49 -2.23 0.00 0.00 178.31 178.53 1u74 h GLU 267 N 0.89 0.40 -0.35 1.11 4.81 -1.35 -2.34 114.58 117.75 1u74 h GLU 267 Ca 0.18 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1u74 h GLU 267 Cb 0.42 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1u74 h GLU 267 CO 0.01 0.54 0.15 -0.22 -0.73 0.00 0.00 179.01 178.77 1u74 h LYS 268 N 0.20 0.49 -0.46 1.92 3.64 -0.99 -0.59 116.57 120.78 1u74 h LYS 268 Ca 0.07 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.29 1u74 h LYS 268 Cb 0.34 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1u74 h LYS 268 CO 0.01 0.40 -0.11 1.25 -2.27 0.00 0.00 179.45 178.72 1u74 h LEU 269 N 0.49 0.90 -0.05 5.20 6.46 -0.48 -2.57 115.31 125.27 1u74 h LEU 269 Ca 0.12 -0.36 -0.05 0.00 -0.12 0.00 0.00 57.88 57.48 1u74 h LEU 269 Cb 0.08 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 39.76 1u74 h LEU 269 CO -0.01 1.05 -0.23 -0.07 -0.62 0.00 0.00 178.44 178.56 1u74 h LEU 270 N 0.74 0.00 -1.59 2.25 3.38 -0.87 -3.28 115.31 115.94 1u74 h LEU 270 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1u74 h LEU 270 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1u74 h LEU 270 CO 0.05 0.23 0.00 -0.62 0.09 0.00 0.00 178.44 178.19 1u74 n GLU 271 N -3.16 2.09 -1.81 1.13 1.02 -0.29 -4.62 120.64 115.00 1u74 n GLU 271 Ca 0.03 -1.59 -0.42 0.00 -0.02 0.00 0.00 57.16 55.16 1u74 n GLU 271 Cb 0.62 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.54 1u74 n GLU 271 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1u74 s ASN 272 N -1.98 6.52 0.00 1.62 0.01 -0.98 -2.76 114.94 117.37 1u74 s ASN 272 Ca 0.32 2.60 0.00 0.00 -0.71 0.00 0.00 52.86 55.07 1u74 s ASN 272 Cb 0.20 -2.56 0.00 0.00 0.41 0.00 0.00 41.25 39.31 1u74 s ASN 272 CO 0.31 -0.96 0.00 0.61 -1.51 0.00 0.00 177.10 175.55 1u74 n GLY 273 N 4.18 0.75 3.57 0.66 0.00 -1.26 -4.46 105.19 108.62 1u74 n GLY 273 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1u74 n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u74 s ILE 274 N -2.57 3.91 -0.24 -0.61 1.01 -1.11 -4.29 121.20 117.29 1u74 s ILE 274 Ca 0.00 -0.38 -0.07 0.00 0.00 0.00 0.00 60.65 60.20 1u74 s ILE 274 Cb 0.00 -2.65 -0.03 0.00 0.01 0.00 0.00 42.46 39.79 1u74 s ILE 274 CO 0.00 0.56 0.06 -0.89 0.00 0.00 0.00 174.94 174.67 1u74 s THR 275 N -0.36 4.24 -0.36 2.92 2.01 0.17 -4.99 115.64 119.27 1u74 s THR 275 Ca 0.06 -0.20 -0.13 0.00 0.31 0.00 0.00 61.69 61.74 1u74 s THR 275 Cb -0.12 -2.98 0.01 0.00 0.01 0.00 0.00 72.50 69.42 1u74 s THR 275 CO 0.02 0.35 0.24 -0.36 -0.69 0.00 0.00 174.62 174.18 1u74 s PHE 276 N 1.53 3.23 0.65 4.92 0.08 -1.26 -0.53 117.98 126.59 1u74 s PHE 276 Ca 0.06 -0.55 -0.17 0.00 0.12 0.00 0.00 56.93 56.38 1u74 s PHE 276 Cb -0.15 -2.48 -0.01 0.00 -0.57 0.00 0.00 43.02 39.81 1u74 s PHE 276 CO 0.03 -0.51 1.21 -2.14 -0.10 0.00 0.00 175.22 173.71 1u74 s PRO 277 N 1.65 2.66 0.21 0.24 0.02 -1.26 -4.89 135.00 133.63 1u74 s PRO 277 Ca 0.05 1.79 0.14 0.00 0.02 0.00 0.00 61.00 62.99 1u74 s PRO 277 Cb -0.18 -1.89 0.75 0.00 0.02 0.00 0.00 34.50 33.20 1u74 s PRO 277 CO 0.09 -1.44 1.42 1.17 -0.33 0.00 0.00 177.00 177.91 1u74 n LYS 278 N -2.04 0.09 0.06 5.54 4.81 -1.26 -1.63 118.16 123.73 1u74 n LYS 278 Ca 0.13 0.59 0.13 0.00 -0.87 0.00 0.00 58.31 58.29 1u74 n LYS 278 Cb 0.50 -1.80 0.37 0.00 0.02 0.00 0.00 35.03 34.12 1u74 n LYS 278 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1u74 n ASP 279 N -1.99 0.60 -4.75 3.14 5.68 -1.26 -4.91 116.55 113.07 1u74 n ASP 279 Ca -0.01 0.37 -0.39 0.00 -0.50 0.00 0.00 54.79 54.26 1u74 n ASP 279 Cb 0.03 -0.40 0.03 0.00 -1.14 0.00 0.00 41.12 39.63 1u74 n ASP 279 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1u74 n ALA 280 N -1.72 1.79 -1.63 2.12 0.00 -0.65 -4.98 120.51 115.44 1u74 n ALA 280 Ca 0.05 0.20 -0.34 0.00 0.00 0.00 0.00 53.44 53.35 1u74 n ALA 280 Cb 0.41 -2.37 0.03 0.00 0.00 0.00 0.00 19.45 17.52 1u74 n ALA 280 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1u74 s PRO 281 N -2.60 3.06 0.55 0.00 0.04 -1.26 -5.00 135.00 129.80 1u74 s PRO 281 Ca 0.65 1.48 -0.21 0.00 0.04 0.00 0.00 61.00 62.96 1u74 s PRO 281 Cb -0.44 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.07 1u74 s PRO 281 CO 0.54 -1.06 1.31 0.45 0.04 0.00 0.00 177.00 178.29 1u74 n SER 282 N -1.91 2.46 -4.71 6.66 2.88 -1.26 -4.91 113.62 112.84 1u74 n SER 282 Ca 0.11 0.96 -0.43 0.00 -1.33 0.00 0.00 58.87 58.17 1u74 n SER 282 Cb 0.52 -1.56 -0.01 0.00 -0.75 0.00 0.00 64.21 62.41 1u74 n SER 282 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1u74 n PRO 283 N -1.05 2.25 -2.87 -1.46 -0.04 -1.26 -4.97 135.00 125.60 1u74 n PRO 283 Ca 0.11 0.80 -0.39 0.00 -0.04 0.00 0.00 63.50 63.97 1u74 n PRO 283 Cb 0.45 -2.45 -0.06 0.00 -0.04 0.00 0.00 33.50 31.40 1u74 n PRO 283 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1u74 s PHE 284 N -0.58 3.92 -0.28 0.54 0.08 0.32 -4.77 117.98 117.20 1u74 s PHE 284 Ca 0.61 1.76 0.01 0.00 0.12 0.00 0.00 56.93 59.43 1u74 s PHE 284 Cb -0.57 -2.87 0.06 0.00 -0.57 0.00 0.00 43.02 39.07 1u74 s PHE 284 CO 0.56 0.46 -0.05 0.42 -0.10 0.00 0.00 175.22 176.51 1u74 s ILE 285 N -1.21 2.58 0.31 0.64 -1.09 -1.26 -1.18 121.20 119.99 1u74 s ILE 285 Ca 0.39 -1.54 -0.18 0.00 -2.23 0.00 0.00 60.65 57.09 1u74 s ILE 285 Cb -0.24 -2.51 -0.09 0.00 -1.58 0.00 0.00 42.46 38.04 1u74 s ILE 285 CO 0.28 -0.09 0.79 -0.36 -1.23 0.00 0.00 174.94 174.34 1u74 s PHE 286 N 1.17 3.47 0.14 3.97 0.08 -1.26 -5.06 117.98 120.49 1u74 s PHE 286 Ca -0.07 1.39 -0.24 0.00 0.12 0.00 0.00 56.93 58.14 1u74 s PHE 286 Cb -0.20 -2.65 -0.08 0.00 -0.57 0.00 0.00 43.02 39.52 1u74 s PHE 286 CO -0.03 0.14 0.72 0.15 -0.10 0.00 0.00 175.22 176.10 1u74 s LYS 287 N -2.63 4.47 0.98 0.44 1.02 -1.26 -5.01 119.74 117.75 1u74 s LYS 287 Ca 0.52 1.04 -0.14 0.00 0.02 0.00 0.00 55.97 57.40 1u74 s LYS 287 Cb -0.13 -3.26 0.18 0.00 -0.52 0.00 0.00 37.83 34.11 1u74 s LYS 287 CO 0.18 0.58 1.17 0.95 -0.92 0.00 0.00 175.35 177.31 1u74 s THR 288 N -1.10 1.92 0.26 2.17 -4.23 -1.26 -4.94 115.64 108.45 1u74 s THR 288 Ca 0.34 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 60.87 1u74 s THR 288 Cb -0.22 -2.74 0.03 0.00 1.34 0.00 0.00 72.50 70.91 1u74 s THR 288 CO 0.24 0.00 1.67 -0.07 -0.54 0.00 0.00 174.62 175.92 1u74 h LEU 289 N -1.76 0.47 -1.15 4.79 3.38 -1.96 -2.90 115.31 116.19 1u74 h LEU 289 Ca -0.48 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.25 1u74 h LEU 289 Cb 1.30 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 1u74 h LEU 289 CO 0.51 0.79 0.07 -0.08 0.09 0.00 0.00 178.44 179.82 1u74 h GLU 290 N 0.39 0.66 0.00 1.13 4.81 -1.93 -0.50 114.58 119.14 1u74 h GLU 290 Ca 0.04 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1u74 h GLU 290 Cb 0.79 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.07 1u74 h GLU 290 CO 0.06 0.63 0.00 0.93 -0.73 0.00 0.00 179.01 179.91 1u74 h GLU 291 N 0.64 0.00 -0.51 1.92 5.08 -1.80 -2.89 114.58 117.01 1u74 h GLU 291 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1u74 h GLU 291 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1u74 h GLU 291 CO 0.00 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.05 1u74 n GLN 292 N -2.34 3.67 -0.10 2.33 6.02 -0.75 -4.95 117.38 121.26 1u74 n GLN 292 Ca 0.04 -2.83 0.00 0.00 -0.01 0.00 0.00 57.00 54.20 1u74 n GLN 292 Cb 0.34 -1.87 0.00 0.00 1.02 0.00 0.00 30.24 29.72 1u74 n GLN 292 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1u74 n GLY 293 N 0.59 1.59 0.36 1.08 0.00 -1.09 -5.06 105.19 102.65 1u74 n GLY 293 Ca 0.23 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.40 1u74 n GLY 293 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36