#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sd0 n ASP 3 N 0.00 0.00 -0.11 4.52 5.68 -1.26 -4.98 116.55 120.40 1sd0 n ASP 3 Ca 0.00 0.00 -0.18 0.00 -0.50 0.00 0.00 54.79 54.11 1sd0 n ASP 3 Cb 0.00 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 39.88 1sd0 n ASP 3 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.20 177.54 1sd0 n GLN 4 N 0.00 0.54 -0.17 0.11 -0.06 -1.26 -4.20 117.38 112.34 1sd0 n GLN 4 Ca 0.00 0.15 0.14 0.00 -2.00 0.00 0.00 57.00 55.29 1sd0 n GLN 4 Cb 0.00 -1.42 0.47 0.00 -4.06 0.00 0.00 30.24 25.24 1sd0 n GLN 4 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1sd0 h ALA 5 N -0.21 2.03 0.29 1.69 0.00 -2.00 -1.36 119.26 119.71 1sd0 h ALA 5 Ca -0.52 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 1sd0 h ALA 5 Cb 1.71 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1sd0 h ALA 5 CO -0.15 -0.22 -0.14 1.15 0.00 0.00 0.00 179.25 179.89 1sd0 h THR 6 N 0.48 0.71 -0.45 0.00 2.02 -1.97 -2.78 112.91 110.93 1sd0 h THR 6 Ca 0.37 -0.63 0.10 0.00 0.77 0.00 0.00 66.41 67.02 1sd0 h THR 6 Cb 0.74 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 1sd0 h THR 6 CO -0.13 0.12 0.31 -0.07 0.37 0.00 0.00 175.52 176.13 1sd0 h LEU 7 N -0.75 0.14 -0.51 2.58 3.38 -1.59 0.76 115.31 119.31 1sd0 h LEU 7 Ca -0.04 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1sd0 h LEU 7 Cb 0.50 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1sd0 h LEU 7 CO 0.07 0.08 0.13 0.44 0.09 0.00 0.00 178.44 179.25 1sd0 h ASP 8 N 0.16 0.78 0.71 -0.43 3.32 -1.18 0.21 116.42 119.99 1sd0 h ASP 8 Ca 0.21 -0.23 -0.15 0.00 0.02 0.00 0.00 57.03 56.88 1sd0 h ASP 8 Cb 0.63 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 1sd0 h ASP 8 CO -0.03 0.81 -0.73 0.11 -1.72 0.00 0.00 179.24 177.68 1sd0 h LYS 9 N 0.71 0.02 0.14 3.56 1.57 -0.74 -2.12 116.57 119.70 1sd0 h LYS 9 Ca 0.16 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1sd0 h LYS 9 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1sd0 h LYS 9 CO 0.00 0.74 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.48 1sd0 h LEU 10 N 0.01 -0.15 -1.25 2.94 3.38 -0.70 0.42 115.31 119.96 1sd0 h LEU 10 Ca -0.01 -0.38 0.08 0.00 0.09 0.00 0.00 57.88 57.66 1sd0 h LEU 10 Cb 1.29 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 42.02 1sd0 h LEU 10 CO 0.10 0.36 0.55 -0.33 0.09 0.00 0.00 178.44 179.20 1sd0 h GLU 11 N -0.73 0.84 -0.12 1.13 4.39 -1.02 0.54 114.58 119.60 1sd0 h GLU 11 Ca -0.02 -0.05 -0.17 0.00 0.34 0.00 0.00 59.36 59.46 1sd0 h GLU 11 Cb 0.53 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.98 1sd0 h GLU 11 CO 0.03 0.56 -0.62 0.00 -1.16 0.00 0.00 179.01 177.81 1sd0 h ALA 12 N 1.56 0.69 -0.17 3.43 0.00 -1.31 -2.71 119.26 120.75 1sd0 h ALA 12 Ca 0.38 -0.55 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 1sd0 h ALA 12 Cb 0.33 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1sd0 h ALA 12 CO -0.15 0.72 -0.38 0.78 0.00 0.00 0.00 179.25 180.22 1sd0 h GLY 13 N 1.20 0.61 0.81 0.00 0.00 0.18 -2.61 103.07 103.26 1sd0 h GLY 13 Ca -0.01 -0.74 0.04 0.00 0.00 0.00 0.00 47.33 46.62 1sd0 h GLY 13 CO 0.11 0.66 0.39 -2.75 0.00 0.00 0.00 176.54 174.95 1sd0 h PHE 14 N 0.20 0.72 -0.77 5.60 3.57 -0.02 -1.65 116.94 124.59 1sd0 h PHE 14 Ca -0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 1sd0 h PHE 14 Cb 0.99 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 39.46 1sd0 h PHE 14 CO 0.10 0.39 0.40 -0.22 -2.23 0.00 0.00 178.31 176.75 1sd0 h LYS 15 N 0.75 1.08 -0.67 1.11 3.64 -1.49 -2.54 116.57 118.45 1sd0 h LYS 15 Ca 0.27 -0.14 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1sd0 h LYS 15 Cb 0.08 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 1sd0 h LYS 15 CO -0.13 0.82 0.40 -0.22 -2.27 0.00 0.00 179.45 178.05 1sd0 h LYS 16 N 1.08 0.91 0.00 1.90 3.64 -0.91 -1.45 116.57 121.74 1sd0 h LYS 16 Ca 0.27 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.54 1sd0 h LYS 16 Cb 0.07 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1sd0 h LYS 16 CO -0.04 0.64 -0.16 -0.07 -2.27 0.00 0.00 179.45 177.56 1sd0 h LEU 17 N 0.93 0.00 0.07 5.20 3.38 -1.00 -3.02 115.31 120.86 1sd0 h LEU 17 Ca 0.24 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.12 1sd0 h LEU 17 Cb -0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.73 1sd0 h LEU 17 CO -0.05 0.16 -0.41 1.56 0.09 0.00 0.00 178.44 179.79 1sd0 h GLN 18 N 0.00 0.16 -0.83 1.13 1.08 -1.22 -3.29 115.11 112.14 1sd0 h GLN 18 Ca -0.00 -0.26 0.00 0.00 -1.45 0.00 0.00 58.65 56.94 1sd0 h GLN 18 Cb 0.51 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 1sd0 h GLN 18 CO 0.02 1.12 0.00 0.39 -0.95 0.00 0.00 178.83 179.41 1sd0 n GLU 19 N -4.36 0.76 -3.30 1.46 1.02 -0.84 -4.00 120.64 111.37 1sd0 n GLU 19 Ca -0.12 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.75 1sd0 n GLU 19 Cb 0.65 -1.34 -0.07 0.00 -0.02 0.00 0.00 31.44 30.66 1sd0 n GLU 19 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sd0 n ALA 20 N 0.19 4.04 -0.42 0.62 0.00 -1.19 -4.93 120.51 118.81 1sd0 n ALA 20 Ca 0.00 -4.64 0.39 0.00 0.00 0.00 0.00 53.44 49.19 1sd0 n ALA 20 Cb 0.22 -0.86 0.74 0.00 0.00 0.00 0.00 19.45 19.55 1sd0 n ALA 20 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1sd0 h SER 21 N 3.90 0.05 -0.26 0.00 0.02 -1.86 0.26 113.55 115.66 1sd0 h SER 21 Ca 0.17 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1sd0 h SER 21 Cb 0.65 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.20 1sd0 h SER 21 CO 0.80 -0.01 0.00 0.47 -1.14 0.00 0.00 176.83 176.96 1sd0 n ASP 22 N -4.19 2.29 -4.69 3.07 8.00 -1.26 -4.91 116.55 114.86 1sd0 n ASP 22 Ca 0.31 -1.83 -0.42 0.00 0.71 0.00 0.00 54.79 53.55 1sd0 n ASP 22 Cb 1.42 -0.17 -0.03 0.00 -0.02 0.00 0.00 41.12 42.32 1sd0 n ASP 22 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1sd0 n LYS 24 N 4.76 1.64 -2.35 0.00 5.02 -1.26 -4.93 118.16 121.03 1sd0 n LYS 24 Ca 0.08 -2.43 -0.35 0.00 -2.02 0.00 0.00 58.31 53.59 1sd0 n LYS 24 Cb 0.49 -1.44 -0.01 0.00 -0.02 0.00 0.00 35.03 34.04 1sd0 n LYS 24 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1sd0 s SER 25 N -2.53 6.08 0.62 4.39 1.04 -1.24 -4.90 113.70 117.16 1sd0 s SER 25 Ca 0.28 2.14 0.37 0.00 0.48 0.00 0.00 55.95 59.21 1sd0 s SER 25 Cb 0.24 -2.58 2.06 0.00 0.10 0.00 0.00 66.02 65.83 1sd0 s SER 25 CO 0.03 -0.97 2.29 -0.07 0.98 0.00 0.00 173.24 175.50 1sd0 h LEU 26 N 1.64 0.00 0.64 2.42 3.38 -1.11 -2.08 115.31 120.20 1sd0 h LEU 26 Ca -0.50 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.44 1sd0 h LEU 26 Cb 1.24 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.00 1sd0 h LEU 26 CO 0.59 0.01 -0.31 0.25 0.09 0.00 0.00 178.44 179.07 1sd0 h LEU 27 N 0.00 -0.73 -0.82 1.67 5.85 -1.60 -1.33 115.31 118.35 1sd0 h LEU 27 Ca -0.00 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 1sd0 h LEU 27 Cb 0.05 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1sd0 h LEU 27 CO 0.00 -0.50 0.41 0.50 -0.34 0.00 0.00 178.44 178.52 1sd0 h LYS 28 N -0.89 1.17 0.00 1.25 3.64 -1.70 0.15 116.57 120.19 1sd0 h LYS 28 Ca -0.09 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1sd0 h LYS 28 Cb 0.67 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1sd0 h LYS 28 CO 0.14 0.89 0.00 -0.22 -2.27 0.00 0.00 179.45 178.00 1sd0 h LYS 29 N 1.16 0.00 0.00 1.90 3.64 -1.24 -3.29 116.57 118.73 1sd0 h LYS 29 Ca 0.28 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 1sd0 h LYS 29 Cb 0.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1sd0 h LYS 29 CO -0.04 0.00 -0.06 0.72 -2.27 0.00 0.00 179.45 177.81 1sd0 n HIS 30 N -3.08 0.00 -2.64 1.91 8.25 -0.51 -4.86 115.22 114.29 1sd0 n HIS 30 Ca -0.01 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 1sd0 n HIS 30 Cb 0.19 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.30 1sd0 n HIS 30 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1sd0 n LEU 31 N -0.79 5.71 -4.84 2.41 7.94 0.49 -4.87 117.00 123.06 1sd0 n LEU 31 Ca 0.00 -4.41 -0.30 0.00 -1.11 0.00 0.00 56.01 50.19 1sd0 n LEU 31 Cb 0.00 -1.60 0.08 0.00 0.53 0.00 0.00 43.42 42.43 1sd0 n LEU 31 CO 0.00 0.86 0.73 0.42 -1.11 0.00 0.00 177.39 178.29 1sd0 s THR 32 N 1.72 3.11 0.42 1.96 -4.23 -1.26 -4.74 115.64 112.61 1sd0 s THR 32 Ca 0.44 0.36 0.31 0.00 -1.18 0.00 0.00 61.69 61.62 1sd0 s THR 32 Cb 0.03 -3.21 0.34 0.00 1.34 0.00 0.00 72.50 70.99 1sd0 s THR 32 CO 0.01 -0.47 2.12 0.50 -0.54 0.00 0.00 174.62 176.23 1sd0 h LYS 33 N -0.95 0.00 -0.10 3.99 3.64 -1.98 0.47 116.57 121.64 1sd0 h LYS 33 Ca -0.46 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 58.71 1sd0 h LYS 33 Cb 1.27 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 1sd0 h LYS 33 CO 0.61 0.08 -0.78 0.22 -2.27 0.00 0.00 179.45 177.32 1sd0 h ASP 34 N 0.00 0.70 0.03 4.20 1.82 -1.98 -2.76 116.42 118.43 1sd0 h ASP 34 Ca -0.00 -0.47 -0.12 0.00 -0.39 0.00 0.00 57.03 56.05 1sd0 h ASP 34 Cb 0.29 -0.21 0.01 0.00 0.68 0.00 0.00 39.33 40.11 1sd0 h ASP 34 CO 0.01 1.24 -0.48 0.58 -1.61 0.00 0.00 179.24 178.98 1sd0 h VAL 35 N 0.39 1.52 0.05 2.25 2.07 -1.54 -3.10 116.25 117.89 1sd0 h VAL 35 Ca -0.05 -2.15 0.00 0.00 0.82 0.00 0.00 66.70 65.33 1sd0 h VAL 35 Cb 1.38 2.85 -0.02 0.00 -1.52 0.00 0.00 31.29 33.98 1sd0 h VAL 35 CO 0.15 0.60 -0.21 0.15 0.02 0.00 0.00 177.57 178.28 1sd0 h PHE 36 N -0.37 -0.60 -0.40 1.57 3.57 -0.17 -2.53 116.94 118.02 1sd0 h PHE 36 Ca -0.07 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.52 1sd0 h PHE 36 Cb 1.25 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 40.23 1sd0 h PHE 36 CO 0.18 -0.24 0.27 -0.44 -2.23 0.00 0.00 178.31 175.86 1sd0 h ASP 37 N -0.30 0.19 0.44 0.41 3.32 -1.66 -0.81 116.42 118.02 1sd0 h ASP 37 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1sd0 h ASP 37 Cb 0.30 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 1sd0 h ASP 37 CO -0.11 0.12 -0.08 0.77 -1.72 0.00 0.00 179.24 178.22 1sd0 h SER 38 N 0.22 0.00 0.00 6.45 4.64 -1.37 -3.35 113.55 120.14 1sd0 h SER 38 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1sd0 h SER 38 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1sd0 h SER 38 CO -0.03 0.08 0.00 2.30 -0.87 0.00 0.00 176.83 178.31 1sd0 n ILE 39 N -3.44 0.00 0.03 0.95 -0.00 -0.99 -4.82 119.36 111.08 1sd0 n ILE 39 Ca -0.01 -0.13 0.02 0.00 -0.00 0.00 0.00 62.75 62.62 1sd0 n ILE 39 Cb 0.23 1.01 0.08 0.00 -0.00 0.00 0.00 39.64 40.96 1sd0 n ILE 39 CO 0.00 0.00 0.00 2.29 -0.00 0.00 0.00 176.55 178.84 1sd0 n LYS 40 N -0.26 0.02 -0.27 6.28 2.85 -0.34 -0.46 118.16 125.98 1sd0 n LYS 40 Ca 0.00 0.44 0.09 0.00 -1.05 0.00 0.00 58.31 57.79 1sd0 n LYS 40 Cb 0.00 -1.67 0.24 0.00 -0.65 0.00 0.00 35.03 32.95 1sd0 n LYS 40 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1sd0 n ASN 41 N -1.53 3.45 -4.90 -5.58 4.13 -1.26 -4.70 115.26 104.86 1sd0 n ASN 41 Ca -0.00 -1.98 -0.30 0.00 1.68 0.00 0.00 54.58 53.98 1sd0 n ASN 41 Cb 0.11 -0.35 -0.04 0.00 -1.54 0.00 0.00 39.78 37.96 1sd0 n ASN 41 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1sd0 s LYS 42 N -1.04 3.64 0.03 3.52 1.02 0.40 -4.37 119.74 122.94 1sd0 s LYS 42 Ca 0.37 -0.02 -0.04 0.00 0.02 0.00 0.00 55.97 56.30 1sd0 s LYS 42 Cb 0.19 -2.73 -0.01 0.00 -0.52 0.00 0.00 37.83 34.76 1sd0 s LYS 42 CO 0.26 0.33 0.05 0.21 -0.92 0.00 0.00 175.35 175.28 1sd0 s LYS 43 N -3.13 0.49 0.35 1.68 2.20 -1.26 -4.20 119.74 115.87 1sd0 s LYS 43 Ca 0.43 -0.69 0.07 0.00 -0.36 0.00 0.00 55.97 55.43 1sd0 s LYS 43 Cb -0.11 0.19 -0.01 0.00 -1.51 0.00 0.00 37.83 36.38 1sd0 s LYS 43 CO 0.27 -0.11 0.44 0.95 -0.36 0.00 0.00 175.35 176.53 1sd0 s THR 44 N -2.15 3.69 0.66 3.43 -4.23 -0.75 -4.93 115.64 111.36 1sd0 s THR 44 Ca -0.09 -1.11 0.25 0.00 -1.18 0.00 0.00 61.69 59.56 1sd0 s THR 44 Cb -0.04 -3.27 0.25 0.00 1.34 0.00 0.00 72.50 70.78 1sd0 s THR 44 CO -0.03 -0.13 1.78 1.23 -0.54 0.00 0.00 174.62 176.93 1sd0 h GLY 45 N 0.95 0.00 -1.91 3.99 0.00 -1.99 0.59 103.07 104.70 1sd0 h GLY 45 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1sd0 h GLY 45 CO 0.53 0.00 0.00 1.03 0.00 0.00 0.00 176.54 178.10 1sd0 n MET 46 N -2.82 2.33 -0.81 4.80 2.81 -1.26 -4.96 117.12 117.20 1sd0 n MET 46 Ca -0.02 -2.12 0.00 0.00 -1.81 0.00 0.00 57.70 53.75 1sd0 n MET 46 Cb 0.47 -1.42 0.00 0.00 -0.71 0.00 0.00 33.22 31.56 1sd0 n MET 46 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1sd0 n GLY 47 N 1.16 0.50 3.74 3.03 0.00 0.21 -5.04 105.19 108.78 1sd0 n GLY 47 Ca 0.16 -0.89 -0.40 0.00 0.00 0.00 0.00 46.02 44.89 1sd0 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sd0 s ALA 48 N -2.00 3.31 0.50 4.61 0.00 -1.26 -4.78 121.76 122.14 1sd0 s ALA 48 Ca 0.00 0.43 0.03 0.00 0.00 0.00 0.00 51.96 52.42 1sd0 s ALA 48 Cb 0.00 -3.14 -0.01 0.00 0.00 0.00 0.00 23.12 19.97 1sd0 s ALA 48 CO 0.00 0.02 0.08 0.95 0.00 0.00 0.00 175.76 176.81 1sd0 s THR 49 N -0.03 1.42 0.53 0.00 -4.23 -1.26 -1.82 115.64 110.25 1sd0 s THR 49 Ca 0.43 -1.89 0.34 0.00 -1.18 0.00 0.00 61.69 59.38 1sd0 s THR 49 Cb -0.22 -2.31 0.37 0.00 1.34 0.00 0.00 72.50 71.68 1sd0 s THR 49 CO 0.26 0.00 2.22 0.25 -0.54 0.00 0.00 174.62 176.82 1sd0 h LEU 50 N 1.30 0.00 -0.36 4.79 5.85 -1.84 -1.48 115.31 123.57 1sd0 h LEU 50 Ca -0.43 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.12 1sd0 h LEU 50 Cb 1.30 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.33 1sd0 h LEU 50 CO 0.72 0.03 -0.49 0.25 -0.34 0.00 0.00 178.44 178.61 1sd0 h LEU 51 N 0.00 0.94 -1.31 2.25 5.85 -1.94 -1.59 115.31 119.52 1sd0 h LEU 51 Ca -0.00 -0.48 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1sd0 h LEU 51 Cb 0.13 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1sd0 h LEU 51 CO 0.00 1.27 0.00 0.44 -0.34 0.00 0.00 178.44 179.81 1sd0 h ASP 52 N 0.68 0.00 0.03 1.25 3.32 -1.66 0.08 116.42 120.12 1sd0 h ASP 52 Ca 0.03 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.76 1sd0 h ASP 52 Cb 1.09 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.60 1sd0 h ASP 52 CO 0.11 0.00 -1.78 0.52 -1.72 0.00 0.00 179.24 176.37 1sd0 n VAL 53 N -2.55 1.60 1.01 -1.35 0.31 -0.99 -4.59 118.33 111.77 1sd0 n VAL 53 Ca 0.00 -0.30 0.11 0.00 -0.01 0.00 0.00 64.34 64.14 1sd0 n VAL 53 Cb 0.19 -1.88 -0.02 0.00 -0.91 0.00 0.00 33.84 31.22 1sd0 n VAL 53 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1sd0 n ILE 54 N -4.05 0.00 -0.29 2.52 -6.64 -0.63 -2.16 119.36 108.11 1sd0 n ILE 54 Ca -0.37 -0.14 0.11 0.00 -1.77 0.00 0.00 62.75 60.58 1sd0 n ILE 54 Cb 0.84 1.07 0.27 0.00 -1.44 0.00 0.00 39.64 40.38 1sd0 n ILE 54 CO 0.00 0.00 0.00 -0.61 -1.77 0.00 0.00 176.55 174.17 1sd0 h GLN 55 N 1.29 0.38 -0.80 6.28 4.15 -1.19 -0.90 115.11 124.32 1sd0 h GLN 55 Ca 0.00 -0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.35 1sd0 h GLN 55 Cb 0.63 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 28.20 1sd0 h GLN 55 CO 0.00 0.25 0.31 1.03 -1.93 0.00 0.00 178.83 178.50 1sd0 h SER 56 N 0.40 1.11 0.87 -0.69 0.87 -1.75 -1.62 113.55 112.73 1sd0 h SER 56 Ca 0.52 -0.18 -0.13 0.00 -1.23 0.00 0.00 61.79 60.77 1sd0 h SER 56 Cb 0.94 -0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 62.60 1sd0 h SER 56 CO -0.51 0.98 -0.63 1.23 -0.53 0.00 0.00 176.83 177.38 1sd0 h GLY 57 N 1.16 0.00 0.90 5.77 0.00 0.52 -2.33 103.07 109.09 1sd0 h GLY 57 Ca 0.27 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.43 1sd0 h GLY 57 CO -0.02 0.00 -0.58 -2.08 0.00 0.00 0.00 176.54 173.86 1sd0 h VAL 58 N 0.00 1.37 0.00 4.60 2.07 -1.02 -3.22 116.25 120.05 1sd0 h VAL 58 Ca -0.01 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.59 1sd0 h VAL 58 Cb 1.23 2.29 0.00 0.00 -1.52 0.00 0.00 31.29 33.29 1sd0 h VAL 58 CO 0.08 0.58 0.00 -0.33 0.02 0.00 0.00 177.57 177.92 1sd0 h GLU 59 N 0.11 0.00 -2.55 1.57 4.39 -1.34 -3.36 114.58 113.40 1sd0 h GLU 59 Ca -0.05 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 59.05 1sd0 h GLU 59 Cb 1.24 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 29.49 1sd0 h GLU 59 CO 0.12 0.00 -0.76 0.09 -1.16 0.00 0.00 179.01 177.29 1sd0 n ASN 60 N -2.51 1.81 0.26 1.42 3.02 -0.88 -4.95 115.26 113.42 1sd0 n ASN 60 Ca 0.04 -2.96 0.17 0.00 -0.03 0.00 0.00 54.58 51.80 1sd0 n ASN 60 Cb 0.40 -0.67 0.80 0.00 -0.61 0.00 0.00 39.78 39.70 1sd0 n ASN 60 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1sd0 h LEU 61 N 5.01 0.00 -0.07 3.41 3.38 -1.72 0.98 115.31 126.30 1sd0 h LEU 61 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1sd0 h LEU 61 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1sd0 h LEU 61 CO 0.61 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.24 1sd0 n ASP 62 N -3.18 0.10 -4.74 -0.43 5.75 -1.26 -4.42 116.55 108.38 1sd0 n ASP 62 Ca 0.01 -1.50 -0.33 0.00 -0.01 0.00 0.00 54.79 52.96 1sd0 n ASP 62 Cb 0.45 -0.01 0.09 0.00 -1.03 0.00 0.00 41.12 40.62 1sd0 n ASP 62 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1sd0 s SER 63 N -1.51 4.41 -0.14 -1.12 0.01 0.34 -4.96 113.70 110.72 1sd0 s SER 63 Ca 0.25 2.09 0.17 0.00 1.31 0.00 0.00 55.95 59.77 1sd0 s SER 63 Cb 0.12 -2.56 -0.24 0.00 0.21 0.00 0.00 66.02 63.54 1sd0 s SER 63 CO 0.19 -2.11 0.26 0.61 0.41 0.00 0.00 173.24 172.61 1sd0 n GLY 64 N -0.30 -1.01 0.87 3.44 0.00 -1.26 -3.64 105.19 103.29 1sd0 n GLY 64 Ca 0.11 -0.27 -0.02 0.00 0.00 0.00 0.00 46.02 45.84 1sd0 n GLY 64 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1sd0 n VAL 65 N -2.80 1.23 -0.26 1.61 0.31 -1.26 -0.91 118.33 116.24 1sd0 n VAL 65 Ca -0.27 0.33 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1sd0 n VAL 65 Cb 1.09 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 32.30 1sd0 n VAL 65 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1sd0 n GLY 66 N 3.09 1.09 3.37 2.92 0.00 -1.26 -1.75 105.19 112.64 1sd0 n GLY 66 Ca -0.03 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 1sd0 n GLY 66 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1sd0 s ILE 67 N -2.75 1.10 0.17 -0.61 -4.36 -1.26 -0.45 121.20 113.03 1sd0 s ILE 67 Ca 0.00 -2.03 -0.10 0.00 -0.26 0.00 0.00 60.65 58.26 1sd0 s ILE 67 Cb 0.00 -2.49 -0.01 0.00 1.25 0.00 0.00 42.46 41.21 1sd0 s ILE 67 CO 0.00 -0.21 0.31 -0.31 0.24 0.00 0.00 174.94 174.97 1sd0 s TYR 68 N -3.37 0.35 -0.36 1.37 1.51 -0.92 -4.65 117.35 111.27 1sd0 s TYR 68 Ca 0.31 -0.71 -0.05 0.00 -1.01 0.00 0.00 57.07 55.62 1sd0 s TYR 68 Cb 0.06 -0.01 0.07 0.00 -0.11 0.00 0.00 41.96 41.97 1sd0 s TYR 68 CO 0.11 -0.74 0.13 0.00 -1.11 0.00 0.00 175.55 173.94 1sd0 s ALA 69 N -3.96 3.05 0.31 3.71 0.00 -0.26 -4.51 121.76 120.10 1sd0 s ALA 69 Ca 0.16 -2.03 0.04 0.00 0.00 0.00 0.00 51.96 50.14 1sd0 s ALA 69 Cb 0.03 -2.27 0.65 0.00 0.00 0.00 0.00 23.12 21.52 1sd0 s ALA 69 CO -0.00 -1.49 1.86 -1.35 0.00 0.00 0.00 175.76 174.77 1sd0 h PRO 70 N 8.14 0.86 -4.01 0.00 0.11 -1.85 -3.44 132.00 131.81 1sd0 h PRO 70 Ca -0.20 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 65.74 1sd0 h PRO 70 Cb 1.07 -0.19 -0.13 0.00 0.11 0.00 0.00 31.00 31.85 1sd0 h PRO 70 CO 0.63 0.57 -0.42 0.16 -0.21 0.00 0.00 178.00 178.74 1sd0 s ASP 71 N -5.76 0.13 0.41 -2.05 3.84 -1.26 -1.95 116.67 110.03 1sd0 s ASP 71 Ca -0.11 -0.91 0.14 0.00 -0.00 0.00 0.00 52.55 51.67 1sd0 s ASP 71 Cb 0.22 0.38 1.00 0.00 -1.38 0.00 0.00 42.92 43.13 1sd0 s ASP 71 CO 0.80 -0.81 1.92 0.00 -0.00 0.00 0.00 175.17 177.08 1sd0 h ALA 72 N 2.68 2.04 0.00 2.11 0.00 -1.95 -0.86 119.26 123.28 1sd0 h ALA 72 Ca -0.33 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 1sd0 h ALA 72 Cb 1.21 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1sd0 h ALA 72 CO 0.53 -0.23 -0.15 1.49 0.00 0.00 0.00 179.25 180.89 1sd0 h GLU 73 N 0.48 0.00 -0.93 0.00 4.81 -1.97 -2.65 114.58 114.32 1sd0 h GLU 73 Ca 0.37 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.67 1sd0 h GLU 73 Cb 0.75 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.07 1sd0 h GLU 73 CO -0.12 0.15 0.60 0.77 -0.73 0.00 0.00 179.01 179.68 1sd0 h SER 74 N 0.00 0.91 -0.30 1.04 0.02 -1.53 0.33 113.55 114.02 1sd0 h SER 74 Ca -0.00 0.01 0.09 0.00 -0.84 0.00 0.00 61.79 61.05 1sd0 h SER 74 Cb 0.28 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 1sd0 h SER 74 CO 0.02 0.56 0.27 1.88 -1.14 0.00 0.00 176.83 178.42 1sd0 h TYR 75 N 1.02 0.00 0.00 3.45 0.99 -1.60 -1.36 116.97 119.48 1sd0 h TYR 75 Ca 0.41 0.00 -0.25 0.00 2.00 0.00 0.00 58.73 60.89 1sd0 h TYR 75 Cb 0.27 0.00 -0.05 0.00 1.00 0.00 0.00 36.73 37.95 1sd0 h TYR 75 CO -0.00 0.00 -1.96 0.54 -0.00 0.00 0.00 178.16 176.74 1sd0 n ARG 76 N -4.03 0.42 -0.17 4.88 1.74 -0.51 -3.72 116.66 115.28 1sd0 n ARG 76 Ca 0.04 0.10 -0.02 0.00 -0.77 0.00 0.00 57.85 57.20 1sd0 n ARG 76 Cb 0.43 -1.34 0.07 0.00 -1.02 0.00 0.00 32.46 30.60 1sd0 n ARG 76 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1sd0 h THR 77 N 0.00 0.69 -1.28 0.55 2.02 -0.28 -0.07 112.91 114.53 1sd0 h THR 77 Ca -0.38 -0.08 -0.68 0.00 0.77 0.00 0.00 66.41 66.04 1sd0 h THR 77 Cb 1.59 0.44 -0.31 0.00 -1.74 0.00 0.00 68.15 68.13 1sd0 h THR 77 CO -0.06 0.04 0.60 0.49 0.37 0.00 0.00 175.52 176.96 1sd0 n PHE 78 N -5.13 3.12 0.01 3.16 3.01 -0.52 -4.77 117.46 116.33 1sd0 n PHE 78 Ca 0.06 -2.74 -0.10 0.00 1.01 0.00 0.00 57.45 55.69 1sd0 n PHE 78 Cb 0.26 -1.14 -0.03 0.00 -0.01 0.00 0.00 39.48 38.56 1sd0 n PHE 78 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1sd0 h GLY 79 N 2.34 -0.07 -1.20 1.37 0.00 -1.08 -2.13 103.07 102.30 1sd0 h GLY 79 Ca 0.55 0.16 0.46 0.00 0.00 0.00 0.00 47.33 48.50 1sd0 h GLY 79 CO 1.39 -0.14 1.12 -2.55 0.00 0.00 0.00 176.54 176.37 1sd0 h PRO 80 N -0.17 0.02 0.01 4.80 0.11 -1.86 0.57 132.00 135.49 1sd0 h PRO 80 Ca 0.08 -0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.93 1sd0 h PRO 80 Cb 0.29 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.37 1sd0 h PRO 80 CO -0.21 0.01 -1.40 -0.11 -0.21 0.00 0.00 178.00 176.08 1sd0 n LEU 81 N -4.13 1.95 0.12 2.35 7.94 -0.94 -4.25 117.00 120.03 1sd0 n LEU 81 Ca 0.36 0.39 -0.14 0.00 -1.11 0.00 0.00 56.01 55.52 1sd0 n LEU 81 Cb 1.62 -0.98 -0.08 0.00 0.53 0.00 0.00 43.42 44.52 1sd0 n LEU 81 CO 0.40 0.35 0.73 -0.26 -1.11 0.00 0.00 177.39 177.50 1sd0 h PHE 82 N -0.88 -0.24 -0.79 1.96 -1.00 -0.56 -3.11 116.94 112.31 1sd0 h PHE 82 Ca -0.38 -0.01 0.12 0.00 2.81 0.00 0.00 57.97 60.52 1sd0 h PHE 82 Cb 1.40 0.08 -0.13 0.00 3.61 0.00 0.00 35.95 40.91 1sd0 h PHE 82 CO 0.09 -0.04 -0.40 -0.44 -1.61 0.00 0.00 178.31 175.91 1sd0 h ASP 83 N -0.40 -1.42 0.32 2.17 3.32 -0.13 0.28 116.42 120.55 1sd0 h ASP 83 Ca -0.03 0.27 -0.09 0.00 0.02 0.00 0.00 57.03 57.20 1sd0 h ASP 83 Cb 0.31 0.70 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 1sd0 h ASP 83 CO 0.04 -0.30 -0.40 1.55 -1.72 0.00 0.00 179.24 178.41 1sd0 h PRO 84 N -0.10 0.11 -0.20 3.56 0.13 -1.74 -1.77 132.00 131.99 1sd0 h PRO 84 Ca 0.26 -0.05 -0.13 0.00 -0.87 0.00 0.00 66.00 65.21 1sd0 h PRO 84 Cb 0.56 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 1sd0 h PRO 84 CO -0.83 0.50 -0.38 0.82 -0.23 0.00 0.00 178.00 177.88 1sd0 h ILE 85 N 0.09 1.33 -0.65 -3.56 2.04 -1.06 -1.95 117.51 113.76 1sd0 h ILE 85 Ca 0.01 -1.61 -0.01 0.00 1.00 0.00 0.00 64.86 64.26 1sd0 h ILE 85 Cb 0.76 1.84 -0.03 0.00 -0.74 0.00 0.00 36.82 38.65 1sd0 h ILE 85 CO 0.06 0.50 0.38 0.40 0.00 0.00 0.00 178.15 179.49 1sd0 h ILE 86 N 0.30 1.19 -0.04 -0.67 5.03 -0.40 -1.58 117.51 121.34 1sd0 h ILE 86 Ca 0.01 -0.44 -0.00 0.00 -0.12 0.00 0.00 64.86 64.31 1sd0 h ILE 86 Cb 0.98 0.31 -0.00 0.00 -3.03 0.00 0.00 36.82 35.08 1sd0 h ILE 86 CO 0.09 0.20 0.03 -0.78 -0.68 0.00 0.00 178.15 177.00 1sd0 h ASP 87 N 0.88 0.05 0.83 1.72 3.58 -1.26 -1.56 116.42 120.65 1sd0 h ASP 87 Ca 0.23 -0.04 -0.04 0.00 0.42 0.00 0.00 57.03 57.60 1sd0 h ASP 87 Cb -0.01 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.03 1sd0 h ASP 87 CO -0.04 0.08 -0.44 -0.78 -2.88 0.00 0.00 179.24 175.17 1sd0 h ASP 88 N 0.02 -1.08 0.13 2.28 1.82 -1.19 0.19 116.42 118.60 1sd0 h ASP 88 Ca 0.02 0.05 0.01 0.00 -0.39 0.00 0.00 57.03 56.72 1sd0 h ASP 88 Cb 0.03 0.30 -0.05 0.00 0.68 0.00 0.00 39.33 40.29 1sd0 h ASP 88 CO -0.00 -0.72 -0.49 0.22 -1.61 0.00 0.00 179.24 176.64 1sd0 h TYR 89 N -1.17 -1.39 0.00 0.28 3.20 -1.31 -2.96 116.97 113.62 1sd0 h TYR 89 Ca -0.11 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.79 1sd0 h TYR 89 Cb 0.91 0.59 0.00 0.00 1.54 0.00 0.00 36.73 39.77 1sd0 h TYR 89 CO -0.02 -0.57 0.00 0.72 -1.64 0.00 0.00 178.16 176.64 1sd0 n HIS 90 N -5.48 0.00 -2.47 -3.82 8.25 -0.59 -4.78 115.22 106.32 1sd0 n HIS 90 Ca -0.08 -0.32 -0.21 0.00 -0.26 0.00 0.00 57.72 56.85 1sd0 n HIS 90 Cb 0.40 -0.19 -0.00 0.00 1.12 0.00 0.00 29.99 31.32 1sd0 n HIS 90 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1sd0 n GLY 91 N 0.62 -0.50 0.00 -1.41 0.00 -1.12 -4.58 105.19 98.20 1sd0 n GLY 91 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1sd0 n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sd0 n GLY 92 N -1.08 0.17 2.65 -0.02 0.00 0.67 -5.05 105.19 102.52 1sd0 n GLY 92 Ca -0.23 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.74 1sd0 n GLY 92 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1sd0 s PHE 93 N 0.00 1.45 1.29 1.61 5.36 -1.23 -5.01 117.98 121.46 1sd0 s PHE 93 Ca 0.00 -1.88 -0.20 0.00 -0.96 0.00 0.00 56.93 53.89 1sd0 s PHE 93 Cb 0.00 -1.52 0.31 0.00 -0.34 0.00 0.00 43.02 41.47 1sd0 s PHE 93 CO 0.00 -0.83 0.69 1.63 -1.46 0.00 0.00 175.22 175.25 1sd0 n LYS 94 N 4.24 -3.88 0.05 10.12 5.02 -1.26 -4.18 118.16 128.26 1sd0 n LYS 94 Ca 0.05 -1.15 -0.07 0.00 -2.02 0.00 0.00 58.31 55.11 1sd0 n LYS 94 Cb 0.38 -1.75 -0.12 0.00 -0.02 0.00 0.00 35.03 33.52 1sd0 n LYS 94 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1sd0 h LEU 95 N -3.30 0.00 0.00 -0.35 -0.00 -2.01 -3.23 115.31 106.43 1sd0 h LEU 95 Ca -0.33 -0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.54 1sd0 h LEU 95 Cb 1.09 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.75 1sd0 h LEU 95 CO 0.21 1.00 -0.64 0.71 -0.00 0.00 0.00 178.44 179.72 1sd0 h THR 96 N 0.00 0.00 -4.14 0.22 1.35 -2.04 -3.47 112.91 104.83 1sd0 h THR 96 Ca -0.04 -0.52 -0.54 0.00 -0.55 0.00 0.00 66.41 64.76 1sd0 h THR 96 Cb 1.80 1.10 0.15 0.00 -1.73 0.00 0.00 68.15 69.47 1sd0 h THR 96 CO 0.12 0.00 0.45 -1.81 -0.25 0.00 0.00 175.52 174.03 1sd0 s ASP 97 N -4.30 4.45 -0.07 5.36 1.11 -1.22 -5.04 116.67 116.96 1sd0 s ASP 97 Ca 0.06 2.47 -0.03 0.00 0.18 0.00 0.00 52.55 55.23 1sd0 s ASP 97 Cb 0.13 -2.60 0.04 0.00 1.07 0.00 0.00 42.92 41.56 1sd0 s ASP 97 CO 0.72 -2.10 0.15 -0.54 1.18 0.00 0.00 175.17 174.58 1sd0 s LYS 98 N -3.63 0.06 0.36 8.23 1.02 -1.26 -4.92 119.74 119.59 1sd0 s LYS 98 Ca 0.78 0.45 -0.27 0.00 0.02 0.00 0.00 55.97 56.95 1sd0 s LYS 98 Cb -0.33 -0.23 -0.12 0.00 -0.52 0.00 0.00 37.83 36.63 1sd0 s LYS 98 CO 0.42 -0.23 1.16 1.58 -0.92 0.00 0.00 175.35 177.36 1sd0 n HIS 99 N 4.71 1.78 -1.58 3.18 -0.00 0.21 -4.96 115.22 118.56 1sd0 n HIS 99 Ca -0.17 0.58 -0.30 0.00 -0.00 0.00 0.00 57.72 57.83 1sd0 n HIS 99 Cb 0.51 -2.33 0.08 0.00 -0.00 0.00 0.00 29.99 28.24 1sd0 n HIS 99 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 1sd0 s PRO 100 N -1.88 2.36 0.66 1.57 0.04 -1.26 -4.77 135.00 131.72 1sd0 s PRO 100 Ca 0.59 0.71 -0.18 0.00 0.04 0.00 0.00 61.00 62.16 1sd0 s PRO 100 Cb -0.59 -1.94 -0.00 0.00 0.04 0.00 0.00 34.50 32.01 1sd0 s PRO 100 CO 0.60 -1.44 1.27 -2.14 0.04 0.00 0.00 177.00 175.33 1sd0 s PRO 101 N -5.14 2.49 0.13 0.56 0.02 -1.26 -4.88 135.00 126.92 1sd0 s PRO 101 Ca 0.60 2.00 -0.34 0.00 0.02 0.00 0.00 61.00 63.27 1sd0 s PRO 101 Cb -0.14 -1.85 -0.14 0.00 0.02 0.00 0.00 34.50 32.39 1sd0 s PRO 101 CO 0.54 -1.62 1.56 1.17 -0.33 0.00 0.00 177.00 178.31 1sd0 n LYS 102 N -2.04 1.95 -3.39 5.54 0.00 -1.26 -4.89 118.16 114.08 1sd0 n LYS 102 Ca 0.15 0.71 -0.16 0.00 0.00 0.00 0.00 58.31 59.01 1sd0 n LYS 102 Cb 0.49 -2.46 -0.09 0.00 0.00 0.00 0.00 35.03 32.97 1sd0 n LYS 102 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 1sd0 s GLN 103 N 1.07 0.33 0.37 1.64 2.00 -1.26 -5.01 119.66 118.80 1sd0 s GLN 103 Ca 0.81 -0.07 0.07 0.00 -2.00 0.00 0.00 55.36 54.17 1sd0 s GLN 103 Cb -0.74 -0.62 0.73 0.00 0.80 0.00 0.00 33.01 33.18 1sd0 s GLN 103 CO 0.41 -1.00 1.93 -1.49 -0.50 0.00 0.00 175.29 174.64 1sd0 h TRP 104 N 8.25 0.42 0.00 1.67 4.06 -1.94 -2.18 115.95 126.23 1sd0 h TRP 104 Ca -0.13 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.79 1sd0 h TRP 104 Cb 1.09 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 29.12 1sd0 h TRP 104 CO 0.27 0.42 0.00 0.41 -3.56 0.00 0.00 178.44 175.98 1sd0 n GLY 105 N -1.01 -2.65 3.56 1.49 0.00 -1.26 -3.54 105.19 101.78 1sd0 n GLY 105 Ca 0.01 -1.68 -0.40 0.00 0.00 0.00 0.00 46.02 43.95 1sd0 n GLY 105 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sd0 s ASP 106 N -2.08 6.35 0.50 1.61 3.68 -1.26 -4.83 116.67 120.64 1sd0 s ASP 106 Ca 0.00 -1.30 0.26 0.00 2.13 0.00 0.00 52.55 53.64 1sd0 s ASP 106 Cb 0.00 -2.57 1.35 0.00 -1.45 0.00 0.00 42.92 40.26 1sd0 s ASP 106 CO 0.00 -1.65 1.90 0.40 0.13 0.00 0.00 175.17 175.95 1sd0 h ILE 107 N 6.79 0.62 0.00 4.11 2.04 -2.00 0.04 117.51 129.11 1sd0 h ILE 107 Ca 0.15 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.97 1sd0 h ILE 107 Cb 1.01 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1sd0 h ILE 107 CO 1.40 0.02 0.00 0.78 0.00 0.00 0.00 178.15 180.35 1sd0 h ASN 108 N 0.12 0.00 0.21 1.72 -0.26 -1.98 -2.34 115.58 113.05 1sd0 h ASN 108 Ca 0.41 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.15 1sd0 h ASN 108 Cb 1.43 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.69 1sd0 h ASN 108 CO -0.05 0.00 -0.05 0.35 -1.06 0.00 0.00 177.43 176.61 1sd0 n THR 109 N -2.50 0.00 -3.10 2.81 -2.24 0.00 -4.87 114.28 104.38 1sd0 n THR 109 Ca -0.01 -0.07 -0.33 0.00 -2.27 0.00 0.00 64.05 61.37 1sd0 n THR 109 Cb 0.10 -0.12 -0.06 0.00 -2.10 0.00 0.00 70.33 68.15 1sd0 n THR 109 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1sd0 s LEU 110 N -2.26 4.08 0.36 3.22 1.43 -0.88 -5.08 118.68 119.54 1sd0 s LEU 110 Ca 0.36 1.34 0.04 0.00 -1.03 0.00 0.00 54.13 54.84 1sd0 s LEU 110 Cb 0.21 -4.07 -0.06 0.00 0.03 0.00 0.00 46.19 42.29 1sd0 s LEU 110 CO 0.42 -0.19 0.05 0.68 0.23 0.00 0.00 176.35 177.54 1sd0 s VAL 111 N -1.95 1.32 0.22 -1.59 -7.23 -1.26 -4.80 120.40 105.11 1sd0 s VAL 111 Ca 0.54 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.41 1sd0 s VAL 111 Cb -0.11 -2.77 -0.09 0.00 0.56 0.00 0.00 36.38 33.97 1sd0 s VAL 111 CO 0.17 0.00 1.27 -0.83 -0.31 0.00 0.00 175.10 175.40 1sd0 s GLY 112 N -3.57 2.62 0.16 2.32 0.00 -1.26 -4.38 107.32 103.21 1sd0 s GLY 112 Ca 0.34 1.08 -0.01 0.00 0.00 0.00 0.00 44.72 46.12 1sd0 s GLY 112 CO 0.15 1.96 1.37 1.41 0.00 0.00 0.00 173.10 178.00 1sd0 h LEU 113 N 4.95 0.44 -5.45 0.66 3.38 -1.71 -3.43 115.31 114.16 1sd0 h LEU 113 Ca -0.45 -0.33 -0.25 0.00 0.09 0.00 0.00 57.88 56.94 1sd0 h LEU 113 Cb 1.22 -0.13 -0.22 0.00 0.09 0.00 0.00 40.66 41.61 1sd0 h LEU 113 CO 0.74 1.10 -0.60 -0.62 0.09 0.00 0.00 178.44 179.15 1sd0 s ASP 114 N -7.00 -0.70 0.20 -0.43 2.15 -1.26 -4.79 116.67 104.84 1sd0 s ASP 114 Ca -0.05 -1.94 -0.20 0.00 0.43 0.00 0.00 52.55 50.78 1sd0 s ASP 114 Cb 0.10 1.33 0.15 0.00 -0.30 0.00 0.00 42.92 44.19 1sd0 s ASP 114 CO 0.85 -0.10 1.57 -0.65 -0.17 0.00 0.00 175.17 176.67 1sd0 h PRO 115 N 5.40 -0.11 0.00 4.34 0.11 -1.97 0.56 132.00 140.33 1sd0 h PRO 115 Ca 0.10 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.22 1sd0 h PRO 115 Cb 1.07 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1sd0 h PRO 115 CO 0.11 -0.08 -0.02 0.00 -0.21 0.00 0.00 178.00 177.80 1sd0 h ALA 116 N 1.07 1.21 -2.49 -0.75 0.00 -2.01 -3.46 119.26 112.83 1sd0 h ALA 116 Ca 0.26 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.88 1sd0 h ALA 116 Cb 0.56 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.36 1sd0 h ALA 116 CO -0.78 0.03 -0.37 0.41 0.00 0.00 0.00 179.25 178.55 1sd0 n GLY 117 N -0.96 -0.13 0.36 0.00 0.00 0.19 -4.93 105.19 99.71 1sd0 n GLY 117 Ca -0.02 -0.26 0.11 0.00 0.00 0.00 0.00 46.02 45.85 1sd0 n GLY 117 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1sd0 n GLN 118 N -2.58 0.90 0.01 1.61 1.13 -1.26 -4.69 117.38 112.51 1sd0 n GLN 118 Ca -0.12 -0.72 0.00 0.00 -1.94 0.00 0.00 57.00 54.22 1sd0 n GLN 118 Cb 0.60 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.46 1sd0 n GLN 118 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1sd0 n PHE 119 N -0.42 -0.09 -2.51 1.08 3.01 -1.26 -4.89 117.46 112.38 1sd0 n PHE 119 Ca 0.09 0.02 -0.42 0.00 1.01 0.00 0.00 57.45 58.14 1sd0 n PHE 119 Cb 0.42 0.12 -0.03 0.00 -0.01 0.00 0.00 39.48 39.98 1sd0 n PHE 119 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1sd0 s ILE 120 N -2.00 4.30 -0.23 4.37 1.01 -1.26 -1.14 121.20 126.25 1sd0 s ILE 120 Ca 0.00 1.65 -0.19 0.00 0.00 0.00 0.00 60.65 62.12 1sd0 s ILE 120 Cb 0.00 -4.06 -0.16 0.00 0.01 0.00 0.00 42.46 38.25 1sd0 s ILE 120 CO 0.00 0.12 -0.00 -0.38 0.00 0.00 0.00 174.94 174.68 1sd0 n ILE 121 N 3.97 1.53 -3.55 2.92 2.08 0.18 -4.72 119.36 121.77 1sd0 n ILE 121 Ca 0.08 -0.15 -0.12 0.00 0.56 0.00 0.00 62.75 63.12 1sd0 n ILE 121 Cb 0.48 -1.99 -0.04 0.00 -0.75 0.00 0.00 39.64 37.33 1sd0 n ILE 121 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1sd0 s SER 122 N -7.06 -0.42 0.00 4.38 1.04 -1.19 -1.80 113.70 108.65 1sd0 s SER 122 Ca -0.32 0.00 0.08 0.00 0.48 0.00 0.00 55.95 56.19 1sd0 s SER 122 Cb 0.09 0.52 -0.02 0.00 0.10 0.00 0.00 66.02 66.71 1sd0 s SER 122 CO 0.55 -0.82 -0.24 -0.89 0.98 0.00 0.00 173.24 172.81 1sd0 s THR 123 N -3.16 1.93 -0.10 2.02 2.01 -0.37 -0.78 115.64 117.19 1sd0 s THR 123 Ca -0.01 -1.13 -0.12 0.00 0.31 0.00 0.00 61.69 60.73 1sd0 s THR 123 Cb -0.00 -1.62 0.03 0.00 0.01 0.00 0.00 72.50 70.92 1sd0 s THR 123 CO -0.07 0.46 0.32 -0.60 -0.69 0.00 0.00 174.62 174.04 1sd0 s ARG 124 N -0.79 0.46 -0.02 4.92 3.52 -0.05 -1.87 118.95 125.12 1sd0 s ARG 124 Ca 0.10 0.29 0.01 0.00 -0.13 0.00 0.00 55.73 56.00 1sd0 s ARG 124 Cb -0.09 0.21 0.02 0.00 -1.56 0.00 0.00 34.95 33.53 1sd0 s ARG 124 CO 0.00 -0.08 -0.01 0.08 -0.81 0.00 0.00 175.30 174.48 1sd0 s VAL 125 N -0.21 0.22 0.10 7.11 1.01 0.27 0.29 120.40 129.20 1sd0 s VAL 125 Ca -0.03 0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.97 1sd0 s VAL 125 Cb -0.03 -0.27 -0.04 0.00 0.00 0.00 0.00 36.38 36.04 1sd0 s VAL 125 CO 0.01 0.13 -0.07 0.00 0.00 0.00 0.00 175.10 175.17 1sd0 s ARG 126 N 0.68 0.86 0.13 2.72 1.04 -1.07 -1.35 118.95 121.96 1sd0 s ARG 126 Ca -0.07 -1.35 0.02 0.00 -1.04 0.00 0.00 55.73 53.29 1sd0 s ARG 126 Cb -0.10 -0.24 -0.04 0.00 -2.04 0.00 0.00 34.95 32.53 1sd0 s ARG 126 CO -0.01 -0.01 -0.05 0.00 -0.04 0.00 0.00 175.30 175.19 1sd0 s GLY 128 N -3.10 1.27 0.02 0.00 0.00 -1.21 -1.51 107.32 102.80 1sd0 s GLY 128 Ca 0.17 -1.19 -0.01 0.00 0.00 0.00 0.00 44.72 43.69 1sd0 s GLY 128 CO -0.01 -1.11 -0.00 0.50 0.00 0.00 0.00 173.10 172.48 1sd0 s ARG 129 N -1.33 0.39 -0.11 2.90 1.81 -0.79 -4.85 118.95 116.97 1sd0 s ARG 129 Ca 0.10 -0.67 0.03 0.00 -1.72 0.00 0.00 55.73 53.46 1sd0 s ARG 129 Cb -0.09 0.14 0.01 0.00 -0.45 0.00 0.00 34.95 34.55 1sd0 s ARG 129 CO 0.02 -0.07 -0.21 -1.12 -0.68 0.00 0.00 175.30 173.24 1sd0 s SER 130 N -1.68 2.85 -0.03 0.23 0.01 -1.26 -2.30 113.70 111.53 1sd0 s SER 130 Ca -0.12 -0.52 -0.30 0.00 1.31 0.00 0.00 55.95 56.31 1sd0 s SER 130 Cb -0.07 -1.31 -0.05 0.00 0.21 0.00 0.00 66.02 64.81 1sd0 s SER 130 CO -0.02 0.10 1.37 -0.76 0.41 0.00 0.00 173.24 174.34 1sd0 s LEU 131 N 0.62 4.30 0.38 2.44 1.43 -1.26 0.20 118.68 126.79 1sd0 s LEU 131 Ca -0.13 2.03 -0.27 0.00 -1.03 0.00 0.00 54.13 54.73 1sd0 s LEU 131 Cb -0.17 -3.56 -0.11 0.00 0.03 0.00 0.00 46.19 42.39 1sd0 s LEU 131 CO 0.03 -0.72 1.41 0.00 0.23 0.00 0.00 176.35 177.31 1sd0 n GLN 132 N 5.59 2.41 -0.06 1.70 6.02 0.12 -2.27 117.38 130.89 1sd0 n GLN 132 Ca 0.13 0.85 0.00 0.00 -0.01 0.00 0.00 57.00 57.97 1sd0 n GLN 132 Cb 0.44 -2.55 0.00 0.00 1.02 0.00 0.00 30.24 29.15 1sd0 n GLN 132 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1sd0 n GLY 133 N 0.58 0.70 3.13 1.08 0.00 -1.26 -5.00 105.19 104.42 1sd0 n GLY 133 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 1sd0 n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1sd0 s TYR 134 N -2.29 1.89 0.49 1.61 1.51 -0.96 -5.14 117.35 114.45 1sd0 s TYR 134 Ca 0.00 -0.65 -0.08 0.00 -1.01 0.00 0.00 57.07 55.33 1sd0 s TYR 134 Cb 0.00 -1.29 0.12 0.00 -0.11 0.00 0.00 41.96 40.67 1sd0 s TYR 134 CO 0.00 -0.26 0.59 -0.35 -1.11 0.00 0.00 175.55 174.42 1sd0 n PRO 135 N 3.40 -1.01 -2.55 -1.71 -0.04 -1.26 -4.77 135.00 127.06 1sd0 n PRO 135 Ca -0.20 -0.92 -0.28 0.00 -0.04 0.00 0.00 63.50 62.07 1sd0 n PRO 135 Cb 0.53 -0.68 0.00 0.00 -0.04 0.00 0.00 33.50 33.31 1sd0 n PRO 135 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1sd0 s PHE 136 N -2.24 3.56 0.01 0.54 2.99 -0.82 -4.82 117.98 117.20 1sd0 s PHE 136 Ca 0.35 0.86 -0.01 0.00 0.00 0.00 0.00 56.93 58.12 1sd0 s PHE 136 Cb -0.02 -2.36 -0.00 0.00 0.00 0.00 0.00 43.02 40.64 1sd0 s PHE 136 CO 0.25 -0.34 0.11 0.09 -0.00 0.00 0.00 175.22 175.33 1sd0 n ASN 137 N -2.32 -0.05 -0.17 1.36 3.02 -1.26 -0.23 115.26 115.61 1sd0 n ASN 137 Ca 0.01 0.12 0.29 0.00 -0.03 0.00 0.00 54.58 54.98 1sd0 n ASN 137 Cb 0.55 -0.03 0.72 0.00 -0.61 0.00 0.00 39.78 40.40 1sd0 n ASN 137 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1sd0 h PRO 138 N 0.00 0.00 -0.59 3.52 0.11 -1.78 0.11 132.00 133.37 1sd0 h PRO 138 Ca 0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1sd0 h PRO 138 Cb 0.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.13 1sd0 h PRO 138 CO -0.04 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.75 1sd0 s LEU 140 N -1.18 4.32 0.27 0.00 1.43 0.39 -4.86 118.68 119.05 1sd0 s LEU 140 Ca 0.44 0.95 0.02 0.00 -1.03 0.00 0.00 54.13 54.52 1sd0 s LEU 140 Cb 0.24 -3.21 -0.03 0.00 0.03 0.00 0.00 46.19 43.22 1sd0 s LEU 140 CO 0.32 0.11 0.44 0.42 0.23 0.00 0.00 176.35 177.87 1sd0 s THR 141 N -1.48 5.19 0.44 5.49 -4.23 -1.26 -4.98 115.64 114.81 1sd0 s THR 141 Ca 0.37 -0.65 0.13 0.00 -1.18 0.00 0.00 61.69 60.36 1sd0 s THR 141 Cb -0.14 -3.83 0.31 0.00 1.34 0.00 0.00 72.50 70.18 1sd0 s THR 141 CO 0.19 -0.38 2.01 0.00 -0.54 0.00 0.00 174.62 175.90 1sd0 h ALA 142 N 1.20 1.97 -0.05 3.99 0.00 -1.98 0.03 119.26 124.42 1sd0 h ALA 142 Ca -0.50 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 1sd0 h ALA 142 Cb 1.22 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1sd0 h ALA 142 CO 0.63 -0.07 -0.38 1.49 0.00 0.00 0.00 179.25 180.92 1sd0 h GLU 143 N 0.40 0.09 -0.00 0.00 4.57 -2.00 -2.76 114.58 114.89 1sd0 h GLU 143 Ca 0.23 -0.04 -0.16 0.00 -1.18 0.00 0.00 59.36 58.21 1sd0 h GLU 143 Cb 0.40 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.96 1sd0 h GLU 143 CO -0.06 0.47 -0.77 1.96 -1.18 0.00 0.00 179.01 179.43 1sd0 h GLN 144 N 0.08 0.03 -0.50 1.92 4.20 -1.38 -1.75 115.11 117.70 1sd0 h GLN 144 Ca 0.01 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.61 1sd0 h GLN 144 Cb 0.72 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.49 1sd0 h GLN 144 CO 0.05 0.78 -0.01 1.88 -0.67 0.00 0.00 178.83 180.86 1sd0 h TYR 145 N 0.02 0.92 -0.21 2.96 -1.99 -1.15 -0.43 116.97 117.09 1sd0 h TYR 145 Ca -0.01 -0.14 -0.21 0.00 2.00 0.00 0.00 58.73 60.37 1sd0 h TYR 145 Cb 1.35 -0.25 0.01 0.00 2.00 0.00 0.00 36.73 39.84 1sd0 h TYR 145 CO 0.00 0.84 -0.69 0.87 -0.00 0.00 0.00 178.16 179.19 1sd0 h LYS 146 N 0.79 0.83 0.09 4.88 1.57 -1.41 -1.29 116.57 122.02 1sd0 h LYS 146 Ca 0.15 -0.62 -0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1sd0 h LYS 146 Cb 0.49 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.91 1sd0 h LYS 146 CO 0.02 1.24 -0.04 0.93 -0.57 0.00 0.00 179.45 181.03 1sd0 h GLU 147 N 0.59 -0.12 -0.65 3.15 5.08 -1.07 -0.37 114.58 121.19 1sd0 h GLU 147 Ca -0.03 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1sd0 h GLU 147 Cb 1.31 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.56 1sd0 h GLU 147 CO 0.15 -0.04 0.38 0.52 -1.00 0.00 0.00 179.01 179.01 1sd0 h MET 148 N -0.16 0.89 -0.84 2.33 2.86 -1.12 -1.02 114.93 117.87 1sd0 h MET 148 Ca -0.01 -0.09 0.06 0.00 -2.06 0.00 0.00 59.70 57.60 1sd0 h MET 148 Cb 0.13 -0.18 -0.06 0.00 0.06 0.00 0.00 31.60 31.55 1sd0 h MET 148 CO 0.02 0.65 0.51 1.49 1.06 0.00 0.00 176.91 180.64 1sd0 h GLU 149 N 0.88 0.92 0.51 1.72 4.81 -0.96 -1.44 114.58 121.02 1sd0 h GLU 149 Ca 0.23 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 1sd0 h GLU 149 Cb 0.00 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.18 1sd0 h GLU 149 CO -0.04 0.61 -0.26 1.49 -0.73 0.00 0.00 179.01 180.07 1sd0 h GLU 150 N 0.94 -0.69 -0.09 1.92 4.22 -0.25 -1.15 114.58 119.49 1sd0 h GLU 150 Ca 0.36 0.05 0.04 0.00 0.08 0.00 0.00 59.36 59.89 1sd0 h GLU 150 Cb 0.16 0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.52 1sd0 h GLU 150 CO -0.17 -0.46 -0.25 0.87 -2.18 0.00 0.00 179.01 176.82 1sd0 h LYS 151 N -0.71 -0.33 -0.19 1.92 1.57 -0.80 -1.97 116.57 116.06 1sd0 h LYS 151 Ca -0.07 0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1sd0 h LYS 151 Cb 0.56 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 1sd0 h LYS 151 CO 0.10 -0.22 0.11 0.28 -0.57 0.00 0.00 179.45 179.16 1sd0 h VAL 152 N -0.34 1.08 -0.85 0.50 2.07 -1.24 -1.55 116.25 115.92 1sd0 h VAL 152 Ca 0.09 -0.19 0.05 0.00 0.82 0.00 0.00 66.70 67.47 1sd0 h VAL 152 Cb 0.47 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 31.04 1sd0 h VAL 152 CO -0.28 0.07 0.53 0.77 0.02 0.00 0.00 177.57 178.68 1sd0 h SER 153 N 0.23 0.84 0.64 0.57 4.64 -1.08 -0.79 113.55 118.60 1sd0 h SER 153 Ca 0.07 0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.37 1sd0 h SER 153 Cb 0.02 -0.17 0.01 0.00 -0.31 0.00 0.00 62.40 61.95 1sd0 h SER 153 CO -0.01 0.55 -0.31 0.28 -0.87 0.00 0.00 176.83 176.47 1sd0 h SER 154 N 0.98 -0.73 -0.98 4.97 0.02 -1.17 -2.08 113.55 114.57 1sd0 h SER 154 Ca 0.36 -0.02 0.20 0.00 -0.84 0.00 0.00 61.79 61.50 1sd0 h SER 154 Cb 0.13 0.19 -0.09 0.00 0.14 0.00 0.00 62.40 62.76 1sd0 h SER 154 CO -0.16 -0.41 0.62 0.74 -1.14 0.00 0.00 176.83 176.48 1sd0 h THR 155 N -1.04 0.68 0.00 -2.27 2.02 -1.05 0.63 112.91 111.87 1sd0 h THR 155 Ca -0.09 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.89 1sd0 h THR 155 Cb 0.70 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 1sd0 h THR 155 CO 0.14 0.11 0.00 -0.07 0.37 0.00 0.00 175.52 176.07 1sd0 h LEU 156 N 0.59 0.00 -0.32 2.58 3.38 -1.02 -3.02 115.31 117.50 1sd0 h LEU 156 Ca 0.54 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.51 1sd0 h LEU 156 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1sd0 h LEU 156 CO -0.29 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.70 1sd0 n SER 157 N -2.56 0.35 -1.87 -0.43 3.41 0.21 -2.27 113.62 110.46 1sd0 n SER 157 Ca 0.04 0.58 0.06 0.00 -0.26 0.00 0.00 58.87 59.29 1sd0 n SER 157 Cb 0.43 -0.66 0.39 0.00 -0.26 0.00 0.00 64.21 64.12 1sd0 n SER 157 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1sd0 n SER 158 N -1.88 5.58 -4.74 4.04 3.41 -1.14 -4.93 113.62 113.96 1sd0 n SER 158 Ca 0.03 -2.92 -0.40 0.00 -0.26 0.00 0.00 58.87 55.32 1sd0 n SER 158 Cb 0.22 -0.69 -0.05 0.00 -0.26 0.00 0.00 64.21 63.43 1sd0 n SER 158 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1sd0 s MET 159 N -2.73 4.45 0.36 4.33 1.00 -0.96 -5.06 119.30 120.68 1sd0 s MET 159 Ca 0.53 0.96 0.08 0.00 0.00 0.00 0.00 55.69 57.27 1sd0 s MET 159 Cb 0.41 -3.39 -0.05 0.00 0.00 0.00 0.00 34.83 31.80 1sd0 s MET 159 CO 0.15 0.20 0.11 -1.21 0.00 0.00 0.00 175.02 174.28 1sd0 s GLU 160 N 0.27 2.25 5.64 2.03 2.02 -1.26 -3.96 118.70 125.69 1sd0 s GLU 160 Ca 0.38 -1.67 0.00 0.00 0.02 0.00 0.00 54.97 53.69 1sd0 s GLU 160 Cb -0.19 -2.06 0.00 0.00 0.10 0.00 0.00 34.13 31.98 1sd0 s GLU 160 CO 0.21 0.07 0.00 -0.25 0.02 0.00 0.00 175.26 175.30 1sd0 n ASP 161 N -1.11 0.00 -0.28 -0.19 8.00 -1.26 -2.60 116.55 119.12 1sd0 n ASP 161 Ca -0.03 0.00 0.19 0.00 0.71 0.00 0.00 54.79 55.67 1sd0 n ASP 161 Cb 0.62 0.00 0.49 0.00 -0.02 0.00 0.00 41.12 42.21 1sd0 n ASP 161 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1sd0 h GLU 162 N 0.00 0.43 -0.01 -1.24 4.81 -2.06 -0.64 114.58 115.87 1sd0 h GLU 162 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1sd0 h GLU 162 Cb 0.00 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.28 1sd0 h GLU 162 CO 0.00 0.29 0.00 1.28 -0.73 0.00 0.00 179.01 179.85 1sd0 n LEU 163 N -4.56 0.17 -4.72 1.64 4.77 -1.07 -4.83 117.00 108.40 1sd0 n LEU 163 Ca 0.21 -0.07 -0.42 0.00 -0.03 0.00 0.00 56.01 55.71 1sd0 n LEU 163 Cb 0.73 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.78 1sd0 n LEU 163 CO 0.28 0.03 0.71 -0.75 -1.33 0.00 0.00 177.39 176.34 1sd0 s LYS 164 N -1.98 4.59 0.00 3.23 2.20 -0.25 -4.60 119.74 122.93 1sd0 s LYS 164 Ca 0.32 1.49 0.00 0.00 -0.36 0.00 0.00 55.97 57.42 1sd0 s LYS 164 Cb 0.15 -3.41 0.00 0.00 -1.51 0.00 0.00 37.83 33.06 1sd0 s LYS 164 CO 0.25 0.02 0.00 0.41 -0.36 0.00 0.00 175.35 175.66 1sd0 n GLY 165 N 2.67 2.32 3.38 5.54 0.00 -1.26 -4.25 105.19 113.59 1sd0 n GLY 165 Ca 0.05 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.75 1sd0 n GLY 165 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sd0 s THR 166 N -2.91 2.38 -0.22 2.61 2.01 -1.10 -4.90 115.64 113.52 1sd0 s THR 166 Ca 0.00 -1.29 -0.17 0.00 0.31 0.00 0.00 61.69 60.54 1sd0 s THR 166 Cb 0.00 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.53 1sd0 s THR 166 CO 0.00 0.38 0.48 -0.47 -0.69 0.00 0.00 174.62 174.31 1sd0 s TYR 167 N -0.83 3.35 -0.39 4.92 5.04 -1.26 -2.88 117.35 125.30 1sd0 s TYR 167 Ca 0.13 0.68 -0.06 0.00 -2.44 0.00 0.00 57.07 55.38 1sd0 s TYR 167 Cb -0.10 -2.63 0.08 0.00 0.35 0.00 0.00 41.96 39.66 1sd0 s TYR 167 CO 0.03 -0.12 0.18 0.71 -1.34 0.00 0.00 175.55 175.01 1sd0 s TYR 168 N 1.69 3.40 0.50 4.97 1.51 -0.57 -5.00 117.35 123.86 1sd0 s TYR 168 Ca 0.22 -1.87 -0.23 0.00 -1.01 0.00 0.00 57.07 54.17 1sd0 s TYR 168 Cb -0.15 -2.83 -0.06 0.00 -0.11 0.00 0.00 41.96 38.80 1sd0 s TYR 168 CO 0.09 -0.87 1.31 -2.14 -1.11 0.00 0.00 175.55 172.83 1sd0 s PRO 169 N 1.30 3.42 0.30 -1.71 0.02 -1.26 -2.21 135.00 134.85 1sd0 s PRO 169 Ca 0.03 2.13 0.10 0.00 0.02 0.00 0.00 61.00 63.28 1sd0 s PRO 169 Cb -0.22 -2.38 0.45 0.00 0.02 0.00 0.00 34.50 32.37 1sd0 s PRO 169 CO -0.01 -0.94 1.67 1.25 -0.33 0.00 0.00 177.00 178.65 1sd0 h LEU 170 N 1.80 0.07 -8.79 -5.54 5.85 -0.88 -3.31 115.31 104.50 1sd0 h LEU 170 Ca -0.50 -0.03 -0.57 0.00 0.84 0.00 0.00 57.88 57.62 1sd0 h LEU 170 Cb 1.28 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 42.24 1sd0 h LEU 170 CO 0.59 0.58 1.06 -0.89 -0.34 0.00 0.00 178.44 179.44 1sd0 s THR 171 N -3.85 3.93 0.00 1.05 2.01 -1.26 -2.13 115.64 115.40 1sd0 s THR 171 Ca -0.02 0.95 0.00 0.00 0.31 0.00 0.00 61.69 62.93 1sd0 s THR 171 Cb 0.13 -4.24 0.00 0.00 0.01 0.00 0.00 72.50 68.40 1sd0 s THR 171 CO 0.76 -0.78 0.00 0.61 -0.69 0.00 0.00 174.62 174.52 1sd0 n GLY 172 N 5.04 0.52 3.74 4.40 0.00 -1.26 -5.07 105.19 112.56 1sd0 n GLY 172 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1sd0 n GLY 172 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1sd0 s MET 173 N -0.69 4.67 0.45 1.61 0.00 -0.91 -5.01 119.30 119.42 1sd0 s MET 173 Ca 0.00 1.65 -0.23 0.00 0.00 0.00 0.00 55.69 57.10 1sd0 s MET 173 Cb 0.00 -3.28 -0.08 0.00 0.00 0.00 0.00 34.83 31.47 1sd0 s MET 173 CO 0.00 0.20 1.16 -1.54 0.00 0.00 0.00 175.02 174.85 1sd0 s SER 174 N -0.42 6.25 0.55 1.11 1.04 -1.26 -4.87 113.70 116.11 1sd0 s SER 174 Ca 0.47 2.31 0.23 0.00 0.48 0.00 0.00 55.95 59.43 1sd0 s SER 174 Cb -0.28 -2.60 1.52 0.00 0.10 0.00 0.00 66.02 64.75 1sd0 s SER 174 CO 0.35 -0.86 2.18 0.11 0.98 0.00 0.00 173.24 176.00 1sd0 h LYS 175 N 2.17 0.00 -0.02 4.02 1.79 -1.98 -0.32 116.57 122.23 1sd0 h LYS 175 Ca -0.49 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 57.97 1sd0 h LYS 175 Cb 1.24 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.89 1sd0 h LYS 175 CO 0.61 0.00 -0.02 0.00 -1.08 0.00 0.00 179.45 178.95 1sd0 h ALA 176 N 1.98 0.03 -0.71 3.86 0.00 -1.99 -1.74 119.26 120.69 1sd0 h ALA 176 Ca 0.01 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 1sd0 h ALA 176 Cb 0.07 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1sd0 h ALA 176 CO -0.00 -0.19 0.24 1.15 0.00 0.00 0.00 179.25 180.45 1sd0 h THR 177 N -0.46 1.25 0.35 0.00 2.02 -1.76 -1.97 112.91 112.34 1sd0 h THR 177 Ca 0.00 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 1sd0 h THR 177 Cb 0.55 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1sd0 h THR 177 CO 0.01 0.33 -0.17 -0.61 0.37 0.00 0.00 175.52 175.45 1sd0 h GLN 178 N 1.04 -0.45 -0.41 6.66 4.15 -1.12 -2.38 115.11 122.60 1sd0 h GLN 178 Ca 0.23 0.03 0.07 0.00 0.77 0.00 0.00 58.65 59.75 1sd0 h GLN 178 Cb 0.26 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.03 1sd0 h GLN 178 CO -0.01 -0.14 0.28 0.37 -1.93 0.00 0.00 178.83 177.40 1sd0 h GLN 179 N -0.78 0.26 -0.10 1.69 5.75 -1.27 -1.74 115.11 118.92 1sd0 h GLN 179 Ca -0.05 -0.02 -0.23 0.00 -0.15 0.00 0.00 58.65 58.20 1sd0 h GLN 179 Cb 0.52 -0.06 0.01 0.00 1.07 0.00 0.00 27.48 29.02 1sd0 h GLN 179 CO 0.08 0.17 -0.86 0.37 -2.65 0.00 0.00 178.83 175.95 1sd0 h GLN 180 N 0.27 0.73 0.00 1.69 4.15 -1.30 -1.56 115.11 119.08 1sd0 h GLN 180 Ca 0.18 -0.65 -0.06 0.00 0.77 0.00 0.00 58.65 58.90 1sd0 h GLN 180 Cb 0.38 0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.22 1sd0 h GLN 180 CO -0.04 1.25 -0.27 -0.07 -1.93 0.00 0.00 178.83 177.77 1sd0 h LEU 181 N 0.47 0.00 0.04 -2.39 3.38 -0.83 0.16 115.31 116.14 1sd0 h LEU 181 Ca -0.07 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.74 1sd0 h LEU 181 Cb 1.49 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.25 1sd0 h LEU 181 CO 0.17 0.27 -0.63 0.40 0.09 0.00 0.00 178.44 178.74 1sd0 h ILE 182 N 0.00 1.47 0.00 1.22 2.04 -1.28 0.18 117.51 121.14 1sd0 h ILE 182 Ca -0.00 -2.22 -0.02 0.00 1.00 0.00 0.00 64.86 63.62 1sd0 h ILE 182 Cb 0.55 2.81 -0.00 0.00 -0.74 0.00 0.00 36.82 39.44 1sd0 h ILE 182 CO 0.04 0.63 -0.08 0.44 0.00 0.00 0.00 178.15 179.18 1sd0 h ASP 183 N -0.23 0.00 -0.28 1.72 3.32 -0.96 -1.68 116.42 118.31 1sd0 h ASP 183 Ca -0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.96 1sd0 h ASP 183 Cb 1.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.94 1sd0 h ASP 183 CO 0.12 0.08 0.00 0.47 -1.72 0.00 0.00 179.24 178.19 1sd0 n ASP 184 N -3.28 2.21 -0.77 6.45 8.00 0.02 -4.93 116.55 124.26 1sd0 n ASP 184 Ca -0.01 -1.84 -0.10 0.00 0.71 0.00 0.00 54.79 53.56 1sd0 n ASP 184 Cb 0.29 -0.18 -0.04 0.00 -0.02 0.00 0.00 41.12 41.17 1sd0 n ASP 184 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1sd0 n HIS 185 N 0.69 -0.03 -0.10 1.24 8.25 -0.63 -4.92 115.22 119.71 1sd0 n HIS 185 Ca 0.16 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.41 1sd0 n HIS 185 Cb 0.40 -1.92 -0.12 0.00 1.12 0.00 0.00 29.99 29.47 1sd0 n HIS 185 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1sd0 n PHE 186 N -2.80 0.32 -3.96 4.41 0.99 0.15 -4.98 117.46 111.59 1sd0 n PHE 186 Ca -0.10 0.08 -0.35 0.00 -0.00 0.00 0.00 57.45 57.09 1sd0 n PHE 186 Cb 0.34 -1.04 -0.06 0.00 -1.00 0.00 0.00 39.48 37.72 1sd0 n PHE 186 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1sd0 s LEU 187 N -6.93 4.25 0.50 4.37 2.96 0.40 -4.98 118.68 119.26 1sd0 s LEU 187 Ca -0.33 0.36 -0.23 0.00 -0.22 0.00 0.00 54.13 53.71 1sd0 s LEU 187 Cb 0.10 -2.27 -0.06 0.00 0.50 0.00 0.00 46.19 44.45 1sd0 s LEU 187 CO 0.61 0.34 1.30 0.72 -1.32 0.00 0.00 176.35 177.99 1sd0 s PHE 188 N -1.15 2.52 0.96 5.38 -0.12 -1.26 -4.30 117.98 120.00 1sd0 s PHE 188 Ca 0.20 1.42 -0.12 0.00 -0.05 0.00 0.00 56.93 58.38 1sd0 s PHE 188 Cb -0.12 -3.67 0.16 0.00 -0.63 0.00 0.00 43.02 38.76 1sd0 s PHE 188 CO 0.11 -2.41 1.09 -1.59 -0.05 0.00 0.00 175.22 172.36 1sd0 s LYS 189 N -2.77 0.77 -0.18 1.99 -2.85 -1.26 -4.90 119.74 110.54 1sd0 s LYS 189 Ca 0.67 0.74 -0.06 0.00 -1.00 0.00 0.00 55.97 56.33 1sd0 s LYS 189 Cb -0.37 -1.76 -0.03 0.00 -2.06 0.00 0.00 37.83 33.61 1sd0 s LYS 189 CO 0.44 -2.56 0.02 -2.00 0.10 0.00 0.00 175.35 171.36 1sd0 s GLU 190 N -4.89 3.84 -0.26 1.78 2.12 -1.26 -4.79 118.70 115.24 1sd0 s GLU 190 Ca 0.65 -0.42 -0.09 0.00 0.36 0.00 0.00 54.97 55.46 1sd0 s GLU 190 Cb -0.19 -3.10 0.01 0.00 0.26 0.00 0.00 34.13 31.11 1sd0 s GLU 190 CO 0.58 0.24 0.35 0.41 -0.54 0.00 0.00 175.26 176.30 1sd0 n GLY 191 N 3.61 -1.10 3.70 -1.50 0.00 -1.26 -5.02 105.19 103.63 1sd0 n GLY 191 Ca -0.17 0.71 -0.37 0.00 0.00 0.00 0.00 46.02 46.18 1sd0 n GLY 191 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sd0 s ASP 192 N -1.95 6.49 0.26 1.61 -1.08 -1.26 -4.99 116.67 115.75 1sd0 s ASP 192 Ca 0.15 0.57 -0.05 0.00 -0.52 0.00 0.00 52.55 52.70 1sd0 s ASP 192 Cb -0.04 -2.23 0.29 0.00 -1.46 0.00 0.00 42.92 39.49 1sd0 s ASP 192 CO 0.46 -0.00 1.93 0.08 0.52 0.00 0.00 175.17 178.16 1sd0 h ARG 193 N 7.00 1.27 -0.79 4.34 0.11 -1.98 0.23 114.38 124.54 1sd0 h ARG 193 Ca -0.39 -0.09 -0.04 0.00 0.10 0.00 0.00 59.98 59.56 1sd0 h ARG 193 Cb 1.17 -0.28 -0.04 0.00 1.11 0.00 0.00 29.97 31.93 1sd0 h ARG 193 CO 0.74 0.85 0.33 0.74 0.10 0.00 0.00 179.97 182.73 1sd0 h PHE 194 N 1.30 1.20 -0.09 4.08 -1.00 -1.94 -1.80 116.94 118.69 1sd0 h PHE 194 Ca 0.35 -0.08 -0.23 0.00 2.81 0.00 0.00 57.97 60.81 1sd0 h PHE 194 Cb -0.12 -0.36 0.01 0.00 3.61 0.00 0.00 35.95 39.09 1sd0 h PHE 194 CO 0.00 0.90 -0.85 -0.07 -1.61 0.00 0.00 178.31 176.68 1sd0 h LEU 195 N 1.15 0.91 -0.33 1.54 3.38 -1.85 -3.06 115.31 117.05 1sd0 h LEU 195 Ca 0.27 -0.67 0.01 0.00 0.09 0.00 0.00 57.88 57.58 1sd0 h LEU 195 Cb 0.20 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1sd0 h LEU 195 CO -0.02 1.45 0.19 1.56 0.09 0.00 0.00 178.44 181.70 1sd0 h GLN 196 N 0.45 0.38 0.00 1.13 4.20 -0.40 0.07 115.11 120.94 1sd0 h GLN 196 Ca -0.08 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1sd0 h GLN 196 Cb 1.49 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 29.19 1sd0 h GLN 196 CO 0.17 0.25 0.00 0.25 -0.67 0.00 0.00 178.83 178.84 1sd0 n THR 197 N -4.90 0.87 -0.32 -0.54 -2.24 -0.69 -0.93 114.28 105.53 1sd0 n THR 197 Ca -0.00 0.21 0.11 0.00 -2.27 0.00 0.00 64.05 62.10 1sd0 n THR 197 Cb 0.05 -1.02 0.32 0.00 -2.10 0.00 0.00 70.33 67.59 1sd0 n THR 197 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sd0 n ALA 198 N -1.61 2.54 -3.81 6.98 0.00 -0.74 -3.94 120.51 119.94 1sd0 n ALA 198 Ca 0.03 -1.31 -0.26 0.00 0.00 0.00 0.00 53.44 51.90 1sd0 n ALA 198 Cb 0.21 -0.96 0.03 0.00 0.00 0.00 0.00 19.45 18.73 1sd0 n ALA 198 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1sd0 n ASN 199 N 1.48 -3.52 -0.34 0.00 3.02 -0.11 -4.58 115.26 111.21 1sd0 n ASN 199 Ca 0.24 -0.78 0.11 0.00 -0.03 0.00 0.00 54.58 54.12 1sd0 n ASN 199 Cb 0.66 -4.03 -0.04 0.00 -0.61 0.00 0.00 39.78 35.76 1sd0 n ASN 199 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sd0 n ALA 200 N -4.55 3.89 -0.39 5.41 0.00 -0.07 -3.02 120.51 121.78 1sd0 n ALA 200 Ca -0.09 -0.62 0.06 0.00 0.00 0.00 0.00 53.44 52.79 1sd0 n ALA 200 Cb 0.59 -0.77 0.18 0.00 0.00 0.00 0.00 19.45 19.44 1sd0 n ALA 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sd0 n ARG 202 N 0.21 0.50 -1.10 0.00 1.74 -1.26 -2.35 116.66 114.40 1sd0 n ARG 202 Ca 0.14 0.21 -0.07 0.00 -0.77 0.00 0.00 57.85 57.36 1sd0 n ARG 202 Cb 0.55 -1.86 -0.03 0.00 -1.02 0.00 0.00 32.46 30.09 1sd0 n ARG 202 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1sd0 n TYR 203 N -2.00 -0.05 -1.68 -1.55 4.02 -1.26 -4.86 117.16 109.77 1sd0 n TYR 203 Ca 0.12 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.59 1sd0 n TYR 203 Cb 0.48 -2.28 0.01 0.00 -0.02 0.00 0.00 39.34 37.53 1sd0 n TYR 203 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 176.86 177.72 1sd0 n TRP 204 N -1.89 2.01 -1.00 -0.72 -0.00 -0.99 -0.64 117.44 114.21 1sd0 n TRP 204 Ca -0.07 0.53 -0.18 0.00 -0.00 0.00 0.00 57.50 57.78 1sd0 n TRP 204 Cb 0.49 -2.36 0.19 0.00 -0.00 0.00 0.00 31.31 29.63 1sd0 n TRP 204 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 1sd0 n PRO 205 N 0.18 2.43 -1.96 5.87 -0.04 -1.26 -5.12 135.00 135.11 1sd0 n PRO 205 Ca 0.07 -2.76 -0.42 0.00 -0.04 0.00 0.00 63.50 60.35 1sd0 n PRO 205 Cb 0.39 -2.09 -0.03 0.00 -0.04 0.00 0.00 33.50 31.72 1sd0 n PRO 205 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1sd0 s THR 206 N -2.96 2.82 0.00 0.52 2.01 0.19 -2.56 115.64 115.66 1sd0 s THR 206 Ca 0.52 0.51 0.00 0.00 0.31 0.00 0.00 61.69 63.03 1sd0 s THR 206 Cb 0.43 -3.33 0.00 0.00 0.01 0.00 0.00 72.50 69.61 1sd0 s THR 206 CO 0.11 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.67 1sd0 n GLY 207 N 3.80 1.52 3.86 4.40 0.00 -1.26 -4.77 105.19 112.73 1sd0 n GLY 207 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 1sd0 n GLY 207 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sd0 s ARG 208 N -0.04 3.78 0.01 1.61 3.00 -1.06 -4.50 118.95 121.76 1sd0 s ARG 208 Ca 0.00 0.22 -0.28 0.00 0.00 0.00 0.00 55.73 55.67 1sd0 s ARG 208 Cb 0.00 -3.08 0.10 0.00 0.00 0.00 0.00 34.95 31.96 1sd0 s ARG 208 CO 0.00 0.62 1.25 0.20 0.00 0.00 0.00 175.30 177.37 1sd0 s GLY 209 N -1.50 -0.16 -0.03 -3.53 0.00 -0.83 -0.23 107.32 101.05 1sd0 s GLY 209 Ca 0.29 0.13 0.00 0.00 0.00 0.00 0.00 44.72 45.14 1sd0 s GLY 209 CO 0.16 3.85 0.00 -1.50 0.00 0.00 0.00 173.10 175.61 1sd0 s ILE 210 N -2.15 0.15 -0.02 0.90 2.07 -0.94 0.51 121.20 121.71 1sd0 s ILE 210 Ca 0.25 0.10 -0.00 0.00 -1.41 0.00 0.00 60.65 59.58 1sd0 s ILE 210 Cb 0.00 -0.25 -0.04 0.00 0.13 0.00 0.00 42.46 42.31 1sd0 s ILE 210 CO -0.01 0.14 0.05 0.12 -1.91 0.00 0.00 174.94 173.33 1sd0 s PHE 211 N 1.02 3.23 -0.23 3.50 5.36 -0.52 -1.50 117.98 128.83 1sd0 s PHE 211 Ca -0.10 0.19 -0.27 0.00 -0.96 0.00 0.00 56.93 55.79 1sd0 s PHE 211 Cb -0.13 -1.74 0.13 0.00 -0.34 0.00 0.00 43.02 40.93 1sd0 s PHE 211 CO -0.02 0.52 1.04 -3.38 -1.46 0.00 0.00 175.22 171.93 1sd0 s HIS 212 N -1.11 -0.40 0.69 10.12 -3.43 -1.14 -0.29 115.29 119.74 1sd0 s HIS 212 Ca 0.20 0.86 -0.12 0.00 -0.80 0.00 0.00 55.06 55.20 1sd0 s HIS 212 Cb -0.12 0.41 0.01 0.00 -1.43 0.00 0.00 32.58 31.45 1sd0 s HIS 212 CO 0.10 -0.27 1.07 0.54 -2.00 0.00 0.00 174.74 174.19 1sd0 s ASN 213 N -0.39 5.21 0.45 7.38 2.20 -1.03 -2.69 114.94 126.06 1sd0 s ASN 213 Ca 0.01 1.73 0.23 0.00 -0.94 0.00 0.00 52.86 53.90 1sd0 s ASN 213 Cb -0.03 -2.51 1.24 0.00 -2.00 0.00 0.00 41.25 37.94 1sd0 s ASN 213 CO -0.03 -1.56 1.83 0.44 -2.94 0.00 0.00 177.10 174.83 1sd0 h ASP 214 N -0.56 0.28 1.22 3.54 3.32 -1.92 0.76 116.42 123.06 1sd0 h ASP 214 Ca -0.44 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 56.61 1sd0 h ASP 214 Cb 1.22 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.76 1sd0 h ASP 214 CO 0.55 0.08 -0.19 0.00 -1.72 0.00 0.00 179.24 177.96 1sd0 h ALA 215 N 1.57 0.95 -4.88 3.45 0.00 -1.93 -3.47 119.26 114.96 1sd0 h ALA 215 Ca 0.52 -0.18 -0.30 0.00 0.00 0.00 0.00 54.91 54.95 1sd0 h ALA 215 Cb 1.55 -0.03 0.12 0.00 0.00 0.00 0.00 17.79 19.42 1sd0 h ALA 215 CO -0.16 0.24 -0.57 1.63 0.00 0.00 0.00 179.25 180.40 1sd0 n LYS 216 N -3.26 -6.04 -0.00 0.00 5.02 0.26 -4.89 118.16 109.25 1sd0 n LYS 216 Ca 0.01 0.67 0.06 0.00 -2.02 0.00 0.00 58.31 57.03 1sd0 n LYS 216 Cb 0.48 -5.20 -0.09 0.00 -0.02 0.00 0.00 35.03 30.20 1sd0 n LYS 216 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1sd0 n THR 217 N -4.19 0.00 -4.29 -0.18 -2.24 -1.26 -4.80 114.28 97.31 1sd0 n THR 217 Ca -0.07 -0.24 -0.25 0.00 -2.27 0.00 0.00 64.05 61.22 1sd0 n THR 217 Cb 0.58 0.67 -0.17 0.00 -2.10 0.00 0.00 70.33 69.31 1sd0 n THR 217 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1sd0 s PHE 218 N -2.53 1.46 0.02 4.78 5.36 -1.26 -1.17 117.98 124.63 1sd0 s PHE 218 Ca 0.01 -0.62 -0.06 0.00 -0.96 0.00 0.00 56.93 55.30 1sd0 s PHE 218 Cb 0.09 -1.13 -0.01 0.00 -0.34 0.00 0.00 43.02 41.64 1sd0 s PHE 218 CO 0.55 -0.37 0.11 -0.51 -1.46 0.00 0.00 175.22 173.54 1sd0 s LEU 219 N 1.09 1.69 -0.23 6.12 1.02 -0.36 -2.48 118.68 125.53 1sd0 s LEU 219 Ca -0.07 -0.38 -0.01 0.00 0.02 0.00 0.00 54.13 53.69 1sd0 s LEU 219 Cb -0.14 0.63 0.07 0.00 0.02 0.00 0.00 46.19 46.77 1sd0 s LEU 219 CO -0.01 -0.45 0.03 -0.69 0.02 0.00 0.00 176.35 175.25 1sd0 s VAL 220 N -2.04 0.85 0.06 -1.59 1.01 0.60 0.83 120.40 120.13 1sd0 s VAL 220 Ca -0.10 -0.92 -0.31 0.00 0.00 0.00 0.00 61.98 60.66 1sd0 s VAL 220 Cb -0.04 -1.37 -0.06 0.00 0.00 0.00 0.00 36.38 34.91 1sd0 s VAL 220 CO -0.02 -0.29 1.18 0.26 0.00 0.00 0.00 175.10 176.23 1sd0 s TRP 221 N 1.69 3.46 -0.21 5.22 0.51 0.02 -1.43 118.94 128.19 1sd0 s TRP 221 Ca 0.00 1.34 -0.04 0.00 -2.12 0.00 0.00 56.10 55.28 1sd0 s TRP 221 Cb -0.18 -3.40 -0.01 0.00 -0.81 0.00 0.00 33.47 29.07 1sd0 s TRP 221 CO -0.11 -1.17 -0.03 0.08 -0.51 0.00 0.00 176.95 175.20 1sd0 s VAL 222 N 1.01 3.54 -1.30 4.03 1.01 0.18 -2.02 120.40 126.85 1sd0 s VAL 222 Ca 0.58 -0.44 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 1sd0 s VAL 222 Cb -0.29 -2.60 0.01 0.00 0.00 0.00 0.00 36.38 33.50 1sd0 s VAL 222 CO 0.29 0.43 1.02 0.59 0.00 0.00 0.00 175.10 177.43 1sd0 n ASN 223 N 4.54 -3.66 0.00 3.32 3.02 -0.28 -1.97 115.26 120.22 1sd0 n ASN 223 Ca -0.18 -0.64 0.00 0.00 -0.03 0.00 0.00 54.58 53.74 1sd0 n ASN 223 Cb 0.51 -4.83 0.00 0.00 -0.61 0.00 0.00 39.78 34.85 1sd0 n ASN 223 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1sd0 n GLU 224 N -4.50 0.00 -0.12 3.52 2.13 -1.26 -4.75 120.64 115.65 1sd0 n GLU 224 Ca -0.16 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.64 1sd0 n GLU 224 Cb 0.62 0.00 0.20 0.00 0.27 0.00 0.00 31.44 32.53 1sd0 n GLU 224 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1sd0 h GLU 225 N 0.00 0.81 -5.78 5.31 4.81 -1.95 -3.44 114.58 114.34 1sd0 h GLU 225 Ca 0.00 -0.16 -0.57 0.00 -0.13 0.00 0.00 59.36 58.49 1sd0 h GLU 225 Cb 0.00 -0.12 -0.14 0.00 0.63 0.00 0.00 28.75 29.12 1sd0 h GLU 225 CO 0.00 0.74 -0.68 -0.51 -0.73 0.00 0.00 179.01 177.83 1sd0 s ASP 226 N -6.59 3.37 0.16 1.04 1.01 -1.26 -4.60 116.67 109.80 1sd0 s ASP 226 Ca -0.10 -1.19 -0.17 0.00 0.71 0.00 0.00 52.55 51.80 1sd0 s ASP 226 Cb 0.15 -0.28 0.07 0.00 1.01 0.00 0.00 42.92 43.87 1sd0 s ASP 226 CO 0.80 -0.25 1.72 0.45 0.21 0.00 0.00 175.17 178.09 1sd0 h HIS 227 N 2.12 0.04 -3.97 4.23 3.86 -1.86 -3.18 115.15 116.40 1sd0 h HIS 227 Ca -0.41 0.02 -0.25 0.00 -1.16 0.00 0.00 60.37 58.57 1sd0 h HIS 227 Cb 1.24 0.03 -0.21 0.00 1.06 0.00 0.00 27.41 29.53 1sd0 h HIS 227 CO 0.74 -0.03 -0.73 -0.51 0.86 0.00 0.00 177.93 178.27 1sd0 s LEU 228 N -10.42 2.25 -0.18 2.43 1.02 -0.97 -1.13 118.68 111.67 1sd0 s LEU 228 Ca -0.13 -0.53 -0.03 0.00 0.02 0.00 0.00 54.13 53.46 1sd0 s LEU 228 Cb 0.13 -0.11 0.06 0.00 0.02 0.00 0.00 46.19 46.29 1sd0 s LEU 228 CO 0.71 -0.22 0.05 -0.13 0.02 0.00 0.00 176.35 176.77 1sd0 s ARG 229 N -1.51 0.51 -0.37 1.70 1.81 -0.86 -1.88 118.95 118.34 1sd0 s ARG 229 Ca -0.11 -0.31 -0.20 0.00 -1.72 0.00 0.00 55.73 53.39 1sd0 s ARG 229 Cb -0.10 -1.98 0.01 0.00 -0.45 0.00 0.00 34.95 32.42 1sd0 s ARG 229 CO 0.00 -0.63 0.59 0.42 -0.68 0.00 0.00 175.30 175.00 1sd0 s ILE 230 N 1.93 4.93 0.02 1.52 1.09 -0.57 -0.80 121.20 129.32 1sd0 s ILE 230 Ca 0.00 0.36 0.02 0.00 -1.10 0.00 0.00 60.65 59.93 1sd0 s ILE 230 Cb -0.17 -4.07 -0.04 0.00 -1.06 0.00 0.00 42.46 37.13 1sd0 s ILE 230 CO -0.08 -0.35 0.01 -0.63 -0.10 0.00 0.00 174.94 173.79 1sd0 s ILE 231 N 2.60 4.18 -0.05 2.92 -1.09 0.24 -1.82 121.20 128.19 1sd0 s ILE 231 Ca 0.22 -0.67 -0.02 0.00 -2.23 0.00 0.00 60.65 57.94 1sd0 s ILE 231 Cb -0.15 -2.90 0.03 0.00 -1.58 0.00 0.00 42.46 37.87 1sd0 s ILE 231 CO 0.15 0.31 0.06 -0.55 -1.23 0.00 0.00 174.94 173.68 1sd0 s SER 232 N -1.75 1.22 0.19 3.58 0.15 -0.46 -1.22 113.70 115.41 1sd0 s SER 232 Ca 0.21 0.04 -0.16 0.00 0.70 0.00 0.00 55.95 56.75 1sd0 s SER 232 Cb -0.12 -0.15 0.02 0.00 -1.71 0.00 0.00 66.02 64.06 1sd0 s SER 232 CO 0.13 -0.25 0.48 0.00 1.20 0.00 0.00 173.24 174.79 1sd0 s MET 233 N 2.16 1.36 0.00 5.44 0.23 -0.32 -0.56 119.30 127.61 1sd0 s MET 233 Ca 0.05 -0.94 0.00 0.00 -1.03 0.00 0.00 55.69 53.77 1sd0 s MET 233 Cb -0.12 0.49 0.00 0.00 -1.53 0.00 0.00 34.83 33.67 1sd0 s MET 233 CO -0.03 -0.56 0.00 0.00 -2.03 0.00 0.00 175.02 172.39 1sd0 n GLN 234 N -0.32 0.00 -1.64 3.16 10.64 -0.78 -4.30 117.38 124.13 1sd0 n GLN 234 Ca -0.09 0.00 -0.33 0.00 -1.83 0.00 0.00 57.00 54.75 1sd0 n GLN 234 Cb 0.62 0.00 0.06 0.00 -0.86 0.00 0.00 30.24 30.06 1sd0 n GLN 234 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 1sd0 s LYS 235 N -2.00 2.61 0.09 2.61 -0.14 -1.26 -1.24 119.74 120.42 1sd0 s LYS 235 Ca 0.00 1.42 0.00 0.00 -1.36 0.00 0.00 55.97 56.03 1sd0 s LYS 235 Cb 0.00 -1.92 0.00 0.00 -1.68 0.00 0.00 37.83 34.23 1sd0 s LYS 235 CO 0.00 -1.40 0.00 0.41 -0.76 0.00 0.00 175.35 173.60 1sd0 n GLY 236 N -0.45 -3.08 0.60 -3.33 0.00 -0.74 -4.70 105.19 93.49 1sd0 n GLY 236 Ca 0.11 -1.96 0.06 0.00 0.00 0.00 0.00 46.02 44.23 1sd0 n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sd0 n GLY 237 N -0.14 4.67 2.82 -0.02 0.00 -1.26 -2.16 105.19 109.10 1sd0 n GLY 237 Ca 0.00 -1.15 -0.38 0.00 0.00 0.00 0.00 46.02 44.49 1sd0 n GLY 237 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1sd0 n ASP 238 N -1.05 3.97 -0.26 1.61 -0.08 -1.26 -1.62 116.55 117.86 1sd0 n ASP 238 Ca 0.21 -2.64 0.09 0.00 -1.51 0.00 0.00 54.79 50.95 1sd0 n ASP 238 Cb 0.80 -1.29 0.34 0.00 2.34 0.00 0.00 41.12 43.31 1sd0 n ASP 238 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1sd0 h LEU 239 N 11.02 0.71 0.15 -2.67 5.85 -1.90 -2.48 115.31 126.00 1sd0 h LEU 239 Ca 0.52 0.03 0.02 0.00 0.84 0.00 0.00 57.88 59.28 1sd0 h LEU 239 Cb 0.52 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1sd0 h LEU 239 CO 1.82 0.40 -0.42 0.50 -0.34 0.00 0.00 178.44 180.40 1sd0 h LYS 240 N 0.78 -0.65 0.45 1.25 3.64 -1.82 -0.25 116.57 119.96 1sd0 h LYS 240 Ca 0.41 0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.82 1sd0 h LYS 240 Cb 0.53 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1sd0 h LYS 240 CO -0.18 -0.43 -0.31 1.15 -2.27 0.00 0.00 179.45 177.41 1sd0 h THR 241 N -0.67 0.37 -0.54 1.00 2.02 -1.87 -1.21 112.91 112.00 1sd0 h THR 241 Ca 0.01 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.28 1sd0 h THR 241 Cb 0.69 0.37 -0.10 0.00 -1.74 0.00 0.00 68.15 67.36 1sd0 h THR 241 CO -0.22 0.00 -0.39 0.58 0.37 0.00 0.00 175.52 175.85 1sd0 h VAL 242 N -0.74 0.13 0.10 3.16 2.07 -1.28 0.19 116.25 119.88 1sd0 h VAL 242 Ca -0.05 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 1sd0 h VAL 242 Cb 0.62 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1sd0 h VAL 242 CO 0.03 0.00 -0.06 0.22 0.02 0.00 0.00 177.57 177.78 1sd0 h TYR 243 N -0.23 -0.14 -0.45 1.57 3.20 -1.00 -1.57 116.97 118.36 1sd0 h TYR 243 Ca 0.19 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.15 1sd0 h TYR 243 Cb 0.56 0.05 -0.09 0.00 1.54 0.00 0.00 36.73 38.79 1sd0 h TYR 243 CO -0.66 -0.09 -0.15 -0.22 -1.64 0.00 0.00 178.16 175.40 1sd0 h LYS 244 N -0.15 -0.05 -0.01 1.82 1.63 -0.45 0.23 116.57 119.59 1sd0 h LYS 244 Ca -0.01 0.00 0.02 0.00 -0.85 0.00 0.00 60.65 59.81 1sd0 h LYS 244 Cb 0.12 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.74 1sd0 h LYS 244 CO 0.02 -0.03 -0.10 -0.09 -3.45 0.00 0.00 179.45 175.79 1sd0 h ARG 245 N -0.05 -0.16 -0.69 1.90 2.43 -0.40 -0.79 114.38 116.61 1sd0 h ARG 245 Ca 0.22 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.48 1sd0 h ARG 245 Cb 0.39 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 29.91 1sd0 h ARG 245 CO -0.49 -0.11 0.36 1.25 -1.51 0.00 0.00 179.97 179.47 1sd0 h LEU 246 N -0.17 0.49 -0.15 3.80 5.85 -0.26 -0.97 115.31 123.90 1sd0 h LEU 246 Ca 0.04 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.84 1sd0 h LEU 246 Cb 0.22 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1sd0 h LEU 246 CO -0.11 0.29 -0.02 0.58 -0.34 0.00 0.00 178.44 178.84 1sd0 h VAL 247 N 0.63 0.87 0.19 1.05 2.07 0.02 -0.46 116.25 120.62 1sd0 h VAL 247 Ca 0.33 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.86 1sd0 h VAL 247 Cb 0.30 0.85 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 1sd0 h VAL 247 CO -0.24 0.00 -0.39 0.74 0.02 0.00 0.00 177.57 177.71 1sd0 h THR 248 N 0.02 0.21 -0.21 2.57 2.02 -0.32 -0.48 112.91 116.72 1sd0 h THR 248 Ca 0.07 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.31 1sd0 h THR 248 Cb 0.10 0.21 -0.07 0.00 -1.74 0.00 0.00 68.15 66.65 1sd0 h THR 248 CO -0.14 0.00 -0.35 0.00 0.37 0.00 0.00 175.52 175.40 1sd0 h ALA 249 N -0.17 -0.37 0.04 6.16 0.00 -0.94 -1.23 119.26 122.74 1sd0 h ALA 249 Ca 0.01 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1sd0 h ALA 249 Cb 0.67 0.69 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1sd0 h ALA 249 CO -0.18 -0.81 -0.09 0.28 0.00 0.00 0.00 179.25 178.45 1sd0 h VAL 250 N -0.38 0.78 -0.66 0.00 2.07 -0.88 0.20 116.25 117.39 1sd0 h VAL 250 Ca 0.11 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.72 1sd0 h VAL 250 Cb 0.56 0.78 -0.07 0.00 -1.52 0.00 0.00 31.29 31.05 1sd0 h VAL 250 CO -0.42 0.00 0.31 0.44 0.02 0.00 0.00 177.57 177.92 1sd0 h ASP 251 N -0.17 0.40 0.52 0.57 3.32 -0.85 0.26 116.42 120.47 1sd0 h ASP 251 Ca 0.02 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 1sd0 h ASP 251 Cb 0.19 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 39.74 1sd0 h ASP 251 CO -0.06 0.24 -0.25 -1.13 -1.72 0.00 0.00 179.24 176.32 1sd0 h ASN 252 N 0.55 -0.59 -0.95 6.45 -1.24 -0.79 -2.86 115.58 116.15 1sd0 h ASN 252 Ca 0.32 -0.03 0.08 0.00 0.71 0.00 0.00 56.30 57.38 1sd0 h ASN 252 Cb 0.34 0.15 -0.07 0.00 0.73 0.00 0.00 38.32 39.47 1sd0 h ASN 252 CO -0.26 -0.34 0.62 0.40 -1.29 0.00 0.00 177.43 176.55 1sd0 h ILE 253 N -0.81 1.04 0.00 2.57 2.04 -0.25 -1.14 117.51 120.97 1sd0 h ILE 253 Ca -0.07 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 1sd0 h ILE 253 Cb 0.58 -0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.55 1sd0 h ILE 253 CO 0.12 0.19 -0.03 -0.33 0.00 0.00 0.00 178.15 178.10 1sd0 h GLU 254 N 1.06 0.00 -0.00 2.37 5.08 -0.36 -0.74 114.58 121.98 1sd0 h GLU 254 Ca 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.78 1sd0 h GLU 254 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1sd0 h GLU 254 CO -0.18 0.03 -0.16 -1.13 -1.00 0.00 0.00 179.01 176.57 1sd0 n SER 255 N -3.36 0.17 -0.04 1.42 3.41 -0.43 -4.13 113.62 110.65 1sd0 n SER 255 Ca -0.02 0.23 -0.05 0.00 -0.26 0.00 0.00 58.87 58.77 1sd0 n SER 255 Cb 0.14 -0.25 -0.06 0.00 -0.26 0.00 0.00 64.21 63.78 1sd0 n SER 255 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1sd0 n LYS 256 N -1.48 1.62 -4.94 4.33 5.02 -0.40 -5.02 118.16 117.29 1sd0 n LYS 256 Ca 0.07 0.02 -0.33 0.00 -2.02 0.00 0.00 58.31 56.06 1sd0 n LYS 256 Cb 0.34 -1.20 -0.14 0.00 -0.02 0.00 0.00 35.03 34.00 1sd0 n LYS 256 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1sd0 s LEU 257 N -5.03 2.61 -0.39 -0.35 1.43 -0.50 -5.09 118.68 111.35 1sd0 s LEU 257 Ca -0.08 -0.28 -0.28 0.00 -1.03 0.00 0.00 54.13 52.47 1sd0 s LEU 257 Cb 0.03 -1.53 0.02 0.00 0.03 0.00 0.00 46.19 44.74 1sd0 s LEU 257 CO 0.29 0.30 1.03 -2.16 0.23 0.00 0.00 176.35 176.04 1sd0 s PRO 258 N -0.45 3.85 -0.10 1.29 0.04 -1.26 -4.62 135.00 133.75 1sd0 s PRO 258 Ca 0.05 0.69 -0.04 0.00 0.04 0.00 0.00 61.00 61.75 1sd0 s PRO 258 Cb -0.12 -3.82 -0.04 0.00 0.04 0.00 0.00 34.50 30.56 1sd0 s PRO 258 CO 0.02 -1.08 0.05 -0.06 0.04 0.00 0.00 177.00 175.97 1sd0 s PHE 259 N 3.83 3.32 0.12 0.56 2.99 -1.26 -0.70 117.98 126.84 1sd0 s PHE 259 Ca 0.43 0.30 -0.31 0.00 0.00 0.00 0.00 56.93 57.35 1sd0 s PHE 259 Cb -0.10 -1.86 -0.09 0.00 0.00 0.00 0.00 43.02 40.97 1sd0 s PHE 259 CO 0.22 0.54 1.51 -1.12 -0.00 0.00 0.00 175.22 176.37 1sd0 s SER 260 N -0.86 6.69 -0.05 1.36 0.01 0.13 -4.78 113.70 116.21 1sd0 s SER 260 Ca 0.13 2.46 0.01 0.00 1.31 0.00 0.00 55.95 59.86 1sd0 s SER 260 Cb -0.12 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.55 1sd0 s SER 260 CO 0.03 -0.77 -0.05 -2.28 0.41 0.00 0.00 173.24 170.57 1sd0 s HIS 261 N 1.47 0.83 -0.16 2.43 2.46 -1.26 -2.82 115.29 118.23 1sd0 s HIS 261 Ca 0.68 -0.24 -0.07 0.00 0.47 0.00 0.00 55.06 55.90 1sd0 s HIS 261 Cb -0.40 -0.71 -0.04 0.00 -0.13 0.00 0.00 32.58 31.30 1sd0 s HIS 261 CO 0.31 -0.20 0.07 0.34 -2.47 0.00 0.00 174.74 172.79 1sd0 s ASP 262 N 0.87 5.73 0.58 9.88 2.15 0.34 -4.95 116.67 131.27 1sd0 s ASP 262 Ca -0.12 0.15 0.30 0.00 0.43 0.00 0.00 52.55 53.31 1sd0 s ASP 262 Cb -0.15 -1.93 1.43 0.00 -0.30 0.00 0.00 42.92 41.98 1sd0 s ASP 262 CO 0.01 0.23 1.83 -0.78 -0.17 0.00 0.00 175.17 176.29 1sd0 h ASP 263 N 6.26 0.00 0.00 -0.34 3.58 -1.97 -0.32 116.42 123.62 1sd0 h ASP 263 Ca -0.41 0.00 -0.28 0.00 0.42 0.00 0.00 57.03 56.76 1sd0 h ASP 263 Cb 1.18 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.18 1sd0 h ASP 263 CO 0.67 0.00 -1.95 -1.14 -2.88 0.00 0.00 179.24 173.95 1sd0 n ARG 264 N -3.80 0.37 -0.15 0.28 0.63 -1.26 -4.54 116.66 108.19 1sd0 n ARG 264 Ca 0.13 0.15 0.06 0.00 -0.92 0.00 0.00 57.85 57.26 1sd0 n ARG 264 Cb 0.84 -1.15 0.16 0.00 0.45 0.00 0.00 32.46 32.77 1sd0 n ARG 264 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1sd0 n PHE 265 N -3.60 0.40 -4.80 -0.14 3.01 -1.17 0.64 117.46 111.79 1sd0 n PHE 265 Ca -0.33 -0.20 0.00 0.00 1.01 0.00 0.00 57.45 57.93 1sd0 n PHE 265 Cb 0.75 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.22 1sd0 n PHE 265 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1sd0 n GLY 266 N 1.01 2.33 3.68 1.37 0.00 -0.14 -0.70 105.19 112.73 1sd0 n GLY 266 Ca 0.11 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 45.21 1sd0 n GLY 266 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1sd0 s PHE 267 N 0.00 2.94 0.37 1.61 0.40 -0.89 0.12 117.98 122.54 1sd0 s PHE 267 Ca 0.00 1.03 -0.26 0.00 -0.60 0.00 0.00 56.93 57.10 1sd0 s PHE 267 Cb 0.00 -3.51 -0.09 0.00 0.51 0.00 0.00 43.02 39.93 1sd0 s PHE 267 CO 0.00 -1.75 1.11 -0.51 0.70 0.00 0.00 175.22 174.77 1sd0 s LEU 268 N 2.84 4.27 0.14 -0.37 1.43 -1.13 -3.15 118.68 122.72 1sd0 s LEU 268 Ca 0.57 2.22 -0.01 0.00 -1.03 0.00 0.00 54.13 55.89 1sd0 s LEU 268 Cb -0.25 -3.97 -0.04 0.00 0.03 0.00 0.00 46.19 41.96 1sd0 s LEU 268 CO 0.20 -0.47 0.06 0.42 0.23 0.00 0.00 176.35 176.78 1sd0 s THR 269 N -1.43 0.17 0.35 5.49 -4.23 -1.26 -3.99 115.64 110.74 1sd0 s THR 269 Ca 0.54 -1.93 0.05 0.00 -1.18 0.00 0.00 61.69 59.17 1sd0 s THR 269 Cb -0.28 -2.11 0.18 0.00 1.34 0.00 0.00 72.50 71.63 1sd0 s THR 269 CO 0.36 -0.41 1.91 0.15 -0.54 0.00 0.00 174.62 176.08 1sd0 h PHE 270 N 2.81 0.54 -3.63 3.99 3.57 -1.87 -3.44 116.94 118.92 1sd0 h PHE 270 Ca -0.35 -0.04 -0.67 0.00 3.53 0.00 0.00 57.97 60.44 1sd0 h PHE 270 Cb 1.21 -0.16 -0.17 0.00 2.79 0.00 0.00 35.95 39.62 1sd0 h PHE 270 CO 0.44 0.49 -0.75 0.00 -2.23 0.00 0.00 178.31 176.27 1sd0 s ALA 271 N -5.07 2.90 0.37 2.41 0.00 -1.26 -1.10 121.76 120.01 1sd0 s ALA 271 Ca -0.08 -1.22 0.25 0.00 0.00 0.00 0.00 51.96 50.91 1sd0 s ALA 271 Cb 0.16 -0.88 1.28 0.00 0.00 0.00 0.00 23.12 23.67 1sd0 s ALA 271 CO 0.76 0.63 2.01 -1.00 0.00 0.00 0.00 175.76 178.15 1sd0 h PRO 272 N 3.83 0.00 0.00 0.00 0.13 -1.85 -2.68 132.00 131.43 1sd0 h PRO 272 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1sd0 h PRO 272 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1sd0 h PRO 272 CO 0.51 0.16 0.00 1.79 -0.23 0.00 0.00 178.00 180.24 1sd0 h THR 273 N 0.00 0.00 -0.54 1.56 1.35 -1.96 -3.24 112.91 110.08 1sd0 h THR 273 Ca -0.00 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 1sd0 h THR 273 Cb 0.43 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 1sd0 h THR 273 CO 0.02 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 175.88 1sd0 n ASN 274 N -2.51 3.99 -4.65 5.36 3.02 -1.01 -4.58 115.26 114.88 1sd0 n ASN 274 Ca 0.04 -2.30 -0.29 0.00 -0.03 0.00 0.00 54.58 52.00 1sd0 n ASN 274 Cb 0.37 -0.46 0.15 0.00 -0.61 0.00 0.00 39.78 39.23 1sd0 n ASN 274 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1sd0 s LEU 275 N -1.56 1.88 0.00 3.41 1.43 -1.23 -3.26 118.68 119.36 1sd0 s LEU 275 Ca 0.42 0.91 0.00 0.00 -1.03 0.00 0.00 54.13 54.43 1sd0 s LEU 275 Cb 0.26 -3.15 0.00 0.00 0.03 0.00 0.00 46.19 43.33 1sd0 s LEU 275 CO 0.22 -2.78 0.00 0.61 0.23 0.00 0.00 176.35 174.63 1sd0 n GLY 276 N -2.06 1.91 0.13 -3.19 0.00 0.12 -2.91 105.19 99.19 1sd0 n GLY 276 Ca 0.07 -0.06 0.08 0.00 0.00 0.00 0.00 46.02 46.12 1sd0 n GLY 276 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1sd0 h THR 277 N 0.00 0.17 -0.38 2.61 1.35 -1.25 -2.37 112.91 113.05 1sd0 h THR 277 Ca 0.00 -1.31 -0.16 0.00 -0.55 0.00 0.00 66.41 64.39 1sd0 h THR 277 Cb 0.00 1.76 -0.06 0.00 -1.73 0.00 0.00 68.15 68.12 1sd0 h THR 277 CO 0.00 0.10 -0.15 0.35 -0.25 0.00 0.00 175.52 175.57 1sd0 n THR 278 N -2.83 0.00 -3.26 6.82 -2.24 -1.15 -4.63 114.28 107.00 1sd0 n THR 278 Ca -0.01 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.38 1sd0 n THR 278 Cb 0.62 -1.35 -0.06 0.00 -2.10 0.00 0.00 70.33 67.45 1sd0 n THR 278 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1sd0 s MET 279 N -2.63 4.34 -0.30 -0.78 -2.45 -1.26 -3.31 119.30 112.90 1sd0 s MET 279 Ca 0.00 0.56 0.01 0.00 -1.25 0.00 0.00 55.69 55.01 1sd0 s MET 279 Cb 0.00 -3.42 0.09 0.00 1.25 0.00 0.00 34.83 32.75 1sd0 s MET 279 CO 0.00 0.18 0.07 0.50 1.05 0.00 0.00 175.02 176.82 1sd0 s ARG 280 N 0.51 1.00 -0.30 4.11 3.52 -0.90 -4.72 118.95 122.17 1sd0 s ARG 280 Ca 0.29 -1.24 -0.15 0.00 -0.13 0.00 0.00 55.73 54.49 1sd0 s ARG 280 Cb -0.16 -2.37 -0.03 0.00 -1.56 0.00 0.00 34.95 30.84 1sd0 s ARG 280 CO 0.13 -0.92 0.39 0.00 -0.81 0.00 0.00 175.30 174.09 1sd0 s ALA 281 N 1.42 3.54 0.33 6.12 0.00 -1.26 -2.61 121.76 129.30 1sd0 s ALA 281 Ca 0.08 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 51.14 1sd0 s ALA 281 Cb -0.18 -2.78 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 1sd0 s ALA 281 CO -0.18 -0.83 0.10 -1.54 0.00 0.00 0.00 175.76 173.31 1sd0 s SER 282 N 1.68 2.11 -0.00 0.00 1.04 0.15 -2.74 113.70 115.92 1sd0 s SER 282 Ca 0.15 -1.50 -0.10 0.00 0.48 0.00 0.00 55.95 54.98 1sd0 s SER 282 Cb -0.16 0.22 0.01 0.00 0.10 0.00 0.00 66.02 66.20 1sd0 s SER 282 CO 0.11 -0.78 0.21 0.68 0.98 0.00 0.00 173.24 174.44 1sd0 s VAL 283 N -3.42 0.07 -0.39 5.02 -7.23 -0.96 -0.87 120.40 112.62 1sd0 s VAL 283 Ca 0.33 -0.60 -0.13 0.00 -1.81 0.00 0.00 61.98 59.77 1sd0 s VAL 283 Cb 0.06 -0.51 0.02 0.00 0.56 0.00 0.00 36.38 36.51 1sd0 s VAL 283 CO 0.15 -0.33 0.26 -1.00 -0.31 0.00 0.00 175.10 173.87 1sd0 s HIS 284 N -1.35 3.24 0.15 2.82 3.76 0.04 -2.24 115.29 121.70 1sd0 s HIS 284 Ca -0.14 -0.69 0.08 0.00 -0.15 0.00 0.00 55.06 54.16 1sd0 s HIS 284 Cb -0.07 -2.52 -0.04 0.00 1.11 0.00 0.00 32.58 31.06 1sd0 s HIS 284 CO 0.03 -0.59 -0.18 -1.50 -0.85 0.00 0.00 174.74 171.64 1sd0 s ILE 285 N 1.64 1.77 -0.21 0.60 -1.16 0.15 0.47 121.20 124.46 1sd0 s ILE 285 Ca 0.04 -1.83 0.01 0.00 -0.51 0.00 0.00 60.65 58.36 1sd0 s ILE 285 Cb -0.19 -1.77 0.03 0.00 0.61 0.00 0.00 42.46 41.14 1sd0 s ILE 285 CO 0.09 -0.27 -0.15 -1.10 -2.81 0.00 0.00 174.94 170.69 1sd0 s GLN 286 N -2.62 2.74 -0.54 3.50 -0.21 -0.29 -0.66 119.66 121.58 1sd0 s GLN 286 Ca 0.13 -1.01 0.07 0.00 0.02 0.00 0.00 55.36 54.57 1sd0 s GLN 286 Cb -0.06 -2.73 0.25 0.00 1.00 0.00 0.00 33.01 31.47 1sd0 s GLN 286 CO 0.06 -0.35 0.66 1.28 -2.12 0.00 0.00 175.29 174.82 1sd0 n LEU 287 N 4.57 2.32 -0.34 2.90 4.77 -1.26 -4.61 117.00 125.35 1sd0 n LEU 287 Ca -0.18 -5.15 0.08 0.00 -0.03 0.00 0.00 56.01 50.73 1sd0 n LEU 287 Cb 0.47 -0.13 0.17 0.00 -2.33 0.00 0.00 43.42 41.60 1sd0 n LEU 287 CO 0.25 2.07 0.71 1.55 -1.33 0.00 0.00 177.39 180.64 1sd0 h PRO 288 N 4.07 0.01 -0.05 3.23 0.13 -1.89 0.75 132.00 138.24 1sd0 h PRO 288 Ca 0.15 -0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.16 1sd0 h PRO 288 Cb 0.75 -0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.88 1sd0 h PRO 288 CO 0.68 0.01 -0.43 0.87 -0.23 0.00 0.00 178.00 178.90 1sd0 h LYS 289 N 0.01 0.38 0.00 0.86 1.57 -1.94 -3.30 116.57 114.16 1sd0 h LYS 289 Ca 0.49 -0.34 -0.06 0.00 -1.87 0.00 0.00 60.65 58.87 1sd0 h LYS 289 Cb 0.83 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.22 1sd0 h LYS 289 CO -0.95 0.99 -0.28 -0.07 -0.57 0.00 0.00 179.45 178.58 1sd0 h LEU 290 N -0.11 0.00 -4.73 2.94 3.38 -1.76 -3.28 115.31 111.74 1sd0 h LEU 290 Ca -0.04 0.00 -0.74 0.00 0.09 0.00 0.00 57.88 57.19 1sd0 h LEU 290 Cb 1.10 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.57 1sd0 h LEU 290 CO 0.09 0.28 0.98 0.00 0.09 0.00 0.00 178.44 179.88 1sd0 n ALA 291 N -2.20 6.45 1.22 1.53 0.00 0.26 -4.05 120.51 123.73 1sd0 n ALA 291 Ca 0.02 -3.96 0.04 0.00 0.00 0.00 0.00 53.44 49.54 1sd0 n ALA 291 Cb 0.56 -1.91 0.11 0.00 0.00 0.00 0.00 19.45 18.21 1sd0 n ALA 291 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1sd0 n LYS 292 N -0.64 1.57 0.00 0.00 3.00 -1.24 -4.55 118.16 116.30 1sd0 n LYS 292 Ca 0.56 -0.87 0.00 0.00 -0.00 0.00 0.00 58.31 58.00 1sd0 n LYS 292 Cb 0.35 -1.20 0.00 0.00 0.00 0.00 0.00 35.03 34.18 1sd0 n LYS 292 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1sd0 n ASP 293 N 0.20 0.00 -0.62 3.14 2.03 -1.26 -5.02 116.55 115.03 1sd0 n ASP 293 Ca 0.08 0.00 0.47 0.00 0.52 0.00 0.00 54.79 55.86 1sd0 n ASP 293 Cb 0.21 0.00 0.72 0.00 -0.72 0.00 0.00 41.12 41.33 1sd0 n ASP 293 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1sd0 n ARG 294 N 0.00 -0.00 -0.04 -0.67 0.63 -1.26 0.83 116.66 116.14 1sd0 n ARG 294 Ca 0.00 0.98 -0.13 0.00 -0.92 0.00 0.00 57.85 57.78 1sd0 n ARG 294 Cb 0.00 -2.23 -0.08 0.00 0.45 0.00 0.00 32.46 30.60 1sd0 n ARG 294 CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 1sd0 h LYS 295 N 0.00 0.29 -0.00 -0.14 3.11 -1.97 -1.65 116.57 116.21 1sd0 h LYS 295 Ca 0.84 -0.16 -0.05 0.00 -2.81 0.00 0.00 60.65 58.46 1sd0 h LYS 295 Cb 3.31 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 34.54 1sd0 h LYS 295 CO -0.04 0.73 -0.23 -0.39 -2.81 0.00 0.00 179.45 176.70 1sd0 h VAL 296 N -0.13 1.17 -0.23 2.00 -1.51 0.09 -1.73 116.25 115.92 1sd0 h VAL 296 Ca 0.01 -0.79 -0.08 0.00 -1.23 0.00 0.00 66.70 64.61 1sd0 h VAL 296 Cb 0.69 1.42 -0.00 0.00 -2.13 0.00 0.00 31.29 31.27 1sd0 h VAL 296 CO 0.03 0.23 -0.17 0.25 -1.23 0.00 0.00 177.57 176.69 1sd0 h LEU 297 N 0.01 0.54 -1.64 4.19 5.85 -1.37 -2.69 115.31 120.19 1sd0 h LEU 297 Ca -0.00 -0.45 -0.03 0.00 0.84 0.00 0.00 57.88 58.24 1sd0 h LEU 297 Cb 0.41 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1sd0 h LEU 297 CO 0.03 0.87 -0.11 -0.33 -0.34 0.00 0.00 178.44 178.56 1sd0 h GLU 298 N 0.21 0.09 -0.06 1.25 5.08 -0.67 0.07 114.58 120.55 1sd0 h GLU 298 Ca 0.04 -0.02 -0.19 0.00 -1.00 0.00 0.00 59.36 58.20 1sd0 h GLU 298 Cb 0.69 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 1sd0 h GLU 298 CO 0.04 0.21 -0.76 -0.44 -1.00 0.00 0.00 179.01 177.06 1sd0 h ASP 299 N 0.09 0.46 0.34 1.42 3.32 -1.25 -1.95 116.42 118.85 1sd0 h ASP 299 Ca 0.02 -0.32 -0.02 0.00 0.02 0.00 0.00 57.03 56.74 1sd0 h ASP 299 Cb 0.25 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1sd0 h ASP 299 CO 0.02 1.07 -0.16 0.40 -1.72 0.00 0.00 179.24 178.84 1sd0 h ILE 300 N 0.25 0.57 -0.88 0.35 1.08 -1.06 -3.23 117.51 114.60 1sd0 h ILE 300 Ca -0.04 -0.66 0.11 0.00 -0.39 0.00 0.00 64.86 63.88 1sd0 h ILE 300 Cb 1.35 0.86 -0.08 0.00 -3.07 0.00 0.00 36.82 35.88 1sd0 h ILE 300 CO 0.13 0.11 0.51 0.00 -0.69 0.00 0.00 178.15 178.21 1sd0 h ALA 301 N -0.45 1.28 -0.25 1.87 0.00 -1.06 -1.52 119.26 119.14 1sd0 h ALA 301 Ca -0.05 0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.97 1sd0 h ALA 301 Cb 0.53 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1sd0 h ALA 301 CO 0.08 0.11 0.18 0.66 0.00 0.00 0.00 179.25 180.28 1sd0 h SER 302 N 0.83 0.00 0.75 0.00 4.64 -1.38 0.25 113.55 118.64 1sd0 h SER 302 Ca 0.43 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1sd0 h SER 302 Cb 0.43 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1sd0 h SER 302 CO -0.26 0.00 -0.01 0.11 -0.87 0.00 0.00 176.83 175.79 1sd0 h LYS 303 N 0.00 0.00 -0.34 4.77 1.79 -1.29 -1.79 116.57 119.71 1sd0 h LYS 303 Ca 0.12 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.59 1sd0 h LYS 303 Cb 0.47 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.12 1sd0 h LYS 303 CO -0.00 0.01 0.00 1.19 -1.08 0.00 0.00 179.45 179.57 1sd0 n PHE 304 N -3.12 1.11 -2.51 -1.35 3.01 0.73 -4.94 117.46 110.39 1sd0 n PHE 304 Ca -0.00 -0.81 -0.18 0.00 1.01 0.00 0.00 57.45 57.47 1sd0 n PHE 304 Cb 0.25 -0.32 -0.00 0.00 -0.01 0.00 0.00 39.48 39.40 1sd0 n PHE 304 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1sd0 n ASN 305 N -0.15 -5.20 -4.78 4.37 5.03 -0.67 -4.82 115.26 109.03 1sd0 n ASN 305 Ca 0.22 0.01 -0.31 0.00 0.87 0.00 0.00 54.58 55.37 1sd0 n ASN 305 Cb 0.90 -4.34 -0.06 0.00 -1.02 0.00 0.00 39.78 35.26 1sd0 n ASN 305 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1sd0 s LEU 306 N -5.99 3.84 0.06 3.41 1.43 -0.42 -1.30 118.68 119.71 1sd0 s LEU 306 Ca 0.05 0.02 0.07 0.00 -1.03 0.00 0.00 54.13 53.23 1sd0 s LEU 306 Cb -0.02 -2.50 -0.03 0.00 0.03 0.00 0.00 46.19 43.67 1sd0 s LEU 306 CO 0.06 0.18 -0.16 -1.58 0.23 0.00 0.00 176.35 175.08 1sd0 s GLN 307 N -2.35 2.08 -0.13 1.70 0.74 0.16 -3.49 119.66 118.37 1sd0 s GLN 307 Ca 0.29 -0.99 -0.02 0.00 0.05 0.00 0.00 55.36 54.69 1sd0 s GLN 307 Cb -0.12 -2.23 -0.03 0.00 1.10 0.00 0.00 33.01 31.74 1sd0 s GLN 307 CO 0.22 0.53 -0.07 0.08 -0.55 0.00 0.00 175.29 175.50 1sd0 s VAL 308 N -1.01 3.65 0.21 1.34 1.01 -1.26 -1.42 120.40 122.91 1sd0 s VAL 308 Ca 0.16 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.72 1sd0 s VAL 308 Cb -0.11 -2.56 -0.05 0.00 0.00 0.00 0.00 36.38 33.67 1sd0 s VAL 308 CO 0.08 0.53 -0.02 -0.13 0.00 0.00 0.00 175.10 175.56 1sd0 s ARG 309 N 0.06 1.25 1.08 2.72 0.52 0.18 -4.97 118.95 119.80 1sd0 s ARG 309 Ca -0.02 -1.61 -0.16 0.00 -0.52 0.00 0.00 55.73 53.42 1sd0 s ARG 309 Cb -0.14 -0.54 0.23 0.00 0.52 0.00 0.00 34.95 35.02 1sd0 s ARG 309 CO 0.03 -0.08 1.14 0.20 0.02 0.00 0.00 175.30 176.61 1sd0 s GLY 310 N -3.26 1.61 0.47 -3.53 0.00 -1.06 -0.94 107.32 100.61 1sd0 s GLY 310 Ca 0.26 -0.81 0.21 0.00 0.00 0.00 0.00 44.72 44.38 1sd0 s GLY 310 CO 0.07 -0.05 1.98 -0.84 0.00 0.00 0.00 173.10 174.26 1sd0 h THR 311 N -2.14 0.83 -0.70 0.90 2.02 -1.49 -2.56 112.91 109.77 1sd0 h THR 311 Ca -0.48 -0.76 0.00 0.00 0.77 0.00 0.00 66.41 65.95 1sd0 h THR 311 Cb 1.30 1.45 0.00 0.00 -1.74 0.00 0.00 68.15 69.16 1sd0 h THR 311 CO 0.44 0.19 0.00 0.54 0.37 0.00 0.00 175.52 177.06 1sd0 n ARG 312 N -3.86 3.38 0.00 6.66 1.74 -1.26 -4.98 116.66 118.34 1sd0 n ARG 312 Ca -0.02 -2.83 0.00 0.00 -0.77 0.00 0.00 57.85 54.23 1sd0 n ARG 312 Cb 0.29 -1.78 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 1sd0 n ARG 312 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1sd0 n GLY 313 N 1.38 -0.54 3.57 -0.13 0.00 -0.96 -4.97 105.19 103.54 1sd0 n GLY 313 Ca 0.26 -2.26 -0.33 0.00 0.00 0.00 0.00 46.02 43.70 1sd0 n GLY 313 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1sd0 n GLU 314 N -0.42 -0.16 -2.17 1.61 0.28 -1.26 -2.56 120.64 115.96 1sd0 n GLU 314 Ca 0.00 0.01 -0.19 0.00 -0.16 0.00 0.00 57.16 56.83 1sd0 n GLU 314 Cb 0.00 -2.17 -0.03 0.00 1.43 0.00 0.00 31.44 30.67 1sd0 n GLU 314 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1sd0 n HIS 315 N -3.61 -0.83 -4.28 -1.84 8.25 -1.26 -4.85 115.22 106.79 1sd0 n HIS 315 Ca 0.11 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.41 1sd0 n HIS 315 Cb 0.52 -3.54 -0.10 0.00 1.12 0.00 0.00 29.99 27.99 1sd0 n HIS 315 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1sd0 s THR 316 N -2.84 0.89 0.52 1.59 -4.23 -1.15 -5.03 115.64 105.39 1sd0 s THR 316 Ca 0.00 -2.01 -0.03 0.00 -1.18 0.00 0.00 61.69 58.47 1sd0 s THR 316 Cb 0.00 -2.21 0.00 0.00 1.34 0.00 0.00 72.50 71.63 1sd0 s THR 316 CO 0.00 -0.42 0.78 -1.61 -0.54 0.00 0.00 174.62 172.83 1sd0 s GLU 317 N -3.88 2.99 0.05 3.99 0.41 -1.26 -2.73 118.70 118.27 1sd0 s GLU 317 Ca 0.26 -0.26 -0.27 0.00 -0.41 0.00 0.00 54.97 54.29 1sd0 s GLU 317 Cb 0.06 -2.42 -0.05 0.00 -1.78 0.00 0.00 34.13 29.93 1sd0 s GLU 317 CO 0.06 -0.48 0.83 -1.54 -0.49 0.00 0.00 175.26 173.64 1sd0 s SER 318 N -4.26 7.29 -0.30 -0.19 1.04 -1.26 -1.87 113.70 114.14 1sd0 s SER 318 Ca 0.51 1.54 -0.06 0.00 0.48 0.00 0.00 55.95 58.42 1sd0 s SER 318 Cb -0.10 -2.51 0.02 0.00 0.10 0.00 0.00 66.02 63.53 1sd0 s SER 318 CO 0.41 -0.05 0.08 -1.61 0.98 0.00 0.00 173.24 173.06 1sd0 s GLU 319 N 0.14 2.96 -1.00 4.02 2.02 -1.25 -4.62 118.70 120.97 1sd0 s GLU 319 Ca 0.42 -0.94 -0.05 0.00 0.02 0.00 0.00 54.97 54.41 1sd0 s GLU 319 Cb -0.21 -3.37 0.01 0.00 0.10 0.00 0.00 34.13 30.65 1sd0 s GLU 319 CO 0.25 -0.50 0.87 0.41 0.02 0.00 0.00 175.26 176.31 1sd0 n GLY 320 N 4.84 -0.17 3.36 -1.39 0.00 -1.26 -2.85 105.19 107.72 1sd0 n GLY 320 Ca -0.14 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1sd0 n GLY 320 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sd0 n GLY 321 N -1.53 0.83 3.58 -0.02 0.00 -1.26 -4.98 105.19 101.81 1sd0 n GLY 321 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1sd0 n GLY 321 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sd0 s VAL 322 N -2.94 4.72 0.22 1.61 1.01 -1.13 -4.26 120.40 119.63 1sd0 s VAL 322 Ca 0.00 0.81 0.08 0.00 0.00 0.00 0.00 61.98 62.87 1sd0 s VAL 322 Cb 0.00 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1sd0 s VAL 322 CO 0.00 -0.47 0.04 -0.31 0.00 0.00 0.00 175.10 174.36 1sd0 s TYR 323 N 3.12 2.84 -0.41 5.22 1.51 0.16 -3.75 117.35 126.04 1sd0 s TYR 323 Ca 0.31 -0.16 -0.11 0.00 -1.01 0.00 0.00 57.07 56.10 1sd0 s TYR 323 Cb -0.13 -1.31 0.06 0.00 -0.11 0.00 0.00 41.96 40.46 1sd0 s TYR 323 CO 0.18 0.56 0.27 0.34 -1.11 0.00 0.00 175.55 175.78 1sd0 s ASP 324 N -3.39 5.78 -0.12 2.29 -1.08 -0.11 -0.67 116.67 119.37 1sd0 s ASP 324 Ca 0.30 -1.28 0.01 0.00 -0.52 0.00 0.00 52.55 51.06 1sd0 s ASP 324 Cb -0.08 -2.04 -0.01 0.00 -1.46 0.00 0.00 42.92 39.33 1sd0 s ASP 324 CO 0.20 -0.51 -0.15 -0.63 0.52 0.00 0.00 175.17 174.60 1sd0 s ILE 325 N 1.52 2.86 0.27 4.11 -1.09 -0.95 0.51 121.20 128.42 1sd0 s ILE 325 Ca 0.03 -0.74 -0.11 0.00 -2.23 0.00 0.00 60.65 57.60 1sd0 s ILE 325 Cb -0.22 -2.18 -0.00 0.00 -1.58 0.00 0.00 42.46 38.48 1sd0 s ILE 325 CO 0.05 0.54 0.48 -0.94 -1.23 0.00 0.00 174.94 173.83 1sd0 s SER 326 N 0.27 0.07 0.12 3.58 1.04 -0.51 -2.28 113.70 116.00 1sd0 s SER 326 Ca -0.11 -1.04 -0.31 0.00 0.48 0.00 0.00 55.95 54.97 1sd0 s SER 326 Cb -0.16 0.60 -0.08 0.00 0.10 0.00 0.00 66.02 66.49 1sd0 s SER 326 CO 0.06 -1.18 1.33 0.54 0.98 0.00 0.00 173.24 174.97 1sd0 s ASN 327 N -3.06 6.90 -0.09 7.02 4.22 -1.11 0.38 114.94 129.21 1sd0 s ASN 327 Ca 0.24 2.28 -0.25 0.00 -2.14 0.00 0.00 52.86 52.99 1sd0 s ASN 327 Cb -0.01 -2.59 -0.29 0.00 1.28 0.00 0.00 41.25 39.65 1sd0 s ASN 327 CO 0.11 -0.58 0.85 0.50 -2.04 0.00 0.00 177.10 175.94 1sd0 h LYS 328 N 6.45 0.17 -6.83 3.55 3.64 -1.50 -3.43 116.57 118.62 1sd0 h LYS 328 Ca -0.43 -0.27 -0.51 0.00 -1.27 0.00 0.00 60.65 58.17 1sd0 h LYS 328 Cb 1.21 0.10 0.04 0.00 -0.41 0.00 0.00 32.23 33.17 1sd0 h LYS 328 CO 0.83 1.12 0.55 1.03 -2.27 0.00 0.00 179.45 180.71 1sd0 s ARG 329 N -2.39 4.51 0.00 1.90 0.52 -1.26 -4.93 118.95 117.30 1sd0 s ARG 329 Ca -0.16 1.99 0.00 0.00 -0.52 0.00 0.00 55.73 57.04 1sd0 s ARG 329 Cb -0.01 -3.14 0.00 0.00 0.52 0.00 0.00 34.95 32.32 1sd0 s ARG 329 CO 0.77 0.02 0.00 0.54 0.02 0.00 0.00 175.30 176.64 1sd0 n ARG 330 N 1.13 3.69 -4.83 3.54 1.74 -1.26 -4.91 116.66 115.75 1sd0 n ARG 330 Ca -0.00 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.75 1sd0 n ARG 330 Cb 0.43 -0.63 -0.14 0.00 -1.02 0.00 0.00 32.46 31.10 1sd0 n ARG 330 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1sd0 s LEU 331 N -1.01 2.72 0.00 0.55 2.96 -1.23 -0.82 118.68 121.85 1sd0 s LEU 331 Ca 0.00 -0.27 0.00 0.00 -0.22 0.00 0.00 54.13 53.64 1sd0 s LEU 331 Cb 0.00 -1.59 0.00 0.00 0.50 0.00 0.00 46.19 45.10 1sd0 s LEU 331 CO 0.00 0.24 0.00 0.61 -1.32 0.00 0.00 176.35 175.88 1sd0 n GLY 332 N 3.00 0.76 3.27 7.98 0.00 -1.26 -4.86 105.19 114.09 1sd0 n GLY 332 Ca -0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 1sd0 n GLY 332 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1sd0 s LEU 333 N 0.00 1.14 0.70 0.99 2.34 -1.26 -4.90 118.68 117.68 1sd0 s LEU 333 Ca 0.00 -0.72 -0.10 0.00 0.06 0.00 0.00 54.13 53.36 1sd0 s LEU 333 Cb 0.00 1.17 0.02 0.00 -0.56 0.00 0.00 46.19 46.82 1sd0 s LEU 333 CO 0.00 -0.81 1.07 0.42 -1.06 0.00 0.00 176.35 175.97 1sd0 s THR 334 N -3.90 3.34 0.18 5.48 -4.23 -1.26 -4.66 115.64 110.59 1sd0 s THR 334 Ca 0.10 0.34 -0.13 0.00 -1.18 0.00 0.00 61.69 60.81 1sd0 s THR 334 Cb 0.04 -3.42 0.09 0.00 1.34 0.00 0.00 72.50 70.55 1sd0 s THR 334 CO -0.06 -0.53 1.73 -0.33 -0.54 0.00 0.00 174.62 174.90 1sd0 h GLU 335 N -0.61 0.28 -0.52 3.99 3.07 -1.87 -0.02 114.58 118.89 1sd0 h GLU 335 Ca -0.45 -0.02 0.05 0.00 -0.50 0.00 0.00 59.36 58.44 1sd0 h GLU 335 Cb 1.26 -0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 29.06 1sd0 h GLU 335 CO 0.63 0.18 0.26 -0.92 -1.40 0.00 0.00 179.01 177.76 1sd0 h TYR 336 N 0.29 0.47 -0.69 4.33 3.20 -1.44 -1.52 116.97 121.60 1sd0 h TYR 336 Ca 0.23 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 1sd0 h TYR 336 Cb 0.27 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 1sd0 h TYR 336 CO -0.19 0.22 0.26 1.96 -1.64 0.00 0.00 178.16 178.77 1sd0 h GLN 337 N 0.49 1.03 0.92 1.82 4.20 -1.60 -1.71 115.11 120.27 1sd0 h GLN 337 Ca 0.24 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.72 1sd0 h GLN 337 Cb 0.16 -0.17 0.01 0.00 0.30 0.00 0.00 27.48 27.78 1sd0 h GLN 337 CO -0.18 0.85 -0.44 0.00 -0.67 0.00 0.00 178.83 178.40 1sd0 h ALA 338 N 1.27 -1.23 -0.41 3.87 0.00 -0.33 -1.21 119.26 121.22 1sd0 h ALA 338 Ca 0.23 -0.27 0.10 0.00 0.00 0.00 0.00 54.91 54.97 1sd0 h ALA 338 Cb 0.22 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1sd0 h ALA 338 CO -0.02 -1.15 0.29 -0.24 0.00 0.00 0.00 179.25 178.13 1sd0 h VAL 339 N -1.30 0.83 -0.27 0.00 3.04 -1.29 -1.47 116.25 115.79 1sd0 h VAL 339 Ca -0.13 -0.03 -0.17 0.00 -1.01 0.00 0.00 66.70 65.37 1sd0 h VAL 339 Cb 0.94 0.75 -0.00 0.00 -2.01 0.00 0.00 31.29 30.97 1sd0 h VAL 339 CO 0.21 0.01 -0.51 0.03 -1.01 0.00 0.00 177.57 176.30 1sd0 h ARG 340 N 0.08 0.77 -0.71 4.17 2.47 -1.00 -1.40 114.38 118.76 1sd0 h ARG 340 Ca 0.19 -0.47 -0.01 0.00 -1.26 0.00 0.00 59.98 58.43 1sd0 h ARG 340 Cb 0.66 0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 29.00 1sd0 h ARG 340 CO -0.02 1.10 0.39 0.93 0.56 0.00 0.00 179.97 182.93 1sd0 h GLU 341 N 0.60 0.98 -0.08 0.04 5.08 -0.12 0.33 114.58 121.41 1sd0 h GLU 341 Ca 0.02 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1sd0 h GLU 341 Cb 1.09 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 1sd0 h GLU 341 CO 0.11 0.72 -0.06 1.98 -1.00 0.00 0.00 179.01 180.76 1sd0 h MET 342 N 0.99 0.19 0.42 2.33 4.05 -1.41 -0.22 114.93 121.28 1sd0 h MET 342 Ca 0.25 -0.09 -0.01 0.00 -0.28 0.00 0.00 59.70 59.57 1sd0 h MET 342 Cb 0.02 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.80 1sd0 h MET 342 CO -0.04 0.59 -0.37 0.37 0.23 0.00 0.00 176.91 177.69 1sd0 h GLN 343 N -0.21 -0.77 -0.60 0.39 4.15 -0.78 0.05 115.11 117.33 1sd0 h GLN 343 Ca 0.02 0.05 0.04 0.00 0.77 0.00 0.00 58.65 59.52 1sd0 h GLN 343 Cb 0.55 0.17 -0.04 0.00 0.21 0.00 0.00 27.48 28.37 1sd0 h GLN 343 CO 0.02 -0.51 0.35 -0.44 -1.93 0.00 0.00 178.83 176.32 1sd0 h ASP 344 N -0.80 0.56 -0.44 -0.69 3.32 -0.42 -1.56 116.42 116.39 1sd0 h ASP 344 Ca -0.04 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1sd0 h ASP 344 Cb 0.70 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 1sd0 h ASP 344 CO -0.03 0.38 0.26 1.23 -1.72 0.00 0.00 179.24 179.36 1sd0 h GLY 345 N 0.69 0.65 0.98 2.75 0.00 -0.79 -2.41 103.07 104.93 1sd0 h GLY 345 Ca 0.25 -0.28 -0.05 0.00 0.00 0.00 0.00 47.33 47.25 1sd0 h GLY 345 CO -0.13 0.27 0.12 -2.22 0.00 0.00 0.00 176.54 174.58 1sd0 h ILE 346 N 0.59 1.24 -0.65 2.60 1.08 -0.72 -2.04 117.51 119.61 1sd0 h ILE 346 Ca 0.16 -0.86 0.05 0.00 -0.39 0.00 0.00 64.86 63.82 1sd0 h ILE 346 Cb 0.01 0.84 -0.05 0.00 -3.07 0.00 0.00 36.82 34.55 1sd0 h ILE 346 CO -0.03 0.31 0.37 -0.07 -0.69 0.00 0.00 178.15 178.04 1sd0 h LEU 347 N 0.70 0.56 -0.04 1.44 3.38 -1.11 -0.91 115.31 119.33 1sd0 h LEU 347 Ca 0.16 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1sd0 h LEU 347 Cb 0.34 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1sd0 h LEU 347 CO 0.00 0.37 -0.02 -0.33 0.09 0.00 0.00 178.44 178.55 1sd0 h GLU 348 N 0.70 0.09 -0.88 1.13 4.39 -1.29 -2.34 114.58 116.37 1sd0 h GLU 348 Ca 0.28 -0.04 0.07 0.00 0.34 0.00 0.00 59.36 60.01 1sd0 h GLU 348 Cb 0.14 -0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.73 1sd0 h GLU 348 CO -0.16 0.50 0.58 0.52 -1.16 0.00 0.00 179.01 179.28 1sd0 h MET 349 N -0.32 0.96 -0.55 2.33 2.86 -1.24 0.45 114.93 119.43 1sd0 h MET 349 Ca 0.01 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 1sd0 h MET 349 Cb 0.47 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.89 1sd0 h MET 349 CO 0.01 0.64 0.28 0.82 1.06 0.00 0.00 176.91 179.71 1sd0 h ILE 350 N 0.99 1.19 0.15 -1.22 5.03 -1.14 0.14 117.51 122.65 1sd0 h ILE 350 Ca 0.38 -0.52 -0.01 0.00 -0.12 0.00 0.00 64.86 64.60 1sd0 h ILE 350 Cb 0.22 0.53 0.00 0.00 -3.03 0.00 0.00 36.82 34.54 1sd0 h ILE 350 CO -0.14 0.21 -0.07 0.03 -0.68 0.00 0.00 178.15 177.50 1sd0 h ARG 351 N 0.73 -0.19 -0.91 2.37 3.08 -0.36 -0.76 114.38 118.33 1sd0 h ARG 351 Ca 0.19 0.01 0.15 0.00 0.07 0.00 0.00 59.98 60.40 1sd0 h ARG 351 Cb 0.08 0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.10 1sd0 h ARG 351 CO -0.03 -0.08 0.59 0.52 -1.07 0.00 0.00 179.97 179.90 1sd0 h MET 352 N -0.26 0.69 -0.38 0.04 2.86 0.11 -0.59 114.93 117.40 1sd0 h MET 352 Ca -0.02 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.52 1sd0 h MET 352 Cb 0.21 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1sd0 h MET 352 CO 0.03 0.45 -0.01 1.49 1.06 0.00 0.00 176.91 179.94 1sd0 h GLU 353 N 0.71 0.68 -0.28 1.72 4.57 -0.19 0.67 114.58 122.45 1sd0 h GLU 353 Ca 0.47 -0.22 -0.05 0.00 -1.18 0.00 0.00 59.36 58.38 1sd0 h GLU 353 Cb 0.75 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.26 1sd0 h GLU 353 CO -0.23 0.78 -0.04 0.87 -1.18 0.00 0.00 179.01 179.22 1sd0 h LYS 354 N 0.50 0.44 0.00 1.92 1.57 0.33 -2.53 116.57 118.80 1sd0 h LYS 354 Ca 0.11 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1sd0 h LYS 354 Cb 0.48 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1sd0 h LYS 354 CO 0.02 0.50 -0.81 0.00 -0.57 0.00 0.00 179.45 178.59 1sd0 n ALA 355 N -2.48 3.11 -1.73 3.86 0.00 -0.58 -4.93 120.51 117.76 1sd0 n ALA 355 Ca 0.01 -0.31 -0.42 0.00 0.00 0.00 0.00 53.44 52.71 1sd0 n ALA 355 Cb 0.25 -1.08 -0.01 0.00 0.00 0.00 0.00 19.45 18.60 1sd0 n ALA 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sd0 n ALA 356 N -1.84 1.86 0.32 0.00 0.00 0.22 -5.08 120.51 115.98 1sd0 n ALA 356 Ca 0.03 0.36 0.03 0.00 0.00 0.00 0.00 53.44 53.86 1sd0 n ALA 356 Cb 0.44 -2.35 0.15 0.00 0.00 0.00 0.00 19.45 17.69 1sd0 n ALA 356 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50