#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1roz s THR 29 N 0.00 5.20 0.44 0.44 2.01 -1.26 -5.09 115.64 117.39 1roz s THR 29 Ca 0.00 0.11 -0.18 0.00 0.31 0.00 0.00 61.69 61.93 1roz s THR 29 Cb 0.00 -3.32 -0.09 0.00 0.01 0.00 0.00 72.50 69.09 1roz s THR 29 CO 0.00 0.51 0.92 -1.10 -0.69 0.00 0.00 174.62 174.26 1roz s GLN 30 N -0.11 4.08 -0.06 4.92 -0.21 -1.26 -5.03 119.66 121.99 1roz s GLN 30 Ca 0.09 0.97 -0.28 0.00 0.02 0.00 0.00 55.36 56.16 1roz s GLN 30 Cb -0.12 -2.21 -0.02 0.00 1.00 0.00 0.00 33.01 31.66 1roz s GLN 30 CO 0.00 -0.09 0.94 0.08 -2.12 0.00 0.00 175.29 174.10 1roz s VAL 31 N -2.32 4.87 -0.28 1.09 1.01 -1.26 -4.89 120.40 118.62 1roz s VAL 31 Ca 0.59 1.93 -0.14 0.00 0.00 0.00 0.00 61.98 64.35 1roz s VAL 31 Cb -0.10 -4.26 0.09 0.00 0.00 0.00 0.00 36.38 32.11 1roz s VAL 31 CO 0.21 0.10 0.67 -0.60 0.00 0.00 0.00 175.10 175.48 1roz s ARG 32 N 1.45 0.67 0.60 2.72 6.06 -0.17 -5.03 118.95 125.25 1roz s ARG 32 Ca 0.47 1.27 0.03 0.00 -2.50 0.00 0.00 55.73 55.00 1roz s ARG 32 Cb -0.19 0.30 0.08 0.00 0.06 0.00 0.00 34.95 35.19 1roz s ARG 32 CO 0.22 -0.16 0.84 0.20 -2.50 0.00 0.00 175.30 173.89 1roz s GLY 33 N 1.91 1.80 0.33 8.12 0.00 -1.26 -3.95 107.32 114.26 1roz s GLY 33 Ca -0.09 -1.67 -0.29 0.00 0.00 0.00 0.00 44.72 42.67 1roz s GLY 33 CO -0.20 -1.26 1.40 -0.47 0.00 0.00 0.00 173.10 172.57 1roz s TYR 34 N -2.84 2.89 -0.37 1.90 5.04 -1.26 -4.99 117.35 117.73 1roz s TYR 34 Ca 0.61 1.23 -0.14 0.00 -2.44 0.00 0.00 57.07 56.34 1roz s TYR 34 Cb -0.08 -3.83 -0.00 0.00 0.35 0.00 0.00 41.96 38.40 1roz s TYR 34 CO 0.40 -2.44 0.26 0.34 -1.34 0.00 0.00 175.55 172.77 1roz s ASP 35 N -0.16 6.06 0.00 4.32 -1.08 -1.26 -4.94 116.67 119.60 1roz s ASP 35 Ca 0.53 -0.61 0.21 0.00 -0.52 0.00 0.00 52.55 52.15 1roz s ASP 35 Cb -0.43 -2.14 1.08 0.00 -1.46 0.00 0.00 42.92 39.97 1roz s ASP 35 CO 0.54 -0.32 1.66 0.49 0.52 0.00 0.00 175.17 178.05 1roz n PHE 36 N 5.12 0.00 0.38 -5.34 3.72 -1.26 -2.13 117.46 117.95 1roz n PHE 36 Ca -0.12 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.37 1roz n PHE 36 Cb 0.49 -0.25 0.38 0.00 -0.94 0.00 0.00 39.48 39.16 1roz n PHE 36 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1roz n ASN 37 N -1.25 0.32 -0.08 4.37 3.02 -1.26 0.11 115.26 120.50 1roz n ASN 37 Ca 0.11 0.59 0.14 0.00 -0.03 0.00 0.00 54.58 55.39 1roz n ASN 37 Cb 0.15 -0.66 0.60 0.00 -0.61 0.00 0.00 39.78 39.26 1roz n ASN 37 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1roz n ARG 38 N -1.87 0.51 0.00 3.52 1.74 -0.91 -5.02 116.66 114.63 1roz n ARG 38 Ca 0.02 -0.16 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 1roz n ARG 38 Cb 0.17 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 1roz n ARG 38 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1roz n GLY 39 N 1.33 -1.75 3.13 -0.13 0.00 0.12 -4.80 105.19 103.08 1roz n GLY 39 Ca 0.13 -1.70 -0.37 0.00 0.00 0.00 0.00 46.02 44.07 1roz n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1roz s VAL 40 N 0.00 3.66 -0.32 1.61 1.01 -1.26 -4.63 120.40 120.47 1roz s VAL 40 Ca 0.00 -2.42 -0.03 0.00 0.00 0.00 0.00 61.98 59.52 1roz s VAL 40 Cb 0.00 -3.43 0.05 0.00 0.00 0.00 0.00 36.38 33.00 1roz s VAL 40 CO 0.00 -0.79 0.05 0.21 0.00 0.00 0.00 175.10 174.56 1roz s ASN 41 N 1.46 5.06 0.34 3.32 3.84 -1.26 -5.00 114.94 122.70 1roz s ASN 41 Ca 0.12 -1.28 0.02 0.00 0.21 0.00 0.00 52.86 51.93 1roz s ASN 41 Cb -0.22 -1.77 0.60 0.00 -0.55 0.00 0.00 41.25 39.31 1roz s ASN 41 CO -0.04 -0.30 1.99 1.88 -2.79 0.00 0.00 177.10 177.84 1roz h TYR 42 N 8.08 0.81 -0.34 0.43 0.05 -1.99 -0.38 116.97 123.63 1roz h TYR 42 Ca -0.21 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.55 1roz h TYR 42 Cb 1.07 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 38.52 1roz h TYR 42 CO 0.60 0.53 0.13 -0.09 -1.05 0.00 0.00 178.16 178.29 1roz h ARG 43 N 0.86 0.52 -0.51 4.88 1.12 -1.99 -1.26 114.38 118.00 1roz h ARG 43 Ca 0.23 -0.10 -0.08 0.00 -1.11 0.00 0.00 59.98 58.91 1roz h ARG 43 Cb -0.05 -0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 29.80 1roz h ARG 43 CO -0.05 0.52 -0.02 0.00 -3.11 0.00 0.00 179.97 177.32 1roz h ALA 44 N 0.97 1.00 -0.04 2.80 0.00 -1.88 -1.41 119.26 120.70 1roz h ALA 44 Ca 0.11 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1roz h ALA 44 Cb 0.20 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1roz h ALA 44 CO -0.01 0.61 0.02 1.25 0.00 0.00 0.00 179.25 181.13 1roz h LEU 45 N 0.81 0.05 -0.33 0.00 5.85 -0.83 -1.65 115.31 119.20 1roz h LEU 45 Ca 0.15 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1roz h LEU 45 Cb 0.52 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 1roz h LEU 45 CO 0.03 0.06 0.15 -0.07 -0.34 0.00 0.00 178.44 178.26 1roz h LEU 46 N 0.03 0.45 -1.51 2.25 3.38 -1.12 -2.70 115.31 116.09 1roz h LEU 46 Ca 0.01 -0.14 0.07 0.00 0.09 0.00 0.00 57.88 57.91 1roz h LEU 46 Cb 0.02 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1roz h LEU 46 CO -0.00 0.47 0.41 -0.08 0.09 0.00 0.00 178.44 179.33 1roz h GLU 47 N 0.40 0.57 0.00 1.13 4.81 -1.10 -1.44 114.58 118.95 1roz h GLU 47 Ca 0.11 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1roz h GLU 47 Cb 0.15 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1roz h GLU 47 CO -0.01 0.38 0.00 0.00 -0.73 0.00 0.00 179.01 178.65 1roz n ALA 48 N -2.48 1.55 -0.21 2.92 0.00 -0.63 -2.58 120.51 119.08 1roz n ALA 48 Ca 0.09 0.01 -0.01 0.00 0.00 0.00 0.00 53.44 53.53 1roz n ALA 48 Cb 0.25 -1.26 0.21 0.00 0.00 0.00 0.00 19.45 18.65 1roz n ALA 48 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1roz h PHE 49 N 0.00 0.96 -0.96 0.00 0.04 -1.26 -2.34 116.94 113.38 1roz h PHE 49 Ca 0.00 -0.01 0.23 0.00 2.80 0.00 0.00 57.97 60.99 1roz h PHE 49 Cb 0.24 -0.31 -0.07 0.00 2.20 0.00 0.00 35.95 38.01 1roz h PHE 49 CO 0.00 0.66 0.63 0.78 -0.60 0.00 0.00 178.31 179.79 1roz h GLY 50 N 1.03 0.93 -2.20 -1.45 0.00 -1.61 0.07 103.07 99.84 1roz h GLY 50 Ca 0.25 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1roz h GLY 50 CO -0.04 -0.04 0.00 -1.30 0.00 0.00 0.00 176.54 175.15 1roz n THR 51 N -4.53 0.82 0.05 4.70 -2.24 -0.91 -4.48 114.28 107.70 1roz n THR 51 Ca 0.21 -0.91 -0.07 0.00 -2.27 0.00 0.00 64.05 61.01 1roz n THR 51 Cb 0.78 0.67 -0.12 0.00 -2.10 0.00 0.00 70.33 69.56 1roz n THR 51 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1roz h THR 52 N 3.75 1.59 0.00 4.28 2.02 -0.68 -0.43 112.91 123.45 1roz h THR 52 Ca 0.00 -3.31 0.00 0.00 0.77 0.00 0.00 66.41 63.87 1roz h THR 52 Cb 0.91 2.79 0.00 0.00 -1.74 0.00 0.00 68.15 70.11 1roz h THR 52 CO 0.00 0.91 0.00 0.61 0.37 0.00 0.00 175.52 177.41 1roz n GLY 53 N 1.37 1.41 7.00 2.16 0.00 -1.25 -4.85 105.19 111.04 1roz n GLY 53 Ca -0.02 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.92 1roz n GLY 53 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1roz n PHE 54 N 0.70 0.00 0.23 1.61 3.72 -1.26 -1.68 117.46 120.78 1roz n PHE 54 Ca 0.00 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.50 1roz n PHE 54 Cb 0.00 0.01 0.51 0.00 -0.94 0.00 0.00 39.48 39.05 1roz n PHE 54 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1roz h GLN 55 N 0.00 0.00 -0.95 -1.08 1.08 -1.97 -2.61 115.11 109.58 1roz h GLN 55 Ca 0.00 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.23 1roz h GLN 55 Cb 0.00 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.38 1roz h GLN 55 CO 0.00 0.21 0.62 0.00 -0.95 0.00 0.00 178.83 178.71 1roz h ALA 56 N 1.79 1.25 -0.36 3.87 0.00 -1.59 0.97 119.26 125.18 1roz h ALA 56 Ca -0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1roz h ALA 56 Cb 0.67 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1roz h ALA 56 CO 0.03 0.51 -0.12 1.15 0.00 0.00 0.00 179.25 180.81 1roz h THR 57 N 1.21 1.28 -0.05 0.00 2.02 -1.10 -1.68 112.91 114.59 1roz h THR 57 Ca 0.37 -1.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 1roz h THR 57 Cb -0.02 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 1roz h THR 57 CO -0.12 0.40 -0.07 0.78 0.37 0.00 0.00 175.52 176.88 1roz h ASN 58 N 0.52 0.06 -0.45 4.18 2.35 -1.11 -0.30 115.58 120.83 1roz h ASN 58 Ca 0.09 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.74 1roz h ASN 58 Cb 0.64 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 1roz h ASN 58 CO 0.04 0.15 -0.06 0.15 -1.65 0.00 0.00 177.43 176.06 1roz h PHE 59 N 0.07 0.93 -0.87 1.19 3.57 -0.34 0.21 116.94 121.71 1roz h PHE 59 Ca 0.02 -0.18 -0.01 0.00 3.53 0.00 0.00 57.97 61.32 1roz h PHE 59 Cb 0.17 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 1roz h PHE 59 CO 0.00 0.91 0.50 0.78 -2.23 0.00 0.00 178.31 178.28 1roz h GLY 60 N 0.68 1.27 1.20 2.40 0.00 -0.20 -0.56 103.07 107.85 1roz h GLY 60 Ca 0.12 -0.55 -0.10 0.00 0.00 0.00 0.00 47.33 46.80 1roz h GLY 60 CO 0.03 0.53 -0.09 3.21 0.00 0.00 0.00 176.54 180.23 1roz h ARG 61 N 1.20 0.95 -0.75 4.80 3.08 -0.82 -2.09 114.38 120.76 1roz h ARG 61 Ca 0.31 -0.33 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 1roz h ARG 61 Cb -0.02 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 1roz h ARG 61 CO -0.05 0.99 0.27 0.00 -1.07 0.00 0.00 179.97 180.10 1roz h ALA 62 N 1.04 0.98 -0.67 0.04 0.00 -0.37 0.38 119.26 120.66 1roz h ALA 62 Ca 0.14 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1roz h ALA 62 Cb 0.62 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1roz h ALA 62 CO 0.04 0.63 0.44 0.28 0.00 0.00 0.00 179.25 180.65 1roz h VAL 63 N 1.10 1.16 -0.15 0.00 2.07 -0.80 0.06 116.25 119.69 1roz h VAL 63 Ca 0.25 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 1roz h VAL 63 Cb 0.26 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1roz h VAL 63 CO -0.01 0.16 0.05 1.56 0.02 0.00 0.00 177.57 179.35 1roz h GLN 64 N 0.90 0.23 -0.76 1.57 4.20 -0.80 -1.33 115.11 119.13 1roz h GLN 64 Ca 0.25 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.85 1roz h GLN 64 Cb -0.09 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.62 1roz h GLN 64 CO -0.06 0.34 0.25 1.96 -0.67 0.00 0.00 178.83 180.66 1roz h GLN 65 N 0.07 1.16 -0.46 1.46 1.08 -0.61 0.11 115.11 117.93 1roz h GLN 65 Ca 0.05 -0.24 -0.12 0.00 -1.45 0.00 0.00 58.65 56.89 1roz h GLN 65 Cb 0.21 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.45 1roz h GLN 65 CO -0.00 0.98 -0.19 0.28 -0.95 0.00 0.00 178.83 178.94 1roz h VAL 66 N 1.12 1.27 -0.34 -0.54 2.07 -0.94 -1.13 116.25 117.75 1roz h VAL 66 Ca 0.25 -1.33 -0.06 0.00 0.82 0.00 0.00 66.70 66.37 1roz h VAL 66 Cb 0.29 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1roz h VAL 66 CO -0.01 0.46 -0.05 0.78 0.02 0.00 0.00 177.57 178.76 1roz h ASN 67 N 0.79 0.52 -0.44 0.57 2.35 -0.87 -1.22 115.58 117.29 1roz h ASN 67 Ca 0.11 -0.12 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 1roz h ASN 67 Cb 0.74 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.95 1roz h ASN 67 CO 0.06 0.63 0.11 0.00 -1.65 0.00 0.00 177.43 176.58 1roz h ALA 68 N 1.43 0.58 -0.49 -0.83 0.00 -0.55 0.65 119.26 120.05 1roz h ALA 68 Ca 0.10 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.88 1roz h ALA 68 Cb 0.42 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 1roz h ALA 68 CO 0.02 0.25 0.20 0.52 0.00 0.00 0.00 179.25 180.24 1roz h MET 69 N 0.57 0.38 -0.48 0.00 2.86 -0.71 0.01 114.93 117.56 1roz h MET 69 Ca 0.14 -0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1roz h MET 69 Cb 0.31 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1roz h MET 69 CO 0.00 0.25 0.02 0.82 1.06 0.00 0.00 176.91 179.06 1roz h ILE 70 N 0.39 1.26 -0.64 -1.22 2.04 -0.95 0.20 117.51 118.59 1roz h ILE 70 Ca 0.23 -1.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.05 1roz h ILE 70 Cb 0.21 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 1roz h ILE 70 CO -0.21 0.36 0.36 -0.33 0.00 0.00 0.00 178.15 178.33 1roz h GLU 71 N 0.68 0.88 -0.25 2.37 4.39 -0.54 -0.63 114.58 121.48 1roz h GLU 71 Ca 0.14 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 1roz h GLU 71 Cb 0.48 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1roz h GLU 71 CO 0.02 0.66 0.07 -0.22 -1.16 0.00 0.00 179.01 178.37 1roz h LYS 72 N 0.86 0.40 -0.79 2.33 1.63 -0.69 -2.43 116.57 117.89 1roz h LYS 72 Ca 0.22 -0.09 0.10 0.00 -0.85 0.00 0.00 60.65 60.03 1roz h LYS 72 Cb 0.02 -0.05 -0.05 0.00 -0.60 0.00 0.00 32.23 31.55 1roz h LYS 72 CO -0.04 0.49 0.51 -0.22 -3.45 0.00 0.00 179.45 176.75 1roz h LYS 73 N 0.24 0.69 0.00 1.90 3.64 -0.17 -0.94 116.57 121.93 1roz h LYS 73 Ca 0.08 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1roz h LYS 73 Cb 0.27 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1roz h LYS 73 CO -0.00 0.46 0.00 1.28 -2.27 0.00 0.00 179.45 178.92 1roz n LEU 74 N -4.50 0.49 -4.75 5.20 4.77 -0.28 -3.58 117.00 114.34 1roz n LEU 74 Ca 0.13 0.56 -0.41 0.00 -0.03 0.00 0.00 56.01 56.26 1roz n LEU 74 Cb 0.33 -0.42 -0.02 0.00 -2.33 0.00 0.00 43.42 40.98 1roz n LEU 74 CO 0.32 -0.18 1.17 -1.61 -1.33 0.00 0.00 177.39 175.76 1roz s GLU 75 N -3.09 4.18 0.69 3.23 2.02 -0.36 -4.97 118.70 120.41 1roz s GLU 75 Ca 0.10 2.46 -0.14 0.00 0.02 0.00 0.00 54.97 57.42 1roz s GLU 75 Cb 0.14 -3.05 0.02 0.00 0.10 0.00 0.00 34.13 31.33 1roz s GLU 75 CO 0.52 -0.52 1.12 -2.14 0.02 0.00 0.00 175.26 174.26 1roz s PRO 76 N -0.71 2.58 0.00 0.39 0.02 -1.26 -4.18 135.00 131.84 1roz s PRO 76 Ca 0.60 1.42 0.00 0.00 0.02 0.00 0.00 61.00 63.04 1roz s PRO 76 Cb -0.45 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.15 1roz s PRO 76 CO 0.48 -1.43 0.00 1.28 -0.33 0.00 0.00 177.00 177.01 1roz n LEU 77 N -2.65 0.00 -4.50 -5.54 4.77 -1.26 -4.91 117.00 102.90 1roz n LEU 77 Ca 0.11 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.67 1roz n LEU 77 Cb 0.52 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.53 1roz n LEU 77 CO 0.48 0.00 2.02 -2.65 -1.33 0.00 0.00 177.39 175.91 1roz n PRO 93 N 0.00 0.75 -1.97 3.23 -0.02 -1.26 -5.16 135.00 130.57 1roz n PRO 93 Ca 0.00 0.09 -0.36 0.00 -2.02 0.00 0.00 63.50 61.21 1roz n PRO 93 Cb 0.00 -2.56 0.04 0.00 -0.02 0.00 0.00 33.50 30.96 1roz n PRO 93 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1roz s LEU 94 N 9.72 3.68 0.33 2.45 2.96 -1.26 -5.05 118.68 131.51 1roz s LEU 94 Ca 1.13 2.45 0.03 0.00 -0.22 0.00 0.00 54.13 57.52 1roz s LEU 94 Cb -0.71 -4.57 -0.05 0.00 0.50 0.00 0.00 46.19 41.36 1roz s LEU 94 CO 0.40 -1.63 0.10 0.42 -1.32 0.00 0.00 176.35 174.32 1roz s THR 95 N -1.54 0.77 -1.23 3.68 -4.23 -1.26 -5.03 115.64 106.80 1roz s THR 95 Ca 0.77 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.46 1roz s THR 95 Cb -0.32 -2.60 0.23 0.00 1.34 0.00 0.00 72.50 71.15 1roz s THR 95 CO 0.35 0.00 1.54 -1.20 -0.54 0.00 0.00 174.62 174.77 1roz n SER 96 N -0.84 0.00 -3.38 3.99 7.64 -1.23 -4.54 113.62 115.25 1roz n SER 96 Ca -0.02 0.25 -0.07 0.00 1.01 0.00 0.00 58.87 60.04 1roz n SER 96 Cb 0.66 -0.39 -0.07 0.00 -1.01 0.00 0.00 64.21 63.40 1roz n SER 96 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1roz s THR 98 N 2.60 4.62 -0.24 0.00 2.01 0.79 -4.68 115.64 120.74 1roz s THR 98 Ca 0.11 1.39 -0.10 0.00 0.31 0.00 0.00 61.69 63.40 1roz s THR 98 Cb -0.15 -4.31 -0.05 0.00 0.01 0.00 0.00 72.50 68.00 1roz s THR 98 CO -0.16 -0.44 0.14 -0.63 -0.69 0.00 0.00 174.62 172.84 1roz s ILE 99 N 3.39 5.17 -0.28 1.82 1.01 -1.26 -1.12 121.20 129.93 1roz s ILE 99 Ca 0.39 0.11 -0.13 0.00 0.00 0.00 0.00 60.65 61.03 1roz s ILE 99 Cb -0.13 -3.40 -0.04 0.00 0.01 0.00 0.00 42.46 38.90 1roz s ILE 99 CO 0.16 0.35 0.27 -0.36 0.00 0.00 0.00 174.94 175.36 1roz s PHE 100 N 1.07 3.23 -0.22 3.97 0.40 -0.13 -0.79 117.98 125.51 1roz s PHE 100 Ca 0.07 0.21 -0.06 0.00 -0.60 0.00 0.00 56.93 56.55 1roz s PHE 100 Cb -0.14 -2.47 -0.02 0.00 0.51 0.00 0.00 43.02 40.90 1roz s PHE 100 CO 0.04 -0.21 0.02 -1.17 0.70 0.00 0.00 175.22 174.60 1roz s LEU 101 N 1.89 3.25 0.02 -0.37 2.96 0.07 -0.86 118.68 125.64 1roz s LEU 101 Ca 0.10 -0.24 0.08 0.00 -0.22 0.00 0.00 54.13 53.85 1roz s LEU 101 Cb -0.16 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.66 1roz s LEU 101 CO 0.11 0.02 -0.24 -0.83 -1.32 0.00 0.00 176.35 174.09 1roz s GLY 102 N 1.29 1.22 -0.15 7.98 0.00 0.00 -1.17 107.32 116.49 1roz s GLY 102 Ca 0.04 -1.11 -0.23 0.00 0.00 0.00 0.00 44.72 43.42 1roz s GLY 102 CO 0.01 -0.99 0.59 -2.52 0.00 0.00 0.00 173.10 170.19 1roz s TYR 103 N -0.71 -0.60 0.77 1.90 1.13 -0.76 -0.06 117.35 119.02 1roz s TYR 103 Ca 0.09 1.31 -0.11 0.00 -1.41 0.00 0.00 57.07 56.96 1roz s TYR 103 Cb -0.09 0.26 0.05 0.00 -1.10 0.00 0.00 41.96 41.08 1roz s TYR 103 CO 0.01 -0.41 1.08 0.95 -2.51 0.00 0.00 175.55 174.68 1roz s THR 104 N -0.30 3.41 0.17 -3.49 -4.23 -1.10 -4.07 115.64 106.03 1roz s THR 104 Ca -0.05 0.46 -0.15 0.00 -1.18 0.00 0.00 61.69 60.77 1roz s THR 104 Cb -0.03 -3.07 0.10 0.00 1.34 0.00 0.00 72.50 70.83 1roz s THR 104 CO 0.04 -0.60 1.68 0.28 -0.54 0.00 0.00 174.62 175.48 1roz h SER 105 N -1.05 -0.26 -0.22 3.99 0.02 -1.91 -2.66 113.55 111.46 1roz h SER 105 Ca -0.45 0.11 0.06 0.00 -0.84 0.00 0.00 61.79 60.67 1roz h SER 105 Cb 1.24 0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.98 1roz h SER 105 CO 0.55 -0.09 0.20 -0.55 -1.14 0.00 0.00 176.83 175.81 1roz h ASN 106 N 0.07 0.00 0.80 3.07 -1.07 -1.93 -0.63 115.58 115.89 1roz h ASN 106 Ca 0.21 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 56.55 1roz h ASN 106 Cb 0.32 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.57 1roz h ASN 106 CO -0.39 0.00 -0.15 -0.07 0.07 0.00 0.00 177.43 176.89 1roz h LEU 107 N 0.00 0.00 0.00 6.14 3.38 -1.84 -1.26 115.31 121.73 1roz h LEU 107 Ca 0.10 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 1roz h LEU 107 Cb 0.51 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1roz h LEU 107 CO -0.00 0.15 -0.57 0.40 0.09 0.00 0.00 178.44 178.51 1roz h ILE 108 N 0.00 0.61 -0.13 1.22 1.08 -1.23 -3.07 117.51 116.00 1roz h ILE 108 Ca -0.00 -1.91 -0.18 0.00 -0.39 0.00 0.00 64.86 62.38 1roz h ILE 108 Cb 0.59 2.24 -0.00 0.00 -3.07 0.00 0.00 36.82 36.58 1roz h ILE 108 CO 0.02 0.35 -0.68 0.28 -0.69 0.00 0.00 178.15 177.43 1roz h SER 109 N 0.00 0.61 -3.80 1.72 0.02 -1.25 -3.41 113.55 107.44 1roz h SER 109 Ca -0.02 -0.38 -0.43 0.00 -0.84 0.00 0.00 61.79 60.12 1roz h SER 109 Cb 1.32 -0.18 0.17 0.00 0.14 0.00 0.00 62.40 63.86 1roz h SER 109 CO 0.05 1.12 0.27 -0.94 -1.14 0.00 0.00 176.83 176.19 1roz s SER 110 N -6.98 2.12 0.00 3.07 1.04 -0.55 -4.93 113.70 107.46 1roz s SER 110 Ca -0.07 0.53 0.17 0.00 0.48 0.00 0.00 55.95 57.05 1roz s SER 110 Cb 0.10 -0.73 0.74 0.00 0.10 0.00 0.00 66.02 66.23 1roz s SER 110 CO 0.85 -3.37 1.53 0.61 0.98 0.00 0.00 173.24 173.84 1roz n GLY 111 N -2.24 -1.04 0.01 7.32 0.00 -1.26 -2.46 105.19 105.52 1roz n GLY 111 Ca 0.13 -0.06 0.02 0.00 0.00 0.00 0.00 46.02 46.11 1roz n GLY 111 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1roz n ILE 112 N -1.47 1.71 -0.11 -0.61 2.08 -1.24 -0.80 119.36 118.92 1roz n ILE 112 Ca 0.05 0.45 -0.01 0.00 0.56 0.00 0.00 62.75 63.80 1roz n ILE 112 Cb 0.19 -1.40 0.24 0.00 -0.75 0.00 0.00 39.64 37.92 1roz n ILE 112 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 1roz h ARG 113 N 0.00 0.78 -0.23 0.38 1.12 -1.42 -1.18 114.38 113.82 1roz h ARG 113 Ca 0.00 -0.12 -0.17 0.00 -1.11 0.00 0.00 59.98 58.58 1roz h ARG 113 Cb 0.06 -0.14 -0.00 0.00 -0.01 0.00 0.00 29.97 29.88 1roz h ARG 113 CO 0.00 0.65 -0.53 0.93 -3.11 0.00 0.00 179.97 177.92 1roz h GLU 114 N 0.77 0.68 -0.31 0.20 3.07 -1.24 -1.33 114.58 116.42 1roz h GLU 114 Ca 0.18 -0.42 -0.02 0.00 -0.50 0.00 0.00 59.36 58.61 1roz h GLU 114 Cb 0.18 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.12 1roz h GLU 114 CO -0.01 1.04 0.13 1.15 -1.40 0.00 0.00 179.01 179.91 1roz h THR 115 N 0.53 1.17 -0.49 1.13 2.02 -1.54 -1.54 112.91 114.19 1roz h THR 115 Ca 0.02 -0.51 -0.10 0.00 0.77 0.00 0.00 66.41 66.59 1roz h THR 115 Cb 1.09 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 1roz h THR 115 CO 0.11 0.18 -0.07 0.40 0.37 0.00 0.00 175.52 176.50 1roz h ILE 116 N 0.35 1.27 -1.00 3.11 2.04 -1.21 -2.71 117.51 119.36 1roz h ILE 116 Ca 0.10 -1.19 0.03 0.00 1.00 0.00 0.00 64.86 64.80 1roz h ILE 116 Cb 0.16 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.23 1roz h ILE 116 CO -0.01 0.41 0.66 -0.09 0.00 0.00 0.00 178.15 179.12 1roz h ARG 117 N 0.77 1.27 0.15 2.37 1.12 -1.01 -2.08 114.38 116.96 1roz h ARG 117 Ca 0.13 -0.08 0.01 0.00 -1.11 0.00 0.00 59.98 58.93 1roz h ARG 117 Cb 0.61 -0.29 -0.02 0.00 -0.01 0.00 0.00 29.97 30.27 1roz h ARG 117 CO 0.04 0.84 -0.18 -0.92 -3.11 0.00 0.00 179.97 176.63 1roz h TYR 118 N 1.30 -0.48 -0.99 2.20 3.20 -0.98 0.43 116.97 121.65 1roz h TYR 118 Ca 0.39 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.31 1roz h TYR 118 Cb -0.06 0.19 -0.06 0.00 1.54 0.00 0.00 36.73 38.34 1roz h TYR 118 CO -0.00 -0.27 0.64 -0.07 -1.64 0.00 0.00 178.16 176.81 1roz h LEU 119 N -0.38 1.04 -0.10 2.82 3.38 -1.22 -2.15 115.31 118.71 1roz h LEU 119 Ca 0.01 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.78 1roz h LEU 119 Cb 0.38 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.91 1roz h LEU 119 CO -0.07 0.69 -0.72 0.58 0.09 0.00 0.00 178.44 179.01 1roz h VAL 120 N 1.19 1.32 -0.98 1.22 2.07 -1.10 -0.08 116.25 119.89 1roz h VAL 120 Ca 0.41 -1.98 0.13 0.00 0.82 0.00 0.00 66.70 66.08 1roz h VAL 120 Cb 0.09 2.17 -0.09 0.00 -1.52 0.00 0.00 31.29 31.95 1roz h VAL 120 CO -0.15 0.61 0.60 -0.61 0.02 0.00 0.00 177.57 178.04 1roz h GLN 121 N 0.32 0.89 -0.77 1.57 4.15 0.23 -2.25 115.11 119.25 1roz h GLN 121 Ca -0.06 -0.05 -0.23 0.00 0.77 0.00 0.00 58.65 59.07 1roz h GLN 121 Cb 1.37 -0.20 -0.14 0.00 0.21 0.00 0.00 27.48 28.72 1roz h GLN 121 CO 0.15 0.59 0.29 0.72 -1.93 0.00 0.00 178.83 178.65 1roz n HIS 122 N -4.67 2.53 -4.16 3.99 8.25 -0.84 -4.95 115.22 115.37 1roz n HIS 122 Ca 0.19 -1.22 -0.35 0.00 -0.26 0.00 0.00 57.72 56.08 1roz n HIS 122 Cb 0.40 -0.71 -0.02 0.00 1.12 0.00 0.00 29.99 30.78 1roz n HIS 122 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1roz n ASN 123 N -0.16 -3.48 0.13 0.41 3.02 -0.85 -4.86 115.26 109.47 1roz n ASN 123 Ca 0.42 -0.97 0.12 0.00 -0.03 0.00 0.00 54.58 54.12 1roz n ASN 123 Cb 1.41 -2.99 0.18 0.00 -0.61 0.00 0.00 39.78 37.77 1roz n ASN 123 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 1roz h MET 124 N -1.63 0.00 -5.52 3.52 2.86 -1.26 -3.46 114.93 109.44 1roz h MET 124 Ca -0.59 0.00 -0.46 0.00 -2.06 0.00 0.00 59.70 56.59 1roz h MET 124 Cb 1.38 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.90 1roz h MET 124 CO 0.76 0.00 -0.71 0.14 1.06 0.00 0.00 176.91 178.16 1roz s VAL 125 N -3.21 1.66 -0.07 -2.22 -7.23 -1.26 -4.91 120.40 103.16 1roz s VAL 125 Ca 0.06 -2.17 0.10 0.00 -1.81 0.00 0.00 61.98 58.16 1roz s VAL 125 Cb 0.10 -2.22 -0.15 0.00 0.56 0.00 0.00 36.38 34.67 1roz s VAL 125 CO 0.70 -0.46 0.11 0.47 -0.31 0.00 0.00 175.10 175.61 1roz n ASP 126 N -0.46 2.39 -3.87 4.85 8.00 0.03 -4.94 116.55 122.56 1roz n ASP 126 Ca -0.07 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.30 1roz n ASP 126 Cb 0.62 1.03 -0.15 0.00 -0.02 0.00 0.00 41.12 42.60 1roz n ASP 126 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1roz s VAL 127 N -2.44 0.07 -0.03 2.53 1.01 -0.99 -4.01 120.40 116.54 1roz s VAL 127 Ca -0.05 0.00 0.05 0.00 0.00 0.00 0.00 61.98 61.99 1roz s VAL 127 Cb 0.05 -0.10 -0.03 0.00 0.00 0.00 0.00 36.38 36.30 1roz s VAL 127 CO 0.45 0.04 -0.18 -0.76 0.00 0.00 0.00 175.10 174.65 1roz s LEU 128 N 0.23 2.52 -0.07 3.92 1.43 -0.26 -0.75 118.68 125.69 1roz s LEU 128 Ca -0.02 -0.31 -0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1roz s LEU 128 Cb -0.03 -1.49 0.03 0.00 0.03 0.00 0.00 46.19 44.73 1roz s LEU 128 CO -0.01 0.32 0.01 -0.69 0.23 0.00 0.00 176.35 176.22 1roz s VAL 129 N -0.73 0.33 0.11 -1.59 1.01 -0.32 -0.95 120.40 118.27 1roz s VAL 129 Ca 0.12 0.15 -0.10 0.00 0.00 0.00 0.00 61.98 62.15 1roz s VAL 129 Cb -0.10 -0.50 0.00 0.00 0.00 0.00 0.00 36.38 35.78 1roz s VAL 129 CO 0.01 0.25 0.24 0.28 0.00 0.00 0.00 175.10 175.88 1roz s THR 130 N 1.98 0.12 0.93 3.92 -1.32 -0.96 -1.83 115.64 118.47 1roz s THR 130 Ca 0.05 -1.12 -0.14 0.00 -1.21 0.00 0.00 61.69 59.27 1roz s THR 130 Cb -0.12 -1.41 0.21 0.00 -1.51 0.00 0.00 72.50 69.66 1roz s THR 130 CO -0.05 -0.53 1.26 0.35 -2.21 0.00 0.00 174.62 173.44 1roz n THR 131 N -0.12 0.00 -0.14 5.08 -2.24 -1.26 -4.23 114.28 111.38 1roz n THR 131 Ca -0.14 -1.08 -0.03 0.00 -2.27 0.00 0.00 64.05 60.53 1roz n THR 131 Cb 0.63 -1.40 0.05 0.00 -2.10 0.00 0.00 70.33 67.50 1roz n THR 131 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1roz h ALA 132 N -1.58 0.50 -0.29 6.98 0.00 -1.81 -1.09 119.26 121.97 1roz h ALA 132 Ca -0.41 0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.62 1roz h ALA 132 Cb 1.18 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1roz h ALA 132 CO 0.31 -0.32 0.19 0.78 0.00 0.00 0.00 179.25 180.22 1roz h GLY 133 N 0.22 0.33 2.00 0.00 0.00 -1.91 -0.92 103.07 102.79 1roz h GLY 133 Ca 0.22 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 1roz h GLY 133 CO -0.30 0.11 -0.04 -1.33 0.00 0.00 0.00 176.54 174.98 1roz h GLY 134 N 0.30 0.00 0.00 4.60 0.00 -1.37 -1.91 103.07 104.69 1roz h GLY 134 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1roz h GLY 134 CO -0.02 0.00 -0.56 -0.62 0.00 0.00 0.00 176.54 175.34 1roz n VAL 135 N -3.52 1.23 -0.28 4.60 0.31 -0.40 -4.39 118.33 115.88 1roz n VAL 135 Ca -0.02 0.24 0.01 0.00 -0.01 0.00 0.00 64.34 64.55 1roz n VAL 135 Cb 0.14 -2.26 0.13 0.00 -0.91 0.00 0.00 33.84 30.95 1roz n VAL 135 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1roz h GLU 136 N -0.86 0.82 0.00 5.55 4.11 -1.47 -2.33 114.58 120.41 1roz h GLU 136 Ca 0.00 -0.05 -0.01 0.00 0.07 0.00 0.00 59.36 59.37 1roz h GLU 136 Cb 0.56 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1roz h GLU 136 CO 0.00 0.55 -0.07 0.93 0.07 0.00 0.00 179.01 180.49 1roz h GLU 137 N 0.85 0.00 -0.23 1.06 5.08 -1.59 0.71 114.58 120.45 1roz h GLU 137 Ca 0.36 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.58 1roz h GLU 137 Cb 0.22 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1roz h GLU 137 CO -0.19 0.07 -0.38 0.22 -1.00 0.00 0.00 179.01 177.73 1roz h ASP 138 N 0.00 0.73 -0.10 1.42 3.58 -1.62 -1.68 116.42 118.75 1roz h ASP 138 Ca -0.00 -0.52 -0.02 0.00 0.42 0.00 0.00 57.03 56.90 1roz h ASP 138 Cb 0.33 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.17 1roz h ASP 138 CO 0.01 1.12 -0.02 -0.07 -2.88 0.00 0.00 179.24 177.39 1roz h LEU 139 N 0.38 0.19 -1.34 2.28 3.38 -1.29 -3.13 115.31 115.77 1roz h LEU 139 Ca 0.02 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.65 1roz h LEU 139 Cb 0.97 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.63 1roz h LEU 139 CO 0.09 0.51 0.47 0.40 0.09 0.00 0.00 178.44 180.00 1roz h ILE 140 N -0.14 1.11 0.00 1.22 2.04 -0.92 -1.11 117.51 119.71 1roz h ILE 140 Ca 0.02 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.59 1roz h ILE 140 Cb 0.43 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1roz h ILE 140 CO 0.01 0.16 0.00 0.11 0.00 0.00 0.00 178.15 178.43 1roz h LYS 141 N 0.86 0.00 0.00 2.37 1.57 -1.24 0.24 116.57 120.37 1roz h LYS 141 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1roz h LYS 141 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1roz h LYS 141 CO -0.08 0.00 -0.26 0.00 -0.57 0.00 0.00 179.45 178.54 1roz n LEU 143 N -1.78 2.74 -3.64 0.00 4.77 0.69 -5.05 117.00 114.74 1roz n LEU 143 Ca 0.06 -0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 55.78 1roz n LEU 143 Cb 0.38 -0.65 -0.07 0.00 -2.33 0.00 0.00 43.42 40.74 1roz n LEU 143 CO 0.32 0.82 0.25 0.00 -1.33 0.00 0.00 177.39 177.45 1roz s ALA 144 N -2.42 -1.33 0.69 -1.18 0.00 -0.25 -5.11 121.76 112.16 1roz s ALA 144 Ca -0.27 0.99 -0.09 0.00 0.00 0.00 0.00 51.96 52.58 1roz s ALA 144 Cb 0.07 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.10 1roz s ALA 144 CO 0.51 -0.31 1.05 -1.25 0.00 0.00 0.00 175.76 175.75 1roz s PRO 145 N -0.99 2.62 0.02 0.00 0.04 -1.26 -3.89 135.00 131.54 1roz s PRO 145 Ca -0.10 0.17 0.01 0.00 0.04 0.00 0.00 61.00 61.12 1roz s PRO 145 Cb -0.03 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 1roz s PRO 145 CO 0.06 -1.07 0.04 0.99 0.04 0.00 0.00 177.00 177.06 1roz s THR 146 N -3.28 4.42 0.31 1.26 2.01 -1.26 -4.77 115.64 114.33 1roz s THR 146 Ca 0.58 -0.59 0.10 0.00 0.31 0.00 0.00 61.69 62.09 1roz s THR 146 Cb -0.11 -3.03 -0.05 0.00 0.01 0.00 0.00 72.50 69.32 1roz s THR 146 CO 0.48 0.30 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.36 1roz s TYR 147 N -1.19 2.51 0.30 4.92 2.02 -0.25 -4.94 117.35 120.71 1roz s TYR 147 Ca 0.23 -0.37 -0.18 0.00 -0.37 0.00 0.00 57.07 56.38 1roz s TYR 147 Cb -0.12 -1.30 -0.09 0.00 -0.40 0.00 0.00 41.96 40.05 1roz s TYR 147 CO 0.14 0.57 0.76 -0.51 -1.57 0.00 0.00 175.55 174.95 1roz s LEU 148 N -3.65 4.17 0.00 -1.29 1.43 -1.26 0.22 118.68 118.29 1roz s LEU 148 Ca 0.33 1.40 0.00 0.00 -1.03 0.00 0.00 54.13 54.82 1roz s LEU 148 Cb -0.02 -3.94 0.00 0.00 0.03 0.00 0.00 46.19 42.26 1roz s LEU 148 CO 0.18 -0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.25 1roz n GLY 149 N 0.05 4.84 3.16 -3.19 0.00 0.28 -4.69 105.19 105.63 1roz n GLY 149 Ca 0.02 -0.57 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 1roz n GLY 149 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1roz s GLU 150 N 4.97 0.65 0.24 1.61 2.02 -1.24 -4.77 118.70 122.18 1roz s GLU 150 Ca 0.00 -0.67 -0.01 0.00 0.02 0.00 0.00 54.97 54.31 1roz s GLU 150 Cb 0.00 0.26 0.28 0.00 0.10 0.00 0.00 34.13 34.77 1roz s GLU 150 CO 0.00 -0.18 1.67 0.74 0.02 0.00 0.00 175.26 177.51 1roz h PHE 151 N 3.56 0.73 0.00 1.61 0.04 -1.87 -3.23 116.94 117.77 1roz h PHE 151 Ca -0.32 -0.16 0.00 0.00 2.80 0.00 0.00 57.97 60.29 1roz h PHE 151 Cb 1.19 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 39.16 1roz h PHE 151 CO 0.52 0.83 0.00 -1.13 -0.60 0.00 0.00 178.31 177.93 1roz n SER 152 N -4.11 0.00 -4.70 2.17 3.41 -1.26 -4.87 113.62 104.26 1roz n SER 152 Ca -0.00 -0.11 -0.42 0.00 -0.26 0.00 0.00 58.87 58.08 1roz n SER 152 Cb 0.43 -0.25 -0.03 0.00 -0.26 0.00 0.00 64.21 64.10 1roz n SER 152 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1roz n LEU 153 N -1.25 4.05 -4.73 1.04 4.77 -1.22 -4.92 117.00 114.74 1roz n LEU 153 Ca 0.11 1.01 -0.42 0.00 -0.03 0.00 0.00 56.01 56.68 1roz n LEU 153 Cb 0.16 -1.56 -0.03 0.00 -2.33 0.00 0.00 43.42 39.66 1roz n LEU 153 CO 0.16 0.19 1.00 -0.13 -1.33 0.00 0.00 177.39 177.28 1roz s ARG 154 N 2.30 4.37 0.39 3.23 1.81 -1.26 -4.94 118.95 124.86 1roz s ARG 154 Ca 0.80 2.03 0.06 0.00 -1.72 0.00 0.00 55.73 56.90 1roz s ARG 154 Cb -0.48 -3.22 0.80 0.00 -0.45 0.00 0.00 34.95 31.59 1roz s ARG 154 CO 0.36 -0.31 2.04 0.78 -0.68 0.00 0.00 175.30 177.48 1roz h GLY 155 N 5.95 0.62 0.95 -3.53 0.00 -1.98 -1.94 103.07 103.14 1roz h GLY 155 Ca -0.44 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 46.62 1roz h GLY 155 CO 0.80 0.24 -0.40 1.70 0.00 0.00 0.00 176.54 178.88 1roz h LYS 156 N 0.59 -1.03 -0.41 4.80 3.64 -1.99 0.61 116.57 122.79 1roz h LYS 156 Ca 0.16 0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.63 1roz h LYS 156 Cb -0.03 0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 1roz h LYS 156 CO -0.03 -0.69 0.24 0.93 -2.27 0.00 0.00 179.45 177.63 1roz h GLU 157 N -1.07 0.48 -0.58 1.90 3.07 -1.95 -0.75 114.58 115.67 1roz h GLU 157 Ca -0.10 -0.03 0.04 0.00 -0.50 0.00 0.00 59.36 58.77 1roz h GLU 157 Cb 0.84 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 28.60 1roz h GLU 157 CO 0.15 0.31 0.34 -0.07 -1.40 0.00 0.00 179.01 178.34 1roz h LEU 158 N 0.49 0.52 -0.47 1.33 3.38 -1.30 -1.54 115.31 117.72 1roz h LEU 158 Ca 0.16 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1roz h LEU 158 Cb 0.00 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1roz h LEU 158 CO -0.07 0.36 0.12 -0.09 0.09 0.00 0.00 178.44 178.84 1roz h ARG 159 N 0.65 0.76 0.00 1.13 2.43 -0.51 0.68 114.38 119.53 1roz h ARG 159 Ca 0.25 -0.18 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1roz h ARG 159 Cb 0.09 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1roz h ARG 159 CO -0.13 0.74 -0.01 0.93 -1.51 0.00 0.00 179.97 180.00 1roz h GLU 160 N 0.64 0.00 -0.48 0.20 5.08 -0.69 -0.97 114.58 118.36 1roz h GLU 160 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1roz h GLU 160 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1roz h GLU 160 CO 0.00 0.01 0.00 0.09 -1.00 0.00 0.00 179.01 178.11 1roz n ASN 161 N -3.70 3.58 -1.80 1.42 3.02 -0.62 -4.96 115.26 112.20 1roz n ASN 161 Ca -0.03 -1.99 -0.13 0.00 -0.03 0.00 0.00 54.58 52.40 1roz n ASN 161 Cb 0.09 -0.31 0.02 0.00 -0.61 0.00 0.00 39.78 38.96 1roz n ASN 161 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1roz n GLY 162 N 1.55 -0.01 3.34 7.41 0.00 -0.37 -4.95 105.19 112.16 1roz n GLY 162 Ca 0.21 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 1roz n GLY 162 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1roz s ILE 163 N -2.88 2.34 -0.11 -0.61 -1.09 0.15 -0.96 121.20 118.03 1roz s ILE 163 Ca 0.16 -0.99 -0.01 0.00 -2.23 0.00 0.00 60.65 57.59 1roz s ILE 163 Cb -0.07 -1.85 -0.03 0.00 -1.58 0.00 0.00 42.46 38.93 1roz s ILE 163 CO 0.20 0.58 -0.07 0.20 -1.23 0.00 0.00 174.94 174.62 1roz s ASN 164 N -0.49 4.56 -0.13 3.58 0.01 0.44 -3.91 114.94 119.00 1roz s ASN 164 Ca 0.06 -0.13 -0.09 0.00 -0.71 0.00 0.00 52.86 52.00 1roz s ASN 164 Cb -0.11 -1.47 -0.04 0.00 0.41 0.00 0.00 41.25 40.04 1roz s ASN 164 CO 0.01 0.25 0.17 -0.60 -1.51 0.00 0.00 177.10 175.42 1roz s ARG 165 N -0.16 3.67 -0.38 -0.60 3.52 -1.26 -0.59 118.95 123.15 1roz s ARG 165 Ca 0.02 -0.09 0.01 0.00 -0.13 0.00 0.00 55.73 55.54 1roz s ARG 165 Cb -0.13 -3.25 0.12 0.00 -1.56 0.00 0.00 34.95 30.13 1roz s ARG 165 CO 0.03 0.65 0.17 0.42 -0.81 0.00 0.00 175.30 175.76 1roz s ILE 166 N -0.68 1.13 0.00 4.11 1.01 -0.68 -4.99 121.20 121.10 1roz s ILE 166 Ca 0.14 -2.01 0.00 0.00 0.00 0.00 0.00 60.65 58.78 1roz s ILE 166 Cb -0.12 -1.82 0.00 0.00 0.01 0.00 0.00 42.46 40.53 1roz s ILE 166 CO 0.04 -0.80 0.00 0.61 0.00 0.00 0.00 174.94 174.79 1roz n GLY 167 N 4.14 3.95 1.49 6.18 0.00 -1.26 -0.92 105.19 118.77 1roz n GLY 167 Ca 0.04 0.04 -0.08 0.00 0.00 0.00 0.00 46.02 46.03 1roz n GLY 167 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1roz n ASN 168 N 9.05 3.19 -4.60 1.61 6.94 -1.26 -4.06 115.26 126.13 1roz n ASN 168 Ca 0.00 -3.60 -0.23 0.00 -0.02 0.00 0.00 54.58 50.73 1roz n ASN 168 Cb 0.00 -0.69 -0.08 0.00 -2.36 0.00 0.00 39.78 36.65 1roz n ASN 168 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1roz s LEU 169 N -3.19 3.05 -0.02 -4.53 1.43 -0.10 0.98 118.68 116.30 1roz s LEU 169 Ca 0.49 -0.73 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 1roz s LEU 169 Cb 0.42 -1.57 0.01 0.00 0.03 0.00 0.00 46.19 45.08 1roz s LEU 169 CO 0.05 0.01 -0.04 -0.76 0.23 0.00 0.00 176.35 175.84 1roz s LEU 170 N -3.62 1.57 -0.13 1.79 1.43 0.13 -1.69 118.68 118.16 1roz s LEU 170 Ca 0.31 -0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.32 1roz s LEU 170 Cb -0.06 -0.33 0.02 0.00 0.03 0.00 0.00 46.19 45.85 1roz s LEU 170 CO 0.19 -0.02 -0.12 -0.69 0.23 0.00 0.00 176.35 175.94 1roz s VAL 171 N 0.52 1.38 0.40 -1.59 1.01 0.24 -1.09 120.40 121.26 1roz s VAL 171 Ca -0.06 -0.52 -0.25 0.00 0.00 0.00 0.00 61.98 61.15 1roz s VAL 171 Cb -0.09 -1.32 -0.09 0.00 0.00 0.00 0.00 36.38 34.88 1roz s VAL 171 CO -0.00 0.43 1.18 -2.84 0.00 0.00 0.00 175.10 173.87 1roz s PRO 172 N 1.51 4.07 0.39 2.72 0.02 -1.26 -0.42 135.00 142.03 1roz s PRO 172 Ca 0.04 1.88 0.15 0.00 0.02 0.00 0.00 61.00 63.09 1roz s PRO 172 Cb -0.13 -2.71 1.00 0.00 0.02 0.00 0.00 34.50 32.68 1roz s PRO 172 CO -0.09 -0.32 1.83 -0.91 -0.33 0.00 0.00 177.00 177.18 1roz h ASN 173 N 2.69 0.51 -0.20 2.53 -0.26 -1.42 0.11 115.58 119.54 1roz h ASN 173 Ca -0.49 0.06 0.06 0.00 -0.56 0.00 0.00 56.30 55.37 1roz h ASN 173 Cb 1.23 -0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 38.45 1roz h ASN 173 CO 0.63 0.19 0.25 -0.08 -1.06 0.00 0.00 177.43 177.36 1roz h GLU 174 N 0.50 0.00 -0.70 0.81 4.57 -1.91 -0.54 114.58 117.30 1roz h GLU 174 Ca 0.50 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.64 1roz h GLU 174 Cb 1.12 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.68 1roz h GLU 174 CO -0.23 0.00 0.28 -0.91 -1.18 0.00 0.00 179.01 176.97 1roz h ASN 175 N 0.00 0.98 0.79 1.04 4.21 -1.15 -2.01 115.58 119.44 1roz h ASN 175 Ca 0.09 -0.18 -0.11 0.00 1.21 0.00 0.00 56.30 57.32 1roz h ASN 175 Cb 0.59 -0.25 -0.02 0.00 -1.12 0.00 0.00 38.32 37.52 1roz h ASN 175 CO -0.00 0.89 -0.52 1.88 -1.29 0.00 0.00 177.43 178.39 1roz h TYR 176 N 1.01 0.00 -0.37 1.19 0.05 -1.24 -1.54 116.97 116.07 1roz h TYR 176 Ca 0.23 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.91 1roz h TYR 176 Cb 0.22 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.95 1roz h TYR 176 CO 0.02 0.52 -0.19 0.00 -1.05 0.00 0.00 178.16 177.46 1roz h LYS 178 N 0.57 1.01 -0.12 0.00 1.57 -1.23 -2.15 116.57 116.22 1roz h LYS 178 Ca 0.08 -0.32 0.02 0.00 -1.87 0.00 0.00 60.65 58.56 1roz h LYS 178 Cb 0.74 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.93 1roz h LYS 178 CO 0.06 1.00 -0.02 0.35 -0.57 0.00 0.00 179.45 180.27 1roz h PHE 179 N 0.92 -0.05 -0.40 -1.35 3.57 -1.00 -0.77 116.94 117.86 1roz h PHE 179 Ca 0.16 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.73 1roz h PHE 179 Cb 0.57 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 39.30 1roz h PHE 179 CO 0.04 -0.04 0.11 1.49 -2.23 0.00 0.00 178.31 177.68 1roz h GLU 180 N 0.01 0.25 -0.78 1.11 4.81 -0.60 0.24 114.58 119.62 1roz h GLU 180 Ca 0.06 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1roz h GLU 180 Cb 0.08 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 1roz h GLU 180 CO -0.12 0.16 0.48 -0.44 -0.73 0.00 0.00 179.01 178.37 1roz h ASP 181 N 0.25 0.92 -0.35 1.04 3.32 -1.12 -0.63 116.42 119.85 1roz h ASP 181 Ca 0.19 -0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.10 1roz h ASP 181 Cb 0.20 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1roz h ASP 181 CO -0.22 0.70 -0.11 -0.25 -1.72 0.00 0.00 179.24 177.64 1roz h TRP 182 N 1.06 0.78 -0.10 4.55 7.01 -0.52 -3.36 115.95 125.38 1roz h TRP 182 Ca 0.28 -0.18 -0.17 0.00 2.11 0.00 0.00 58.89 60.93 1roz h TRP 182 Cb -0.06 -0.19 0.01 0.00 -2.10 0.00 0.00 29.16 26.82 1roz h TRP 182 CO -0.01 0.86 -0.61 1.25 -2.79 0.00 0.00 178.44 177.14 1roz h LEU 183 N 0.48 0.71 -0.68 0.65 5.85 -0.19 -3.39 115.31 118.74 1roz h LEU 183 Ca 0.09 -0.66 0.12 0.00 0.84 0.00 0.00 57.88 58.27 1roz h LEU 183 Cb 0.63 -0.21 -0.12 0.00 0.37 0.00 0.00 40.66 41.32 1roz h LEU 183 CO 0.04 1.25 -0.34 0.24 -0.34 0.00 0.00 178.44 179.30 1roz h MET 184 N 0.22 -0.12 0.00 1.25 2.86 -1.26 -0.15 114.93 117.73 1roz h MET 184 Ca -0.05 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1roz h MET 184 Cb 1.26 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.94 1roz h MET 184 CO 0.13 -0.08 -0.06 -1.00 1.06 0.00 0.00 176.91 176.95 1roz h PRO 185 N -0.12 0.00 0.10 -0.22 0.13 -1.78 -1.32 132.00 128.80 1roz h PRO 185 Ca 0.26 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 65.10 1roz h PRO 185 Cb 0.56 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.72 1roz h PRO 185 CO -0.75 0.06 -1.22 0.82 -0.23 0.00 0.00 178.00 176.68 1roz h ILE 186 N 0.00 1.28 -0.54 -3.56 2.04 -1.27 -2.83 117.51 112.63 1roz h ILE 186 Ca -0.00 -2.43 -0.03 0.00 1.00 0.00 0.00 64.86 63.40 1roz h ILE 186 Cb 0.25 2.65 -0.03 0.00 -0.74 0.00 0.00 36.82 38.96 1roz h ILE 186 CO 0.01 0.74 0.21 -0.07 0.00 0.00 0.00 178.15 179.03 1roz h LEU 187 N 0.30 0.71 -0.43 1.44 3.38 -0.46 -0.62 115.31 119.62 1roz h LEU 187 Ca -0.18 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1roz h LEU 187 Cb 1.89 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 42.44 1roz h LEU 187 CO 0.24 0.64 0.22 0.44 0.09 0.00 0.00 178.44 180.07 1roz h ASP 188 N 0.77 0.54 -0.82 -0.43 3.32 -1.24 -1.11 116.42 117.45 1roz h ASP 188 Ca 0.18 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1roz h ASP 188 Cb 0.17 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.54 1roz h ASP 188 CO -0.02 0.49 0.42 1.56 -1.72 0.00 0.00 179.24 179.97 1roz h GLN 189 N 0.55 1.17 -0.40 3.56 4.20 -1.15 -1.97 115.11 121.07 1roz h GLN 189 Ca 0.15 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1roz h GLN 189 Cb 0.08 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.62 1roz h GLN 189 CO -0.02 0.88 0.19 0.52 -0.67 0.00 0.00 178.83 179.73 1roz h MET 190 N 1.17 0.59 -0.52 1.46 2.86 -0.70 0.93 114.93 120.71 1roz h MET 190 Ca 0.29 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.82 1roz h MET 190 Cb 0.08 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 1roz h MET 190 CO -0.04 0.52 0.27 0.28 1.06 0.00 0.00 176.91 178.99 1roz h VAL 191 N 0.51 1.19 -0.33 -2.22 2.07 -0.99 -1.39 116.25 115.09 1roz h VAL 191 Ca 0.14 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1roz h VAL 191 Cb 0.13 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1roz h VAL 191 CO -0.02 0.21 0.21 -0.03 0.02 0.00 0.00 177.57 177.96 1roz h MET 192 N 0.70 0.43 -0.31 1.57 -1.53 -1.06 -1.07 114.93 113.66 1roz h MET 192 Ca 0.18 -0.03 -0.06 0.00 -3.44 0.00 0.00 59.70 56.35 1roz h MET 192 Cb 0.09 -0.10 -0.02 0.00 -0.55 0.00 0.00 31.60 31.03 1roz h MET 192 CO -0.03 0.29 -0.06 0.93 0.14 0.00 0.00 176.91 178.18 1roz h GLU 193 N 0.44 0.49 0.05 0.39 5.08 -0.68 0.19 114.58 120.54 1roz h GLU 193 Ca 0.12 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1roz h GLU 193 Cb -0.04 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.15 1roz h GLU 193 CO -0.03 0.57 -0.02 0.37 -1.00 0.00 0.00 179.01 178.90 1roz h GLN 194 N 0.47 -0.06 0.00 2.33 4.15 -0.76 0.11 115.11 121.35 1roz h GLN 194 Ca 0.09 0.00 -0.15 0.00 0.77 0.00 0.00 58.65 59.37 1roz h GLN 194 Cb 0.41 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.09 1roz h GLN 194 CO 0.02 0.17 -0.70 -0.91 -1.93 0.00 0.00 178.83 175.49 1roz h ASN 195 N -0.30 0.00 0.00 -0.69 2.35 -1.02 -3.10 115.58 112.83 1roz h ASN 195 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1roz h ASN 195 Cb 0.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1roz h ASN 195 CO 0.01 0.70 -0.98 0.35 -1.65 0.00 0.00 177.43 175.85 1roz n THR 196 N -3.46 0.00 -0.04 2.81 -2.24 0.04 -4.66 114.28 106.73 1roz n THR 196 Ca 0.00 -0.24 0.01 0.00 -2.27 0.00 0.00 64.05 61.55 1roz n THR 196 Cb 0.74 0.59 0.04 0.00 -2.10 0.00 0.00 70.33 69.60 1roz n THR 196 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1roz n GLU 197 N -1.55 2.90 -0.98 -0.78 1.02 0.37 -5.00 120.64 116.62 1roz n GLU 197 Ca -0.00 -1.61 0.00 0.00 -0.02 0.00 0.00 57.16 55.53 1roz n GLU 197 Cb 0.19 -1.06 0.00 0.00 -0.02 0.00 0.00 31.44 30.54 1roz n GLU 197 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1roz n GLY 198 N -0.25 0.25 3.72 0.62 0.00 -1.07 -4.93 105.19 103.52 1roz n GLY 198 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1roz n GLY 198 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1roz s VAL 199 N -1.53 2.55 -0.75 1.61 1.01 -1.12 -4.97 120.40 117.21 1roz s VAL 199 Ca 0.00 0.36 -0.05 0.00 0.00 0.00 0.00 61.98 62.30 1roz s VAL 199 Cb 0.00 -3.23 0.19 0.00 0.00 0.00 0.00 36.38 33.34 1roz s VAL 199 CO 0.00 0.03 0.61 -0.54 0.00 0.00 0.00 175.10 175.19 1roz s LYS 200 N 1.31 2.99 0.54 2.72 1.02 -1.26 -4.40 119.74 122.67 1roz s LYS 200 Ca 0.71 -2.74 -0.21 0.00 0.02 0.00 0.00 55.97 53.75 1roz s LYS 200 Cb -0.45 -3.94 -0.06 0.00 -0.52 0.00 0.00 37.83 32.87 1roz s LYS 200 CO 0.32 -1.22 1.17 0.91 -0.92 0.00 0.00 175.35 175.60 1roz n TRP 201 N 3.24 1.61 -4.05 3.18 7.02 -1.26 -4.89 117.44 122.29 1roz n TRP 201 Ca 0.13 0.46 -0.09 0.00 -1.02 0.00 0.00 57.50 56.97 1roz n TRP 201 Cb 0.39 -2.27 -0.09 0.00 -2.42 0.00 0.00 31.31 26.93 1roz n TRP 201 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1roz s THR 202 N -1.36 0.10 0.19 -0.99 -4.23 -1.26 -1.65 115.64 106.43 1roz s THR 202 Ca 0.72 -1.64 -0.12 0.00 -1.18 0.00 0.00 61.69 59.46 1roz s THR 202 Cb -0.44 -1.86 0.10 0.00 1.34 0.00 0.00 72.50 71.64 1roz s THR 202 CO 0.50 -0.47 1.75 -0.65 -0.54 0.00 0.00 174.62 175.21 1roz h PRO 203 N 2.76 0.37 -0.84 3.99 0.11 -1.86 -1.48 132.00 135.06 1roz h PRO 203 Ca -0.34 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.78 1roz h PRO 203 Cb 1.20 -0.08 -0.05 0.00 0.11 0.00 0.00 31.00 32.18 1roz h PRO 203 CO 0.55 0.25 0.54 0.66 -0.21 0.00 0.00 178.00 179.79 1roz h SER 204 N 0.38 0.91 -0.41 -2.05 4.64 -1.89 0.61 113.55 115.74 1roz h SER 204 Ca 0.25 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.46 1roz h SER 204 Cb 0.25 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.12 1roz h SER 204 CO -0.24 0.64 -0.09 0.11 -0.87 0.00 0.00 176.83 176.38 1roz h LYS 205 N 1.07 0.86 -0.34 4.77 1.57 -1.76 -2.07 116.57 120.68 1roz h LYS 205 Ca 0.33 -0.29 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1roz h LYS 205 Cb -0.03 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1roz h LYS 205 CO -0.10 0.92 0.01 1.98 -0.57 0.00 0.00 179.45 181.68 1roz h MET 206 N 0.78 0.60 -0.56 3.15 4.05 -0.63 -1.95 114.93 120.38 1roz h MET 206 Ca 0.13 -0.19 -0.01 0.00 -0.28 0.00 0.00 59.70 59.35 1roz h MET 206 Cb 0.59 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 31.31 1roz h MET 206 CO 0.04 0.71 0.30 0.82 0.23 0.00 0.00 176.91 179.01 1roz h ILE 207 N 0.41 1.17 -0.27 1.77 2.04 -0.70 0.49 117.51 122.43 1roz h ILE 207 Ca 0.10 -0.45 -0.04 0.00 1.00 0.00 0.00 64.86 65.47 1roz h ILE 207 Cb 0.44 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1roz h ILE 207 CO 0.02 0.19 0.02 0.00 0.00 0.00 0.00 178.15 178.38 1roz h ALA 208 N 1.55 0.37 -0.58 1.87 0.00 -1.22 -1.50 119.26 119.75 1roz h ALA 208 Ca 0.20 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1roz h ALA 208 Cb 0.03 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1roz h ALA 208 CO -0.03 0.08 0.34 -0.09 0.00 0.00 0.00 179.25 179.54 1roz h ARG 209 N 0.27 0.80 -0.23 0.00 9.65 -0.66 -1.38 114.38 122.82 1roz h ARG 209 Ca 0.08 -0.08 -0.11 0.00 -1.10 0.00 0.00 59.98 58.77 1roz h ARG 209 Cb 0.38 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.79 1roz h ARG 209 CO 0.01 0.59 -0.31 -0.07 2.80 0.00 0.00 179.97 183.00 1roz h LEU 210 N 0.79 0.48 -0.49 3.80 3.38 -0.83 0.13 115.31 122.57 1roz h LEU 210 Ca 0.21 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1roz h LEU 210 Cb 0.01 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1roz h LEU 210 CO -0.04 0.77 0.03 1.23 0.09 0.00 0.00 178.44 180.52 1roz h GLY 211 N 1.05 0.92 1.15 0.83 0.00 -0.99 -0.05 103.07 105.98 1roz h GLY 211 Ca 0.05 -0.66 -0.08 0.00 0.00 0.00 0.00 47.33 46.65 1roz h GLY 211 CO 0.06 0.61 0.08 1.70 0.00 0.00 0.00 176.54 178.98 1roz h LYS 212 N 0.72 1.03 -0.42 4.80 3.64 -0.94 -2.96 116.57 122.45 1roz h LYS 212 Ca 0.14 -0.28 -0.15 0.00 -1.27 0.00 0.00 60.65 59.10 1roz h LYS 212 Cb 0.48 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1roz h LYS 212 CO 0.02 0.97 -0.31 0.93 -2.27 0.00 0.00 179.45 178.78 1roz h GLU 213 N 0.97 0.96 0.00 1.90 4.39 -0.69 -2.99 114.58 119.11 1roz h GLU 213 Ca 0.19 -0.47 -0.01 0.00 0.34 0.00 0.00 59.36 59.41 1roz h GLU 213 Cb 0.45 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1roz h GLU 213 CO 0.02 1.13 -0.03 0.97 -1.16 0.00 0.00 179.01 179.94 1roz h ILE 214 N 0.79 0.94 -7.06 3.13 6.09 -0.91 -3.46 117.51 117.04 1roz h ILE 214 Ca 0.08 -0.11 -0.62 0.00 -1.37 0.00 0.00 64.86 62.84 1roz h ILE 214 Cb 0.90 1.06 -0.17 0.00 0.47 0.00 0.00 36.82 39.09 1roz h ILE 214 CO 0.08 0.03 -0.98 -3.20 -3.07 0.00 0.00 178.15 171.02 1roz n ASN 215 N -4.38 -0.07 -3.70 2.19 5.15 -1.13 -4.94 115.26 108.38 1roz n ASN 215 Ca -0.03 -1.28 -0.22 0.00 -0.60 0.00 0.00 54.58 52.45 1roz n ASN 215 Cb 0.12 -1.61 -0.18 0.00 -0.53 0.00 0.00 39.78 37.58 1roz n ASN 215 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1roz s ASN 216 N -4.22 1.43 0.09 1.20 3.84 -1.26 -5.02 114.94 111.00 1roz s ASN 216 Ca 0.10 -0.05 0.04 0.00 0.21 0.00 0.00 52.86 53.16 1roz s ASN 216 Cb -0.06 -0.26 0.22 0.00 -0.55 0.00 0.00 41.25 40.60 1roz s ASN 216 CO 0.99 -0.24 0.98 -0.81 -2.79 0.00 0.00 177.10 175.23 1roz n PRO 217 N 5.24 0.03 0.08 0.43 -0.04 -1.26 -0.76 135.00 138.72 1roz n PRO 217 Ca -0.05 0.40 0.12 0.00 -0.04 0.00 0.00 63.50 63.93 1roz n PRO 217 Cb 0.50 -1.78 0.21 0.00 -0.04 0.00 0.00 33.50 32.39 1roz n PRO 217 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1roz h GLU 218 N 0.00 0.00 -6.14 0.54 5.08 -1.99 -3.47 114.58 108.60 1roz h GLU 218 Ca 0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 1roz h GLU 218 Cb 0.39 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 1roz h GLU 218 CO 0.00 0.00 0.16 0.45 -1.00 0.00 0.00 179.01 178.62 1roz s SER 219 N -4.44 7.09 0.13 1.42 0.15 0.06 -4.96 113.70 113.15 1roz s SER 219 Ca 0.07 1.32 -0.20 0.00 0.70 0.00 0.00 55.95 57.84 1roz s SER 219 Cb 0.13 -2.45 -0.04 0.00 -1.71 0.00 0.00 66.02 61.94 1roz s SER 219 CO 0.70 -0.15 1.72 0.58 1.20 0.00 0.00 173.24 177.29 1roz h VAL 220 N 4.75 0.87 0.00 4.45 2.07 -1.88 -2.67 116.25 123.84 1roz h VAL 220 Ca -0.41 -0.02 -0.05 0.00 0.82 0.00 0.00 66.70 67.04 1roz h VAL 220 Cb 1.20 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1roz h VAL 220 CO 0.75 0.01 -0.26 1.88 0.02 0.00 0.00 177.57 179.98 1roz h TYR 221 N 0.06 0.00 -0.04 1.57 0.05 -1.93 0.20 116.97 116.87 1roz h TYR 221 Ca 0.09 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.87 1roz h TYR 221 Cb 0.11 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.85 1roz h TYR 221 CO -0.17 0.26 0.02 -0.92 -1.05 0.00 0.00 178.16 176.29 1roz h TYR 222 N 0.00 0.07 -0.53 4.88 3.20 -1.60 -2.52 116.97 120.47 1roz h TYR 222 Ca -0.00 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.79 1roz h TYR 222 Cb 0.75 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.98 1roz h TYR 222 CO 0.00 0.22 0.06 -1.49 -1.64 0.00 0.00 178.16 175.31 1roz h TRP 223 N -0.11 0.96 -0.17 -3.82 4.06 -1.12 -2.61 115.95 113.14 1roz h TRP 223 Ca 0.01 -0.14 0.05 0.00 2.06 0.00 0.00 58.89 60.87 1roz h TRP 223 Cb 0.19 -0.26 -0.06 0.00 -1.00 0.00 0.00 29.16 28.03 1roz h TRP 223 CO -0.01 0.87 -0.22 0.00 -3.56 0.00 0.00 178.44 175.51 1roz h ALA 224 N 0.97 -0.15 -0.12 1.49 0.00 -0.87 0.07 119.26 120.65 1roz h ALA 224 Ca 0.16 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 1roz h ALA 224 Cb 0.45 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1roz h ALA 224 CO 0.02 -0.67 -0.38 -0.56 0.00 0.00 0.00 179.25 177.66 1roz h GLN 225 N -0.26 0.25 -0.75 0.00 -0.00 -1.47 0.25 115.11 113.12 1roz h GLN 225 Ca 0.11 -0.11 -0.05 0.00 -0.00 0.00 0.00 58.65 58.60 1roz h GLN 225 Cb 0.43 -0.01 -0.03 0.00 -0.00 0.00 0.00 27.48 27.87 1roz h GLN 225 CO -0.32 0.60 0.27 -0.22 -0.00 0.00 0.00 178.83 179.16 1roz h LYS 226 N 0.21 1.14 -0.63 0.06 3.64 -1.00 -2.83 116.57 117.15 1roz h LYS 226 Ca 0.02 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 1roz h LYS 226 Cb 0.77 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1roz h LYS 226 CO 0.06 0.95 0.00 0.09 -2.27 0.00 0.00 179.45 178.28 1roz n ASN 227 N -4.29 3.75 -3.71 4.20 3.02 -0.04 -4.95 115.26 113.22 1roz n ASN 227 Ca 0.06 -2.20 -0.26 0.00 -0.03 0.00 0.00 54.58 52.15 1roz n ASN 227 Cb 0.20 -0.48 0.06 0.00 -0.61 0.00 0.00 39.78 38.95 1roz n ASN 227 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1roz n HIS 228 N 1.12 -2.59 -3.55 3.10 8.25 -0.28 -4.97 115.22 116.30 1roz n HIS 228 Ca 0.21 0.96 -0.41 0.00 -0.26 0.00 0.00 57.72 58.23 1roz n HIS 228 Cb 0.66 -4.62 -0.11 0.00 1.12 0.00 0.00 29.99 27.04 1roz n HIS 228 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1roz s ILE 229 N -3.33 4.89 0.49 1.59 1.01 0.72 -5.02 121.20 121.56 1roz s ILE 229 Ca 0.56 -0.67 -0.21 0.00 0.00 0.00 0.00 60.65 60.32 1roz s ILE 229 Cb -0.26 -3.68 -0.07 0.00 0.01 0.00 0.00 42.46 38.46 1roz s ILE 229 CO 0.77 -0.20 1.14 -2.16 0.00 0.00 0.00 174.94 174.50 1roz s PRO 230 N 1.62 3.60 -0.12 2.79 0.04 -1.26 -4.36 135.00 137.31 1roz s PRO 230 Ca 0.04 1.69 0.02 0.00 0.04 0.00 0.00 61.00 62.79 1roz s PRO 230 Cb -0.19 -2.23 0.01 0.00 0.04 0.00 0.00 34.50 32.13 1roz s PRO 230 CO 0.08 -0.66 -0.17 0.08 0.04 0.00 0.00 177.00 176.37 1roz s VAL 231 N -1.65 1.64 -0.08 -0.36 1.01 -1.26 -1.11 120.40 118.59 1roz s VAL 231 Ca 0.67 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 1roz s VAL 231 Cb -0.26 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 1roz s VAL 231 CO 0.31 0.47 -0.02 -0.36 0.00 0.00 0.00 175.10 175.50 1roz s PHE 232 N 1.01 3.10 -0.48 5.22 0.08 -0.12 -3.59 117.98 123.20 1roz s PHE 232 Ca -0.05 0.14 0.07 0.00 0.12 0.00 0.00 56.93 57.21 1roz s PHE 232 Cb -0.15 -1.77 0.19 0.00 -0.57 0.00 0.00 43.02 40.72 1roz s PHE 232 CO -0.03 0.43 0.71 0.45 -0.10 0.00 0.00 175.22 176.67 1roz s SER 233 N -0.84 -1.45 0.25 1.36 0.15 -1.26 -2.28 113.70 109.63 1roz s SER 233 Ca 0.13 -1.39 -0.03 0.00 0.70 0.00 0.00 55.95 55.35 1roz s SER 233 Cb -0.11 1.89 0.45 0.00 -1.71 0.00 0.00 66.02 66.53 1roz s SER 233 CO 0.02 -0.09 1.78 -0.65 1.20 0.00 0.00 173.24 175.50 1roz h PRO 234 N 5.64 0.63 -2.02 5.44 0.11 -1.97 -2.61 132.00 137.22 1roz h PRO 234 Ca 0.05 -0.04 -0.75 0.00 0.11 0.00 0.00 66.00 65.38 1roz h PRO 234 Cb 1.13 -0.14 -0.26 0.00 0.11 0.00 0.00 31.00 31.84 1roz h PRO 234 CO 0.04 0.42 1.02 0.00 -0.21 0.00 0.00 178.00 179.26 1roz n ALA 235 N -2.41 6.49 0.27 -0.75 0.00 -1.26 -4.73 120.51 118.12 1roz n ALA 235 Ca 0.15 -4.06 0.16 0.00 0.00 0.00 0.00 53.44 49.68 1roz n ALA 235 Cb 0.35 -2.03 0.80 0.00 0.00 0.00 0.00 19.45 18.57 1roz n ALA 235 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1roz h LEU 236 N 3.18 0.00 0.00 0.00 5.85 -1.85 -1.67 115.31 120.82 1roz h LEU 236 Ca 0.55 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.27 1roz h LEU 236 Cb 0.10 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.13 1roz h LEU 236 CO 1.37 0.00 0.00 0.35 -0.34 0.00 0.00 178.44 179.82 1roz n THR 237 N -2.63 0.05 -1.98 1.05 -2.24 -1.26 -4.28 114.28 102.99 1roz n THR 237 Ca -0.01 0.01 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 1roz n THR 237 Cb 0.11 -0.53 -0.01 0.00 -2.10 0.00 0.00 70.33 67.81 1roz n THR 237 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1roz n ASP 238 N -1.37 7.04 0.00 3.42 2.03 -0.63 -3.83 116.55 123.22 1roz n ASP 238 Ca 0.11 -3.03 0.00 0.00 0.52 0.00 0.00 54.79 52.39 1roz n ASP 238 Cb 0.27 -1.44 0.00 0.00 -0.72 0.00 0.00 41.12 39.23 1roz n ASP 238 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1roz n GLY 239 N 2.44 -0.64 0.19 0.27 0.00 -1.26 -4.49 105.19 101.70 1roz n GLY 239 Ca 0.58 -0.64 0.01 0.00 0.00 0.00 0.00 46.02 45.97 1roz n GLY 239 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1roz h SER 240 N 0.00 0.10 0.47 1.61 0.87 -1.91 -1.95 113.55 112.73 1roz h SER 240 Ca 0.00 -0.04 -0.08 0.00 -1.23 0.00 0.00 61.79 60.44 1roz h SER 240 Cb 0.00 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 1roz h SER 240 CO 0.00 0.46 -0.38 0.25 -0.53 0.00 0.00 176.83 176.63 1roz h LEU 241 N 0.09 0.00 -0.04 2.23 5.85 -1.90 -1.25 115.31 120.29 1roz h LEU 241 Ca 0.01 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1roz h LEU 241 Cb 0.69 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.72 1roz h LEU 241 CO 0.05 0.38 -0.03 1.23 -0.34 0.00 0.00 178.44 179.73 1roz h GLY 242 N 1.31 0.10 -0.08 3.75 0.00 -1.48 -1.03 103.07 105.65 1roz h GLY 242 Ca -0.00 -0.10 0.10 0.00 0.00 0.00 0.00 47.33 47.33 1roz h GLY 242 CO 0.05 0.09 -0.18 -0.55 0.00 0.00 0.00 176.54 175.95 1roz h ASP 243 N -0.32 -0.63 -0.61 0.19 3.32 -1.00 0.20 116.42 117.56 1roz h ASP 243 Ca 0.01 0.17 -0.05 0.00 0.02 0.00 0.00 57.03 57.17 1roz h ASP 243 Cb 0.49 0.37 -0.03 0.00 0.22 0.00 0.00 39.33 40.38 1roz h ASP 243 CO 0.01 -0.21 0.17 0.24 -1.72 0.00 0.00 179.24 177.73 1roz h MET 244 N -0.07 0.97 -0.82 3.56 2.86 -1.20 0.23 114.93 120.46 1roz h MET 244 Ca 0.24 -0.22 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 1roz h MET 244 Cb 0.43 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 1roz h MET 244 CO -0.54 0.87 0.38 0.82 1.06 0.00 0.00 176.91 179.50 1roz h ILE 245 N 0.89 1.26 0.88 -1.22 2.04 -0.19 0.11 117.51 121.27 1roz h ILE 245 Ca 0.20 -0.74 -0.04 0.00 1.00 0.00 0.00 64.86 65.27 1roz h ILE 245 Cb 0.32 0.23 0.01 0.00 -0.74 0.00 0.00 36.82 36.63 1roz h ILE 245 CO -0.00 0.32 -0.45 0.15 0.00 0.00 0.00 178.15 178.17 1roz h PHE 246 N 1.17 -1.16 -0.54 1.37 3.57 -0.21 -0.27 116.94 120.87 1roz h PHE 246 Ca 0.28 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.83 1roz h PHE 246 Cb 0.14 0.39 -0.06 0.00 2.79 0.00 0.00 35.95 39.21 1roz h PHE 246 CO 0.02 -0.71 0.21 0.74 -2.23 0.00 0.00 178.31 176.34 1roz h PHE 247 N -1.21 0.38 -0.39 0.41 0.04 -0.88 -1.81 116.94 113.48 1roz h PHE 247 Ca -0.12 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.67 1roz h PHE 247 Cb 0.94 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.98 1roz h PHE 247 CO -0.00 0.13 0.20 1.25 -0.60 0.00 0.00 178.31 179.29 1roz h HIS 248 N 0.41 0.52 0.00 -0.55 2.76 -0.69 -2.46 115.15 115.14 1roz h HIS 248 Ca 0.26 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.42 1roz h HIS 248 Cb 0.27 -0.17 -0.00 0.00 1.55 0.00 0.00 27.41 29.06 1roz h HIS 248 CO -0.15 0.38 -0.03 0.66 -1.30 0.00 0.00 177.93 177.49 1roz h SER 249 N 0.55 0.00 1.20 3.26 4.64 -0.13 0.19 113.55 123.26 1roz h SER 249 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1roz h SER 249 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1roz h SER 249 CO -0.02 0.03 -0.39 1.88 -0.87 0.00 0.00 176.83 177.46 1roz h TYR 250 N 0.00 0.00 0.00 4.77 0.05 -1.47 -1.60 116.97 118.72 1roz h TYR 250 Ca -0.00 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.55 1roz h TYR 250 Cb 0.17 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.87 1roz h TYR 250 CO 0.00 0.00 -2.19 1.63 -1.05 0.00 0.00 178.16 176.55 1roz n LYS 251 N -2.32 0.68 -2.91 4.88 5.02 -0.37 -4.76 118.16 118.38 1roz n LYS 251 Ca 0.04 -0.06 -0.11 0.00 -2.02 0.00 0.00 58.31 56.16 1roz n LYS 251 Cb 0.46 -1.54 -0.01 0.00 -0.02 0.00 0.00 35.03 33.92 1roz n LYS 251 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1roz n ASN 252 N -2.59 -2.44 -4.69 4.39 2.85 0.53 -5.12 115.26 108.18 1roz n ASN 252 Ca -0.22 -2.91 -0.31 0.00 -0.11 0.00 0.00 54.58 51.03 1roz n ASN 252 Cb 0.94 1.15 0.15 0.00 1.24 0.00 0.00 39.78 43.25 1roz n ASN 252 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1roz s PRO 253 N 0.48 1.27 0.00 1.20 0.04 -0.60 -4.42 135.00 132.97 1roz s PRO 253 Ca 0.32 1.55 0.00 0.00 0.04 0.00 0.00 61.00 62.90 1roz s PRO 253 Cb 0.09 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.87 1roz s PRO 253 CO -0.14 -2.45 0.00 0.41 0.04 0.00 0.00 177.00 174.87 1roz n GLY 254 N 0.10 2.25 3.69 0.56 0.00 -1.26 -5.06 105.19 105.47 1roz n GLY 254 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 1roz n GLY 254 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1roz n LEU 255 N 0.00 3.71 -4.30 0.99 7.94 -1.26 -4.98 117.00 119.09 1roz n LEU 255 Ca 0.00 1.02 -0.32 0.00 -1.11 0.00 0.00 56.01 55.59 1roz n LEU 255 Cb 0.00 -1.49 -0.16 0.00 0.53 0.00 0.00 43.42 42.30 1roz n LEU 255 CO 0.00 0.02 -0.52 -0.69 -1.11 0.00 0.00 177.39 175.09 1roz s VAL 256 N 2.32 2.43 -0.28 1.96 1.01 -1.26 -5.09 120.40 121.50 1roz s VAL 256 Ca 0.82 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.93 1roz s VAL 256 Cb -0.57 -1.95 0.07 0.00 0.00 0.00 0.00 36.38 33.94 1roz s VAL 256 CO 0.39 0.56 -0.07 -0.76 0.00 0.00 0.00 175.10 175.22 1roz s LEU 257 N 0.07 3.73 -0.02 3.92 1.43 -1.26 -4.17 118.68 122.38 1roz s LEU 257 Ca -0.09 -1.58 -0.20 0.00 -1.03 0.00 0.00 54.13 51.23 1roz s LEU 257 Cb -0.15 -1.55 -0.05 0.00 0.03 0.00 0.00 46.19 44.47 1roz s LEU 257 CO 0.06 -0.24 0.58 -0.62 0.23 0.00 0.00 176.35 176.36 1roz s ASP 258 N 1.07 6.93 0.00 2.29 2.15 -0.66 -4.93 116.67 123.52 1roz s ASP 258 Ca -0.04 1.11 0.20 0.00 0.43 0.00 0.00 52.55 54.26 1roz s ASP 258 Cb -0.20 -2.35 -0.10 0.00 -0.30 0.00 0.00 42.92 39.96 1roz s ASP 258 CO -0.06 0.08 0.93 2.30 -0.17 0.00 0.00 175.17 178.26 1roz n ILE 259 N 2.88 0.00 -0.03 4.11 -5.35 -1.26 -4.16 119.36 115.55 1roz n ILE 259 Ca -0.07 -0.17 -0.15 0.00 -0.27 0.00 0.00 62.75 62.10 1roz n ILE 259 Cb 0.51 1.13 -0.10 0.00 -1.74 0.00 0.00 39.64 39.44 1roz n ILE 259 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 1roz h VAL 260 N 1.21 1.45 -0.71 7.28 2.07 -1.98 -2.96 116.25 122.62 1roz h VAL 260 Ca 0.00 -1.78 -0.01 0.00 0.82 0.00 0.00 66.70 65.74 1roz h VAL 260 Cb 0.59 2.45 -0.03 0.00 -1.52 0.00 0.00 31.29 32.77 1roz h VAL 260 CO 0.00 0.50 0.41 -0.08 0.02 0.00 0.00 177.57 178.42 1roz h GLU 261 N -0.25 0.96 0.00 1.57 4.57 -1.98 -1.76 114.58 117.69 1roz h GLU 261 Ca -0.02 -0.09 -0.04 0.00 -1.18 0.00 0.00 59.36 58.03 1roz h GLU 261 Cb 0.98 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 29.36 1roz h GLU 261 CO 0.06 0.69 -0.19 -0.44 -1.18 0.00 0.00 179.01 177.95 1roz h ASP 262 N 0.98 0.00 -0.07 1.04 5.19 -1.77 -0.96 116.42 120.83 1roz h ASP 262 Ca 0.25 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.46 1roz h ASP 262 Cb -0.02 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.50 1roz h ASP 262 CO -0.05 0.19 -0.70 0.25 -3.12 0.00 0.00 179.24 175.81 1roz h LEU 263 N 0.00 0.82 -0.23 1.55 5.85 -1.14 -1.96 115.31 120.20 1roz h LEU 263 Ca -0.00 -0.51 -0.01 0.00 0.84 0.00 0.00 57.88 58.19 1roz h LEU 263 Cb 0.45 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1roz h LEU 263 CO 0.02 1.29 0.09 0.03 -0.34 0.00 0.00 178.44 179.53 1roz h ARG 264 N 0.50 0.35 -0.37 1.25 3.08 -1.20 -0.89 114.38 117.09 1roz h ARG 264 Ca -0.03 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 59.97 1roz h ARG 264 Cb 1.31 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.28 1roz h ARG 264 CO 0.14 0.41 0.23 -0.07 -1.07 0.00 0.00 179.97 179.61 1roz h LEU 265 N 0.21 0.39 -0.18 3.04 3.38 -1.16 -1.21 115.31 119.78 1roz h LEU 265 Ca 0.08 -0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.82 1roz h LEU 265 Cb 0.19 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.86 1roz h LEU 265 CO -0.01 0.28 -0.78 -0.29 0.09 0.00 0.00 178.44 177.74 1roz h ILE 266 N 0.47 1.29 -0.49 1.22 2.10 -1.29 -2.89 117.51 117.92 1roz h ILE 266 Ca 0.14 -1.99 -0.04 0.00 1.08 0.00 0.00 64.86 64.05 1roz h ILE 266 Cb -0.02 1.99 -0.02 0.00 -1.09 0.00 0.00 36.82 37.68 1roz h ILE 266 CO -0.05 0.63 0.12 0.78 -1.08 0.00 0.00 178.15 178.55 1roz h ASN 267 N 0.52 0.69 1.35 2.19 2.35 -1.08 -1.97 115.58 119.62 1roz h ASN 267 Ca -0.05 -0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 1roz h ASN 267 Cb 1.40 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 39.59 1roz h ASN 267 CO 0.16 0.68 0.00 0.71 -1.65 0.00 0.00 177.43 177.33 1roz h THR 268 N 0.72 0.00 -0.26 2.81 1.35 -1.22 -1.54 112.91 114.77 1roz h THR 268 Ca 0.16 -0.67 -0.09 0.00 -0.55 0.00 0.00 66.41 65.26 1roz h THR 268 Cb 0.27 1.67 -0.01 0.00 -1.73 0.00 0.00 68.15 68.35 1roz h THR 268 CO -0.00 0.00 -0.23 1.56 -0.25 0.00 0.00 175.52 176.60 1roz h GLN 269 N 0.00 0.48 0.18 4.72 1.08 -1.13 -2.86 115.11 117.59 1roz h GLN 269 Ca 0.00 -0.17 -0.35 0.00 -1.45 0.00 0.00 58.65 56.67 1roz h GLN 269 Cb 0.68 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 28.08 1roz h GLN 269 CO 0.00 0.68 -1.77 0.00 -0.95 0.00 0.00 178.83 176.79 1roz h ALA 270 N 1.33 0.17 -0.36 3.87 0.00 -1.42 -3.34 119.26 119.51 1roz h ALA 270 Ca 0.07 -1.16 0.02 0.00 0.00 0.00 0.00 54.91 53.84 1roz h ALA 270 Cb 0.64 0.47 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1roz h ALA 270 CO 0.05 1.04 0.19 0.82 0.00 0.00 0.00 179.25 181.35 1roz h ILE 271 N 0.11 1.00 -0.33 0.00 2.04 -1.29 -2.85 117.51 116.19 1roz h ILE 271 Ca -0.35 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.37 1roz h ILE 271 Cb 2.10 0.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.75 1roz h ILE 271 CO 0.17 0.07 0.00 0.49 0.00 0.00 0.00 178.15 178.89 1roz n PHE 272 N -4.92 1.20 -3.33 1.37 3.72 -1.08 -4.92 117.46 109.49 1roz n PHE 272 Ca 0.01 -0.42 -0.37 0.00 -0.05 0.00 0.00 57.45 56.62 1roz n PHE 272 Cb 0.08 -0.34 -0.06 0.00 -0.94 0.00 0.00 39.48 38.22 1roz n PHE 272 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1roz s ALA 273 N -2.00 3.58 0.02 4.37 0.00 -1.08 -4.98 121.76 121.67 1roz s ALA 273 Ca 0.31 -0.07 -0.25 0.00 0.00 0.00 0.00 51.96 51.95 1roz s ALA 273 Cb 0.24 -2.56 -0.18 0.00 0.00 0.00 0.00 23.12 20.62 1roz s ALA 273 CO 0.09 0.43 1.40 -0.22 0.00 0.00 0.00 175.76 177.46 1roz h LYS 274 N 3.94 -0.11 -4.18 0.00 3.64 -1.83 -3.46 116.57 114.58 1roz h LYS 274 Ca -0.49 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 58.78 1roz h LYS 274 Cb 1.20 0.02 -0.15 0.00 -0.41 0.00 0.00 32.23 32.89 1roz h LYS 274 CO 0.65 0.20 -0.65 0.00 -2.27 0.00 0.00 179.45 177.37 1roz s THR 276 N -3.73 0.16 0.05 0.00 -4.23 -1.26 -0.15 115.64 106.48 1roz s THR 276 Ca 0.05 -0.45 0.07 0.00 -1.18 0.00 0.00 61.69 60.18 1roz s THR 276 Cb 0.06 -0.21 -0.03 0.00 1.34 0.00 0.00 72.50 73.67 1roz s THR 276 CO -0.09 -0.19 -0.19 -0.83 -0.54 0.00 0.00 174.62 172.78 1roz s GLY 277 N -0.67 1.03 -0.13 3.99 0.00 -0.27 -1.18 107.32 110.09 1roz s GLY 277 Ca -0.06 -1.02 0.03 0.00 0.00 0.00 0.00 44.72 43.67 1roz s GLY 277 CO -0.00 -0.97 -0.22 1.06 0.00 0.00 0.00 173.10 172.96 1roz s MET 278 N -1.29 3.01 -0.25 2.90 -1.94 0.58 -0.95 119.30 121.36 1roz s MET 278 Ca 0.05 -0.85 0.02 0.00 -1.71 0.00 0.00 55.69 53.20 1roz s MET 278 Cb -0.09 -2.41 0.06 0.00 2.01 0.00 0.00 34.83 34.41 1roz s MET 278 CO 0.02 0.01 -0.07 0.42 -0.01 0.00 0.00 175.02 175.39 1roz s ILE 279 N 0.75 1.87 -0.18 2.53 1.01 -0.04 -0.40 121.20 126.75 1roz s ILE 279 Ca -0.09 -1.49 0.01 0.00 0.00 0.00 0.00 60.65 59.09 1roz s ILE 279 Cb -0.16 -2.08 0.03 0.00 0.01 0.00 0.00 42.46 40.26 1roz s ILE 279 CO -0.01 -0.10 -0.16 -0.63 0.00 0.00 0.00 174.94 174.04 1roz s ILE 280 N 1.23 1.86 -0.40 2.92 1.01 -0.56 -0.82 121.20 126.44 1roz s ILE 280 Ca -0.06 -0.91 -0.14 0.00 0.00 0.00 0.00 60.65 59.53 1roz s ILE 280 Cb -0.19 -1.76 0.02 0.00 0.01 0.00 0.00 42.46 40.54 1roz s ILE 280 CO -0.06 0.42 0.28 -0.76 0.00 0.00 0.00 174.94 174.82 1roz s LEU 281 N 1.35 5.02 0.00 2.97 1.43 0.92 -1.18 118.68 129.19 1roz s LEU 281 Ca 0.03 -0.89 0.00 0.00 -1.03 0.00 0.00 54.13 52.24 1roz s LEU 281 Cb -0.14 -2.14 0.00 0.00 0.03 0.00 0.00 46.19 43.94 1roz s LEU 281 CO -0.11 -0.43 0.00 0.61 0.23 0.00 0.00 176.35 176.65 1roz n GLY 282 N 5.13 -3.43 0.00 -3.19 0.00 -0.10 -2.70 105.19 100.90 1roz n GLY 282 Ca -0.11 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1roz n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1roz n GLY 283 N -0.36 5.97 6.37 -0.02 0.00 -1.26 -4.61 105.19 111.28 1roz n GLY 283 Ca 0.00 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.11 1roz n GLY 283 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1roz n GLY 284 N 5.00 -0.88 0.37 -0.02 0.00 -1.26 -4.11 105.19 104.28 1roz n GLY 284 Ca 0.00 -1.27 0.11 0.00 0.00 0.00 0.00 46.02 44.86 1roz n GLY 284 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1roz h VAL 285 N 0.00 0.83 -0.87 1.61 2.07 -1.98 -2.18 116.25 115.73 1roz h VAL 285 Ca 0.00 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 1roz h VAL 285 Cb 0.00 -0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 29.68 1roz h VAL 285 CO 0.00 0.15 0.53 0.58 0.02 0.00 0.00 177.57 178.85 1roz h VAL 286 N 0.81 1.24 0.21 2.57 2.07 -1.91 0.46 116.25 121.71 1roz h VAL 286 Ca 0.50 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1roz h VAL 286 Cb 0.70 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1roz h VAL 286 CO -0.26 0.25 -0.10 0.50 0.02 0.00 0.00 177.57 177.97 1roz h LYS 287 N 1.19 -0.27 -0.36 1.57 3.64 -1.58 -3.18 116.57 117.57 1roz h LYS 287 Ca 0.31 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.65 1roz h LYS 287 Cb -0.06 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1roz h LYS 287 CO -0.06 0.10 -0.03 1.25 -2.27 0.00 0.00 179.45 178.44 1roz h HIS 288 N -0.88 0.62 -0.52 1.91 2.76 -1.41 -1.82 115.15 115.80 1roz h HIS 288 Ca -0.03 -0.08 -0.09 0.00 -2.20 0.00 0.00 60.37 57.98 1roz h HIS 288 Cb 0.51 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 29.27 1roz h HIS 288 CO 0.07 0.62 -0.03 1.25 -1.30 0.00 0.00 177.93 178.53 1roz h HIS 289 N 0.55 0.98 -0.14 5.26 -0.00 -1.02 0.27 115.15 121.05 1roz h HIS 289 Ca 0.11 -0.16 -0.15 0.00 -0.00 0.00 0.00 60.37 60.17 1roz h HIS 289 Cb 0.41 -0.26 0.00 0.00 -0.00 0.00 0.00 27.41 27.56 1roz h HIS 289 CO 0.02 0.90 -0.48 0.82 -0.00 0.00 0.00 177.93 179.18 1roz h ILE 290 N 0.83 1.34 -0.47 6.26 2.04 -1.50 -2.69 117.51 123.33 1roz h ILE 290 Ca 0.15 -1.76 -0.05 0.00 1.00 0.00 0.00 64.86 64.20 1roz h ILE 290 Cb 0.53 2.05 -0.02 0.00 -0.74 0.00 0.00 36.82 38.64 1roz h ILE 290 CO 0.03 0.54 0.11 0.00 0.00 0.00 0.00 178.15 178.82 1roz h ALA 291 N 0.53 0.62 -0.33 1.87 0.00 -1.19 -2.33 119.26 118.43 1roz h ALA 291 Ca -0.02 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 1roz h ALA 291 Cb 1.11 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1roz h ALA 291 CO 0.10 0.32 0.01 -0.97 0.00 0.00 0.00 179.25 178.71 1roz h ASN 292 N 0.64 0.46 -0.21 0.00 -1.24 -0.52 -0.72 115.58 113.98 1roz h ASN 292 Ca 0.15 -0.08 -0.09 0.00 0.71 0.00 0.00 56.30 56.98 1roz h ASN 292 Cb 0.34 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 39.25 1roz h ASN 292 CO 0.00 0.52 -0.17 0.00 -1.29 0.00 0.00 177.43 176.50 1roz h ALA 293 N 1.54 1.06 0.00 1.57 0.00 -1.18 -2.62 119.26 119.63 1roz h ALA 293 Ca 0.11 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 1roz h ALA 293 Cb 0.30 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1roz h ALA 293 CO 0.01 0.57 -0.27 -0.91 0.00 0.00 0.00 179.25 178.65 1roz h ASN 294 N 0.57 0.00 0.16 0.00 2.35 -0.83 -2.85 115.58 114.98 1roz h ASN 294 Ca 0.09 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 1roz h ASN 294 Cb 0.61 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.98 1roz h ASN 294 CO 0.04 0.27 -0.13 0.25 -1.65 0.00 0.00 177.43 176.22 1roz h LEU 295 N 0.00 0.00 -0.16 1.61 5.85 -0.76 0.73 115.31 122.58 1roz h LEU 295 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1roz h LEU 295 Cb 1.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.08 1roz h LEU 295 CO 0.04 0.13 0.00 0.23 -0.34 0.00 0.00 178.44 178.49 1roz n MET 296 N -4.24 0.03 -0.04 1.25 2.81 -1.08 -1.10 117.12 114.76 1roz n MET 296 Ca -0.03 0.33 0.03 0.00 -1.81 0.00 0.00 57.70 56.22 1roz n MET 296 Cb 0.20 -1.57 0.05 0.00 -0.71 0.00 0.00 33.22 31.19 1roz n MET 296 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 1roz n ARG 297 N -1.64 2.63 -1.82 0.03 1.85 -0.63 -4.77 116.66 112.32 1roz n ARG 297 Ca 0.03 -1.80 -0.05 0.00 -1.00 0.00 0.00 57.85 55.03 1roz n ARG 297 Cb 0.15 -1.14 -0.01 0.00 -1.05 0.00 0.00 32.46 30.40 1roz n ARG 297 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1roz n ASN 298 N -0.62 -2.61 0.00 2.89 2.85 -0.26 -4.93 115.26 112.59 1roz n ASN 298 Ca 0.05 0.03 0.00 0.00 -0.11 0.00 0.00 54.58 54.55 1roz n ASN 298 Cb 0.36 -1.57 0.00 0.00 1.24 0.00 0.00 39.78 39.80 1roz n ASN 298 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1roz n GLY 299 N -1.40 3.22 3.86 8.20 0.00 0.16 -4.32 105.19 114.91 1roz n GLY 299 Ca -0.06 -1.73 -0.32 0.00 0.00 0.00 0.00 46.02 43.91 1roz n GLY 299 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1roz s ALA 300 N -1.94 3.27 0.03 4.61 0.00 -0.19 -4.47 121.76 123.08 1roz s ALA 300 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 51.96 51.96 1roz s ALA 300 Cb 0.00 -2.82 -0.26 0.00 0.00 0.00 0.00 23.12 20.03 1roz s ALA 300 CO 0.00 0.10 0.96 -0.44 0.00 0.00 0.00 175.76 176.38 1roz h ASP 301 N 1.65 0.30 -4.34 0.00 3.32 -1.51 -1.87 116.42 113.96 1roz h ASP 301 Ca -0.48 -0.39 -0.32 0.00 0.02 0.00 0.00 57.03 55.87 1roz h ASP 301 Cb 1.18 -0.10 -0.25 0.00 0.22 0.00 0.00 39.33 40.39 1roz h ASP 301 CO 0.64 1.32 -0.75 -0.31 -1.72 0.00 0.00 179.24 178.41 1roz s TYR 302 N -2.64 0.66 -0.15 4.55 1.51 -0.96 -4.52 117.35 115.79 1roz s TYR 302 Ca -0.06 -0.31 -0.07 0.00 -1.01 0.00 0.00 57.07 55.62 1roz s TYR 302 Cb 0.07 -0.40 0.06 0.00 -0.11 0.00 0.00 41.96 41.59 1roz s TYR 302 CO 0.85 -0.04 0.35 0.00 -1.11 0.00 0.00 175.55 175.60 1roz s ALA 303 N -0.77 -0.86 -0.08 3.71 0.00 -1.26 -0.31 121.76 122.18 1roz s ALA 303 Ca -0.03 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1roz s ALA 303 Cb -0.06 -0.96 0.02 0.00 0.00 0.00 0.00 23.12 22.12 1roz s ALA 303 CO 0.00 -0.42 -0.07 0.08 0.00 0.00 0.00 175.76 175.35 1roz s VAL 304 N 1.81 0.89 -0.03 0.00 1.01 0.46 -0.96 120.40 123.59 1roz s VAL 304 Ca -0.06 -0.26 0.07 0.00 0.00 0.00 0.00 61.98 61.73 1roz s VAL 304 Cb -0.10 -0.90 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 1roz s VAL 304 CO -0.11 0.33 -0.23 -0.31 0.00 0.00 0.00 175.10 174.78 1roz s TYR 305 N 1.31 2.42 -0.30 5.22 1.51 0.10 -1.50 117.35 126.12 1roz s TYR 305 Ca -0.03 -0.39 -0.00 0.00 -1.01 0.00 0.00 57.07 55.63 1roz s TYR 305 Cb -0.14 -1.54 0.09 0.00 -0.11 0.00 0.00 41.96 40.27 1roz s TYR 305 CO -0.03 0.00 0.08 0.42 -1.11 0.00 0.00 175.55 174.91 1roz s ILE 306 N -0.61 1.00 0.14 2.71 1.01 -0.32 -0.05 121.20 125.07 1roz s ILE 306 Ca 0.10 -1.38 -0.14 0.00 0.00 0.00 0.00 60.65 59.22 1roz s ILE 306 Cb -0.10 -1.70 0.02 0.00 0.01 0.00 0.00 42.46 40.69 1roz s ILE 306 CO -0.00 -0.59 0.38 0.54 0.00 0.00 0.00 174.94 175.27 1roz s ASN 307 N 1.57 -0.15 0.00 3.58 2.20 -0.98 -0.92 114.94 120.23 1roz s ASN 307 Ca 0.08 -0.48 0.24 0.00 -0.94 0.00 0.00 52.86 51.77 1roz s ASN 307 Cb -0.17 0.47 0.32 0.00 -2.00 0.00 0.00 41.25 39.86 1roz s ASN 307 CO -0.21 -0.89 1.30 0.35 -2.94 0.00 0.00 177.10 174.72 1roz n THR 308 N -0.23 0.00 -2.25 0.54 -2.24 -1.26 -2.97 114.28 105.87 1roz n THR 308 Ca -0.13 -0.29 -0.35 0.00 -2.27 0.00 0.00 64.05 61.00 1roz n THR 308 Cb 0.63 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.92 1roz n THR 308 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1roz s ALA 309 N -2.31 2.72 0.18 6.98 0.00 -1.26 -4.97 121.76 123.09 1roz s ALA 309 Ca 0.24 0.85 0.08 0.00 0.00 0.00 0.00 51.96 53.13 1roz s ALA 309 Cb 0.19 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 1roz s ALA 309 CO 0.47 -0.77 -0.06 -0.65 0.00 0.00 0.00 175.76 174.74 1roz s GLN 310 N -3.22 2.18 0.23 0.00 -1.52 -1.26 -4.65 119.66 111.41 1roz s GLN 310 Ca 0.72 -1.21 0.12 0.00 -1.95 0.00 0.00 55.36 53.04 1roz s GLN 310 Cb -0.25 -2.23 0.06 0.00 -0.22 0.00 0.00 33.01 30.38 1roz s GLN 310 CO 0.28 0.44 1.43 1.05 -0.25 0.00 0.00 175.29 178.25 1roz h GLU 311 N 2.87 0.00 -0.70 2.91 4.11 -1.75 -3.36 114.58 118.65 1roz h GLU 311 Ca -0.47 0.00 0.20 0.00 0.07 0.00 0.00 59.36 59.16 1roz h GLU 311 Cb 1.20 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1roz h GLU 311 CO 0.55 0.69 0.82 0.27 0.07 0.00 0.00 179.01 181.42 1roz h PHE 312 N 0.00 0.00 -0.29 2.06 -0.00 -1.96 0.61 116.94 117.36 1roz h PHE 312 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.96 1roz h PHE 312 Cb 1.45 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.40 1roz h PHE 312 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 178.31 177.91 1roz n ASP 313 N -3.44 2.04 0.00 -0.68 5.68 -1.26 -4.92 116.55 113.97 1roz n ASP 313 Ca 0.15 -1.86 0.00 0.00 -0.50 0.00 0.00 54.79 52.58 1roz n ASP 313 Cb 1.06 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.85 1roz n ASP 313 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1roz n GLY 314 N 1.17 0.38 3.74 6.12 0.00 0.21 -5.00 105.19 111.81 1roz n GLY 314 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1roz n GLY 314 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1roz s SER 315 N -2.20 4.42 0.12 1.61 1.04 -1.26 -4.94 113.70 112.49 1roz s SER 315 Ca 0.00 2.06 -0.05 0.00 0.48 0.00 0.00 55.95 58.44 1roz s SER 315 Cb 0.00 -2.55 -0.13 0.00 0.10 0.00 0.00 66.02 63.43 1roz s SER 315 CO 0.00 -2.10 1.27 -0.78 0.98 0.00 0.00 173.24 172.61 1roz h ASP 316 N -0.63 0.53 -0.32 7.02 3.58 -1.96 -2.81 116.42 121.83 1roz h ASP 316 Ca -0.46 -0.45 0.06 0.00 0.42 0.00 0.00 57.03 56.60 1roz h ASP 316 Cb 1.26 -0.17 -0.05 0.00 1.72 0.00 0.00 39.33 42.09 1roz h ASP 316 CO 0.50 1.27 0.00 0.28 -2.88 0.00 0.00 179.24 178.41 1roz h SER 317 N 0.21 -0.12 -0.05 2.28 0.02 -1.92 -2.66 113.55 111.31 1roz h SER 317 Ca -0.09 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1roz h SER 317 Cb 1.66 0.13 0.00 0.00 0.14 0.00 0.00 62.40 64.32 1roz h SER 317 CO 0.17 -0.03 0.00 0.61 -1.14 0.00 0.00 176.83 176.45 1roz n GLY 318 N -1.24 -0.34 3.74 -3.77 0.00 -1.23 -4.71 105.19 97.65 1roz n GLY 318 Ca 0.01 -0.32 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 1roz n GLY 318 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1roz s ALA 319 N -1.95 3.52 0.75 4.61 0.00 -1.01 -1.94 121.76 125.75 1roz s ALA 319 Ca 0.37 1.10 -0.13 0.00 0.00 0.00 0.00 51.96 53.30 1roz s ALA 319 Cb 0.19 -3.48 0.05 0.00 0.00 0.00 0.00 23.12 19.88 1roz s ALA 319 CO 0.30 -0.53 1.13 1.03 0.00 0.00 0.00 175.76 177.70 1roz s ARG 320 N -0.21 2.17 0.63 0.00 0.52 -1.26 -4.87 118.95 115.94 1roz s ARG 320 Ca 0.56 1.44 0.37 0.00 -0.52 0.00 0.00 55.73 57.58 1roz s ARG 320 Cb -0.36 -1.87 2.11 0.00 0.52 0.00 0.00 34.95 35.35 1roz s ARG 320 CO 0.39 -1.74 2.29 -1.35 0.02 0.00 0.00 175.30 174.90 1roz h PRO 321 N -0.71 0.00 0.00 3.54 0.11 -1.96 -0.69 132.00 132.28 1roz h PRO 321 Ca -0.45 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 1roz h PRO 321 Cb 1.26 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1roz h PRO 321 CO 0.50 0.00 -0.17 0.22 -0.21 0.00 0.00 178.00 178.34 1roz h ASP 322 N 0.00 0.00 -0.45 -2.05 3.58 -1.98 -1.28 116.42 114.24 1roz h ASP 322 Ca 0.01 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.38 1roz h ASP 322 Cb 0.08 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.12 1roz h ASP 322 CO -0.00 0.17 -0.03 -0.08 -2.88 0.00 0.00 179.24 176.41 1roz h GLU 323 N 0.00 0.82 0.00 0.28 4.81 -1.46 -2.82 114.58 116.21 1roz h GLU 323 Ca -0.00 -0.28 -0.01 0.00 -0.13 0.00 0.00 59.36 58.94 1roz h GLU 323 Cb 0.37 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 1roz h GLU 323 CO 0.02 0.89 -0.06 0.00 -0.73 0.00 0.00 179.01 179.13 1roz h ALA 324 N 0.90 1.72 -0.31 2.92 0.00 -1.34 -1.39 119.26 121.75 1roz h ALA 324 Ca 0.12 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1roz h ALA 324 Cb 0.55 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1roz h ALA 324 CO 0.03 0.08 -0.18 0.28 0.00 0.00 0.00 179.25 179.46 1roz h VAL 325 N 0.00 1.25 -0.27 0.00 2.07 -1.18 -1.18 116.25 116.94 1roz h VAL 325 Ca -0.00 -1.17 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 1roz h VAL 325 Cb 0.12 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1roz h VAL 325 CO 0.01 0.38 0.05 0.77 0.02 0.00 0.00 177.57 178.80 1roz h SER 326 N 0.51 0.36 1.41 0.57 4.64 -1.22 -2.37 113.55 117.44 1roz h SER 326 Ca 0.08 -0.04 -0.11 0.00 -0.47 0.00 0.00 61.79 61.26 1roz h SER 326 Cb 0.60 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.58 1roz h SER 326 CO 0.04 0.38 -0.61 -0.50 -0.87 0.00 0.00 176.83 175.28 1roz h TRP 327 N 0.39 0.00 0.00 4.77 4.06 -1.48 -3.48 115.95 120.21 1roz h TRP 327 Ca 0.09 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.04 1roz h TRP 327 Cb 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.34 1roz h TRP 327 CO 0.00 0.48 0.00 0.41 -3.56 0.00 0.00 178.44 175.77 1roz n GLY 328 N 1.24 0.85 0.14 1.49 0.00 -0.85 -4.96 105.19 103.09 1roz n GLY 328 Ca 0.01 -0.17 0.01 0.00 0.00 0.00 0.00 46.02 45.87 1roz n GLY 328 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1roz h LYS 329 N 1.30 0.00 -4.66 1.61 1.57 -1.48 -1.77 116.57 113.13 1roz h LYS 329 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 1roz h LYS 329 Cb 0.00 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 31.97 1roz h LYS 329 CO 0.00 0.58 -0.83 0.42 -0.57 0.00 0.00 179.45 179.05 1roz s ILE 330 N -3.24 1.37 0.54 1.86 1.01 -1.22 -1.02 121.20 120.51 1roz s ILE 330 Ca 0.01 -0.58 -0.21 0.00 0.00 0.00 0.00 60.65 59.87 1roz s ILE 330 Cb 0.10 -1.26 -0.06 0.00 0.01 0.00 0.00 42.46 41.25 1roz s ILE 330 CO 0.74 0.41 1.12 0.54 0.00 0.00 0.00 174.94 177.75 1roz n ARG 331 N 4.13 1.29 0.16 2.79 1.74 -0.70 -4.45 116.66 121.61 1roz n ARG 331 Ca -0.20 0.48 0.06 0.00 -0.77 0.00 0.00 57.85 57.42 1roz n ARG 331 Cb 0.51 -2.29 0.52 0.00 -1.02 0.00 0.00 32.46 30.18 1roz n ARG 331 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1roz h VAL 332 N 1.08 1.08 -0.00 1.55 2.07 -1.89 -2.22 116.25 117.91 1roz h VAL 332 Ca -0.48 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1roz h VAL 332 Cb 1.34 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1roz h VAL 332 CO 0.54 0.09 -0.12 -0.90 0.02 0.00 0.00 177.57 177.21 1roz n ASP 333 N -4.45 0.18 -4.77 0.57 5.75 -1.26 -4.90 116.55 107.67 1roz n ASP 333 Ca -0.01 0.09 -0.31 0.00 -0.01 0.00 0.00 54.79 54.55 1roz n ASP 333 Cb 0.13 -0.25 0.09 0.00 -1.03 0.00 0.00 41.12 40.06 1roz n ASP 333 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1roz s ALA 334 N -2.86 2.18 -0.63 2.12 0.00 -0.84 -5.00 121.76 116.74 1roz s ALA 334 Ca 0.18 0.14 0.06 0.00 0.00 0.00 0.00 51.96 52.34 1roz s ALA 334 Cb 0.19 -3.23 0.23 0.00 0.00 0.00 0.00 23.12 20.31 1roz s ALA 334 CO 0.55 -1.80 0.68 1.04 0.00 0.00 0.00 175.76 176.22 1roz n GLN 335 N -3.53 2.21 -1.37 0.00 6.02 -1.26 -5.00 117.38 114.45 1roz n GLN 335 Ca 0.08 -4.49 -0.35 0.00 -0.01 0.00 0.00 57.00 52.24 1roz n GLN 335 Cb 0.54 -2.16 0.10 0.00 1.02 0.00 0.00 30.24 29.74 1roz n GLN 335 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1roz s PRO 336 N -2.14 2.00 -0.02 -1.09 0.04 -1.26 -4.77 135.00 127.76 1roz s PRO 336 Ca 0.37 1.88 0.02 0.00 0.04 0.00 0.00 61.00 63.30 1roz s PRO 336 Cb 0.12 -1.80 0.01 0.00 0.04 0.00 0.00 34.50 32.86 1roz s PRO 336 CO -0.05 -1.97 -0.05 0.08 0.04 0.00 0.00 177.00 175.05 1roz s VAL 337 N -1.85 0.47 -0.10 -0.36 1.01 -0.13 -5.01 120.40 114.43 1roz s VAL 337 Ca 0.77 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 62.58 1roz s VAL 337 Cb -0.32 -0.43 0.01 0.00 0.00 0.00 0.00 36.38 35.64 1roz s VAL 337 CO 0.46 0.16 -0.16 -0.75 0.00 0.00 0.00 175.10 174.81 1roz s LYS 338 N 0.25 2.25 -0.25 2.72 2.20 -1.26 0.00 119.74 125.66 1roz s LYS 338 Ca -0.03 -0.58 -0.08 0.00 -0.36 0.00 0.00 55.97 54.92 1roz s LYS 338 Cb -0.07 -1.85 -0.03 0.00 -1.51 0.00 0.00 37.83 34.37 1roz s LYS 338 CO -0.00 0.00 0.09 0.08 -0.36 0.00 0.00 175.35 175.16 1roz s VAL 339 N 0.79 4.51 -0.93 4.02 1.01 0.93 -4.91 120.40 125.81 1roz s VAL 339 Ca -0.11 -0.11 -0.20 0.00 0.00 0.00 0.00 61.98 61.56 1roz s VAL 339 Cb -0.16 -3.11 0.10 0.00 0.00 0.00 0.00 36.38 33.22 1roz s VAL 339 CO 0.02 0.34 1.20 -0.31 0.00 0.00 0.00 175.10 176.35 1roz s TYR 340 N 1.48 2.92 -0.03 5.22 1.51 -1.26 -2.32 117.35 124.87 1roz s TYR 340 Ca 0.06 -1.17 -0.30 0.00 -1.01 0.00 0.00 57.07 54.65 1roz s TYR 340 Cb -0.15 -4.40 0.11 0.00 -0.11 0.00 0.00 41.96 37.41 1roz s TYR 340 CO 0.04 -1.63 0.95 0.00 -1.11 0.00 0.00 175.55 173.81 1roz s ALA 341 N 3.43 -1.87 0.01 3.71 0.00 -1.16 -4.96 121.76 120.92 1roz s ALA 341 Ca 0.36 1.09 -0.30 0.00 0.00 0.00 0.00 51.96 53.10 1roz s ALA 341 Cb -0.04 0.33 -0.07 0.00 0.00 0.00 0.00 23.12 23.34 1roz s ALA 341 CO -0.08 -0.69 1.63 0.34 0.00 0.00 0.00 175.76 176.96 1roz s ASP 342 N -2.45 6.66 0.33 0.00 -1.08 -1.26 -3.97 116.67 114.90 1roz s ASP 342 Ca 0.06 2.34 0.26 0.00 -0.52 0.00 0.00 52.55 54.69 1roz s ASP 342 Cb -0.01 -2.55 1.16 0.00 -1.46 0.00 0.00 42.92 40.06 1roz s ASP 342 CO -0.08 -0.88 1.77 0.00 0.52 0.00 0.00 175.17 176.50 1roz h ALA 343 N 8.82 1.00 0.00 3.66 0.00 -1.97 -1.97 119.26 128.80 1roz h ALA 343 Ca -0.41 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 1roz h ALA 343 Cb 1.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1roz h ALA 343 CO 0.94 0.00 -0.30 0.66 0.00 0.00 0.00 179.25 180.55 1roz h SER 344 N 0.00 0.00 0.06 0.00 4.64 -1.99 -1.29 113.55 114.96 1roz h SER 344 Ca 0.00 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.10 1roz h SER 344 Cb 0.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 1roz h SER 344 CO 0.00 0.30 -1.18 -0.07 -0.87 0.00 0.00 176.83 175.02 1roz h LEU 345 N 0.00 0.19 0.20 5.97 3.38 -1.76 -3.43 115.31 119.87 1roz h LEU 345 Ca -0.00 -0.76 -0.32 0.00 0.09 0.00 0.00 57.88 56.89 1roz h LEU 345 Cb 0.53 -0.06 0.03 0.00 0.09 0.00 0.00 40.66 41.26 1roz h LEU 345 CO 0.04 1.49 -1.40 0.58 0.09 0.00 0.00 178.44 179.24 1roz h VAL 346 N -0.64 1.31 -0.85 1.22 2.07 -1.46 -3.38 116.25 114.52 1roz h VAL 346 Ca -0.28 -2.69 0.01 0.00 0.82 0.00 0.00 66.70 64.56 1roz h VAL 346 Cb 1.49 2.95 -0.04 0.00 -1.52 0.00 0.00 31.29 34.17 1roz h VAL 346 CO -0.05 0.81 0.56 0.15 0.02 0.00 0.00 177.57 179.06 1roz h PHE 347 N 0.17 1.07 -0.76 1.57 3.57 -1.50 -1.12 116.94 119.94 1roz h PHE 347 Ca -0.23 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.26 1roz h PHE 347 Cb 2.09 -0.36 -0.03 0.00 2.79 0.00 0.00 35.95 40.43 1roz h PHE 347 CO 0.12 0.67 0.32 -1.35 -2.23 0.00 0.00 178.31 175.83 1roz h PRO 348 N 1.15 1.12 -0.41 6.41 0.11 -1.77 -0.66 132.00 137.94 1roz h PRO 348 Ca 0.31 -0.19 -0.05 0.00 0.11 0.00 0.00 66.00 66.19 1roz h PRO 348 Cb -0.12 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 30.78 1roz h PRO 348 CO -0.07 0.89 0.07 -0.07 -0.21 0.00 0.00 178.00 178.61 1roz h LEU 349 N 1.10 0.64 -0.50 2.35 3.38 -1.65 -1.51 115.31 119.12 1roz h LEU 349 Ca 0.26 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1roz h LEU 349 Cb 0.18 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1roz h LEU 349 CO -0.02 0.73 0.31 0.25 0.09 0.00 0.00 178.44 179.80 1roz h LEU 350 N 0.53 0.58 -1.00 1.67 5.85 -0.87 -2.31 115.31 119.77 1roz h LEU 350 Ca 0.12 -0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 1roz h LEU 350 Cb 0.36 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 1roz h LEU 350 CO 0.01 0.45 0.01 0.58 -0.34 0.00 0.00 178.44 179.14 1roz h VAL 351 N 0.67 1.23 -0.80 1.05 2.07 -1.06 -2.39 116.25 117.01 1roz h VAL 351 Ca 0.18 -0.94 -0.02 0.00 0.82 0.00 0.00 66.70 66.74 1roz h VAL 351 Cb -0.04 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 1roz h VAL 351 CO -0.04 0.33 0.43 0.00 0.02 0.00 0.00 177.57 178.31 1roz h ALA 352 N 1.32 1.03 -0.02 1.67 0.00 -0.80 -0.70 119.26 121.76 1roz h ALA 352 Ca 0.14 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1roz h ALA 352 Cb 0.41 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1roz h ALA 352 CO 0.02 0.56 0.00 0.39 0.00 0.00 0.00 179.25 180.21 1roz n GLU 353 N -4.39 1.53 0.00 0.00 -0.58 -0.91 -3.96 120.64 112.32 1roz n GLU 353 Ca 0.08 -0.77 0.00 0.00 -0.42 0.00 0.00 57.16 56.05 1roz n GLU 353 Cb 0.11 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.50 1roz n GLU 353 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1roz n THR 354 N -0.07 0.00 -0.30 2.62 -2.24 -0.92 -4.83 114.28 108.54 1roz n THR 354 Ca 0.20 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.09 1roz n THR 354 Cb 0.30 0.00 0.28 0.00 -2.10 0.00 0.00 70.33 68.81 1roz n THR 354 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1roz h PHE 355 N 0.00 0.66 0.00 4.78 0.04 -1.76 -0.22 116.94 120.44 1roz h PHE 355 Ca 0.00 0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.79 1roz h PHE 355 Cb 0.00 -0.16 -0.00 0.00 2.20 0.00 0.00 35.95 37.99 1roz h PHE 355 CO 0.00 0.01 -0.08 0.00 -0.60 0.00 0.00 178.31 177.64 1roz h ALA 356 N 1.67 1.04 0.00 2.45 0.00 -1.35 -1.98 119.26 121.09 1roz h ALA 356 Ca 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1roz h ALA 356 Cb 0.94 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1roz h ALA 356 CO -0.49 0.10 0.00 1.96 0.00 0.00 0.00 179.25 180.83 1roz h GLN 357 N 0.00 0.00 -0.29 0.00 1.08 -1.16 -3.21 115.11 111.53 1roz h GLN 357 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1roz h GLN 357 Cb 0.52 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 1roz h GLN 357 CO 0.01 0.00 0.00 1.63 -0.95 0.00 0.00 178.83 179.52 1roz n LYS 358 N -2.36 2.94 -0.32 1.46 4.76 -0.75 -4.71 118.16 119.17 1roz n LYS 358 Ca 0.05 -2.59 0.17 0.00 -2.87 0.00 0.00 58.31 53.07 1roz n LYS 358 Cb 0.40 -1.66 0.34 0.00 -1.84 0.00 0.00 35.03 32.27 1roz n LYS 358 CO 0.00 0.00 0.00 1.98 -1.37 0.00 0.00 177.40 178.01 1roz h MET 359 N 1.91 0.10 0.04 1.97 1.85 -1.54 -1.89 114.93 117.36 1roz h MET 359 Ca 0.00 -0.01 0.01 0.00 -0.61 0.00 0.00 59.70 59.10 1roz h MET 359 Cb 1.22 -0.02 -0.04 0.00 0.43 0.00 0.00 31.60 33.18 1roz h MET 359 CO 0.15 0.06 -0.44 -0.44 -0.40 0.00 0.00 176.91 175.85 1roz h ASP 360 N 0.10 -1.36 -0.93 1.39 3.32 -1.89 -2.47 116.42 114.59 1roz h ASP 360 Ca 0.62 0.15 0.20 0.00 0.02 0.00 0.00 57.03 58.02 1roz h ASP 360 Cb 1.36 0.51 -0.07 0.00 0.22 0.00 0.00 39.33 41.35 1roz h ASP 360 CO -0.77 -0.45 0.60 0.00 -1.72 0.00 0.00 179.24 176.90 1roz h ALA 361 N -0.65 2.09 -0.05 3.45 0.00 -1.73 -0.32 119.26 122.05 1roz h ALA 361 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1roz h ALA 361 Cb 0.61 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1roz h ALA 361 CO -0.28 -0.39 0.02 1.19 0.00 0.00 0.00 179.25 179.79 1roz n PHE 362 N -4.56 0.18 -1.65 0.00 3.72 -0.93 -5.16 117.46 109.06 1roz n PHE 362 Ca 0.20 -0.24 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 1roz n PHE 362 Cb 0.67 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 1roz n PHE 362 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38