#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qso n ILE 9 N 0.00 -2.90 -4.51 -1.44 5.41 -1.26 -4.86 119.36 109.79 1qso n ILE 9 Ca 0.00 1.06 -0.20 0.00 1.00 0.00 0.00 62.75 64.61 1qso n ILE 9 Cb 0.00 -1.86 -0.15 0.00 -0.71 0.00 0.00 39.64 36.92 1qso n ILE 9 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 1qso s THR 10 N -1.67 0.91 -0.12 1.39 2.01 1.00 -4.63 115.64 114.52 1qso s THR 10 Ca 0.00 -0.49 -0.01 0.00 0.31 0.00 0.00 61.69 61.50 1qso s THR 10 Cb 0.00 -0.76 -0.02 0.00 0.01 0.00 0.00 72.50 71.72 1qso s THR 10 CO 0.00 0.26 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.42 1qso s VAL 11 N -0.24 3.54 0.07 3.82 1.01 -1.26 -0.12 120.40 127.22 1qso s VAL 11 Ca 0.04 -0.50 -0.26 0.00 0.00 0.00 0.00 61.98 61.25 1qso s VAL 11 Cb -0.05 -2.50 0.07 0.00 0.00 0.00 0.00 36.38 33.90 1qso s VAL 11 CO -0.00 0.53 0.63 0.00 0.00 0.00 0.00 175.10 176.26 1qso s ARG 12 N 0.03 1.19 0.52 2.72 1.70 -0.74 -4.98 118.95 119.39 1qso s ARG 12 Ca -0.02 -0.17 -0.22 0.00 -0.47 0.00 0.00 55.73 54.85 1qso s ARG 12 Cb -0.14 0.55 -0.06 0.00 -0.57 0.00 0.00 34.95 34.74 1qso s ARG 12 CO 0.03 -0.47 1.29 -0.06 -1.08 0.00 0.00 175.30 175.01 1qso s PHE 13 N -2.71 2.49 0.65 5.89 0.40 -1.26 -0.42 117.98 123.01 1qso s PHE 13 Ca -0.04 1.44 -0.15 0.00 -0.60 0.00 0.00 56.93 57.57 1qso s PHE 13 Cb -0.01 -3.64 -0.00 0.00 0.51 0.00 0.00 43.02 39.87 1qso s PHE 13 CO -0.04 -2.40 1.11 0.14 0.70 0.00 0.00 175.22 174.73 1qso s VAL 14 N -1.40 3.27 0.30 -0.44 -7.23 -0.75 -4.80 120.40 109.36 1qso s VAL 14 Ca 0.69 0.60 0.04 0.00 -1.81 0.00 0.00 61.98 61.50 1qso s VAL 14 Cb -0.36 -3.12 -0.06 0.00 0.56 0.00 0.00 36.38 33.40 1qso s VAL 14 CO 0.43 -0.36 0.03 0.42 -0.31 0.00 0.00 175.10 175.31 1qso s THR 15 N -2.32 1.23 0.50 5.32 -4.23 -1.26 -4.94 115.64 109.94 1qso s THR 15 Ca 0.67 -2.02 0.36 0.00 -1.18 0.00 0.00 61.69 59.51 1qso s THR 15 Cb -0.20 -2.67 0.56 0.00 1.34 0.00 0.00 72.50 71.53 1qso s THR 15 CO 0.41 -0.10 1.70 -0.33 -0.54 0.00 0.00 174.62 175.76 1qso h GLU 16 N 2.20 0.08 0.00 3.99 5.08 -1.99 0.11 114.58 124.05 1qso h GLU 16 Ca -0.40 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 57.90 1qso h GLU 16 Cb 1.24 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 1qso h GLU 16 CO 0.68 0.05 -0.28 -0.91 -1.00 0.00 0.00 179.01 177.56 1qso h ASN 17 N 0.08 0.00 0.63 1.42 2.35 -2.02 -3.20 115.58 114.83 1qso h ASN 17 Ca 0.72 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.47 1qso h ASN 17 Cb 2.59 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.96 1qso h ASN 17 CO -0.14 0.28 0.00 0.47 -1.65 0.00 0.00 177.43 176.39 1qso n ASP 18 N -3.22 0.00 -0.11 5.81 8.00 0.37 -3.95 116.55 123.45 1qso n ASP 18 Ca 0.02 0.13 -0.06 0.00 0.71 0.00 0.00 54.79 55.59 1qso n ASP 18 Cb 0.59 -0.36 0.02 0.00 -0.02 0.00 0.00 41.12 41.35 1qso n ASP 18 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1qso h LYS 19 N 0.00 0.27 -0.79 -1.24 3.64 -1.64 0.72 116.57 117.52 1qso h LYS 19 Ca 0.00 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1qso h LYS 19 Cb 0.31 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 1qso h LYS 19 CO 0.00 0.18 0.52 1.49 -2.27 0.00 0.00 179.45 179.36 1qso h GLU 20 N 0.27 1.05 -0.06 1.90 4.81 -1.84 0.35 114.58 121.07 1qso h GLU 20 Ca 0.18 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.26 1qso h GLU 20 Cb 0.17 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.32 1qso h GLU 20 CO -0.19 0.71 -0.26 0.78 -0.73 0.00 0.00 179.01 179.32 1qso h GLY 21 N 1.08 0.31 0.69 1.92 0.00 -1.65 -3.11 103.07 102.30 1qso h GLY 21 Ca 0.29 -0.43 0.05 0.00 0.00 0.00 0.00 47.33 47.24 1qso h GLY 21 CO -0.06 0.38 0.26 -0.25 0.00 0.00 0.00 176.54 176.88 1qso h TRP 22 N -0.24 0.48 -0.12 5.60 7.01 0.57 -1.69 115.95 127.57 1qso h TRP 22 Ca -0.02 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.02 1qso h TRP 22 Cb 0.91 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.83 1qso h TRP 22 CO 0.13 0.23 0.08 1.96 -2.79 0.00 0.00 178.44 178.05 1qso h GLN 23 N 0.51 0.09 -0.64 2.65 4.20 -0.99 -0.24 115.11 120.68 1qso h GLN 23 Ca 0.24 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.91 1qso h GLN 23 Cb 0.16 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 1qso h GLN 23 CO -0.17 0.06 0.26 -0.09 -0.67 0.00 0.00 178.83 178.22 1qso h ARG 24 N 0.09 0.96 -0.04 1.46 2.43 -1.24 -0.46 114.38 117.59 1qso h ARG 24 Ca 0.05 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.02 1qso h ARG 24 Cb 0.08 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1qso h ARG 24 CO -0.01 0.81 -0.06 -0.07 -1.51 0.00 0.00 179.97 179.12 1qso h LEU 25 N 0.91 0.12 -0.72 3.80 3.38 -1.19 -2.95 115.31 118.65 1qso h LEU 25 Ca 0.22 -0.56 0.16 0.00 0.09 0.00 0.00 57.88 57.78 1qso h LEU 25 Cb 0.20 -0.03 -0.11 0.00 0.09 0.00 0.00 40.66 40.81 1qso h LEU 25 CO -0.02 0.65 0.15 -0.25 0.09 0.00 0.00 178.44 179.07 1qso h TRP 26 N -0.41 0.23 -0.16 1.13 2.91 -0.95 0.49 115.95 119.18 1qso h TRP 26 Ca 0.00 0.04 -0.00 0.00 1.13 0.00 0.00 58.89 60.06 1qso h TRP 26 Cb 0.63 0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 29.28 1qso h TRP 26 CO 0.12 -0.10 0.08 0.87 -1.03 0.00 0.00 178.44 178.38 1qso h LYS 27 N 0.25 0.23 0.00 2.65 1.79 -1.08 -0.81 116.57 119.60 1qso h LYS 27 Ca 0.40 -0.03 -0.02 0.00 -2.18 0.00 0.00 60.65 58.82 1qso h LYS 27 Cb 0.68 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.29 1qso h LYS 27 CO -0.51 0.25 -0.09 0.66 -1.08 0.00 0.00 179.45 178.68 1qso h SER 28 N 0.15 0.00 -0.28 0.86 4.64 -1.20 -1.90 113.55 115.82 1qso h SER 28 Ca 0.06 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.32 1qso h SER 28 Cb 0.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 1qso h SER 28 CO -0.01 0.09 -0.05 0.22 -0.87 0.00 0.00 176.83 176.21 1qso h TYR 29 N 0.00 0.59 -0.36 4.77 3.20 0.52 -0.79 116.97 124.89 1qso h TYR 29 Ca -0.00 -0.12 -0.03 0.00 3.14 0.00 0.00 58.73 61.72 1qso h TYR 29 Cb 0.73 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 1qso h TYR 29 CO 0.00 0.72 0.09 1.96 -1.64 0.00 0.00 178.16 179.29 1qso h GLN 30 N 0.29 0.53 -0.23 1.82 4.20 -0.84 -1.55 115.11 119.34 1qso h GLN 30 Ca 0.07 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1qso h GLN 30 Cb 0.52 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 1qso h GLN 30 CO 0.02 0.49 0.11 -0.44 -0.67 0.00 0.00 178.83 178.34 1qso h ASP 31 N 0.52 0.30 -0.52 1.46 5.19 -0.71 -0.80 116.42 121.86 1qso h ASP 31 Ca 0.12 -0.13 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1qso h ASP 31 Cb 0.20 -0.08 -0.03 0.00 0.18 0.00 0.00 39.33 39.61 1qso h ASP 31 CO -0.00 0.34 0.32 0.15 -3.12 0.00 0.00 179.24 176.93 1qso h PHE 32 N 0.23 0.67 -0.09 4.55 3.57 -0.60 -2.08 116.94 123.20 1qso h PHE 32 Ca 0.08 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.58 1qso h PHE 32 Cb 0.12 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.64 1qso h PHE 32 CO -0.02 0.45 0.00 0.66 -2.23 0.00 0.00 178.31 177.17 1qso n TYR 33 N -4.69 0.12 -4.12 0.41 4.02 -0.64 -4.91 117.16 107.35 1qso n TYR 33 Ca 0.03 -0.06 -0.31 0.00 -0.01 0.00 0.00 57.90 57.54 1qso n TYR 33 Cb 0.04 -0.01 -0.03 0.00 -0.02 0.00 0.00 39.34 39.33 1qso n TYR 33 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1qso n GLU 34 N -0.23 -3.03 -4.41 -0.72 1.02 -0.68 -4.97 120.64 107.62 1qso n GLU 34 Ca 0.03 0.36 -0.20 0.00 -0.02 0.00 0.00 57.16 57.33 1qso n GLU 34 Cb 0.09 -4.74 -0.10 0.00 -0.02 0.00 0.00 31.44 26.66 1qso n GLU 34 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1qso s VAL 35 N -3.66 1.28 -0.30 2.62 -7.23 -0.39 -5.04 120.40 107.67 1qso s VAL 35 Ca 0.38 -2.05 -0.00 0.00 -1.81 0.00 0.00 61.98 58.50 1qso s VAL 35 Cb -0.21 -2.56 0.14 0.00 0.56 0.00 0.00 36.38 34.31 1qso s VAL 35 CO 0.92 -0.19 0.29 -0.55 -0.31 0.00 0.00 175.10 175.26 1qso s SER 36 N -3.42 1.83 0.41 4.85 0.15 -1.26 -4.41 113.70 111.86 1qso s SER 36 Ca 0.32 -0.97 -0.20 0.00 0.70 0.00 0.00 55.95 55.80 1qso s SER 36 Cb 0.06 0.40 -0.10 0.00 -1.71 0.00 0.00 66.02 64.67 1qso s SER 36 CO 0.12 -0.37 0.91 -0.36 1.20 0.00 0.00 173.24 174.74 1qso s PHE 37 N 2.17 3.33 0.05 3.44 0.08 -1.26 -4.99 117.98 120.79 1qso s PHE 37 Ca 0.11 1.52 -0.30 0.00 0.12 0.00 0.00 56.93 58.38 1qso s PHE 37 Cb -0.15 -2.78 -0.07 0.00 -0.57 0.00 0.00 43.02 39.44 1qso s PHE 37 CO -0.28 -0.08 1.61 -1.25 -0.10 0.00 0.00 175.22 175.11 1qso s PRO 38 N -3.19 4.21 0.53 0.24 0.04 -1.26 -4.87 135.00 130.71 1qso s PRO 38 Ca 0.60 2.25 0.43 0.00 0.04 0.00 0.00 61.00 64.32 1qso s PRO 38 Cb -0.09 -3.63 1.63 0.00 0.04 0.00 0.00 34.50 32.44 1qso s PRO 38 CO 0.15 -0.71 1.65 0.22 0.04 0.00 0.00 177.00 178.35 1qso h ASP 39 N 8.34 0.05 -0.03 6.66 1.82 -2.04 0.49 116.42 131.71 1qso h ASP 39 Ca -0.41 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.25 1qso h ASP 39 Cb 1.19 0.02 0.00 0.00 0.68 0.00 0.00 39.33 41.22 1qso h ASP 39 CO 0.93 -0.03 0.00 -0.90 -1.61 0.00 0.00 179.24 177.63 1qso n ASP 40 N -4.14 0.15 0.05 2.28 5.75 -1.26 -3.01 116.55 116.37 1qso n ASP 40 Ca 0.37 -1.99 -0.18 0.00 -0.01 0.00 0.00 54.79 52.98 1qso n ASP 40 Cb 1.68 -0.02 -0.14 0.00 -1.03 0.00 0.00 41.12 41.60 1qso n ASP 40 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1qso h LEU 41 N 0.16 0.42 -0.37 -2.12 6.46 -0.38 -3.31 115.31 116.18 1qso h LEU 41 Ca 0.00 -0.64 0.06 0.00 -0.12 0.00 0.00 57.88 57.18 1qso h LEU 41 Cb 0.04 -0.14 -0.06 0.00 -0.73 0.00 0.00 40.66 39.77 1qso h LEU 41 CO 0.00 1.54 0.01 0.44 -0.62 0.00 0.00 178.44 179.82 1qso h ASP 42 N 0.07 -0.12 -0.83 1.25 5.19 -1.70 -0.36 116.42 119.93 1qso h ASP 42 Ca -0.29 0.08 0.09 0.00 -0.62 0.00 0.00 57.03 56.29 1qso h ASP 42 Cb 2.04 0.14 -0.07 0.00 0.18 0.00 0.00 39.33 41.62 1qso h ASP 42 CO 0.15 -0.02 0.49 0.44 -3.12 0.00 0.00 179.24 177.18 1qso h ASP 43 N 0.12 0.71 -0.13 6.45 3.32 -1.73 0.01 116.42 125.18 1qso h ASP 43 Ca 0.18 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 1qso h ASP 43 Cb 0.24 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 1qso h ASP 43 CO -0.29 0.42 -0.00 0.15 -1.72 0.00 0.00 179.24 177.80 1qso h PHE 44 N 0.83 0.25 0.10 4.55 3.57 -1.41 -0.84 116.94 123.99 1qso h PHE 44 Ca 0.39 -0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.85 1qso h PHE 44 Cb 0.31 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1qso h PHE 44 CO -0.05 0.47 -0.38 -0.91 -2.23 0.00 0.00 178.31 175.21 1qso h ASN 45 N -0.05 -1.15 -0.58 0.41 2.35 -0.34 -0.21 115.58 116.02 1qso h ASN 45 Ca 0.04 0.12 0.15 0.00 -0.55 0.00 0.00 56.30 56.05 1qso h ASN 45 Cb 0.38 0.42 -0.03 0.00 0.05 0.00 0.00 38.32 39.14 1qso h ASN 45 CO 0.01 -0.41 0.41 0.15 -1.65 0.00 0.00 177.43 175.94 1qso h PHE 46 N -0.55 0.14 -0.46 1.19 3.57 -1.04 0.33 116.94 120.12 1qso h PHE 46 Ca -0.01 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 1qso h PHE 46 Cb 0.55 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.23 1qso h PHE 46 CO -0.40 0.06 0.17 0.78 -2.23 0.00 0.00 178.31 176.68 1qso h GLY 47 N 0.13 0.75 1.58 2.40 0.00 0.20 -1.60 103.07 106.52 1qso h GLY 47 Ca 0.28 -0.42 -0.15 0.00 0.00 0.00 0.00 47.33 47.04 1qso h GLY 47 CO -0.03 0.40 -0.52 3.21 0.00 0.00 0.00 176.54 179.60 1qso h ARG 48 N 0.60 0.45 0.32 4.80 3.08 0.12 -1.48 114.38 122.27 1qso h ARG 48 Ca 0.15 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1qso h ARG 48 Cb 0.22 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1qso h ARG 48 CO -0.01 0.86 -0.16 0.74 -1.07 0.00 0.00 179.97 180.33 1qso h PHE 49 N 0.35 -0.43 0.00 3.04 0.04 -0.64 -3.09 116.94 116.21 1qso h PHE 49 Ca 0.01 -0.01 -0.07 0.00 2.80 0.00 0.00 57.97 60.71 1qso h PHE 49 Cb 1.03 0.14 -0.01 0.00 2.20 0.00 0.00 35.95 39.31 1qso h PHE 49 CO 0.03 -0.26 -0.32 -0.07 -0.60 0.00 0.00 178.31 177.10 1qso h LEU 50 N -0.45 0.00 -9.12 1.54 3.38 -1.22 -3.43 115.31 106.01 1qso h LEU 50 Ca -0.04 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.37 1qso h LEU 50 Cb 0.35 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1qso h LEU 50 CO 0.06 0.32 1.07 -0.62 0.09 0.00 0.00 178.44 179.35 1qso s ASP 51 N -6.61 6.58 0.50 -0.43 -1.08 -0.57 -4.88 116.67 110.19 1qso s ASP 51 Ca -0.02 1.78 0.15 0.00 -0.52 0.00 0.00 52.55 53.94 1qso s ASP 51 Cb 0.13 -2.53 1.21 0.00 -1.46 0.00 0.00 42.92 40.27 1qso s ASP 51 CO 0.68 -1.06 2.14 -0.65 0.52 0.00 0.00 175.17 176.80 1qso h PRO 52 N 9.84 0.07 0.11 4.34 0.11 -1.86 -2.89 132.00 141.72 1qso h PRO 52 Ca -0.33 -0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.51 1qso h PRO 52 Cb 1.15 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1qso h PRO 52 CO 0.98 0.05 -1.20 -0.91 -0.21 0.00 0.00 178.00 176.72 1qso h ASN 53 N 0.07 0.40 -3.59 -2.05 2.35 -1.93 -3.43 115.58 107.41 1qso h ASN 53 Ca 0.02 -0.42 -0.58 0.00 -0.55 0.00 0.00 56.30 54.76 1qso h ASN 53 Cb -0.00 -0.13 -0.09 0.00 0.05 0.00 0.00 38.32 38.15 1qso h ASN 53 CO -0.00 1.32 0.70 -0.63 -1.65 0.00 0.00 177.43 177.16 1qso s ILE 54 N -2.72 4.44 -0.83 2.81 1.01 -1.09 -4.94 121.20 119.89 1qso s ILE 54 Ca -0.04 1.10 -0.08 0.00 0.00 0.00 0.00 60.65 61.63 1qso s ILE 54 Cb 0.07 -4.45 -0.06 0.00 0.01 0.00 0.00 42.46 38.03 1qso s ILE 54 CO 0.88 -0.76 2.00 0.29 0.00 0.00 0.00 174.94 177.36 1qso n LYS 55 N 7.19 1.85 -3.70 2.79 5.02 -1.26 -4.73 118.16 125.33 1qso n LYS 55 Ca 0.08 -1.45 -0.21 0.00 -2.02 0.00 0.00 58.31 54.72 1qso n LYS 55 Cb 0.48 -2.49 -0.18 0.00 -0.02 0.00 0.00 35.03 32.82 1qso n LYS 55 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1qso s MET 56 N 3.77 0.12 0.45 1.97 1.75 -1.26 -1.81 119.30 124.28 1qso s MET 56 Ca 0.40 0.30 0.05 0.00 -1.25 0.00 0.00 55.69 55.19 1qso s MET 56 Cb 0.10 -0.65 -0.05 0.00 2.84 0.00 0.00 34.83 37.08 1qso s MET 56 CO -0.01 -0.32 0.08 -1.58 -0.65 0.00 0.00 175.02 172.54 1qso s TRP 57 N 2.11 2.31 -0.22 4.11 0.51 0.07 -3.42 118.94 124.42 1qso s TRP 57 Ca 0.05 -0.73 -0.09 0.00 -2.12 0.00 0.00 56.10 53.20 1qso s TRP 57 Cb -0.12 -1.79 0.09 0.00 -0.81 0.00 0.00 33.47 30.83 1qso s TRP 57 CO -0.04 0.26 0.49 0.00 -0.51 0.00 0.00 176.95 177.16 1qso s ALA 58 N -2.73 -1.36 0.24 0.98 0.00 -1.26 -1.88 121.76 115.75 1qso s ALA 58 Ca 0.29 1.78 0.08 0.00 0.00 0.00 0.00 51.96 54.11 1qso s ALA 58 Cb 0.06 -1.29 -0.04 0.00 0.00 0.00 0.00 23.12 21.85 1qso s ALA 58 CO 0.16 -0.57 0.06 0.00 0.00 0.00 0.00 175.76 175.40 1qso s ALA 59 N 2.13 3.31 0.03 0.00 0.00 -0.53 -1.80 121.76 124.89 1qso s ALA 59 Ca -0.06 -1.51 0.04 0.00 0.00 0.00 0.00 51.96 50.43 1qso s ALA 59 Cb -0.10 -0.99 -0.02 0.00 0.00 0.00 0.00 23.12 22.01 1qso s ALA 59 CO -0.15 0.31 -0.12 0.08 0.00 0.00 0.00 175.76 175.88 1qso s VAL 60 N -2.14 0.97 -0.43 0.00 1.01 0.43 -2.31 120.40 117.94 1qso s VAL 60 Ca 0.31 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 61.32 1qso s VAL 60 Cb -0.07 -0.88 0.07 0.00 0.00 0.00 0.00 36.38 35.50 1qso s VAL 60 CO 0.21 0.02 0.30 0.00 0.00 0.00 0.00 175.10 175.64 1qso s ALA 61 N -0.74 3.39 -0.01 5.51 0.00 -0.46 -1.79 121.76 127.66 1qso s ALA 61 Ca 0.01 -2.08 -0.04 0.00 0.00 0.00 0.00 51.96 49.85 1qso s ALA 61 Cb -0.07 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.21 1qso s ALA 61 CO 0.01 -1.64 0.21 0.14 0.00 0.00 0.00 175.76 174.47 1qso s VAL 62 N 1.52 5.39 -0.90 0.00 -7.23 0.83 -0.09 120.40 119.93 1qso s VAL 62 Ca 0.03 -0.01 -0.24 0.00 -1.81 0.00 0.00 61.98 59.95 1qso s VAL 62 Cb -0.23 -3.54 -0.04 0.00 0.56 0.00 0.00 36.38 33.14 1qso s VAL 62 CO 0.04 0.36 1.90 -1.61 -0.31 0.00 0.00 175.10 175.49 1qso s GLU 63 N -1.80 2.64 0.04 4.82 2.02 0.33 -0.00 118.70 126.75 1qso s GLU 63 Ca 0.26 -0.33 -0.36 0.00 0.02 0.00 0.00 54.97 54.56 1qso s GLU 63 Cb -0.13 -5.06 -0.16 0.00 0.10 0.00 0.00 34.13 28.88 1qso s GLU 63 CO 0.16 -3.26 1.48 0.45 0.02 0.00 0.00 175.26 174.12 1qso n SER 64 N 13.53 2.19 -1.42 -0.19 2.88 -1.26 -0.41 113.62 128.94 1qso n SER 64 Ca 0.39 1.10 -0.10 0.00 -1.33 0.00 0.00 58.87 58.93 1qso n SER 64 Cb 0.47 -1.25 0.01 0.00 -0.75 0.00 0.00 64.21 62.70 1qso n SER 64 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1qso n SER 65 N 3.38 -3.52 0.00 -3.46 2.88 -1.26 -4.28 113.62 107.36 1qso n SER 65 Ca 0.19 -0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 1qso n SER 65 Cb 0.21 -2.47 0.00 0.00 -0.75 0.00 0.00 64.21 61.20 1qso n SER 65 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1qso n SER 66 N -0.09 0.00 0.00 -3.46 7.64 0.45 -5.09 113.62 113.07 1qso n SER 66 Ca -0.06 -0.83 0.00 0.00 1.01 0.00 0.00 58.87 58.99 1qso n SER 66 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 1qso n SER 66 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1qso n GLU 67 N 0.00 0.00 -0.77 1.43 1.02 -0.80 -4.87 120.64 116.66 1qso n GLU 67 Ca 0.00 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.86 1qso n GLU 67 Cb 0.23 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.68 1qso n GLU 67 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1qso n LYS 68 N 0.00 0.00 -3.81 3.49 2.85 -1.26 -4.00 118.16 115.42 1qso n LYS 68 Ca 0.00 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 56.91 1qso n LYS 68 Cb 0.00 -0.77 -0.05 0.00 -0.65 0.00 0.00 35.03 33.56 1qso n LYS 68 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1qso s ILE 69 N -1.53 5.38 0.00 0.58 1.01 -1.26 -0.51 121.20 124.87 1qso s ILE 69 Ca 0.30 0.17 0.00 0.00 0.00 0.00 0.00 60.65 61.12 1qso s ILE 69 Cb -0.09 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 38.87 1qso s ILE 69 CO 0.60 0.46 0.00 2.30 0.00 0.00 0.00 174.94 178.31 1qso n ILE 70 N 1.44 0.00 -4.12 2.92 -5.35 0.88 -4.92 119.36 110.20 1qso n ILE 70 Ca -0.14 -0.03 -0.13 0.00 -0.27 0.00 0.00 62.75 62.18 1qso n ILE 70 Cb 0.53 0.53 -0.11 0.00 -1.74 0.00 0.00 39.64 38.85 1qso n ILE 70 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1qso s GLY 71 N -0.20 0.66 -0.07 3.28 0.00 -1.01 -1.33 107.32 108.65 1qso s GLY 71 Ca 0.00 -1.03 -0.04 0.00 0.00 0.00 0.00 44.72 43.65 1qso s GLY 71 CO 0.00 -1.10 0.16 -0.29 0.00 0.00 0.00 173.10 171.87 1qso s MET 72 N -2.51 0.15 -0.10 2.90 1.75 0.41 -1.35 119.30 120.55 1qso s MET 72 Ca -0.00 0.32 -0.03 0.00 -1.25 0.00 0.00 55.69 54.73 1qso s MET 72 Cb -0.04 -0.05 0.05 0.00 2.84 0.00 0.00 34.83 37.63 1qso s MET 72 CO -0.01 -0.10 0.14 -1.50 -0.65 0.00 0.00 175.02 172.90 1qso s ILE 73 N 0.70 -0.23 -0.14 10.11 2.07 -0.98 -0.46 121.20 132.27 1qso s ILE 73 Ca -0.05 0.28 -0.03 0.00 -1.41 0.00 0.00 60.65 59.43 1qso s ILE 73 Cb -0.07 -0.33 -0.03 0.00 0.13 0.00 0.00 42.46 42.16 1qso s ILE 73 CO -0.04 0.08 -0.04 0.20 -1.91 0.00 0.00 174.94 173.23 1qso s ASN 74 N 2.26 4.77 0.16 4.50 0.02 -0.46 -1.46 114.94 124.73 1qso s ASN 74 Ca 0.04 -0.12 -0.05 0.00 -1.02 0.00 0.00 52.86 51.71 1qso s ASN 74 Cb -0.13 -1.71 -0.02 0.00 0.02 0.00 0.00 41.25 39.41 1qso s ASN 74 CO -0.06 0.19 0.19 0.72 0.02 0.00 0.00 177.10 178.16 1qso s PHE 75 N 0.21 0.68 0.16 2.20 -0.12 -0.79 0.11 117.98 120.43 1qso s PHE 75 Ca -0.02 -1.02 -0.20 0.00 -0.05 0.00 0.00 56.93 55.63 1qso s PHE 75 Cb -0.14 -0.27 0.05 0.00 -0.63 0.00 0.00 43.02 42.03 1qso s PHE 75 CO 0.03 -0.65 0.53 -0.59 -0.05 0.00 0.00 175.22 174.49 1qso s PHE 76 N -4.03 -0.35 -0.06 3.49 -0.12 -0.71 -0.75 117.98 115.44 1qso s PHE 76 Ca 0.23 0.08 -0.10 0.00 -0.05 0.00 0.00 56.93 57.09 1qso s PHE 76 Cb 0.05 0.45 -0.05 0.00 -0.63 0.00 0.00 43.02 42.84 1qso s PHE 76 CO 0.03 -0.83 0.26 1.21 -0.05 0.00 0.00 175.22 175.84 1qso s ASN 77 N -2.79 6.57 -0.01 1.98 2.47 -0.75 -0.94 114.94 121.46 1qso s ASN 77 Ca 0.03 0.68 -0.20 0.00 0.42 0.00 0.00 52.86 53.79 1qso s ASN 77 Cb -0.00 -2.15 0.04 0.00 -1.45 0.00 0.00 41.25 37.69 1qso s ASN 77 CO -0.10 0.37 0.44 -1.38 -3.72 0.00 0.00 177.10 172.70 1qso s HIS 78 N -1.07 -0.33 0.73 0.43 -3.43 -0.02 -4.95 115.29 106.65 1qso s HIS 78 Ca 0.19 0.49 -0.11 0.00 -0.80 0.00 0.00 55.06 54.83 1qso s HIS 78 Cb -0.14 0.21 0.03 0.00 -1.43 0.00 0.00 32.58 31.26 1qso s HIS 78 CO 0.08 -0.50 1.08 0.00 -2.00 0.00 0.00 174.74 173.41 1qso s MET 79 N -1.58 2.62 0.02 -0.38 0.23 -1.26 -1.53 119.30 117.42 1qso s MET 79 Ca -0.11 0.70 -0.02 0.00 -1.03 0.00 0.00 55.69 55.23 1qso s MET 79 Cb -0.03 -1.97 -0.02 0.00 -1.53 0.00 0.00 34.83 31.28 1qso s MET 79 CO 0.04 -1.26 0.01 -0.08 -2.03 0.00 0.00 175.02 171.70 1qso s THR 80 N -3.17 0.11 -0.73 3.16 -1.32 -1.26 -4.87 115.64 107.56 1qso s THR 80 Ca 0.59 -0.93 0.26 0.00 -1.21 0.00 0.00 61.69 60.39 1qso s THR 80 Cb -0.13 -0.40 0.19 0.00 -1.51 0.00 0.00 72.50 70.64 1qso s THR 80 CO 0.54 -0.51 1.61 0.35 -2.21 0.00 0.00 174.62 174.39 1qso n THR 81 N 1.43 0.44 1.60 5.08 -2.24 -1.26 -3.89 114.28 115.45 1qso n THR 81 Ca -0.23 -0.25 0.13 0.00 -2.27 0.00 0.00 64.05 61.44 1qso n THR 81 Cb 0.56 -0.38 0.59 0.00 -2.10 0.00 0.00 70.33 69.00 1qso n THR 81 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1qso n TRP 82 N -2.12 0.05 -3.58 4.78 7.02 -1.26 -4.93 117.44 117.41 1qso n TRP 82 Ca 0.05 -0.02 -0.11 0.00 -1.02 0.00 0.00 57.50 56.39 1qso n TRP 82 Cb 0.42 0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 29.26 1qso n TRP 82 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1qso s ASP 83 N -1.85 -0.41 0.09 -0.99 3.68 -1.25 -5.06 116.67 110.88 1qso s ASP 83 Ca 0.38 0.49 -0.25 0.00 2.13 0.00 0.00 52.55 55.29 1qso s ASP 83 Cb 0.19 0.39 -0.14 0.00 -1.45 0.00 0.00 42.92 41.91 1qso s ASP 83 CO 0.31 -0.36 1.71 -0.26 0.13 0.00 0.00 175.17 176.70 1qso h PHE 84 N 2.77 -0.23 -4.22 -5.34 -1.00 -1.91 -3.42 116.94 103.58 1qso h PHE 84 Ca -0.20 -0.00 -0.51 0.00 2.81 0.00 0.00 57.97 60.07 1qso h PHE 84 Cb 1.16 0.09 0.11 0.00 3.61 0.00 0.00 35.95 40.92 1qso h PHE 84 CO 0.31 -0.14 0.36 0.15 -1.61 0.00 0.00 178.31 177.38 1qso s LYS 85 N -6.16 2.63 0.00 1.51 1.02 -1.26 -4.98 119.74 112.50 1qso s LYS 85 Ca -0.14 1.39 0.00 0.00 0.02 0.00 0.00 55.97 57.24 1qso s LYS 85 Cb 0.06 -1.93 0.00 0.00 -0.52 0.00 0.00 37.83 35.44 1qso s LYS 85 CO 0.66 -1.38 0.00 -0.25 -0.92 0.00 0.00 175.35 173.45 1qso n ASP 86 N -2.65 0.00 -3.99 2.83 9.92 -1.26 -4.66 116.55 116.74 1qso n ASP 86 Ca 0.10 -0.89 -0.09 0.00 -0.53 0.00 0.00 54.79 53.38 1qso n ASP 86 Cb 0.52 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 40.92 1qso n ASP 86 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 1qso s LYS 87 N -2.26 1.02 -0.05 -1.24 -2.85 -0.58 -4.66 119.74 109.11 1qso s LYS 87 Ca 0.00 -1.19 0.03 0.00 -1.00 0.00 0.00 55.97 53.80 1qso s LYS 87 Cb 0.00 0.33 -0.03 0.00 -2.06 0.00 0.00 37.83 36.08 1qso s LYS 87 CO 0.00 -0.34 -0.11 0.42 0.10 0.00 0.00 175.35 175.41 1qso s ILE 88 N -3.96 3.30 -0.17 3.79 1.01 -0.92 -0.84 121.20 123.41 1qso s ILE 88 Ca 0.16 -0.65 0.01 0.00 0.00 0.00 0.00 60.65 60.17 1qso s ILE 88 Cb 0.05 -2.32 0.02 0.00 0.01 0.00 0.00 42.46 40.22 1qso s ILE 88 CO -0.02 0.58 -0.18 -0.47 0.00 0.00 0.00 174.94 174.85 1qso s TYR 89 N -0.77 2.60 -0.54 3.97 5.04 -0.12 -1.94 117.35 125.58 1qso s TYR 89 Ca 0.12 -1.52 -0.28 0.00 -2.44 0.00 0.00 57.07 52.95 1qso s TYR 89 Cb -0.11 -1.82 0.03 0.00 0.35 0.00 0.00 41.96 40.41 1qso s TYR 89 CO 0.01 -0.77 1.12 0.42 -1.34 0.00 0.00 175.55 175.00 1qso s ILE 90 N 1.35 4.15 0.08 3.14 1.01 -0.33 -1.74 121.20 128.86 1qso s ILE 90 Ca 0.05 0.89 0.08 0.00 0.00 0.00 0.00 60.65 61.67 1qso s ILE 90 Cb -0.13 -4.65 -0.22 0.00 0.01 0.00 0.00 42.46 37.47 1qso s ILE 90 CO -0.12 -1.19 1.11 -1.13 0.00 0.00 0.00 174.94 173.61 1qso h ASN 91 N 9.39 0.02 -4.71 3.58 -0.73 -0.65 -3.43 115.58 119.06 1qso h ASN 91 Ca -0.24 -0.03 -0.17 0.00 1.87 0.00 0.00 56.30 57.73 1qso h ASN 91 Cb 1.06 -0.01 -0.22 0.00 0.27 0.00 0.00 38.32 39.42 1qso h ASN 91 CO 1.15 1.02 -0.58 -1.81 -0.37 0.00 0.00 177.43 176.84 1qso s ASP 92 N -6.57 0.06 -0.13 1.15 1.01 -0.70 -4.96 116.67 106.53 1qso s ASP 92 Ca -0.01 -0.21 -0.06 0.00 0.71 0.00 0.00 52.55 52.98 1qso s ASP 92 Cb 0.09 0.17 0.05 0.00 1.01 0.00 0.00 42.92 44.25 1qso s ASP 92 CO 0.82 -0.27 0.29 -0.22 0.21 0.00 0.00 175.17 176.00 1qso s LEU 93 N -1.09 0.10 -0.28 1.23 2.96 -1.25 -1.36 118.68 118.99 1qso s LEU 93 Ca -0.12 0.63 -0.11 0.00 -0.22 0.00 0.00 54.13 54.32 1qso s LEU 93 Cb -0.07 0.88 0.11 0.00 0.50 0.00 0.00 46.19 47.61 1qso s LEU 93 CO 0.00 -0.19 0.63 -0.47 -1.32 0.00 0.00 176.35 175.01 1qso s TYR 94 N 1.61 -1.22 0.29 5.38 5.04 0.39 -4.98 117.35 123.87 1qso s TYR 94 Ca -0.07 2.20 0.10 0.00 -2.44 0.00 0.00 57.07 56.86 1qso s TYR 94 Cb -0.10 0.71 -0.05 0.00 0.35 0.00 0.00 41.96 42.87 1qso s TYR 94 CO -0.10 -0.61 -0.02 0.08 -1.34 0.00 0.00 175.55 173.56 1qso s VAL 95 N 2.55 3.04 0.13 3.14 1.01 -1.26 -0.45 120.40 128.57 1qso s VAL 95 Ca -0.07 -1.99 -0.30 0.00 0.00 0.00 0.00 61.98 59.63 1qso s VAL 95 Cb -0.10 -2.76 -0.07 0.00 0.00 0.00 0.00 36.38 33.45 1qso s VAL 95 CO -0.19 -0.31 1.14 -1.81 0.00 0.00 0.00 175.10 173.93 1qso s ASP 96 N -3.68 7.18 -0.92 3.32 -0.00 -0.44 -4.80 116.67 117.33 1qso s ASP 96 Ca 0.33 2.07 -0.27 0.00 -0.00 0.00 0.00 52.55 54.67 1qso s ASP 96 Cb -0.04 -2.59 -0.26 0.00 -0.00 0.00 0.00 42.92 40.03 1qso s ASP 96 CO 0.19 -0.33 2.02 1.21 -0.00 0.00 0.00 175.17 178.27 1qso n GLU 97 N 2.98 0.08 0.00 8.23 0.00 -1.26 -1.02 120.64 129.64 1qso n GLU 97 Ca 0.05 -1.58 0.00 0.00 0.00 0.00 0.00 57.16 55.63 1qso n GLU 97 Cb 0.46 -3.70 0.00 0.00 0.00 0.00 0.00 31.44 28.20 1qso n GLU 97 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 1qso n ASN 98 N 18.30 0.00 -0.47 4.31 6.94 -1.26 -4.89 115.26 138.19 1qso n ASN 98 Ca 0.41 0.00 0.08 0.00 -0.02 0.00 0.00 54.58 55.05 1qso n ASN 98 Cb 0.46 0.00 0.29 0.00 -2.36 0.00 0.00 39.78 38.18 1qso n ASN 98 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1qso n SER 99 N 0.00 1.40 -0.08 0.53 3.41 -0.81 -4.17 113.62 113.90 1qso n SER 99 Ca 0.00 -1.79 -0.08 0.00 -0.26 0.00 0.00 58.87 56.74 1qso n SER 99 Cb 0.00 -0.13 -0.01 0.00 -0.26 0.00 0.00 64.21 63.82 1qso n SER 99 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1qso h ARG 100 N 1.72 0.31 -0.00 4.33 2.43 -1.39 -2.86 114.38 118.92 1qso h ARG 100 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1qso h ARG 100 Cb 0.38 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1qso h ARG 100 CO 0.00 0.21 -0.16 1.33 -1.51 0.00 0.00 179.97 179.84 1qso n VAL 101 N -4.95 0.00 -0.65 0.20 0.24 -1.26 -4.09 118.33 107.82 1qso n VAL 101 Ca -0.01 -0.06 -0.10 0.00 -2.04 0.00 0.00 64.34 62.13 1qso n VAL 101 Cb 0.07 -0.03 0.03 0.00 -1.47 0.00 0.00 33.84 32.43 1qso n VAL 101 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1qso n LYS 102 N -1.01 1.49 0.00 7.34 4.76 -1.08 -4.82 118.16 124.84 1qso n LYS 102 Ca 0.13 -0.96 0.00 0.00 -2.87 0.00 0.00 58.31 54.61 1qso n LYS 102 Cb 0.30 -1.38 0.00 0.00 -1.84 0.00 0.00 35.03 32.11 1qso n LYS 102 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1qso n GLY 103 N 0.72 3.01 0.19 0.72 0.00 -1.26 -4.98 105.19 103.59 1qso n GLY 103 Ca 0.18 -0.37 -0.05 0.00 0.00 0.00 0.00 46.02 45.79 1qso n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qso n ALA 104 N 0.00 -0.29 -0.22 4.61 0.00 -1.26 -0.84 120.51 122.51 1qso n ALA 104 Ca 0.00 0.39 0.14 0.00 0.00 0.00 0.00 53.44 53.97 1qso n ALA 104 Cb 0.00 0.19 0.44 0.00 0.00 0.00 0.00 19.45 20.08 1qso n ALA 104 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1qso h GLY 105 N 0.00 0.95 1.54 0.00 0.00 -1.90 0.15 103.07 103.81 1qso h GLY 105 Ca 0.07 -0.24 -0.28 0.00 0.00 0.00 0.00 47.33 46.89 1qso h GLY 105 CO -0.43 0.07 -1.24 -1.33 0.00 0.00 0.00 176.54 173.61 1qso h GLY 106 N 0.55 0.41 1.05 4.60 0.00 -1.76 -2.50 103.07 105.42 1qso h GLY 106 Ca 0.41 -0.97 -0.07 0.00 0.00 0.00 0.00 47.33 46.70 1qso h GLY 106 CO -0.16 0.85 0.17 1.70 0.00 0.00 0.00 176.54 179.10 1qso h LYS 107 N 0.12 1.10 0.05 4.80 1.63 -0.15 -2.40 116.57 121.72 1qso h LYS 107 Ca -0.15 -0.26 -0.00 0.00 -0.85 0.00 0.00 60.65 59.38 1qso h LYS 107 Cb 1.95 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 33.44 1qso h LYS 107 CO 0.21 0.97 -0.03 -0.07 -3.45 0.00 0.00 179.45 177.09 1qso h LEU 108 N 1.03 -0.06 -2.47 5.20 3.38 -0.79 -2.56 115.31 119.04 1qso h LEU 108 Ca 0.22 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1qso h LEU 108 Cb 0.37 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1qso h LEU 108 CO 0.00 0.28 0.00 0.40 0.09 0.00 0.00 178.44 179.21 1qso h ILE 109 N -0.41 0.52 0.07 1.22 2.04 -1.40 -0.43 117.51 119.13 1qso h ILE 109 Ca -0.01 0.00 -0.25 0.00 1.00 0.00 0.00 64.86 65.61 1qso h ILE 109 Cb 0.36 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1qso h ILE 109 CO 0.01 0.00 -1.11 -0.61 0.00 0.00 0.00 178.15 176.45 1qso h GLN 110 N 0.00 0.23 -0.60 2.37 -0.00 -1.31 -2.87 115.11 112.92 1qso h GLN 110 Ca 0.00 -0.35 0.03 0.00 -0.00 0.00 0.00 58.65 58.33 1qso h GLN 110 Cb 0.00 0.12 -0.04 0.00 0.00 0.00 0.00 27.48 27.57 1qso h GLN 110 CO -0.00 1.13 0.37 0.35 0.00 0.00 0.00 178.83 180.68 1qso h PHE 111 N 0.09 0.69 -0.39 3.99 3.57 -0.66 0.34 116.94 124.56 1qso h PHE 111 Ca -0.09 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.37 1qso h PHE 111 Cb 1.81 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 40.31 1qso h PHE 111 CO 0.05 0.40 -0.00 0.28 -2.23 0.00 0.00 178.31 176.80 1qso h VAL 112 N 0.73 1.22 0.13 1.41 2.07 -1.46 0.31 116.25 120.66 1qso h VAL 112 Ca 0.24 -0.88 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 1qso h VAL 112 Cb 0.02 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1qso h VAL 112 CO -0.10 0.30 -0.06 1.88 0.02 0.00 0.00 177.57 179.61 1qso h TYR 113 N 0.60 -0.16 -0.33 1.57 0.05 -0.96 0.26 116.97 117.99 1qso h TYR 113 Ca 0.12 -0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.88 1qso h TYR 113 Cb 0.38 0.05 -0.02 0.00 1.01 0.00 0.00 36.73 38.15 1qso h TYR 113 CO 0.02 0.21 0.11 -0.44 -1.05 0.00 0.00 178.16 177.01 1qso h ASP 114 N -0.57 0.43 0.15 3.88 3.32 -0.20 -1.03 116.42 122.40 1qso h ASP 114 Ca -0.02 -0.04 -0.31 0.00 0.02 0.00 0.00 57.03 56.68 1qso h ASP 114 Cb 0.44 -0.11 0.03 0.00 0.22 0.00 0.00 39.33 39.92 1qso h ASP 114 CO 0.03 0.41 -1.29 -0.33 -1.72 0.00 0.00 179.24 176.34 1qso h GLU 115 N 0.47 0.61 -0.65 3.56 4.39 -0.92 -3.02 114.58 119.02 1qso h GLU 115 Ca 0.12 -0.86 0.07 0.00 0.34 0.00 0.00 59.36 59.03 1qso h GLU 115 Cb 0.13 0.29 -0.04 0.00 -0.10 0.00 0.00 28.75 29.03 1qso h GLU 115 CO -0.01 1.40 0.43 0.00 -1.16 0.00 0.00 179.01 179.67 1qso h ALA 116 N 0.26 1.81 0.20 3.43 0.00 0.13 -0.44 119.26 124.66 1qso h ALA 116 Ca -0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1qso h ALA 116 Cb 1.96 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1qso h ALA 116 CO 0.25 0.07 -0.10 -0.44 0.00 0.00 0.00 179.25 179.03 1qso h ASP 117 N 0.61 -0.23 -0.91 0.00 3.32 -1.23 -1.56 116.42 116.42 1qso h ASP 117 Ca 0.29 -0.22 0.15 0.00 0.02 0.00 0.00 57.03 57.27 1qso h ASP 117 Cb 0.34 0.06 -0.09 0.00 0.22 0.00 0.00 39.33 39.85 1qso h ASP 117 CO -0.09 0.10 0.52 0.11 -1.72 0.00 0.00 179.24 178.16 1qso h LYS 118 N -0.59 0.72 0.00 3.56 1.57 -1.21 0.28 116.57 120.90 1qso h LYS 118 Ca -0.03 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1qso h LYS 118 Cb 0.43 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1qso h LYS 118 CO 0.05 0.47 0.00 1.28 -0.57 0.00 0.00 179.45 180.68 1qso n LEU 119 N -4.79 0.09 -0.50 2.94 4.77 -0.25 -4.84 117.00 114.42 1qso n LEU 119 Ca 0.19 0.53 -0.06 0.00 -0.03 0.00 0.00 56.01 56.63 1qso n LEU 119 Cb 0.44 -0.52 -0.03 0.00 -2.33 0.00 0.00 43.42 40.99 1qso n LEU 119 CO 0.23 -0.36 -0.06 0.61 -1.33 0.00 0.00 177.39 176.47 1qso n GLY 120 N -0.37 0.86 2.44 -0.72 0.00 1.00 -4.94 105.19 103.45 1qso n GLY 120 Ca 0.02 -0.49 -0.27 0.00 0.00 0.00 0.00 46.02 45.29 1qso n GLY 120 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1qso n THR 121 N -2.71 -0.52 0.09 2.61 5.66 -0.61 -4.83 114.28 113.98 1qso n THR 121 Ca -0.06 -3.83 -0.05 0.00 -3.05 0.00 0.00 64.05 57.05 1qso n THR 121 Cb 0.26 -1.81 0.10 0.00 -1.55 0.00 0.00 70.33 67.33 1qso n THR 121 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 1qso h PRO 122 N 5.24 0.18 -5.41 1.09 0.13 -1.81 -3.41 132.00 128.01 1qso h PRO 122 Ca 0.21 -0.14 -0.07 0.00 -0.87 0.00 0.00 66.00 65.13 1qso h PRO 122 Cb 0.87 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.01 1qso h PRO 122 CO 0.46 0.78 0.19 0.45 -0.23 0.00 0.00 178.00 179.66 1qso s SER 123 N -6.89 4.13 0.27 1.44 0.15 -1.26 -4.86 113.70 106.67 1qso s SER 123 Ca -0.03 -0.22 -0.05 0.00 0.70 0.00 0.00 55.95 56.35 1qso s SER 123 Cb 0.12 -2.56 -0.05 0.00 -1.71 0.00 0.00 66.02 61.82 1qso s SER 123 CO 0.80 -3.71 0.53 -0.69 1.20 0.00 0.00 173.24 171.36 1qso s VAL 124 N 13.96 5.04 0.11 4.45 1.01 -1.26 -2.17 120.40 141.54 1qso s VAL 124 Ca 0.86 0.04 -0.25 0.00 0.00 0.00 0.00 61.98 62.63 1qso s VAL 124 Cb -0.11 -3.72 0.07 0.00 0.00 0.00 0.00 36.38 32.63 1qso s VAL 124 CO 0.07 -0.27 0.83 -0.72 0.00 0.00 0.00 175.10 175.01 1qso s TYR 125 N -2.02 -0.30 0.00 5.22 -0.85 -0.82 -4.96 117.35 113.61 1qso s TYR 125 Ca 0.43 0.06 0.00 0.00 -0.52 0.00 0.00 57.07 57.05 1qso s TYR 125 Cb -0.11 0.59 0.00 0.00 0.38 0.00 0.00 41.96 42.83 1qso s TYR 125 CO 0.29 -0.78 0.00 -2.67 -1.52 0.00 0.00 175.55 170.87 1qso n TRP 126 N -0.37 -0.07 -3.60 -3.49 2.14 -1.26 -1.18 117.44 109.61 1qso n TRP 126 Ca -0.09 0.00 0.02 0.00 2.07 0.00 0.00 57.50 59.50 1qso n TRP 126 Cb 0.62 0.00 -0.00 0.00 -0.81 0.00 0.00 31.31 31.11 1qso n TRP 126 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1qso n THR 128 N -0.46 0.00 -2.38 0.00 -2.24 -1.26 -5.08 114.28 102.86 1qso n THR 128 Ca -0.08 -1.19 -0.41 0.00 -2.27 0.00 0.00 64.05 60.10 1qso n THR 128 Cb 0.63 0.91 -0.04 0.00 -2.10 0.00 0.00 70.33 69.73 1qso n THR 128 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1qso s ASP 129 N -2.86 7.13 0.52 3.42 1.01 -1.26 -4.90 116.67 119.72 1qso s ASP 129 Ca 0.19 2.35 0.29 0.00 0.71 0.00 0.00 52.55 56.09 1qso s ASP 129 Cb -0.03 -2.63 1.40 0.00 1.01 0.00 0.00 42.92 42.68 1qso s ASP 129 CO 0.14 -0.26 1.89 1.05 0.21 0.00 0.00 175.17 178.20 1qso h GLU 130 N 3.99 0.07 -0.01 8.23 4.11 -2.05 0.16 114.58 129.08 1qso h GLU 130 Ca -0.47 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1qso h GLU 130 Cb 1.21 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1qso h GLU 130 CO 0.68 0.05 -0.07 -1.13 0.07 0.00 0.00 179.01 178.61 1qso n SER 131 N -4.32 0.79 -4.41 3.06 3.41 -1.26 -4.59 113.62 106.29 1qso n SER 131 Ca 0.18 -1.00 -0.43 0.00 -0.26 0.00 0.00 58.87 57.35 1qso n SER 131 Cb 0.89 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 1qso n SER 131 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1qso n ASN 132 N -0.55 4.96 -0.04 4.04 2.85 0.55 -4.78 115.26 122.31 1qso n ASN 132 Ca 0.18 -2.95 -0.14 0.00 -0.11 0.00 0.00 54.58 51.56 1qso n ASN 132 Cb 0.28 -1.65 -0.09 0.00 1.24 0.00 0.00 39.78 39.55 1qso n ASN 132 CO 0.00 0.00 0.00 0.45 -2.11 0.00 0.00 177.26 175.60 1qso h HIS 133 N 7.12 0.27 -0.80 1.20 3.86 -1.84 -3.04 115.15 121.91 1qso h HIS 133 Ca 0.41 -0.10 0.19 0.00 -1.16 0.00 0.00 60.37 59.71 1qso h HIS 133 Cb 0.83 -0.05 -0.14 0.00 1.06 0.00 0.00 27.41 29.11 1qso h HIS 133 CO 1.29 0.73 0.02 -0.09 0.86 0.00 0.00 177.93 180.74 1qso h ARG 134 N -0.27 0.09 -0.25 2.45 9.65 -2.00 0.21 114.38 124.26 1qso h ARG 134 Ca 0.00 -0.01 -0.13 0.00 -1.10 0.00 0.00 59.98 58.75 1qso h ARG 134 Cb 0.72 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.27 1qso h ARG 134 CO 0.03 0.06 -0.38 0.00 2.80 0.00 0.00 179.97 182.48 1qso h ALA 135 N 1.76 0.88 0.00 2.80 0.00 -1.97 -2.93 119.26 119.80 1qso h ALA 135 Ca 0.45 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1qso h ALA 135 Cb 0.82 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1qso h ALA 135 CO -0.71 0.63 0.00 1.96 0.00 0.00 0.00 179.25 181.13 1qso h GLN 136 N 0.47 0.00 -0.03 0.00 4.20 -0.51 -1.51 115.11 117.73 1qso h GLN 136 Ca 0.04 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.70 1qso h GLN 136 Cb 0.87 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 1qso h GLN 136 CO 0.07 0.00 -0.26 -0.07 -0.67 0.00 0.00 178.83 177.90 1qso h LEU 137 N 0.00 0.04 0.11 1.46 3.38 -1.08 -2.28 115.31 116.94 1qso h LEU 137 Ca 0.00 -0.01 -0.35 0.00 0.09 0.00 0.00 57.88 57.61 1qso h LEU 137 Cb 0.44 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1qso h LEU 137 CO 0.00 0.31 -1.92 -0.11 0.09 0.00 0.00 178.44 176.80 1qso n LEU 138 N -4.21 2.55 -0.30 1.67 7.94 -0.91 -4.35 117.00 119.39 1qso n LEU 138 Ca -0.02 0.23 0.03 0.00 -1.11 0.00 0.00 56.01 55.14 1qso n LEU 138 Cb 0.32 -1.10 0.17 0.00 0.53 0.00 0.00 43.42 43.35 1qso n LEU 138 CO 0.38 0.78 1.16 1.88 -1.11 0.00 0.00 177.39 180.48 1qso h TYR 139 N -0.07 0.91 -0.07 1.96 0.99 -1.14 -1.28 116.97 118.27 1qso h TYR 139 Ca -0.42 0.03 -0.03 0.00 2.00 0.00 0.00 58.73 60.31 1qso h TYR 139 Cb 1.94 -0.28 -0.01 0.00 1.00 0.00 0.00 36.73 39.38 1qso h TYR 139 CO 0.08 0.39 -0.11 0.28 -0.00 0.00 0.00 178.16 178.80 1qso h VAL 140 N 0.85 1.12 0.20 -2.88 2.07 -1.57 0.83 116.25 116.87 1qso h VAL 140 Ca 0.41 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1qso h VAL 140 Cb 0.35 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1qso h VAL 140 CO -0.24 0.17 -0.10 0.11 0.02 0.00 0.00 177.57 177.53 1qso h LYS 141 N 0.11 -0.26 0.00 1.57 1.57 -1.44 -3.36 116.57 114.76 1qso h LYS 141 Ca 0.02 0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1qso h LYS 141 Cb 0.26 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 1qso h LYS 141 CO 0.02 -0.18 -0.01 -0.39 -0.57 0.00 0.00 179.45 178.32 1qso h VAL 142 N -0.54 0.02 -2.11 0.50 -1.51 -1.49 -3.46 116.25 107.66 1qso h VAL 142 Ca -0.03 -0.41 -0.02 0.00 -1.23 0.00 0.00 66.70 65.02 1qso h VAL 142 Cb 0.21 1.40 -0.00 0.00 -2.13 0.00 0.00 31.29 30.77 1qso h VAL 142 CO 0.05 0.01 -0.01 0.61 -1.23 0.00 0.00 177.57 177.00 1qso n GLY 143 N -0.22 2.95 3.10 5.19 0.00 0.28 -5.09 105.19 111.40 1qso n GLY 143 Ca -0.00 -1.35 -0.16 0.00 0.00 0.00 0.00 46.02 44.51 1qso n GLY 143 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1qso s TYR 144 N -5.34 0.92 0.07 1.61 -0.85 -1.26 -4.15 117.35 108.35 1qso s TYR 144 Ca 0.02 -0.44 -0.30 0.00 -0.52 0.00 0.00 57.07 55.82 1qso s TYR 144 Cb -0.00 -0.54 -0.06 0.00 0.38 0.00 0.00 41.96 41.75 1qso s TYR 144 CO 0.01 -0.01 1.16 0.21 -1.52 0.00 0.00 175.55 175.40 1qso s LYS 145 N -1.49 4.46 0.06 -3.49 2.20 -1.26 -5.03 119.74 115.19 1qso s LYS 145 Ca -0.05 1.72 -0.14 0.00 -0.36 0.00 0.00 55.97 57.14 1qso s LYS 145 Cb -0.09 -3.35 -0.06 0.00 -1.51 0.00 0.00 37.83 32.82 1qso s LYS 145 CO 0.01 -0.20 0.46 0.00 -0.36 0.00 0.00 175.35 175.26 1qso s ALA 146 N 0.92 3.67 0.00 3.13 0.00 -1.26 -4.95 121.76 123.26 1qso s ALA 146 Ca 0.57 -0.20 -0.02 0.00 0.00 0.00 0.00 51.96 52.30 1qso s ALA 146 Cb -0.28 -2.42 -0.11 0.00 0.00 0.00 0.00 23.12 20.30 1qso s ALA 146 CO 0.30 0.48 2.20 -0.35 0.00 0.00 0.00 175.76 178.39 1qso n PRO 147 N 1.39 1.13 -4.86 0.00 -0.04 -1.26 -4.84 135.00 126.52 1qso n PRO 147 Ca -0.10 -0.41 -0.33 0.00 -0.04 0.00 0.00 63.50 62.62 1qso n PRO 147 Cb 0.52 -1.54 -0.14 0.00 -0.04 0.00 0.00 33.50 32.30 1qso n PRO 147 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1qso s LYS 148 N 1.10 2.89 -0.16 0.54 -0.14 -1.26 -5.11 119.74 117.61 1qso s LYS 148 Ca 0.27 -0.70 -0.09 0.00 -1.36 0.00 0.00 55.97 54.09 1qso s LYS 148 Cb 0.13 -2.48 -0.05 0.00 -1.68 0.00 0.00 37.83 33.76 1qso s LYS 148 CO 0.00 0.44 0.15 0.42 -0.76 0.00 0.00 175.35 175.59 1qso s ILE 149 N -0.24 5.44 -0.20 2.17 1.01 -1.26 -5.09 121.20 123.03 1qso s ILE 149 Ca 0.01 0.23 -0.10 0.00 0.00 0.00 0.00 60.65 60.79 1qso s ILE 149 Cb -0.13 -3.45 -0.05 0.00 0.01 0.00 0.00 42.46 38.84 1qso s ILE 149 CO 0.03 0.52 0.12 -0.22 0.00 0.00 0.00 174.94 175.39 1qso s LEU 150 N -0.28 4.16 -0.03 2.97 2.96 -1.26 -5.09 118.68 122.10 1qso s LEU 150 Ca 0.12 0.21 0.04 0.00 -0.22 0.00 0.00 54.13 54.28 1qso s LEU 150 Cb -0.12 -2.08 -0.03 0.00 0.50 0.00 0.00 46.19 44.47 1qso s LEU 150 CO 0.01 0.17 -0.15 -0.31 -1.32 0.00 0.00 176.35 174.75 1qso s TYR 151 N 0.41 2.67 0.22 5.38 1.51 -1.26 -5.14 117.35 121.14 1qso s TYR 151 Ca 0.07 -0.18 0.08 0.00 -1.01 0.00 0.00 57.07 56.03 1qso s TYR 151 Cb -0.11 -1.60 -0.05 0.00 -0.11 0.00 0.00 41.96 40.09 1qso s TYR 151 CO -0.01 0.19 -0.14 0.15 -1.11 0.00 0.00 175.55 174.63 1qso s LYS 152 N -0.87 1.40 0.42 -0.62 1.02 -1.26 -5.13 119.74 114.70 1qso s LYS 152 Ca 0.12 -1.64 -0.24 0.00 0.02 0.00 0.00 55.97 54.23 1qso s LYS 152 Cb -0.11 -1.18 -0.08 0.00 -0.52 0.00 0.00 37.83 35.94 1qso s LYS 152 CO 0.01 0.18 1.16 0.50 -0.92 0.00 0.00 175.35 176.28 1qso s ARG 153 N -3.65 3.97 0.14 1.68 3.52 -1.26 -4.95 118.95 118.41 1qso s ARG 153 Ca 0.24 1.78 -0.31 0.00 -0.13 0.00 0.00 55.73 57.31 1qso s ARG 153 Cb -0.00 -2.57 -0.09 0.00 -1.56 0.00 0.00 34.95 30.72 1qso s ARG 153 CO 0.08 -0.38 1.55 0.15 -0.81 0.00 0.00 175.30 175.90 1qso s LYS 154 N -2.45 4.23 0.00 5.12 1.02 -1.26 -1.99 119.74 124.41 1qso s LYS 154 Ca 0.59 2.31 0.00 0.00 0.02 0.00 0.00 55.97 58.90 1qso s LYS 154 Cb -0.29 -3.22 0.00 0.00 -0.52 0.00 0.00 37.83 33.80 1qso s LYS 154 CO 0.36 -0.60 0.00 0.41 -0.92 0.00 0.00 175.35 174.60 1qso n GLY 155 N 3.75 0.71 0.00 -3.33 0.00 -1.26 -5.36 105.19 99.69 1qso n GLY 155 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1qso n GLY 155 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60