#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i50 n ASP 2 N 0.00 3.67 0.00 7.83 8.00 -1.26 -5.04 116.55 129.75 1i50 n ASP 2 Ca 0.00 -2.04 0.00 0.00 0.71 0.00 0.00 54.79 53.46 1i50 n ASP 2 Cb 0.00 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.64 1i50 n ASP 2 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1i50 n GLN 3 N 1.41 0.00 0.00 -1.24 10.64 -1.26 -3.17 117.38 123.76 1i50 n GLN 3 Ca 0.23 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.40 1i50 n GLN 3 Cb 0.59 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.97 1i50 n GLN 3 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1i50 n GLU 4 N 7.03 0.00 0.00 2.61 -0.58 -1.26 -3.59 120.64 124.85 1i50 n GLU 4 Ca 0.00 0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 1i50 n GLU 4 Cb 0.00 -0.73 0.00 0.00 -0.57 0.00 0.00 31.44 30.14 1i50 n GLU 4 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1i50 n ASN 5 N -0.32 0.00 -0.12 1.62 2.85 -1.26 0.45 115.26 118.50 1i50 n ASN 5 Ca 0.00 0.00 -0.06 0.00 -0.11 0.00 0.00 54.58 54.41 1i50 n ASN 5 Cb 0.00 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 40.97 1i50 n ASN 5 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 1i50 h GLU 6 N 0.00 -0.12 0.00 1.20 4.57 -1.60 1.60 114.58 120.23 1i50 h GLU 6 Ca 0.00 0.01 -0.13 0.00 -1.18 0.00 0.00 59.36 58.05 1i50 h GLU 6 Cb 0.00 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 1i50 h GLU 6 CO 0.00 -0.08 -0.64 0.07 -1.18 0.00 0.00 179.01 177.18 1i50 h ARG 7 N -0.12 0.00 0.00 1.92 0.11 -0.18 -2.74 114.38 113.37 1i50 h ARG 7 Ca 0.05 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.12 1i50 h ARG 7 Cb 0.26 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.33 1i50 h ARG 7 CO -0.35 0.64 -0.05 -0.97 0.10 0.00 0.00 179.97 179.35 1i50 h ASN 8 N 0.00 0.00 0.08 0.08 -0.73 -0.36 -0.80 115.58 113.86 1i50 h ASN 8 Ca -0.01 0.00 -0.21 0.00 1.87 0.00 0.00 56.30 57.95 1i50 h ASN 8 Cb 1.27 0.00 0.02 0.00 0.27 0.00 0.00 38.32 39.88 1i50 h ASN 8 CO 0.08 0.05 -0.87 0.40 -0.37 0.00 0.00 177.43 176.72 1i50 h ILE 9 N 0.00 1.41 -0.80 2.57 2.04 0.26 -3.30 117.51 119.69 1i50 h ILE 9 Ca -0.00 -2.34 0.18 0.00 1.00 0.00 0.00 64.86 63.69 1i50 h ILE 9 Cb 0.25 2.83 -0.11 0.00 -0.74 0.00 0.00 36.82 39.04 1i50 h ILE 9 CO 0.01 0.69 0.27 -1.28 0.00 0.00 0.00 178.15 177.83 1i50 h SER 10 N -0.08 0.16 -0.73 1.72 0.87 -1.06 0.18 113.55 114.61 1i50 h SER 10 Ca -0.13 0.14 0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1i50 h SER 10 Cb 1.61 0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 63.69 1i50 h SER 10 CO 0.17 0.00 0.48 0.03 -0.53 0.00 0.00 176.83 176.98 1i50 h ARG 11 N 0.35 0.97 -0.27 2.24 3.08 -1.58 0.13 114.38 119.30 1i50 h ARG 11 Ca 0.46 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 60.35 1i50 h ARG 11 Cb 0.81 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 1i50 h ARG 11 CO -0.50 0.64 -0.28 1.25 -1.07 0.00 0.00 179.97 180.01 1i50 h LEU 12 N 1.00 0.55 -0.62 3.04 5.85 -1.18 -1.34 115.31 122.60 1i50 h LEU 12 Ca 0.27 -0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.72 1i50 h LEU 12 Cb -0.11 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 1i50 h LEU 12 CO -0.06 0.81 0.12 -0.25 -0.34 0.00 0.00 178.44 178.72 1i50 h TRP 13 N 0.47 1.08 -0.13 1.25 7.01 -0.18 0.43 115.95 125.88 1i50 h TRP 13 Ca 0.06 -0.14 -0.04 0.00 2.11 0.00 0.00 58.89 60.88 1i50 h TRP 13 Cb 0.73 -0.30 -0.00 0.00 -2.10 0.00 0.00 29.16 27.49 1i50 h TRP 13 CO 0.03 0.92 -0.07 0.00 -2.79 0.00 0.00 178.44 176.52 1i50 h ARG 14 N 0.93 0.27 -0.56 2.65 3.08 -0.58 -2.03 114.38 118.15 1i50 h ARG 14 Ca 0.19 -0.12 0.02 0.00 0.07 0.00 0.00 59.98 60.13 1i50 h ARG 14 Cb 0.40 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.42 1i50 h ARG 14 CO 0.01 0.62 0.37 0.00 -1.07 0.00 0.00 179.97 179.90 1i50 h ALA 15 N 0.65 1.65 -0.40 0.04 0.00 -1.17 0.73 119.26 120.75 1i50 h ALA 15 Ca 0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1i50 h ALA 15 Cb 0.54 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1i50 h ALA 15 CO 0.02 0.31 0.16 0.35 0.00 0.00 0.00 179.25 180.09 1i50 h PHE 16 N 0.71 0.62 -0.19 0.00 3.57 -0.73 -2.16 116.94 118.76 1i50 h PHE 16 Ca 0.21 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.71 1i50 h PHE 16 Cb -0.02 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 38.48 1i50 h PHE 16 CO -0.00 0.55 -0.15 -0.09 -2.23 0.00 0.00 178.31 176.39 1i50 h ARG 17 N 0.51 -0.15 -0.83 1.11 2.43 -0.18 -2.14 114.38 115.12 1i50 h ARG 17 Ca 0.13 0.01 0.12 0.00 -0.81 0.00 0.00 59.98 59.44 1i50 h ARG 17 Cb 0.20 0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 29.70 1i50 h ARG 17 CO -0.01 -0.10 0.45 1.15 -1.51 0.00 0.00 179.97 179.95 1i50 h THR 18 N -0.16 0.81 -0.09 0.20 2.02 -0.86 -0.14 112.91 114.70 1i50 h THR 18 Ca 0.12 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 66.99 1i50 h THR 18 Cb 0.33 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 1i50 h THR 18 CO -0.29 0.13 -0.22 0.58 0.37 0.00 0.00 175.52 176.09 1i50 h VAL 19 N 0.70 1.21 0.21 3.16 2.07 -0.77 0.48 116.25 123.30 1i50 h VAL 19 Ca 0.43 -0.96 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1i50 h VAL 19 Cb 0.51 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1i50 h VAL 19 CO -0.31 0.29 -0.10 0.11 0.02 0.00 0.00 177.57 177.58 1i50 h LYS 20 N 0.15 -0.27 -0.71 1.57 1.79 -0.60 0.66 116.57 119.16 1i50 h LYS 20 Ca 0.03 0.02 0.06 0.00 -2.18 0.00 0.00 60.65 58.58 1i50 h LYS 20 Cb 0.48 0.06 -0.06 0.00 -1.58 0.00 0.00 32.23 31.14 1i50 h LYS 20 CO 0.03 0.08 0.40 0.93 -1.08 0.00 0.00 179.45 179.81 1i50 h GLU 21 N -0.66 0.71 -0.19 3.15 5.08 -0.64 0.28 114.58 122.29 1i50 h GLU 21 Ca -0.03 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1i50 h GLU 21 Cb 0.47 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1i50 h GLU 21 CO 0.05 0.47 0.03 1.98 -1.00 0.00 0.00 179.01 180.53 1i50 h MET 22 N 0.73 0.32 -0.54 2.33 4.05 -0.02 0.86 114.93 122.66 1i50 h MET 22 Ca 0.32 -0.09 -0.02 0.00 -0.28 0.00 0.00 59.70 59.64 1i50 h MET 22 Cb 0.21 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 30.95 1i50 h MET 22 CO -0.19 0.48 0.27 0.28 0.23 0.00 0.00 176.91 177.98 1i50 h VAL 23 N 0.11 1.18 -0.23 -5.77 2.07 -0.23 -1.58 116.25 111.79 1i50 h VAL 23 Ca 0.06 -0.48 -0.13 0.00 0.82 0.00 0.00 66.70 66.97 1i50 h VAL 23 Cb 0.31 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1i50 h VAL 23 CO 0.00 0.20 -0.42 0.50 0.02 0.00 0.00 177.57 177.87 1i50 h LYS 24 N 0.75 0.55 0.00 1.57 3.64 -0.09 -2.79 116.57 120.20 1i50 h LYS 24 Ca 0.19 -0.28 -0.04 0.00 -1.27 0.00 0.00 60.65 59.25 1i50 h LYS 24 Cb 0.06 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1i50 h LYS 24 CO -0.03 0.87 -0.18 -0.44 -2.27 0.00 0.00 179.45 177.40 1i50 h ASP 25 N 0.45 0.00 1.25 4.20 3.32 0.10 -2.21 116.42 123.53 1i50 h ASP 25 Ca 0.04 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.04 1i50 h ASP 25 Cb 0.92 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.47 1i50 h ASP 25 CO 0.08 0.18 -0.21 0.03 -1.72 0.00 0.00 179.24 177.60 1i50 h ARG 26 N 0.00 0.00 0.00 3.56 3.08 -1.19 -3.47 114.38 116.36 1i50 h ARG 26 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1i50 h ARG 26 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.76 1i50 h ARG 26 CO 0.02 0.21 0.00 0.41 -1.07 0.00 0.00 179.97 179.54 1i50 n GLY 27 N 0.52 1.86 3.73 0.04 0.00 -0.83 -5.09 105.19 105.42 1i50 n GLY 27 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1i50 n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1i50 s TYR 28 N -2.00 3.21 -0.13 1.61 1.51 -1.07 -2.60 117.35 117.88 1i50 s TYR 28 Ca 0.00 0.20 -0.29 0.00 -1.01 0.00 0.00 57.07 55.97 1i50 s TYR 28 Cb 0.00 -1.76 -0.06 0.00 -0.11 0.00 0.00 41.96 40.03 1i50 s TYR 28 CO 0.00 0.51 2.09 0.12 -1.11 0.00 0.00 175.55 177.16 1i50 s PHE 29 N -1.03 1.26 -0.13 2.71 5.36 -0.14 -4.43 117.98 121.59 1i50 s PHE 29 Ca 0.17 0.19 -0.09 0.00 -0.96 0.00 0.00 56.93 56.24 1i50 s PHE 29 Cb -0.12 -4.05 0.04 0.00 -0.34 0.00 0.00 43.02 38.56 1i50 s PHE 29 CO 0.07 -4.54 0.33 0.42 -1.46 0.00 0.00 175.22 170.04 1i50 s ILE 30 N 6.77 -0.02 0.05 3.12 1.01 -1.26 -4.69 121.20 126.18 1i50 s ILE 30 Ca 0.94 0.07 -0.31 0.00 0.00 0.00 0.00 60.65 61.36 1i50 s ILE 30 Cb -0.36 -0.48 -0.06 0.00 0.01 0.00 0.00 42.46 41.58 1i50 s ILE 30 CO 0.37 0.03 1.25 0.42 0.00 0.00 0.00 174.94 177.01 1i50 s THR 31 N 0.86 3.90 0.55 2.92 -4.23 -1.26 -4.86 115.64 113.52 1i50 s THR 31 Ca -0.06 1.34 0.30 0.00 -1.18 0.00 0.00 61.69 62.10 1i50 s THR 31 Cb -0.06 -3.86 0.30 0.00 1.34 0.00 0.00 72.50 70.21 1i50 s THR 31 CO -0.06 0.08 1.91 -0.61 -0.54 0.00 0.00 174.62 175.40 1i50 h GLN 32 N 6.96 0.00 0.13 3.99 5.75 -2.00 0.18 115.11 130.12 1i50 h GLN 32 Ca -0.41 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.09 1i50 h GLN 32 Cb 1.20 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.76 1i50 h GLN 32 CO 0.84 0.00 -0.06 0.93 -2.65 0.00 0.00 178.83 177.88 1i50 h GLU 33 N 0.00 -0.17 -0.75 1.69 5.08 -1.96 -2.59 114.58 115.88 1i50 h GLU 33 Ca 0.00 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1i50 h GLU 33 Cb 0.53 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.78 1i50 h GLU 33 CO 0.00 0.22 0.35 1.49 -1.00 0.00 0.00 179.01 180.06 1i50 h GLU 34 N -0.60 1.08 -0.78 2.33 4.81 -1.06 -2.19 114.58 118.17 1i50 h GLU 34 Ca -0.02 -0.16 0.12 0.00 -0.13 0.00 0.00 59.36 59.18 1i50 h GLU 34 Cb 0.46 -0.19 -0.08 0.00 0.63 0.00 0.00 28.75 29.56 1i50 h GLU 34 CO 0.03 0.84 0.39 0.28 -0.73 0.00 0.00 179.01 179.82 1i50 h VAL 35 N 1.07 0.77 -0.52 0.32 2.07 -1.32 -1.35 116.25 117.29 1i50 h VAL 35 Ca 0.26 -0.21 -0.24 0.00 0.82 0.00 0.00 66.70 67.33 1i50 h VAL 35 Cb 0.13 0.12 -0.14 0.00 -1.52 0.00 0.00 31.29 29.88 1i50 h VAL 35 CO -0.03 0.11 0.30 -0.62 0.02 0.00 0.00 177.57 177.35 1i50 n GLU 36 N -4.88 1.98 -1.56 1.57 1.02 -0.83 -4.80 120.64 113.14 1i50 n GLU 36 Ca 0.14 -1.71 -0.47 0.00 -0.02 0.00 0.00 57.16 55.10 1i50 n GLU 36 Cb 0.36 -1.71 -0.05 0.00 -0.02 0.00 0.00 31.44 30.02 1i50 n GLU 36 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1i50 n LEU 37 N -0.28 2.87 -4.63 -4.62 7.94 -0.51 -4.89 117.00 112.87 1i50 n LEU 37 Ca 0.30 0.47 -0.35 0.00 -1.11 0.00 0.00 56.01 55.33 1i50 n LEU 37 Cb 1.09 -1.40 0.10 0.00 0.53 0.00 0.00 43.42 43.75 1i50 n LEU 37 CO 0.31 -0.55 0.57 -0.81 -1.11 0.00 0.00 177.39 175.80 1i50 n PRO 38 N 8.04 0.35 0.00 1.96 -0.04 -1.26 -4.77 135.00 139.28 1i50 n PRO 38 Ca 0.33 0.18 0.00 0.00 -0.04 0.00 0.00 63.50 63.97 1i50 n PRO 38 Cb 0.33 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.51 1i50 n PRO 38 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1i50 n LEU 39 N -2.18 0.00 -0.51 1.53 7.94 -1.26 -1.58 117.00 120.94 1i50 n LEU 39 Ca 0.13 0.88 0.42 0.00 -1.11 0.00 0.00 56.01 56.32 1i50 n LEU 39 Cb 0.50 -0.38 0.72 0.00 0.53 0.00 0.00 43.42 44.79 1i50 n LEU 39 CO 0.49 -0.38 1.33 -0.08 -1.11 0.00 0.00 177.39 177.64 1i50 h GLU 40 N 0.00 0.05 0.06 1.96 4.57 -2.00 0.97 114.58 120.19 1i50 h GLU 40 Ca 0.00 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1i50 h GLU 40 Cb 0.00 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 1i50 h GLU 40 CO 0.00 0.04 -0.03 -0.44 -1.18 0.00 0.00 179.01 177.40 1i50 h ASP 41 N 0.06 -0.06 -1.04 1.04 3.32 -1.87 -2.86 116.42 115.00 1i50 h ASP 41 Ca 0.82 -0.41 0.29 0.00 0.02 0.00 0.00 57.03 57.75 1i50 h ASP 41 Cb 2.89 0.02 -0.13 0.00 0.22 0.00 0.00 39.33 42.33 1i50 h ASP 41 CO -0.23 0.39 0.63 0.15 -1.72 0.00 0.00 179.24 178.46 1i50 h PHE 42 N -0.54 0.86 -0.57 4.55 3.57 0.20 0.35 116.94 125.37 1i50 h PHE 42 Ca -0.01 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 1i50 h PHE 42 Cb 0.47 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1i50 h PHE 42 CO 0.08 -0.04 0.09 0.87 -2.23 0.00 0.00 178.31 177.08 1i50 h LYS 43 N 0.41 0.94 0.28 1.11 1.57 -1.20 -1.80 116.57 117.88 1i50 h LYS 43 Ca 0.68 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 59.20 1i50 h LYS 43 Cb 1.57 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.77 1i50 h LYS 43 CO -0.48 0.90 -0.13 0.00 -0.57 0.00 0.00 179.45 179.17 1i50 h ALA 44 N 1.00 -0.39 0.00 3.86 0.00 -0.40 0.10 119.26 123.43 1i50 h ALA 44 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1i50 h ALA 44 Cb 0.41 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1i50 h ALA 44 CO 0.01 -0.36 0.08 1.17 0.00 0.00 0.00 179.25 180.15 1i50 n LYS 45 N -4.89 0.00 0.00 0.00 4.81 0.92 -3.56 118.16 115.44 1i50 n LYS 45 Ca -0.05 0.43 0.00 0.00 -0.87 0.00 0.00 58.31 57.82 1i50 n LYS 45 Cb 0.15 -1.59 0.00 0.00 0.02 0.00 0.00 35.03 33.61 1i50 n LYS 45 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1i50 n TYR 46 N -1.45 0.00 -3.14 5.64 4.02 -0.68 -5.03 117.16 116.53 1i50 n TYR 46 Ca -0.00 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.66 1i50 n TYR 46 Cb 0.08 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.40 1i50 n TYR 46 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1i50 s ASP 48 N -4.15 5.77 -0.80 0.00 -4.77 -1.01 -4.85 116.67 106.86 1i50 s ASP 48 Ca 0.45 -0.25 -0.25 0.00 -3.30 0.00 0.00 52.55 49.21 1i50 s ASP 48 Cb -0.10 -0.96 -0.19 0.00 -1.09 0.00 0.00 42.92 40.58 1i50 s ASP 48 CO 0.37 -0.66 1.89 -1.54 0.70 0.00 0.00 175.17 175.94 1i50 n SER 49 N -1.82 2.24 0.00 2.11 3.41 -1.26 -2.21 113.62 116.09 1i50 n SER 49 Ca 0.04 -2.63 0.00 0.00 -0.26 0.00 0.00 58.87 56.03 1i50 n SER 49 Cb 0.59 -1.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.26 1i50 n SER 49 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 1i50 n MET 50 N 7.74 0.00 0.00 4.33 0.00 -1.26 -4.99 117.12 122.94 1i50 n MET 50 Ca 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 58.16 1i50 n MET 50 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.66 1i50 n MET 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1i50 n GLY 51 N -0.00 0.48 3.79 -5.12 0.00 -0.94 -5.09 105.19 98.31 1i50 n GLY 51 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1i50 n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i50 s ARG 52 N -0.70 4.42 0.15 1.61 0.52 -1.26 -4.91 118.95 118.78 1i50 s ARG 52 Ca 0.00 0.99 -0.29 0.00 -0.52 0.00 0.00 55.73 55.91 1i50 s ARG 52 Cb 0.00 -3.26 -0.07 0.00 0.52 0.00 0.00 34.95 32.14 1i50 s ARG 52 CO 0.00 0.59 0.90 -1.25 0.02 0.00 0.00 175.30 175.56 1i50 s PRO 53 N -1.08 4.70 -0.82 3.54 0.04 -1.26 -2.41 135.00 137.72 1i50 s PRO 53 Ca 0.33 1.37 -0.10 0.00 0.04 0.00 0.00 61.00 62.64 1i50 s PRO 53 Cb -0.22 -3.33 0.21 0.00 0.04 0.00 0.00 34.50 31.21 1i50 s PRO 53 CO 0.23 0.38 0.73 -0.65 0.04 0.00 0.00 177.00 177.73 1i50 s GLN 54 N -0.57 3.41 0.28 4.56 -1.52 -1.23 -4.94 119.66 119.65 1i50 s GLN 54 Ca 0.42 -2.64 0.02 0.00 -1.95 0.00 0.00 55.36 51.21 1i50 s GLN 54 Cb -0.24 -4.24 0.67 0.00 -0.22 0.00 0.00 33.01 28.97 1i50 s GLN 54 CO 0.29 -1.25 1.70 0.00 -0.25 0.00 0.00 175.29 175.77 1i50 h ARG 55 N 7.33 0.38 -1.13 2.91 3.08 -1.90 -1.09 114.38 123.96 1i50 h ARG 55 Ca 0.09 -0.02 0.36 0.00 0.07 0.00 0.00 59.98 60.48 1i50 h ARG 55 Cb 0.98 -0.09 -0.13 0.00 0.08 0.00 0.00 29.97 30.81 1i50 h ARG 55 CO 0.78 0.25 0.69 0.87 -1.07 0.00 0.00 179.97 181.49 1i50 h LYS 56 N 0.39 0.21 0.00 0.04 1.79 -1.92 0.92 116.57 118.00 1i50 h LYS 56 Ca 0.53 -0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.96 1i50 h LYS 56 Cb 0.97 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.57 1i50 h LYS 56 CO -0.52 0.14 -0.09 0.52 -1.08 0.00 0.00 179.45 178.42 1i50 h MET 57 N 0.22 0.00 -0.05 3.15 2.86 -1.52 -3.28 114.93 116.30 1i50 h MET 57 Ca 0.76 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 58.22 1i50 h MET 57 Cb 2.04 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.69 1i50 h MET 57 CO -0.50 0.09 -0.73 0.52 1.06 0.00 0.00 176.91 177.36 1i50 h MET 58 N 0.00 0.29 -5.19 1.72 2.86 -0.93 -3.47 114.93 110.22 1i50 h MET 58 Ca -0.00 -0.24 -0.48 0.00 -2.06 0.00 0.00 59.70 56.91 1i50 h MET 58 Cb 0.69 0.05 0.20 0.00 0.06 0.00 0.00 31.60 32.60 1i50 h MET 58 CO 0.01 0.89 -1.48 0.43 1.06 0.00 0.00 176.91 177.82 1i50 n SER 59 N -3.80 -4.80 -3.62 1.22 7.64 -1.24 -4.95 113.62 104.07 1i50 n SER 59 Ca -0.03 0.24 -0.02 0.00 1.01 0.00 0.00 58.87 60.07 1i50 n SER 59 Cb 0.70 -0.67 -0.01 0.00 -1.01 0.00 0.00 64.21 63.22 1i50 n SER 59 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1i50 s PHE 60 N -1.73 -0.11 0.16 1.43 -0.12 -0.93 -5.00 117.98 111.69 1i50 s PHE 60 Ca 0.38 -0.01 0.05 0.00 -0.05 0.00 0.00 56.93 57.30 1i50 s PHE 60 Cb -0.21 0.55 -0.04 0.00 -0.63 0.00 0.00 43.02 42.69 1i50 s PHE 60 CO 0.69 -0.37 0.11 -1.14 -0.05 0.00 0.00 175.22 174.46 1i50 s GLN 61 N -2.63 2.82 -0.03 1.99 0.74 -1.26 -0.82 119.66 120.47 1i50 s GLN 61 Ca 0.11 -0.90 -0.02 0.00 0.05 0.00 0.00 55.36 54.60 1i50 s GLN 61 Cb 0.02 -2.60 0.01 0.00 1.10 0.00 0.00 33.01 31.54 1i50 s GLN 61 CO -0.04 0.48 0.08 0.00 -0.55 0.00 0.00 175.29 175.26 1i50 s ALA 62 N -1.74 -0.16 0.02 1.58 0.00 -0.88 -4.97 121.76 115.60 1i50 s ALA 62 Ca 0.30 0.29 0.06 0.00 0.00 0.00 0.00 51.96 52.61 1i50 s ALA 62 Cb -0.10 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 1i50 s ALA 62 CO 0.23 -0.06 -0.16 -0.80 0.00 0.00 0.00 175.76 174.97 1i50 s ASN 63 N 0.33 3.95 0.78 0.00 0.01 -1.26 -0.72 114.94 118.02 1i50 s ASN 63 Ca -0.02 -0.35 -0.15 0.00 -0.71 0.00 0.00 52.86 51.63 1i50 s ASN 63 Cb -0.04 -0.72 0.03 0.00 0.41 0.00 0.00 41.25 40.94 1i50 s ASN 63 CO -0.01 0.27 0.95 -2.65 -1.51 0.00 0.00 177.10 174.16 1i50 n PRO 64 N 1.68 0.29 -3.47 -0.60 -0.02 -1.26 -0.97 135.00 130.65 1i50 n PRO 64 Ca -0.16 0.16 -0.25 0.00 -2.02 0.00 0.00 63.50 61.23 1i50 n PRO 64 Cb 0.52 -2.22 -0.02 0.00 -0.02 0.00 0.00 33.50 31.76 1i50 n PRO 64 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1i50 s THR 65 N -2.00 5.12 0.23 3.45 -4.23 -1.07 -4.53 115.64 112.62 1i50 s THR 65 Ca 0.71 -0.39 -0.07 0.00 -1.18 0.00 0.00 61.69 60.76 1i50 s THR 65 Cb -0.31 -3.81 0.18 0.00 1.34 0.00 0.00 72.50 69.89 1i50 s THR 65 CO 0.53 -0.43 1.76 -0.33 -0.54 0.00 0.00 174.62 175.61 1i50 h GLU 66 N 1.19 0.52 -0.82 3.99 5.08 -1.94 0.35 114.58 122.94 1i50 h GLU 66 Ca -0.49 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 57.88 1i50 h GLU 66 Cb 1.21 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 30.29 1i50 h GLU 66 CO 0.63 0.34 0.52 1.49 -1.00 0.00 0.00 179.01 181.00 1i50 h GLU 67 N 0.53 0.97 -0.24 2.33 4.81 -1.96 -2.40 114.58 118.63 1i50 h GLU 67 Ca 0.36 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 59.42 1i50 h GLU 67 Cb 0.44 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1i50 h GLU 67 CO -0.31 0.64 -0.32 0.77 -0.73 0.00 0.00 179.01 179.07 1i50 h SER 68 N 1.00 0.50 1.29 1.04 0.02 -1.28 -3.06 113.55 113.06 1i50 h SER 68 Ca 0.34 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1i50 h SER 68 Cb 0.05 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.45 1i50 h SER 68 CO -0.13 0.79 -0.04 0.40 -1.14 0.00 0.00 176.83 176.72 1i50 h ILE 69 N 0.42 0.08 0.00 3.27 2.04 -0.63 -1.54 117.51 121.14 1i50 h ILE 69 Ca 0.05 -0.75 -0.03 0.00 1.00 0.00 0.00 64.86 65.13 1i50 h ILE 69 Cb 0.76 1.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.53 1i50 h ILE 69 CO 0.06 0.04 -0.15 0.77 0.00 0.00 0.00 178.15 178.86 1i50 h SER 70 N 0.00 0.00 0.00 1.72 4.64 -1.38 -3.20 113.55 115.33 1i50 h SER 70 Ca -0.00 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.07 1i50 h SER 70 Cb 0.69 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.74 1i50 h SER 70 CO 0.00 0.15 -1.88 0.29 -0.87 0.00 0.00 176.83 174.53 1i50 n LYS 71 N -3.75 0.36 -3.78 4.77 5.02 -1.16 -4.86 118.16 114.77 1i50 n LYS 71 Ca -0.02 0.12 -0.34 0.00 -2.02 0.00 0.00 58.31 56.05 1i50 n LYS 71 Cb 0.26 -1.19 -0.10 0.00 -0.02 0.00 0.00 35.03 33.98 1i50 n LYS 71 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1i50 s PHE 72 N -2.30 3.41 0.08 2.13 0.40 -0.59 -4.93 117.98 116.18 1i50 s PHE 72 Ca -0.21 -2.91 -0.19 0.00 -0.60 0.00 0.00 56.93 53.02 1i50 s PHE 72 Cb 0.07 -3.08 -0.09 0.00 0.51 0.00 0.00 43.02 40.43 1i50 s PHE 72 CO 0.32 -0.78 1.52 -1.35 0.70 0.00 0.00 175.22 175.62 1i50 h PRO 73 N 6.67 0.41 -0.25 0.24 0.11 -1.80 -3.20 132.00 134.19 1i50 h PRO 73 Ca 0.00 -0.13 0.00 0.00 0.11 0.00 0.00 66.00 65.98 1i50 h PRO 73 Cb 0.91 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1i50 h PRO 73 CO 0.72 0.59 0.00 -0.25 -0.21 0.00 0.00 178.00 178.85 1i50 n ASP 74 N -4.65 0.25 -4.56 -2.05 8.00 -1.26 -4.73 116.55 107.55 1i50 n ASP 74 Ca -0.04 -1.42 -0.41 0.00 0.71 0.00 0.00 54.79 53.63 1i50 n ASP 74 Cb 0.24 -0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.19 1i50 n ASP 74 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1i50 s MET 75 N -1.65 3.28 0.00 -1.24 1.75 -1.21 -5.00 119.30 115.24 1i50 s MET 75 Ca 0.00 -0.12 0.00 0.00 -1.25 0.00 0.00 55.69 54.32 1i50 s MET 75 Cb 0.00 -4.13 0.00 0.00 2.84 0.00 0.00 34.83 33.54 1i50 s MET 75 CO 0.00 -2.00 0.00 0.41 -0.65 0.00 0.00 175.02 172.78 1i50 n GLY 76 N 5.28 -1.36 3.74 2.11 0.00 -1.26 -4.73 105.19 108.98 1i50 n GLY 76 Ca 0.04 -1.19 -0.26 0.00 0.00 0.00 0.00 46.02 44.62 1i50 n GLY 76 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i50 s SER 77 N -1.55 4.35 0.39 1.61 1.04 -1.26 -4.26 113.70 114.01 1i50 s SER 77 Ca 0.00 -1.17 0.08 0.00 0.48 0.00 0.00 55.95 55.33 1i50 s SER 77 Cb 0.00 -0.33 -0.04 0.00 0.10 0.00 0.00 66.02 65.75 1i50 s SER 77 CO 0.00 -0.60 0.21 -0.76 0.98 0.00 0.00 173.24 173.07 1i50 s LEU 78 N -3.91 3.22 -0.24 2.42 1.43 0.10 -2.99 118.68 118.71 1i50 s LEU 78 Ca 0.37 -0.91 -0.03 0.00 -1.03 0.00 0.00 54.13 52.54 1i50 s LEU 78 Cb 0.04 -1.67 0.11 0.00 0.03 0.00 0.00 46.19 44.71 1i50 s LEU 78 CO 0.20 -0.48 0.26 0.86 0.23 0.00 0.00 176.35 177.41 1i50 s TRP 79 N -2.52 -0.36 0.32 0.29 -0.11 -0.99 -2.08 118.94 113.51 1i50 s TRP 79 Ca 0.41 0.09 -0.09 0.00 1.22 0.00 0.00 56.10 57.74 1i50 s TRP 79 Cb 0.00 -0.39 -0.06 0.00 -1.50 0.00 0.00 33.47 31.52 1i50 s TRP 79 CO 0.24 -0.73 0.65 0.08 -4.62 0.00 0.00 176.95 172.56 1i50 s VAL 80 N 2.35 4.89 -0.19 5.86 1.01 -0.00 -1.47 120.40 132.86 1i50 s VAL 80 Ca 0.08 0.40 -0.12 0.00 0.00 0.00 0.00 61.98 62.35 1i50 s VAL 80 Cb -0.15 -3.70 0.06 0.00 0.00 0.00 0.00 36.38 32.58 1i50 s VAL 80 CO -0.21 -0.34 0.46 -0.70 0.00 0.00 0.00 175.10 174.31 1i50 s GLU 81 N -3.49 0.47 0.01 2.72 2.56 -0.64 -2.18 118.70 118.15 1i50 s GLU 81 Ca 0.48 0.82 0.06 0.00 0.00 0.00 0.00 54.97 56.33 1i50 s GLU 81 Cb -0.11 0.06 -0.03 0.00 2.00 0.00 0.00 34.13 36.05 1i50 s GLU 81 CO 0.28 -0.14 -0.17 -0.06 -0.56 0.00 0.00 175.26 174.61 1i50 s PHE 82 N 1.20 2.60 -0.07 5.30 0.40 -1.26 -0.79 117.98 125.36 1i50 s PHE 82 Ca -0.08 -0.23 0.04 0.00 -0.60 0.00 0.00 56.93 56.06 1i50 s PHE 82 Cb -0.07 -1.52 0.00 0.00 0.51 0.00 0.00 43.02 41.94 1i50 s PHE 82 CO -0.11 0.22 -0.19 0.00 0.70 0.00 0.00 175.22 175.84 1i50 h ASP 84 N 6.59 0.00 -3.39 0.00 3.45 -1.95 -3.41 116.42 117.71 1i50 h ASP 84 Ca -0.27 0.00 -0.57 0.00 0.43 0.00 0.00 57.03 56.62 1i50 h ASP 84 Cb 1.20 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 39.92 1i50 h ASP 84 CO 0.47 0.01 1.03 -1.61 -1.57 0.00 0.00 179.24 177.58 1i50 s GLU 85 N -4.45 3.62 0.19 3.56 2.02 -1.26 -4.90 118.70 117.48 1i50 s GLU 85 Ca -0.05 0.84 -0.14 0.00 0.02 0.00 0.00 54.97 55.64 1i50 s GLU 85 Cb 0.14 -3.99 0.18 0.00 0.10 0.00 0.00 34.13 30.55 1i50 s GLU 85 CO 0.52 -1.52 1.67 -1.35 0.02 0.00 0.00 175.26 174.60 1i50 h PRO 86 N 10.30 0.05 -4.76 0.39 0.11 -1.94 -3.35 132.00 132.81 1i50 h PRO 86 Ca -0.26 -0.00 -0.68 0.00 0.11 0.00 0.00 66.00 65.16 1i50 h PRO 86 Cb 1.09 -0.01 -0.28 0.00 0.11 0.00 0.00 31.00 31.91 1i50 h PRO 86 CO 1.10 0.04 -0.63 0.45 -0.21 0.00 0.00 178.00 178.75 1i50 s SER 87 N -5.23 5.12 -0.09 -2.05 0.15 -1.26 -2.25 113.70 108.09 1i50 s SER 87 Ca -0.14 -0.90 -0.22 0.00 0.70 0.00 0.00 55.95 55.39 1i50 s SER 87 Cb 0.16 -1.85 -0.04 0.00 -1.71 0.00 0.00 66.02 62.58 1i50 s SER 87 CO 0.72 -0.24 0.66 -0.69 1.20 0.00 0.00 173.24 174.89 1i50 s VAL 88 N 1.44 5.07 0.50 4.45 1.01 -1.08 -4.96 120.40 126.83 1i50 s VAL 88 Ca 0.01 1.35 0.07 0.00 0.00 0.00 0.00 61.98 63.40 1i50 s VAL 88 Cb -0.18 -4.00 0.02 0.00 0.00 0.00 0.00 36.38 32.23 1i50 s VAL 88 CO 0.02 0.25 0.47 -0.83 0.00 0.00 0.00 175.10 175.01 1i50 s GLY 89 N 0.80 2.15 0.17 4.51 0.00 -1.26 -1.00 107.32 112.68 1i50 s GLY 89 Ca 0.35 -1.69 -0.18 0.00 0.00 0.00 0.00 44.72 43.20 1i50 s GLY 89 CO 0.16 -1.79 1.65 -0.24 0.00 0.00 0.00 173.10 172.89 1i50 h VAL 90 N 0.75 0.50 -0.96 1.40 3.04 -1.91 -0.18 116.25 118.89 1i50 h VAL 90 Ca -0.37 0.00 0.17 0.00 -1.01 0.00 0.00 66.70 65.49 1i50 h VAL 90 Cb 1.28 0.50 -0.09 0.00 -2.01 0.00 0.00 31.29 30.98 1i50 h VAL 90 CO 0.54 0.00 0.61 0.11 -1.01 0.00 0.00 177.57 177.81 1i50 h LYS 91 N -0.07 0.70 -0.20 4.17 1.57 -2.00 -0.37 116.57 120.38 1i50 h LYS 91 Ca 0.20 -0.04 -0.17 0.00 -1.87 0.00 0.00 60.65 58.76 1i50 h LYS 91 Cb 0.37 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1i50 h LYS 91 CO -0.45 0.47 -0.54 1.15 -0.57 0.00 0.00 179.45 179.51 1i50 h THR 92 N 0.73 1.31 -0.25 -0.16 2.02 -1.48 -3.19 112.91 111.88 1i50 h THR 92 Ca 0.51 -1.76 -0.10 0.00 0.77 0.00 0.00 66.41 65.83 1i50 h THR 92 Cb 0.83 1.88 -0.00 0.00 -1.74 0.00 0.00 68.15 69.12 1i50 h THR 92 CO -0.28 0.55 -0.23 -0.03 0.37 0.00 0.00 175.52 175.91 1i50 h MET 93 N 0.42 0.60 -0.87 6.66 1.85 -0.43 -3.10 114.93 120.05 1i50 h MET 93 Ca -0.01 -0.31 0.16 0.00 -0.61 0.00 0.00 59.70 58.94 1i50 h MET 93 Cb 1.15 0.01 -0.10 0.00 0.43 0.00 0.00 31.60 33.09 1i50 h MET 93 CO 0.12 0.90 0.45 0.87 -0.40 0.00 0.00 176.91 178.84 1i50 h LYS 94 N 0.31 0.58 -0.72 0.39 1.57 -1.18 0.80 116.57 118.32 1i50 h LYS 94 Ca 0.04 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1i50 h LYS 94 Cb 0.78 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.92 1i50 h LYS 94 CO 0.06 0.38 0.47 1.15 -0.57 0.00 0.00 179.45 180.94 1i50 h THR 95 N 0.59 1.09 0.03 -0.16 2.02 -1.52 -0.02 112.91 114.94 1i50 h THR 95 Ca 0.49 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 67.38 1i50 h THR 95 Cb 0.76 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1i50 h THR 95 CO -0.40 0.15 -0.02 0.15 0.37 0.00 0.00 175.52 175.78 1i50 h PHE 96 N 0.84 -0.04 0.00 3.16 3.57 -0.40 -2.03 116.94 122.04 1i50 h PHE 96 Ca 0.29 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.79 1i50 h PHE 96 Cb 0.10 0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.86 1i50 h PHE 96 CO -0.00 0.50 0.24 0.28 -2.23 0.00 0.00 178.31 177.10 1i50 h VAL 97 N -0.97 0.00 0.09 1.41 2.07 0.55 0.87 116.25 120.28 1i50 h VAL 97 Ca -0.00 0.00 -0.35 0.00 0.82 0.00 0.00 66.70 67.17 1i50 h VAL 97 Cb 0.56 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1i50 h VAL 97 CO 0.01 0.00 -1.94 -0.38 0.02 0.00 0.00 177.57 175.28 1i50 n ILE 98 N -2.78 1.72 0.10 4.57 5.41 -0.04 -3.39 119.36 124.96 1i50 n ILE 98 Ca -0.02 -0.55 -0.12 0.00 1.00 0.00 0.00 62.75 63.06 1i50 n ILE 98 Cb 0.29 -1.76 -0.06 0.00 -0.71 0.00 0.00 39.64 37.40 1i50 n ILE 98 CO 0.00 0.00 0.00 -0.74 0.00 0.00 0.00 176.55 175.81 1i50 h HIS 99 N -0.12 -0.37 -0.26 1.39 2.76 -0.10 0.63 115.15 119.07 1i50 h HIS 99 Ca -0.43 0.00 0.03 0.00 -2.20 0.00 0.00 60.37 57.78 1i50 h HIS 99 Cb 1.90 0.15 -0.03 0.00 1.55 0.00 0.00 27.41 30.98 1i50 h HIS 99 CO 0.07 -0.22 0.06 0.82 -1.30 0.00 0.00 177.93 177.37 1i50 h ILE 100 N -0.30 0.89 0.67 6.26 2.04 -1.47 -2.02 117.51 123.59 1i50 h ILE 100 Ca 0.01 -0.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 1i50 h ILE 100 Cb 0.30 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1i50 h ILE 100 CO -0.06 0.03 -0.35 -0.61 0.00 0.00 0.00 178.15 177.16 1i50 h GLN 101 N 0.17 -0.91 -0.32 2.37 4.15 -1.49 -2.37 115.11 116.72 1i50 h GLN 101 Ca 0.12 0.06 0.04 0.00 0.77 0.00 0.00 58.65 59.65 1i50 h GLN 101 Cb 0.11 0.21 -0.08 0.00 0.21 0.00 0.00 27.48 27.93 1i50 h GLN 101 CO -0.15 -0.60 -0.55 0.93 -1.93 0.00 0.00 178.83 176.52 1i50 h GLU 102 N -0.94 -0.44 -0.28 1.69 5.08 0.43 -1.23 114.58 118.88 1i50 h GLU 102 Ca -0.09 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1i50 h GLU 102 Cb 0.74 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1i50 h GLU 102 CO 0.13 -0.30 0.00 1.63 -1.00 0.00 0.00 179.01 179.48 1i50 n LYS 103 N -5.40 0.80 -3.31 2.33 4.76 -0.78 -4.91 118.16 111.66 1i50 n LYS 103 Ca -0.04 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.11 1i50 n LYS 103 Cb 0.35 -1.14 0.03 0.00 -1.84 0.00 0.00 35.03 32.43 1i50 n LYS 103 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1i50 n ASN 104 N -0.29 -6.28 -4.25 4.39 4.05 -0.47 -5.00 115.26 107.42 1i50 n ASN 104 Ca 0.00 0.02 -0.33 0.00 0.45 0.00 0.00 54.58 54.72 1i50 n ASN 104 Cb 0.07 -2.89 -0.16 0.00 1.23 0.00 0.00 39.78 38.04 1i50 n ASN 104 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 1i50 s PHE 105 N -1.92 2.75 0.25 1.20 2.99 -0.92 -4.88 117.98 117.45 1i50 s PHE 105 Ca 0.32 -1.07 0.30 0.00 0.00 0.00 0.00 56.93 56.48 1i50 s PHE 105 Cb -0.05 -1.86 1.33 0.00 0.00 0.00 0.00 43.02 42.44 1i50 s PHE 105 CO 0.84 -0.48 1.99 0.37 -0.00 0.00 0.00 175.22 177.94 1i50 h GLN 106 N 7.23 0.00 -3.44 0.44 4.15 -1.89 -3.44 115.11 118.15 1i50 h GLN 106 Ca -0.31 0.00 -0.19 0.00 0.77 0.00 0.00 58.65 58.92 1i50 h GLN 106 Cb 1.19 0.00 -0.26 0.00 0.21 0.00 0.00 27.48 28.63 1i50 h GLN 106 CO 0.56 0.11 -0.56 0.99 -1.93 0.00 0.00 178.83 178.00 1i50 s THR 107 N -3.85 0.01 -0.08 2.39 2.01 -1.16 -2.42 115.64 112.54 1i50 s THR 107 Ca -0.01 -0.10 -0.01 0.00 0.31 0.00 0.00 61.69 61.88 1i50 s THR 107 Cb 0.11 -0.22 0.03 0.00 0.01 0.00 0.00 72.50 72.42 1i50 s THR 107 CO 0.57 -0.06 -0.04 -0.83 -0.69 0.00 0.00 174.62 173.58 1i50 s GLY 108 N -0.14 0.61 -0.22 4.40 0.00 -1.07 -2.35 107.32 108.55 1i50 s GLY 108 Ca -0.02 -0.28 -0.07 0.00 0.00 0.00 0.00 44.72 44.35 1i50 s GLY 108 CO 0.00 0.89 0.07 -0.42 0.00 0.00 0.00 173.10 173.65 1i50 s ILE 109 N 1.69 4.56 -0.37 0.90 1.01 -0.54 -0.75 121.20 127.71 1i50 s ILE 109 Ca 0.02 -0.10 -0.05 0.00 0.00 0.00 0.00 60.65 60.52 1i50 s ILE 109 Cb -0.13 -3.10 0.07 0.00 0.01 0.00 0.00 42.46 39.31 1i50 s ILE 109 CO -0.05 0.38 0.14 0.12 0.00 0.00 0.00 174.94 175.53 1i50 s PHE 110 N 1.09 3.37 -0.17 3.97 5.36 0.11 -1.61 117.98 130.09 1i50 s PHE 110 Ca 0.04 -1.84 -0.18 0.00 -0.96 0.00 0.00 56.93 53.99 1i50 s PHE 110 Cb -0.14 -2.65 -0.04 0.00 -0.34 0.00 0.00 43.02 39.85 1i50 s PHE 110 CO 0.03 -0.84 0.48 0.08 -1.46 0.00 0.00 175.22 173.51 1i50 s VAL 111 N 1.30 5.15 0.36 3.12 1.01 0.03 -1.36 120.40 130.01 1i50 s VAL 111 Ca 0.01 0.90 0.09 0.00 0.00 0.00 0.00 61.98 62.98 1i50 s VAL 111 Cb -0.21 -3.81 -0.07 0.00 0.00 0.00 0.00 36.38 32.29 1i50 s VAL 111 CO -0.00 0.24 -0.06 -0.72 0.00 0.00 0.00 175.10 174.55 1i50 s TYR 112 N 1.25 2.40 -0.01 5.22 -0.85 -0.12 -3.46 117.35 121.77 1i50 s TYR 112 Ca 0.24 -0.56 -0.00 0.00 -0.52 0.00 0.00 57.07 56.22 1i50 s TYR 112 Cb -0.15 -1.48 -0.00 0.00 0.38 0.00 0.00 41.96 40.71 1i50 s TYR 112 CO 0.09 0.52 -0.01 1.96 -1.52 0.00 0.00 175.55 176.60 1i50 h GLN 113 N 1.97 0.00 0.00 -3.49 4.20 -1.80 -0.09 115.11 115.89 1i50 h GLN 113 Ca -0.42 0.00 -0.39 0.00 0.06 0.00 0.00 58.65 57.90 1i50 h GLN 113 Cb 1.25 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.96 1i50 h GLN 113 CO 0.73 0.00 -2.45 0.27 -0.67 0.00 0.00 178.83 176.71 1i50 n ASN 114 N -2.39 2.02 0.00 1.46 0.23 -0.96 -4.40 115.26 111.22 1i50 n ASN 114 Ca -0.00 -0.08 0.00 0.00 -0.53 0.00 0.00 54.58 53.97 1i50 n ASN 114 Cb 0.01 -0.45 0.00 0.00 -2.08 0.00 0.00 39.78 37.26 1i50 n ASN 114 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1i50 n ASN 115 N -3.37 0.00 -4.62 0.53 6.94 -1.22 -5.07 115.26 108.45 1i50 n ASN 115 Ca -0.46 0.00 -0.24 0.00 -0.02 0.00 0.00 54.58 53.86 1i50 n ASN 115 Cb 0.96 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 38.30 1i50 n ASN 115 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1i50 s ILE 116 N -2.00 2.79 -0.01 1.53 1.01 -1.26 -2.62 121.20 120.64 1i50 s ILE 116 Ca 0.00 -1.99 -0.30 0.00 0.00 0.00 0.00 60.65 58.36 1i50 s ILE 116 Cb 0.00 -2.76 -0.03 0.00 0.01 0.00 0.00 42.46 39.68 1i50 s ILE 116 CO 0.00 -0.25 0.98 -0.89 0.00 0.00 0.00 174.94 174.77 1i50 s THR 117 N -2.48 4.87 0.58 2.92 2.01 -0.17 -4.90 115.64 118.48 1i50 s THR 117 Ca 0.34 2.05 0.31 0.00 0.31 0.00 0.00 61.69 64.69 1i50 s THR 117 Cb -0.02 -4.32 0.43 0.00 0.01 0.00 0.00 72.50 68.60 1i50 s THR 117 CO 0.19 0.15 1.71 -0.65 -0.69 0.00 0.00 174.62 175.34 1i50 h PRO 118 N 6.81 0.00 0.60 4.92 0.11 -1.99 0.50 132.00 142.95 1i50 h PRO 118 Ca -0.41 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.68 1i50 h PRO 118 Cb 1.22 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.33 1i50 h PRO 118 CO 0.75 0.00 -0.29 0.77 -0.21 0.00 0.00 178.00 179.03 1i50 h SER 119 N 0.00 -0.68 -0.35 -2.05 0.02 -1.96 -3.08 113.55 105.46 1i50 h SER 119 Ca 0.38 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 1i50 h SER 119 Cb 1.93 0.18 -0.02 0.00 0.14 0.00 0.00 62.40 64.63 1i50 h SER 119 CO -0.00 -0.28 0.22 0.00 -1.14 0.00 0.00 176.83 175.63 1i50 h ALA 120 N -1.17 1.73 -0.93 3.77 0.00 -0.81 -2.14 119.26 119.71 1i50 h ALA 120 Ca -0.08 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.91 1i50 h ALA 120 Cb 0.63 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.20 1i50 h ALA 120 CO 0.13 0.24 0.60 0.52 0.00 0.00 0.00 179.25 180.74 1i50 h MET 121 N 0.48 0.87 0.00 0.00 2.86 -0.19 0.47 114.93 119.42 1i50 h MET 121 Ca 0.13 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1i50 h MET 121 Cb -0.04 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.42 1i50 h MET 121 CO -0.03 0.57 0.00 1.63 1.06 0.00 0.00 176.91 180.15 1i50 n LYS 122 N -4.56 0.79 0.10 1.72 5.02 -0.80 -2.35 118.16 118.07 1i50 n LYS 122 Ca 0.17 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.58 1i50 n LYS 122 Cb 0.35 -1.45 0.14 0.00 -0.02 0.00 0.00 35.03 34.05 1i50 n LYS 122 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1i50 h LEU 123 N 0.00 0.00 0.00 -0.35 6.46 -0.10 -3.40 115.31 117.92 1i50 h LEU 123 Ca 0.00 -0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.66 1i50 h LEU 123 Cb 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.93 1i50 h LEU 123 CO 0.00 0.05 0.00 0.52 -0.62 0.00 0.00 178.44 178.39 1i50 n VAL 124 N -2.42 0.00 -1.99 1.05 0.31 -0.99 -4.10 118.33 110.18 1i50 n VAL 124 Ca 0.03 1.33 -0.36 0.00 -0.01 0.00 0.00 64.34 65.32 1i50 n VAL 124 Cb 0.48 -2.24 -0.03 0.00 -0.91 0.00 0.00 33.84 31.14 1i50 n VAL 124 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1i50 s PRO 125 N -2.32 2.55 0.00 5.55 0.04 -1.26 -4.42 135.00 135.14 1i50 s PRO 125 Ca 0.00 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.61 1i50 s PRO 125 Cb 0.00 -4.49 0.00 0.00 0.04 0.00 0.00 34.50 30.05 1i50 s PRO 125 CO 0.00 -2.89 0.29 -1.13 0.04 0.00 0.00 177.00 173.31 1i50 n SER 126 N 13.28 0.00 -2.82 6.66 3.41 -1.26 -5.02 113.62 127.86 1i50 n SER 126 Ca 0.25 -0.77 -0.11 0.00 -0.26 0.00 0.00 58.87 57.98 1i50 n SER 126 Cb 0.52 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.53 1i50 n SER 126 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1i50 n ILE 127 N 0.00 0.08 -1.63 -1.33 -5.35 -1.26 -5.14 119.36 104.73 1i50 n ILE 127 Ca 0.00 -2.39 -0.42 0.00 -0.27 0.00 0.00 62.75 59.68 1i50 n ILE 127 Cb 0.38 0.89 0.01 0.00 -1.74 0.00 0.00 39.64 39.18 1i50 n ILE 127 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1i50 n PRO 128 N 0.07 1.49 0.08 6.28 -0.04 -1.26 -2.66 135.00 138.97 1i50 n PRO 128 Ca 0.09 0.53 -0.01 0.00 -0.04 0.00 0.00 63.50 64.07 1i50 n PRO 128 Cb 0.74 -2.10 -0.04 0.00 -0.04 0.00 0.00 33.50 32.05 1i50 n PRO 128 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1i50 h PRO 129 N 1.73 0.00 -3.95 0.54 0.13 -1.99 -3.50 132.00 124.95 1i50 h PRO 129 Ca -0.45 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.12 1i50 h PRO 129 Cb 1.33 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.46 1i50 h PRO 129 CO 0.58 0.54 0.56 0.00 -0.23 0.00 0.00 178.00 179.45 1i50 n ALA 130 N -2.32 -0.64 -2.90 -0.56 0.00 -1.09 -4.89 120.51 108.12 1i50 n ALA 130 Ca -0.03 0.28 -0.22 0.00 0.00 0.00 0.00 53.44 53.47 1i50 n ALA 130 Cb 0.83 -1.29 -0.02 0.00 0.00 0.00 0.00 19.45 18.97 1i50 n ALA 130 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1i50 s THR 131 N 2.46 5.23 -0.03 0.00 -4.23 -1.02 -4.56 115.64 113.49 1i50 s THR 131 Ca 0.72 -0.87 0.03 0.00 -1.18 0.00 0.00 61.69 60.39 1i50 s THR 131 Cb -0.99 -3.86 -0.00 0.00 1.34 0.00 0.00 72.50 68.99 1i50 s THR 131 CO 0.51 -0.38 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.47 1i50 s ILE 132 N -2.05 1.01 0.14 2.99 1.01 -1.26 -2.60 121.20 120.45 1i50 s ILE 132 Ca 0.35 -0.50 0.11 0.00 0.00 0.00 0.00 60.65 60.61 1i50 s ILE 132 Cb -0.09 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 1i50 s ILE 132 CO 0.30 0.30 -0.26 -1.61 0.00 0.00 0.00 174.94 173.68 1i50 s GLU 133 N 0.05 1.40 0.01 2.79 2.02 0.07 -4.95 118.70 120.10 1i50 s GLU 133 Ca -0.02 -1.37 0.05 0.00 0.02 0.00 0.00 54.97 53.65 1i50 s GLU 133 Cb -0.09 -1.85 -0.02 0.00 0.10 0.00 0.00 34.13 32.28 1i50 s GLU 133 CO 0.01 0.43 -0.14 0.95 0.02 0.00 0.00 175.26 176.53 1i50 s THR 134 N -1.18 1.13 -0.02 3.63 -4.23 -1.26 0.06 115.64 113.77 1i50 s THR 134 Ca 0.15 -0.77 0.01 0.00 -1.18 0.00 0.00 61.69 59.89 1i50 s THR 134 Cb -0.10 -0.98 0.01 0.00 1.34 0.00 0.00 72.50 72.78 1i50 s THR 134 CO 0.07 0.19 -0.03 -0.36 -0.54 0.00 0.00 174.62 173.95 1i50 s PHE 135 N -0.54 0.40 -0.26 3.99 0.40 -0.46 -4.93 117.98 116.57 1i50 s PHE 135 Ca 0.04 -0.06 -0.22 0.00 -0.60 0.00 0.00 56.93 56.09 1i50 s PHE 135 Cb -0.06 -0.34 -0.01 0.00 0.51 0.00 0.00 43.02 43.12 1i50 s PHE 135 CO 0.00 -0.06 0.71 1.21 0.70 0.00 0.00 175.22 177.78 1i50 s ASN 136 N 0.35 6.67 0.12 1.36 3.84 -1.26 -0.95 114.94 125.06 1i50 s ASN 136 Ca -0.04 0.80 -0.04 0.00 0.21 0.00 0.00 52.86 53.79 1i50 s ASN 136 Cb -0.07 -2.38 0.18 0.00 -0.55 0.00 0.00 41.25 38.44 1i50 s ASN 136 CO -0.01 -0.45 0.68 -0.62 -2.79 0.00 0.00 177.10 173.91 1i50 n GLU 137 N 5.87 -0.05 -0.25 0.43 1.02 -0.05 0.45 120.64 128.07 1i50 n GLU 137 Ca 0.02 0.68 0.05 0.00 -0.02 0.00 0.00 57.16 57.89 1i50 n GLU 137 Cb 0.48 -1.01 0.18 0.00 -0.02 0.00 0.00 31.44 31.07 1i50 n GLU 137 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1i50 h ALA 138 N 0.82 0.98 0.00 0.62 0.00 -1.85 0.47 119.26 120.31 1i50 h ALA 138 Ca 0.20 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1i50 h ALA 138 Cb 0.31 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1i50 h ALA 138 CO -0.45 -0.29 0.00 0.00 0.00 0.00 0.00 179.25 178.52 1i50 n ALA 139 N -2.59 2.05 -0.03 0.00 0.00 0.17 -2.48 120.51 117.63 1i50 n ALA 139 Ca 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1i50 n ALA 139 Cb 0.43 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.69 1i50 n ALA 139 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1i50 n LEU 140 N -0.89 0.43 0.30 0.00 4.77 0.13 -4.66 117.00 117.08 1i50 n LEU 140 Ca 0.09 -0.68 0.19 0.00 -0.03 0.00 0.00 56.01 55.58 1i50 n LEU 140 Cb 0.04 0.00 1.02 0.00 -2.33 0.00 0.00 43.42 42.15 1i50 n LEU 140 CO 0.07 0.11 1.16 0.58 -1.33 0.00 0.00 177.39 177.97 1i50 h VAL 141 N 0.03 0.26 -3.96 4.08 2.07 -1.17 -3.35 116.25 114.22 1i50 h VAL 141 Ca 0.00 0.00 -0.43 0.00 0.82 0.00 0.00 66.70 67.09 1i50 h VAL 141 Cb 0.02 0.95 -0.30 0.00 -1.52 0.00 0.00 31.29 30.43 1i50 h VAL 141 CO 0.00 0.00 -0.79 -0.69 0.02 0.00 0.00 177.57 176.11 1i50 s VAL 142 N -4.39 0.84 -0.62 2.57 1.01 -1.26 -4.39 120.40 114.15 1i50 s VAL 142 Ca -0.05 -0.42 -0.22 0.00 0.00 0.00 0.00 61.98 61.29 1i50 s VAL 142 Cb 0.14 -0.72 0.07 0.00 0.00 0.00 0.00 36.38 35.87 1i50 s VAL 142 CO 0.47 0.25 0.88 0.21 0.00 0.00 0.00 175.10 176.91 1i50 s ASN 143 N -0.04 6.20 0.38 3.32 3.84 -1.26 -4.92 114.94 122.45 1i50 s ASN 143 Ca 0.01 -1.01 0.11 0.00 0.21 0.00 0.00 52.86 52.18 1i50 s ASN 143 Cb -0.06 -2.39 0.90 0.00 -0.55 0.00 0.00 41.25 39.16 1i50 s ASN 143 CO 0.00 -1.31 1.88 0.16 -2.79 0.00 0.00 177.10 175.05 1i50 h ILE 144 N 5.96 0.81 0.00 -5.21 3.07 -1.95 0.07 117.51 120.26 1i50 h ILE 144 Ca -0.29 -0.20 0.00 0.00 1.55 0.00 0.00 64.86 65.92 1i50 h ILE 144 Cb 1.08 0.17 0.00 0.00 -0.27 0.00 0.00 36.82 37.79 1i50 h ILE 144 CO 1.14 0.11 0.03 0.35 -1.05 0.00 0.00 178.15 178.73 1i50 n THR 145 N -4.53 1.06 1.66 0.16 -2.24 -1.26 -0.02 114.28 109.11 1i50 n THR 145 Ca 0.17 0.72 0.14 0.00 -2.27 0.00 0.00 64.05 62.81 1i50 n THR 145 Cb 0.50 -1.72 0.64 0.00 -2.10 0.00 0.00 70.33 67.66 1i50 n THR 145 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1i50 n HIS 146 N -2.17 0.03 -2.90 4.78 8.25 0.01 -4.89 115.22 118.32 1i50 n HIS 146 Ca -0.01 -0.01 -0.38 0.00 -0.26 0.00 0.00 57.72 57.05 1i50 n HIS 146 Cb 0.06 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.11 1i50 n HIS 146 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1i50 s HIS 147 N -1.97 3.84 0.18 4.41 5.04 0.97 -4.99 115.29 122.76 1i50 s HIS 147 Ca 0.40 1.70 -0.27 0.00 -1.54 0.00 0.00 55.06 55.34 1i50 s HIS 147 Cb 0.20 -2.83 0.01 0.00 0.04 0.00 0.00 32.58 30.01 1i50 s HIS 147 CO 0.33 0.40 1.55 1.49 -2.34 0.00 0.00 174.74 176.17 1i50 h GLU 148 N 3.87 -0.04 0.00 2.88 4.81 -1.90 -0.67 114.58 123.52 1i50 h GLU 148 Ca -0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1i50 h GLU 148 Cb 1.20 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.59 1i50 h GLU 148 CO 0.66 -0.03 0.00 1.28 -0.73 0.00 0.00 179.01 180.20 1i50 n LEU 149 N -5.32 0.00 -4.45 1.64 7.99 -1.26 -4.65 117.00 110.95 1i50 n LEU 149 Ca 0.04 0.10 -0.43 0.00 -0.01 0.00 0.00 56.01 55.71 1i50 n LEU 149 Cb 0.31 -0.10 -0.10 0.00 -0.11 0.00 0.00 43.42 43.41 1i50 n LEU 149 CO -0.13 -0.04 -0.08 -0.69 -1.51 0.00 0.00 177.39 174.94 1i50 s VAL 150 N -2.20 5.20 0.72 4.08 1.01 -0.26 -5.07 120.40 123.87 1i50 s VAL 150 Ca 0.26 -0.67 -0.11 0.00 0.00 0.00 0.00 61.98 61.45 1i50 s VAL 150 Cb 0.13 -3.89 0.02 0.00 0.00 0.00 0.00 36.38 32.64 1i50 s VAL 150 CO 0.25 -0.30 1.09 -2.16 0.00 0.00 0.00 175.10 173.99 1i50 s PRO 151 N 1.67 2.74 -0.04 2.72 0.04 -1.26 -4.78 135.00 136.08 1i50 s PRO 151 Ca 0.05 0.51 -0.30 0.00 0.04 0.00 0.00 61.00 61.30 1i50 s PRO 151 Cb -0.19 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.29 1i50 s PRO 151 CO 0.10 -1.13 1.57 0.15 0.04 0.00 0.00 177.00 177.72 1i50 s LYS 152 N -5.31 4.21 -0.09 4.56 1.02 -1.25 -4.92 119.74 117.96 1i50 s LYS 152 Ca 0.59 2.11 -0.05 0.00 0.02 0.00 0.00 55.97 58.64 1i50 s LYS 152 Cb -0.12 -3.85 -0.04 0.00 -0.52 0.00 0.00 37.83 33.31 1i50 s LYS 152 CO 0.52 -0.77 0.11 -1.01 -0.92 0.00 0.00 175.35 173.28 1i50 s HIS 153 N 3.54 3.47 -0.10 3.18 3.76 -1.26 -2.01 115.29 125.86 1i50 s HIS 153 Ca 0.70 0.42 -0.02 0.00 -0.15 0.00 0.00 55.06 56.01 1i50 s HIS 153 Cb -0.32 -1.88 0.03 0.00 1.11 0.00 0.00 32.58 31.52 1i50 s HIS 153 CO 0.28 0.66 0.00 0.42 -0.85 0.00 0.00 174.74 175.25 1i50 s ILE 154 N -1.03 0.46 0.15 0.60 1.01 0.27 -4.93 121.20 117.72 1i50 s ILE 154 Ca 0.16 -0.06 -0.31 0.00 0.00 0.00 0.00 60.65 60.44 1i50 s ILE 154 Cb -0.12 -0.68 -0.09 0.00 0.01 0.00 0.00 42.46 41.58 1i50 s ILE 154 CO 0.06 0.16 1.42 -0.60 0.00 0.00 0.00 174.94 175.98 1i50 s ARG 155 N 1.93 4.30 0.03 2.79 3.52 -1.26 -0.45 118.95 129.81 1i50 s ARG 155 Ca 0.04 2.16 -0.11 0.00 -0.13 0.00 0.00 55.73 57.68 1i50 s ARG 155 Cb -0.13 -3.21 -0.06 0.00 -1.56 0.00 0.00 34.95 30.00 1i50 s ARG 155 CO -0.06 -0.44 0.37 -0.51 -0.81 0.00 0.00 175.30 173.85 1i50 s LEU 156 N 0.77 4.40 0.62 -0.88 1.43 -0.13 -4.92 118.68 119.97 1i50 s LEU 156 Ca 0.64 0.80 -0.16 0.00 -1.03 0.00 0.00 54.13 54.38 1i50 s LEU 156 Cb -0.39 -2.75 -0.02 0.00 0.03 0.00 0.00 46.19 43.06 1i50 s LEU 156 CO 0.33 0.25 1.10 -0.94 0.23 0.00 0.00 176.35 177.32 1i50 s SER 157 N -1.47 5.38 0.40 2.29 1.04 -1.26 -4.58 113.70 115.50 1i50 s SER 157 Ca 0.28 1.98 0.27 0.00 0.48 0.00 0.00 55.95 58.96 1i50 s SER 157 Cb -0.15 -2.55 1.45 0.00 0.10 0.00 0.00 66.02 64.88 1i50 s SER 157 CO 0.15 -1.44 1.83 0.77 0.98 0.00 0.00 173.24 175.53 1i50 h SER 158 N 0.33 0.00 -0.00 7.02 4.64 -1.98 0.13 113.55 123.70 1i50 h SER 158 Ca -0.47 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.81 1i50 h SER 158 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1i50 h SER 158 CO 0.55 0.00 -0.16 -0.78 -0.87 0.00 0.00 176.83 175.57 1i50 h ASP 159 N 0.00 0.14 -0.05 4.97 1.82 -1.95 -2.32 116.42 119.04 1i50 h ASP 159 Ca 0.00 -0.78 -0.05 0.00 -0.39 0.00 0.00 57.03 55.81 1i50 h ASP 159 Cb 0.03 -0.04 -0.01 0.00 0.68 0.00 0.00 39.33 39.98 1i50 h ASP 159 CO 0.00 0.91 -0.09 -0.33 -1.61 0.00 0.00 179.24 178.12 1i50 h GLU 160 N -0.60 0.30 -0.64 0.28 5.08 -1.37 -2.14 114.58 115.50 1i50 h GLU 160 Ca -0.02 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.21 1i50 h GLU 160 Cb 0.93 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 1i50 h GLU 160 CO 0.03 0.41 0.13 -0.22 -1.00 0.00 0.00 179.01 178.36 1i50 h LYS 161 N 0.29 1.04 -0.53 2.33 3.64 -0.81 0.39 116.57 122.93 1i50 h LYS 161 Ca 0.06 -0.27 -0.12 0.00 -1.27 0.00 0.00 60.65 59.06 1i50 h LYS 161 Cb 0.34 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1i50 h LYS 161 CO 0.02 0.95 -0.13 0.00 -2.27 0.00 0.00 179.45 178.02 1i50 h ARG 162 N 0.96 1.01 -0.62 1.90 3.08 -0.88 -0.28 114.38 119.56 1i50 h ARG 162 Ca 0.20 -0.39 -0.04 0.00 0.07 0.00 0.00 59.98 59.82 1i50 h ARG 162 Cb 0.40 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 1i50 h ARG 162 CO 0.01 1.07 0.22 1.49 -1.07 0.00 0.00 179.97 181.69 1i50 h GLU 163 N 0.88 0.94 0.53 0.04 4.57 -1.15 0.22 114.58 120.63 1i50 h GLU 163 Ca 0.13 -0.19 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 1i50 h GLU 163 Cb 0.70 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1i50 h GLU 163 CO 0.05 0.81 -0.34 1.25 -1.18 0.00 0.00 179.01 179.61 1i50 h LEU 164 N 0.87 -0.86 -2.20 1.64 5.85 -0.60 -1.14 115.31 118.88 1i50 h LEU 164 Ca 0.20 0.05 0.06 0.00 0.84 0.00 0.00 57.88 59.03 1i50 h LEU 164 Cb 0.24 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1i50 h LEU 164 CO -0.01 -0.51 0.24 -0.07 -0.34 0.00 0.00 178.44 177.75 1i50 h LEU 165 N -0.82 0.00 0.00 2.25 3.38 -0.97 -2.87 115.31 116.28 1i50 h LEU 165 Ca -0.07 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1i50 h LEU 165 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1i50 h LEU 165 CO 0.07 0.00 -0.02 0.50 0.09 0.00 0.00 178.44 179.07 1i50 h LYS 166 N 0.00 0.00 -0.67 1.13 3.64 0.02 -2.20 116.57 118.49 1i50 h LYS 166 Ca 0.09 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1i50 h LYS 166 Cb 0.58 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.37 1i50 h LYS 166 CO -0.00 0.58 0.35 0.00 -2.27 0.00 0.00 179.45 178.11 1i50 h ARG 167 N -1.00 0.93 0.00 1.90 2.47 -1.14 -1.20 114.38 116.34 1i50 h ARG 167 Ca -0.01 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 58.61 1i50 h ARG 167 Cb 0.59 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 28.72 1i50 h ARG 167 CO -0.00 0.70 -0.34 0.66 0.56 0.00 0.00 179.97 181.54 1i50 n TYR 168 N -4.36 0.54 -3.23 3.04 4.02 -1.09 -4.97 117.16 111.10 1i50 n TYR 168 Ca 0.06 0.16 -0.10 0.00 -0.01 0.00 0.00 57.90 58.01 1i50 n TYR 168 Cb 0.11 -0.67 0.03 0.00 -0.02 0.00 0.00 39.34 38.79 1i50 n TYR 168 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1i50 n ARG 169 N -2.01 -1.70 -4.37 -0.72 1.74 -0.45 -5.03 116.66 104.13 1i50 n ARG 169 Ca 0.05 1.12 -0.21 0.00 -0.77 0.00 0.00 57.85 58.04 1i50 n ARG 169 Cb 0.41 -5.48 -0.10 0.00 -1.02 0.00 0.00 32.46 26.27 1i50 n ARG 169 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1i50 s LEU 170 N -4.83 2.53 0.71 0.55 1.43 -0.88 -5.04 118.68 113.14 1i50 s LEU 170 Ca 0.23 -0.97 -0.06 0.00 -1.03 0.00 0.00 54.13 52.29 1i50 s LEU 170 Cb -0.04 -0.81 0.07 0.00 0.03 0.00 0.00 46.19 45.44 1i50 s LEU 170 CO 0.76 -0.09 1.01 -0.54 0.23 0.00 0.00 176.35 177.73 1i50 s LYS 171 N -3.36 2.13 0.28 1.70 1.02 -1.26 -4.86 119.74 115.39 1i50 s LYS 171 Ca 0.22 -0.33 0.11 0.00 0.02 0.00 0.00 55.97 55.99 1i50 s LYS 171 Cb -0.03 -2.18 0.38 0.00 -0.52 0.00 0.00 37.83 35.48 1i50 s LYS 171 CO 0.08 -1.27 1.62 0.93 -0.92 0.00 0.00 175.35 175.80 1i50 h GLU 172 N -0.60 0.00 0.00 1.68 5.08 -1.98 -2.96 114.58 115.79 1i50 h GLU 172 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1i50 h GLU 172 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 1i50 h GLU 172 CO 0.58 0.60 0.00 0.66 -1.00 0.00 0.00 179.01 179.85 1i50 h SER 173 N 0.00 0.00 -0.08 1.42 4.64 -2.00 -3.01 113.55 114.52 1i50 h SER 173 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1i50 h SER 173 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1i50 h SER 173 CO 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.04 1i50 n GLN 174 N -2.38 1.65 -3.46 4.77 6.02 -1.12 -4.88 117.38 117.98 1i50 n GLN 174 Ca 0.02 -0.96 -0.30 0.00 -0.01 0.00 0.00 57.00 55.76 1i50 n GLN 174 Cb 0.27 -1.44 -0.04 0.00 1.02 0.00 0.00 30.24 30.05 1i50 n GLN 174 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1i50 s LEU 175 N -1.79 4.14 0.84 1.08 1.43 -1.14 -4.97 118.68 118.27 1i50 s LEU 175 Ca 0.36 0.69 -0.11 0.00 -1.03 0.00 0.00 54.13 54.04 1i50 s LEU 175 Cb 0.19 -3.47 0.10 0.00 0.03 0.00 0.00 46.19 43.04 1i50 s LEU 175 CO 0.30 -0.11 1.14 -2.84 0.23 0.00 0.00 176.35 175.07 1i50 s PRO 176 N -3.22 1.61 0.27 1.29 0.02 -1.25 -4.83 135.00 128.89 1i50 s PRO 176 Ca 0.43 1.47 0.11 0.00 0.02 0.00 0.00 61.00 63.03 1i50 s PRO 176 Cb -0.11 -1.80 -0.05 0.00 0.02 0.00 0.00 34.50 32.56 1i50 s PRO 176 CO 0.27 -2.18 -0.10 1.03 -0.33 0.00 0.00 177.00 175.69 1i50 s ARG 177 N -4.58 2.00 -0.03 5.54 0.52 -1.26 -1.83 118.95 119.31 1i50 s ARG 177 Ca 0.66 -1.57 -0.01 0.00 -0.52 0.00 0.00 55.73 54.30 1i50 s ARG 177 Cb -0.22 -1.98 0.03 0.00 0.52 0.00 0.00 34.95 33.30 1i50 s ARG 177 CO 0.55 0.35 0.03 -1.50 0.02 0.00 0.00 175.30 174.75 1i50 s ILE 178 N -2.38 0.02 0.55 1.52 2.07 -0.42 -4.75 121.20 117.80 1i50 s ILE 178 Ca 0.30 0.24 -0.21 0.00 -1.41 0.00 0.00 60.65 59.57 1i50 s ILE 178 Cb -0.06 -0.18 -0.05 0.00 0.13 0.00 0.00 42.46 42.30 1i50 s ILE 178 CO 0.17 0.14 1.22 0.00 -1.91 0.00 0.00 174.94 174.57 1i50 n GLN 179 N 4.56 1.43 -0.03 3.50 1.13 -1.26 -1.26 117.38 125.45 1i50 n GLN 179 Ca -0.19 0.53 0.00 0.00 -1.94 0.00 0.00 57.00 55.40 1i50 n GLN 179 Cb 0.50 -2.41 0.29 0.00 0.11 0.00 0.00 30.24 28.73 1i50 n GLN 179 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 1i50 h ARG 180 N 1.16 0.61 -0.41 -1.09 2.43 -1.92 -2.30 114.38 112.86 1i50 h ARG 180 Ca -0.49 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 58.57 1i50 h ARG 180 Cb 1.32 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1i50 h ARG 180 CO 0.55 0.56 0.00 0.00 -1.51 0.00 0.00 179.97 179.58 1i50 n ALA 181 N -2.47 2.44 -1.82 2.80 0.00 -1.26 -4.20 120.51 116.00 1i50 n ALA 181 Ca 0.02 -0.71 -0.42 0.00 0.00 0.00 0.00 53.44 52.33 1i50 n ALA 181 Cb 0.20 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.65 1i50 n ALA 181 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1i50 s ASP 182 N -1.01 6.47 0.51 0.00 -1.08 -0.87 -4.75 116.67 115.94 1i50 s ASP 182 Ca 0.27 2.76 0.39 0.00 -0.52 0.00 0.00 52.55 55.46 1i50 s ASP 182 Cb 0.14 -2.60 1.56 0.00 -1.46 0.00 0.00 42.92 40.57 1i50 s ASP 182 CO 0.19 -0.91 1.65 -0.65 0.52 0.00 0.00 175.17 175.97 1i50 h PRO 183 N 6.77 0.05 0.02 4.34 0.11 -1.91 0.73 132.00 142.11 1i50 h PRO 183 Ca -0.43 -0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.42 1i50 h PRO 183 Cb 1.20 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 1i50 h PRO 183 CO 0.94 0.03 -1.33 0.28 -0.21 0.00 0.00 178.00 177.71 1i50 h VAL 184 N 0.05 1.33 -0.21 3.15 2.07 -1.96 -2.47 116.25 118.21 1i50 h VAL 184 Ca 0.80 -3.07 -0.09 0.00 0.82 0.00 0.00 66.70 65.16 1i50 h VAL 184 Cb 2.93 2.69 -0.00 0.00 -1.52 0.00 0.00 31.29 35.39 1i50 h VAL 184 CO -0.16 0.79 -0.23 0.00 0.02 0.00 0.00 177.57 177.98 1i50 h ALA 185 N 0.90 0.31 -0.76 1.67 0.00 0.04 -1.75 119.26 119.67 1i50 h ALA 185 Ca -0.14 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 54.46 1i50 h ALA 185 Cb 1.90 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 19.56 1i50 h ALA 185 CO 0.12 0.27 0.44 -0.07 0.00 0.00 0.00 179.25 180.02 1i50 h LEU 186 N 0.20 0.67 -0.28 0.00 3.38 -0.89 0.40 115.31 118.79 1i50 h LEU 186 Ca 0.03 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1i50 h LEU 186 Cb 0.79 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 1i50 h LEU 186 CO 0.06 0.42 0.14 0.22 0.09 0.00 0.00 178.44 179.37 1i50 h TYR 187 N 0.80 0.27 -0.00 1.13 3.20 -1.23 -2.24 116.97 118.89 1i50 h TYR 187 Ca 0.35 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.23 1i50 h TYR 187 Cb 0.23 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.41 1i50 h TYR 187 CO -0.06 0.15 -0.07 1.28 -1.64 0.00 0.00 178.16 177.82 1i50 n LEU 188 N -4.96 0.17 -1.73 2.82 4.77 -0.67 -4.92 117.00 112.48 1i50 n LEU 188 Ca -0.01 0.24 -0.12 0.00 -0.03 0.00 0.00 56.01 56.09 1i50 n LEU 188 Cb 0.06 -0.31 0.02 0.00 -2.33 0.00 0.00 43.42 40.86 1i50 n LEU 188 CO 0.32 0.03 -0.01 0.61 -1.33 0.00 0.00 177.39 177.01 1i50 n GLY 189 N 1.36 0.02 3.76 -0.72 0.00 0.13 -4.94 105.19 104.80 1i50 n GLY 189 Ca 0.12 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 1i50 n GLY 189 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i50 s LEU 190 N -3.83 4.07 0.00 0.99 1.43 -0.52 -5.02 118.68 115.80 1i50 s LEU 190 Ca 0.16 2.88 0.07 0.00 -1.03 0.00 0.00 54.13 56.20 1i50 s LEU 190 Cb -0.07 -4.00 -0.03 0.00 0.03 0.00 0.00 46.19 42.13 1i50 s LEU 190 CO 0.19 -1.23 -0.20 -0.54 0.23 0.00 0.00 176.35 174.80 1i50 s LYS 191 N -2.52 2.15 -0.34 1.70 1.02 -1.26 -4.90 119.74 115.58 1i50 s LYS 191 Ca 0.63 -0.92 -0.44 0.00 0.02 0.00 0.00 55.97 55.26 1i50 s LYS 191 Cb -0.43 -2.17 -0.19 0.00 -0.52 0.00 0.00 37.83 34.52 1i50 s LYS 191 CO 0.54 0.56 1.52 -2.13 -0.92 0.00 0.00 175.35 174.93 1i50 n ARG 192 N 1.98 0.30 0.00 1.68 0.63 -1.26 -0.73 116.66 119.26 1i50 n ARG 192 Ca -0.16 0.11 0.00 0.00 -0.92 0.00 0.00 57.85 56.87 1i50 n ARG 192 Cb 0.52 -1.65 0.00 0.00 0.45 0.00 0.00 32.46 31.78 1i50 n ARG 192 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1i50 n GLY 193 N 3.53 2.30 3.78 5.14 0.00 -0.71 -5.01 105.19 114.22 1i50 n GLY 193 Ca 0.28 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.95 1i50 n GLY 193 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i50 s GLU 194 N -0.24 3.38 -0.00 1.61 2.02 0.09 -4.70 118.70 120.86 1i50 s GLU 194 Ca 0.00 1.52 0.06 0.00 0.02 0.00 0.00 54.97 56.57 1i50 s GLU 194 Cb 0.00 -2.02 -0.03 0.00 0.10 0.00 0.00 34.13 32.19 1i50 s GLU 194 CO 0.00 -0.81 -0.18 0.08 0.02 0.00 0.00 175.26 174.37 1i50 s VAL 195 N -1.90 2.80 -0.04 2.63 1.01 -1.26 -0.85 120.40 122.78 1i50 s VAL 195 Ca 0.71 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.76 1i50 s VAL 195 Cb -0.22 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.03 1i50 s VAL 195 CO 0.28 0.48 -0.22 0.68 0.00 0.00 0.00 175.10 176.31 1i50 s VAL 196 N -0.80 2.36 -0.17 2.92 -7.23 0.09 -0.96 120.40 116.61 1i50 s VAL 196 Ca 0.13 -0.98 -0.15 0.00 -1.81 0.00 0.00 61.98 59.17 1i50 s VAL 196 Cb -0.10 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 34.93 1i50 s VAL 196 CO 0.02 0.58 0.34 -0.75 -0.31 0.00 0.00 175.10 174.98 1i50 s LYS 197 N -0.52 4.23 -0.22 4.82 2.20 0.40 -2.13 119.74 128.52 1i50 s LYS 197 Ca 0.07 0.14 -0.05 0.00 -0.36 0.00 0.00 55.97 55.77 1i50 s LYS 197 Cb -0.11 -3.47 -0.02 0.00 -1.51 0.00 0.00 37.83 32.72 1i50 s LYS 197 CO 0.01 0.14 0.00 0.42 -0.36 0.00 0.00 175.35 175.55 1i50 s ILE 198 N 0.77 3.81 -0.36 5.43 1.01 0.05 -0.57 121.20 131.34 1i50 s ILE 198 Ca 0.18 -0.35 -0.06 0.00 0.00 0.00 0.00 60.65 60.42 1i50 s ILE 198 Cb -0.14 -2.74 0.06 0.00 0.01 0.00 0.00 42.46 39.65 1i50 s ILE 198 CO 0.06 0.40 0.15 -0.63 0.00 0.00 0.00 174.94 174.92 1i50 s ILE 199 N 1.36 3.75 0.22 2.92 1.01 -0.85 -0.83 121.20 128.79 1i50 s ILE 199 Ca 0.04 -1.35 0.11 0.00 0.00 0.00 0.00 60.65 59.46 1i50 s ILE 199 Cb -0.15 -3.23 -0.05 0.00 0.01 0.00 0.00 42.46 39.05 1i50 s ILE 199 CO 0.00 -0.32 -0.22 0.00 0.00 0.00 0.00 174.94 174.40 1i50 s ARG 200 N 1.36 1.60 0.63 2.79 1.70 -0.61 -3.74 118.95 122.67 1i50 s ARG 200 Ca 0.00 -1.59 -0.16 0.00 -0.47 0.00 0.00 55.73 53.51 1i50 s ARG 200 Cb -0.21 -1.84 -0.02 0.00 -0.57 0.00 0.00 34.95 32.31 1i50 s ARG 200 CO 0.01 0.38 1.11 0.15 -1.08 0.00 0.00 175.30 175.87 1i50 s LYS 201 N -2.96 2.98 -0.05 3.89 -0.14 -1.26 -1.45 119.74 120.74 1i50 s LYS 201 Ca 0.24 1.43 -0.03 0.00 -1.36 0.00 0.00 55.97 56.25 1i50 s LYS 201 Cb -0.07 -1.97 0.03 0.00 -1.68 0.00 0.00 37.83 34.14 1i50 s LYS 201 CO 0.12 -1.12 0.13 0.45 -0.76 0.00 0.00 175.35 174.17 1i50 s SER 202 N -2.40 -0.09 0.08 2.83 0.15 -0.47 -4.79 113.70 109.01 1i50 s SER 202 Ca 0.68 0.25 0.23 0.00 0.70 0.00 0.00 55.95 57.81 1i50 s SER 202 Cb -0.21 0.17 0.92 0.00 -1.71 0.00 0.00 66.02 65.19 1i50 s SER 202 CO 0.38 -0.12 1.71 -1.84 1.20 0.00 0.00 173.24 174.57 1i50 n GLU 203 N 3.88 0.08 -0.06 5.44 0.28 -1.26 -3.80 120.64 125.21 1i50 n GLU 203 Ca -0.23 0.19 -0.04 0.00 -0.16 0.00 0.00 57.16 56.93 1i50 n GLU 203 Cb 0.54 -1.62 -0.01 0.00 1.43 0.00 0.00 31.44 31.77 1i50 n GLU 203 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1i50 n THR 204 N -1.77 1.13 -3.71 3.84 -1.04 -1.26 -4.99 114.28 106.47 1i50 n THR 204 Ca 0.05 0.27 -0.16 0.00 -2.04 0.00 0.00 64.05 62.17 1i50 n THR 204 Cb 0.28 -2.21 0.00 0.00 -1.82 0.00 0.00 70.33 66.58 1i50 n THR 204 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1i50 n SER 205 N -4.13 2.04 0.00 8.00 3.41 -1.25 -5.07 113.62 116.63 1i50 n SER 205 Ca -0.06 -2.14 -0.05 0.00 -0.26 0.00 0.00 58.87 56.36 1i50 n SER 205 Cb 0.22 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.10 1i50 n SER 205 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1i50 h GLY 206 N 0.39 -0.14 -3.33 5.00 0.00 -1.95 -3.35 103.07 99.70 1i50 h GLY 206 Ca -0.21 0.05 -0.49 0.00 0.00 0.00 0.00 47.33 46.68 1i50 h GLY 206 CO 0.33 -0.05 -0.77 0.50 0.00 0.00 0.00 176.54 176.55 1i50 s ARG 207 N -2.21 1.22 -0.07 4.80 0.52 -1.26 -1.37 118.95 120.58 1i50 s ARG 207 Ca -0.06 -1.38 -0.05 0.00 -0.52 0.00 0.00 55.73 53.73 1i50 s ARG 207 Cb -0.00 -1.21 0.03 0.00 0.52 0.00 0.00 34.95 34.28 1i50 s ARG 207 CO 0.20 0.24 0.17 -0.47 0.02 0.00 0.00 175.30 175.46 1i50 s TYR 208 N -2.13 -0.20 -0.06 -0.53 5.04 -0.53 -4.87 117.35 114.08 1i50 s TYR 208 Ca 0.14 0.50 0.02 0.00 -2.44 0.00 0.00 57.07 55.29 1i50 s TYR 208 Cb -0.05 0.02 -0.03 0.00 0.35 0.00 0.00 41.96 42.25 1i50 s TYR 208 CO 0.06 -0.13 -0.10 0.00 -1.34 0.00 0.00 175.55 174.04 1i50 s ALA 209 N 0.51 2.86 0.41 3.97 0.00 -1.26 -1.58 121.76 126.67 1i50 s ALA 209 Ca -0.03 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 51.02 1i50 s ALA 209 Cb -0.05 -1.12 -0.03 0.00 0.00 0.00 0.00 23.12 21.92 1i50 s ALA 209 CO -0.02 0.57 0.08 0.45 0.00 0.00 0.00 175.76 176.84 1i50 s SER 210 N -0.83 3.00 0.00 0.00 0.15 -0.01 -4.96 113.70 111.07 1i50 s SER 210 Ca 0.12 -1.58 -0.01 0.00 0.70 0.00 0.00 55.95 55.18 1i50 s SER 210 Cb -0.11 0.32 -0.01 0.00 -1.71 0.00 0.00 66.02 64.52 1i50 s SER 210 CO 0.01 -0.81 0.02 -0.31 1.20 0.00 0.00 173.24 173.35 1i50 s TYR 211 N -3.14 0.10 -0.00 3.44 1.51 -1.26 -0.77 117.35 117.22 1i50 s TYR 211 Ca 0.24 -0.20 0.01 0.00 -1.01 0.00 0.00 57.07 56.11 1i50 s TYR 211 Cb 0.04 -0.08 0.00 0.00 -0.11 0.00 0.00 41.96 41.81 1i50 s TYR 211 CO 0.13 -0.12 -0.03 1.03 -1.11 0.00 0.00 175.55 175.45 1i50 s ARG 212 N -0.76 0.25 -0.10 -0.62 0.52 -0.91 -3.89 118.95 113.45 1i50 s ARG 212 Ca -0.08 -0.09 -0.03 0.00 -0.52 0.00 0.00 55.73 55.01 1i50 s ARG 212 Cb -0.05 -0.26 -0.03 0.00 0.52 0.00 0.00 34.95 35.13 1i50 s ARG 212 CO -0.00 0.04 0.01 -1.50 0.02 0.00 0.00 175.30 173.88 1i50 s ILE 213 N 0.04 4.42 0.05 1.52 2.07 -0.76 -0.73 121.20 127.81 1i50 s ILE 213 Ca 0.00 -0.20 -0.31 0.00 -1.41 0.00 0.00 60.65 58.73 1i50 s ILE 213 Cb -0.02 -2.87 -0.06 0.00 0.13 0.00 0.00 42.46 39.63 1i50 s ILE 213 CO -0.00 0.59 1.34 0.00 -1.91 0.00 0.00 174.94 174.96