#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xgt s VAL 2 N 0.00 4.29 0.63 3.15 1.01 -1.26 -0.84 120.40 127.38 1xgt s VAL 2 Ca 0.00 -1.08 -0.15 0.00 0.00 0.00 0.00 61.98 60.75 1xgt s VAL 2 Cb 0.00 -3.47 -0.01 0.00 0.00 0.00 0.00 36.38 32.90 1xgt s VAL 2 CO 0.00 -0.30 1.09 -0.36 0.00 0.00 0.00 175.10 175.53 1xgt s PHE 3 N 1.48 2.75 0.33 5.22 0.40 0.76 -4.99 117.98 123.94 1xgt s PHE 3 Ca 0.01 1.54 -0.13 0.00 -0.60 0.00 0.00 56.93 57.75 1xgt s PHE 3 Cb -0.20 -3.12 -0.08 0.00 0.51 0.00 0.00 43.02 40.13 1xgt s PHE 3 CO 0.04 -1.49 0.72 0.20 0.70 0.00 0.00 175.22 175.39 1xgt s GLY 4 N -2.64 2.20 0.07 4.36 0.00 -1.26 -4.82 107.32 105.22 1xgt s GLY 4 Ca 0.66 -0.09 -0.24 0.00 0.00 0.00 0.00 44.72 45.05 1xgt s GLY 4 CO 0.40 0.10 1.38 -0.09 0.00 0.00 0.00 173.10 174.89 1xgt h ARG 5 N 1.97 -0.51 -0.87 2.90 2.43 -1.97 0.38 114.38 118.71 1xgt h ARG 5 Ca -0.47 0.03 0.05 0.00 -0.81 0.00 0.00 59.98 58.78 1xgt h ARG 5 Cb 1.18 0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 30.79 1xgt h ARG 5 CO 0.65 -0.34 0.57 0.00 -1.51 0.00 0.00 179.97 179.35 1xgt h GLU 7 N 1.04 0.59 -0.24 0.00 4.81 -1.84 -0.22 114.58 118.72 1xgt h GLU 7 Ca 0.36 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.41 1xgt h GLU 7 Cb 0.10 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1xgt h GLU 7 CO -0.12 0.39 -0.43 1.25 -0.73 0.00 0.00 179.01 179.37 1xgt h LEU 8 N 0.61 0.64 -0.28 1.64 5.85 0.18 -1.85 115.31 122.10 1xgt h LEU 8 Ca 0.25 -0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.70 1xgt h LEU 8 Cb 0.12 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 1xgt h LEU 8 CO -0.15 0.99 0.09 0.00 -0.34 0.00 0.00 178.44 179.03 1xgt h ALA 9 N 1.04 0.31 -0.62 1.25 0.00 -0.04 0.33 119.26 121.53 1xgt h ALA 9 Ca 0.04 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1xgt h ALA 9 Cb 0.95 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1xgt h ALA 9 CO 0.09 -0.31 0.30 0.00 0.00 0.00 0.00 179.25 179.32 1xgt h ALA 10 N 1.18 0.80 0.13 0.00 0.00 -0.98 -0.96 119.26 119.42 1xgt h ALA 10 Ca 0.12 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1xgt h ALA 10 Cb 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1xgt h ALA 10 CO -0.13 0.36 -0.09 0.00 0.00 0.00 0.00 179.25 179.39 1xgt h ALA 11 N 1.13 -0.21 -0.22 0.00 0.00 -0.56 0.73 119.26 120.13 1xgt h ALA 11 Ca 0.21 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1xgt h ALA 11 Cb 0.12 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1xgt h ALA 11 CO -0.03 -0.63 0.04 0.52 0.00 0.00 0.00 179.25 179.16 1xgt h MET 12 N -0.23 0.31 -0.28 0.00 2.86 -0.21 0.69 114.93 118.06 1xgt h MET 12 Ca -0.01 -0.04 -0.11 0.00 -2.06 0.00 0.00 59.70 57.49 1xgt h MET 12 Cb 0.20 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1xgt h MET 12 CO -0.00 0.30 -0.24 -0.22 1.06 0.00 0.00 176.91 177.81 1xgt h LYS 13 N 0.31 0.65 -0.99 1.72 3.64 -0.69 -0.93 116.57 120.29 1xgt h LYS 13 Ca 0.08 -0.33 0.01 0.00 -1.27 0.00 0.00 60.65 59.13 1xgt h LYS 13 Cb 0.14 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.92 1xgt h LYS 13 CO -0.00 0.93 0.64 -0.09 -2.27 0.00 0.00 179.45 178.66 1xgt h ARG 14 N 0.39 1.31 -0.76 1.90 2.43 -0.08 -1.21 114.38 118.37 1xgt h ARG 14 Ca 0.05 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1xgt h ARG 14 Cb 0.80 -0.29 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1xgt h ARG 14 CO 0.06 0.88 0.00 0.72 -1.51 0.00 0.00 179.97 180.12 1xgt n HIS 15 N -4.37 0.28 -3.14 2.20 8.25 0.16 -4.91 115.22 113.69 1xgt n HIS 15 Ca 0.12 -0.10 -0.21 0.00 -0.26 0.00 0.00 57.72 57.26 1xgt n HIS 15 Cb 0.02 -0.13 0.05 0.00 1.12 0.00 0.00 29.99 31.05 1xgt n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xgt n GLY 16 N 0.22 -0.44 0.12 -1.41 0.00 -0.46 -4.93 105.19 98.29 1xgt n GLY 16 Ca 0.04 0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1xgt n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xgt h LEU 17 N -1.68 0.00 -9.00 0.99 3.38 -1.36 -3.41 115.31 104.23 1xgt h LEU 17 Ca -0.51 -0.04 -0.57 0.00 0.09 0.00 0.00 57.88 56.85 1xgt h LEU 17 Cb 1.34 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.06 1xgt h LEU 17 CO 0.53 0.02 1.07 -0.62 0.09 0.00 0.00 178.44 179.53 1xgt s ASP 18 N -5.24 6.49 -0.12 -0.43 2.15 -1.26 -2.31 116.67 115.94 1xgt s ASP 18 Ca 0.02 1.45 0.00 0.00 0.43 0.00 0.00 52.55 54.44 1xgt s ASP 18 Cb 0.10 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.18 1xgt s ASP 18 CO 0.76 -1.20 0.00 -3.20 -0.17 0.00 0.00 175.17 171.37 1xgt n ASN 19 N 8.15 -3.36 -4.65 -0.34 5.15 0.81 -4.85 115.26 116.17 1xgt n ASN 19 Ca 0.17 0.03 -0.43 0.00 -0.60 0.00 0.00 54.58 53.76 1xgt n ASN 19 Cb 0.46 -0.96 -0.03 0.00 -0.53 0.00 0.00 39.78 38.72 1xgt n ASN 19 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1xgt s TYR 20 N -1.97 2.07 -1.56 1.20 5.04 -0.98 -2.78 117.35 118.38 1xgt s TYR 20 Ca 0.00 0.39 -0.10 0.00 -2.44 0.00 0.00 57.07 54.91 1xgt s TYR 20 Cb 0.00 -3.90 0.08 0.00 0.35 0.00 0.00 41.96 38.49 1xgt s TYR 20 CO 0.00 -3.38 0.66 0.54 -1.34 0.00 0.00 175.55 172.04 1xgt n ARG 21 N 7.30 -3.56 -1.29 4.97 5.12 -1.26 -1.99 116.66 125.94 1xgt n ARG 21 Ca 0.18 0.42 -0.04 0.00 -1.93 0.00 0.00 57.85 56.48 1xgt n ARG 21 Cb 0.44 -4.92 -0.01 0.00 -1.16 0.00 0.00 32.46 26.80 1xgt n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1xgt n GLY 22 N -1.68 0.59 3.07 -0.13 0.00 -1.12 -5.03 105.19 100.89 1xgt n GLY 22 Ca -0.09 -0.87 -0.32 0.00 0.00 0.00 0.00 46.02 44.74 1xgt n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xgt s TYR 23 N -2.15 3.26 0.76 1.61 2.02 -0.84 -4.96 117.35 117.05 1xgt s TYR 23 Ca 0.00 -2.31 -0.14 0.00 -0.37 0.00 0.00 57.07 54.25 1xgt s TYR 23 Cb 0.00 -1.93 0.06 0.00 -0.40 0.00 0.00 41.96 39.68 1xgt s TYR 23 CO 0.00 -0.88 1.20 -1.54 -1.57 0.00 0.00 175.55 172.76 1xgt s SER 24 N 1.11 4.02 0.25 2.29 1.04 -1.26 -0.14 113.70 121.01 1xgt s SER 24 Ca -0.09 2.32 -0.08 0.00 0.48 0.00 0.00 55.95 58.58 1xgt s SER 24 Cb -0.20 -2.58 0.43 0.00 0.10 0.00 0.00 66.02 63.77 1xgt s SER 24 CO -0.05 -2.38 1.61 0.25 0.98 0.00 0.00 173.24 173.65 1xgt h LEU 25 N -0.55 -0.55 -0.98 2.42 5.85 -1.89 -1.60 115.31 118.00 1xgt h LEU 25 Ca -0.47 0.23 0.26 0.00 0.84 0.00 0.00 57.88 58.74 1xgt h LEU 25 Cb 1.29 0.43 -0.13 0.00 0.37 0.00 0.00 40.66 42.62 1xgt h LEU 25 CO 0.49 -0.24 0.54 1.23 -0.34 0.00 0.00 178.44 180.12 1xgt h GLY 26 N 0.04 1.88 0.33 3.75 0.00 -1.91 -1.00 103.07 106.16 1xgt h GLY 26 Ca 0.42 -0.26 0.09 0.00 0.00 0.00 0.00 47.33 47.58 1xgt h GLY 26 CO -0.77 -0.33 0.09 3.43 0.00 0.00 0.00 176.54 178.96 1xgt h ASN 27 N 0.46 -0.02 -0.35 0.19 2.35 -1.51 0.93 115.58 117.64 1xgt h ASN 27 Ca 0.66 0.09 -0.14 0.00 -0.55 0.00 0.00 56.30 56.36 1xgt h ASN 27 Cb 1.33 0.13 -0.01 0.00 0.05 0.00 0.00 38.32 39.82 1xgt h ASN 27 CO -0.53 0.02 -0.33 -0.50 -1.65 0.00 0.00 177.43 174.43 1xgt h TRP 28 N 0.23 1.01 -0.09 1.19 4.06 -1.33 -1.73 115.95 119.29 1xgt h TRP 28 Ca 0.25 -0.30 -0.00 0.00 2.06 0.00 0.00 58.89 60.90 1xgt h TRP 28 Cb 0.35 -0.21 -0.00 0.00 -1.00 0.00 0.00 29.16 28.29 1xgt h TRP 28 CO -0.24 1.09 0.05 0.28 -3.56 0.00 0.00 178.44 176.07 1xgt h VAL 29 N 0.63 1.07 -0.29 1.49 2.07 -1.02 -0.36 116.25 119.85 1xgt h VAL 29 Ca 0.06 -0.20 0.05 0.00 0.82 0.00 0.00 66.70 67.43 1xgt h VAL 29 Cb 0.92 1.05 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 1xgt h VAL 29 CO 0.08 0.06 -0.03 0.00 0.02 0.00 0.00 177.57 177.71 1xgt h ALA 31 N 1.27 1.12 -0.53 0.00 0.00 -1.09 -1.65 119.26 118.38 1xgt h ALA 31 Ca 0.14 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1xgt h ALA 31 Cb 0.20 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1xgt h ALA 31 CO -0.27 0.49 0.19 0.00 0.00 0.00 0.00 179.25 179.66 1xgt h ALA 32 N 1.33 0.69 0.40 0.00 0.00 -0.32 -0.48 119.26 120.89 1xgt h ALA 32 Ca 0.33 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1xgt h ALA 32 Cb -0.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1xgt h ALA 32 CO -0.08 0.33 -0.42 -0.22 0.00 0.00 0.00 179.25 178.86 1xgt h LYS 33 N 0.73 -0.81 0.00 0.00 1.63 -0.37 -1.27 116.57 116.47 1xgt h LYS 33 Ca 0.17 0.06 -0.08 0.00 -0.85 0.00 0.00 60.65 59.95 1xgt h LYS 33 Cb 0.24 0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 32.04 1xgt h LYS 33 CO -0.01 -0.54 -0.40 0.74 -3.45 0.00 0.00 179.45 175.79 1xgt h PHE 34 N -0.85 0.00 0.10 1.91 0.04 -1.28 0.74 116.94 117.61 1xgt h PHE 34 Ca -0.04 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.50 1xgt h PHE 34 Cb 0.76 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.93 1xgt h PHE 34 CO -0.23 0.40 -1.00 0.93 -0.60 0.00 0.00 178.31 177.81 1xgt h GLU 35 N 0.00 0.50 0.00 1.51 4.39 -0.96 -3.43 114.58 116.58 1xgt h GLU 35 Ca -0.00 -0.67 0.00 0.00 0.34 0.00 0.00 59.36 59.03 1xgt h GLU 35 Cb 0.76 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 1xgt h GLU 35 CO 0.05 1.29 0.00 -1.13 -1.16 0.00 0.00 179.01 178.06 1xgt n SER 36 N -3.97 0.00 -2.65 1.42 3.41 -0.53 -4.83 113.62 106.46 1xgt n SER 36 Ca -0.13 -0.91 -0.18 0.00 -0.26 0.00 0.00 58.87 57.39 1xgt n SER 36 Cb 0.88 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.87 1xgt n SER 36 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1xgt n ASN 37 N 0.00 -5.34 -1.60 4.04 3.02 0.25 -2.57 115.26 113.06 1xgt n ASN 37 Ca 0.00 -0.31 -0.15 0.00 -0.03 0.00 0.00 54.58 54.09 1xgt n ASN 37 Cb 0.23 -4.09 -0.02 0.00 -0.61 0.00 0.00 39.78 35.29 1xgt n ASN 37 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1xgt n PHE 38 N -4.36 -0.58 -3.60 3.10 3.72 -1.20 -4.75 117.46 109.79 1xgt n PHE 38 Ca -0.05 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 56.95 1xgt n PHE 38 Cb 0.58 -3.04 -0.11 0.00 -0.94 0.00 0.00 39.48 35.96 1xgt n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1xgt s ASN 39 N -2.42 5.75 0.49 4.37 2.47 -1.06 -0.17 114.94 124.36 1xgt s ASN 39 Ca 0.00 -0.51 0.27 0.00 0.42 0.00 0.00 52.86 53.04 1xgt s ASN 39 Cb 0.00 -2.05 1.15 0.00 -1.45 0.00 0.00 41.25 38.90 1xgt s ASN 39 CO 0.00 -0.22 1.92 0.71 -3.72 0.00 0.00 177.10 175.79 1xgt h THR 40 N 5.61 0.42 -0.17 -5.21 1.35 -1.31 -2.98 112.91 110.62 1xgt h THR 40 Ca -0.31 -0.86 0.00 0.00 -0.55 0.00 0.00 66.41 64.69 1xgt h THR 40 Cb 1.15 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.18 1xgt h THR 40 CO 0.62 0.15 0.00 0.00 -0.25 0.00 0.00 175.52 176.04 1xgt n GLN 41 N -3.36 1.96 -1.88 4.72 1.13 -1.26 -4.00 117.38 114.68 1xgt n GLN 41 Ca -0.00 -1.43 -0.41 0.00 -1.94 0.00 0.00 57.00 53.22 1xgt n GLN 41 Cb 0.36 -1.44 -0.01 0.00 0.11 0.00 0.00 30.24 29.26 1xgt n GLN 41 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1xgt s ALA 42 N -1.79 3.57 0.02 -1.58 0.00 -1.13 -4.81 121.76 116.04 1xgt s ALA 42 Ca 0.34 1.49 -0.05 0.00 0.00 0.00 0.00 51.96 53.74 1xgt s ALA 42 Cb 0.20 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 1xgt s ALA 42 CO 0.29 -0.94 0.09 0.95 0.00 0.00 0.00 175.76 176.14 1xgt s THR 43 N -1.00 0.10 -0.10 0.00 -4.23 -1.26 -1.09 115.64 108.06 1xgt s THR 43 Ca 0.53 -0.85 -0.04 0.00 -1.18 0.00 0.00 61.69 60.15 1xgt s THR 43 Cb -0.45 -0.50 0.05 0.00 1.34 0.00 0.00 72.50 72.94 1xgt s THR 43 CO 0.59 -0.47 0.22 0.21 -0.54 0.00 0.00 174.62 174.63 1xgt s ASN 44 N -1.59 0.13 0.27 3.99 2.47 -0.56 -4.95 114.94 114.70 1xgt s ASN 44 Ca -0.13 0.47 -0.26 0.00 0.42 0.00 0.00 52.86 53.37 1xgt s ASN 44 Cb -0.07 0.43 -0.09 0.00 -1.45 0.00 0.00 41.25 40.08 1xgt s ASN 44 CO -0.01 -0.20 0.89 -0.13 -3.72 0.00 0.00 177.10 173.94 1xgt s ARG 45 N 1.78 4.60 0.40 0.43 0.52 -1.26 -0.25 118.95 125.18 1xgt s ARG 45 Ca -0.04 1.28 0.07 0.00 -0.52 0.00 0.00 55.73 56.53 1xgt s ARG 45 Cb -0.11 -2.97 -0.05 0.00 0.52 0.00 0.00 34.95 32.34 1xgt s ARG 45 CO -0.08 0.38 0.19 -0.80 0.02 0.00 0.00 175.30 175.02 1xgt s ASN 46 N -1.47 4.51 0.26 0.23 0.01 -0.74 -4.95 114.94 112.79 1xgt s ASN 46 Ca 0.45 -1.01 -0.05 0.00 -0.71 0.00 0.00 52.86 51.54 1xgt s ASN 46 Cb -0.21 -0.51 0.30 0.00 0.41 0.00 0.00 41.25 41.24 1xgt s ASN 46 CO 0.26 -0.52 1.92 0.74 -1.51 0.00 0.00 177.10 177.98 1xgt h THR 47 N 1.41 1.22 -2.97 1.60 2.02 -1.98 -3.41 112.91 110.80 1xgt h THR 47 Ca -0.43 -0.45 -0.25 0.00 0.77 0.00 0.00 66.41 66.05 1xgt h THR 47 Cb 1.25 -0.21 0.10 0.00 -1.74 0.00 0.00 68.15 67.55 1xgt h THR 47 CO 0.68 0.24 0.21 -0.90 0.37 0.00 0.00 175.52 176.12 1xgt n ASP 48 N -4.40 -0.29 -0.06 4.18 3.85 -1.26 -4.90 116.55 113.67 1xgt n ASP 48 Ca 0.13 -1.20 0.00 0.00 -0.71 0.00 0.00 54.79 53.01 1xgt n ASP 48 Cb 0.05 -0.59 0.00 0.00 -1.35 0.00 0.00 41.12 39.23 1xgt n ASP 48 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1xgt n GLY 49 N -0.40 -0.68 3.91 6.12 0.00 -1.26 -4.88 105.19 108.01 1xgt n GLY 49 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 1xgt n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xgt s SER 50 N -0.93 4.98 -0.05 1.61 1.04 -1.26 -4.57 113.70 114.52 1xgt s SER 50 Ca 0.00 0.69 -0.07 0.00 0.48 0.00 0.00 55.95 57.04 1xgt s SER 50 Cb 0.00 -1.39 0.02 0.00 0.10 0.00 0.00 66.02 64.75 1xgt s SER 50 CO 0.00 -1.53 0.19 -0.89 0.98 0.00 0.00 173.24 171.99 1xgt s THR 51 N -3.30 0.02 -0.11 2.02 2.01 -1.26 -1.80 115.64 113.23 1xgt s THR 51 Ca 0.59 -0.18 -0.14 0.00 0.31 0.00 0.00 61.69 62.27 1xgt s THR 51 Cb -0.11 -0.33 -0.05 0.00 0.01 0.00 0.00 72.50 72.02 1xgt s THR 51 CO 0.47 -0.10 0.34 -1.81 -0.69 0.00 0.00 174.62 172.84 1xgt s ASP 52 N -0.29 6.57 -0.00 3.53 1.01 0.65 -0.74 116.67 127.40 1xgt s ASP 52 Ca -0.04 0.67 0.08 0.00 0.71 0.00 0.00 52.55 53.97 1xgt s ASP 52 Cb -0.03 -2.21 -0.02 0.00 1.01 0.00 0.00 42.92 41.67 1xgt s ASP 52 CO 0.01 0.16 -0.24 -0.31 0.21 0.00 0.00 175.17 175.00 1xgt s TYR 53 N 0.01 2.14 0.00 4.23 1.51 0.61 -1.50 117.35 124.34 1xgt s TYR 53 Ca 0.20 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.86 1xgt s TYR 53 Cb -0.14 -1.36 0.00 0.00 -0.11 0.00 0.00 41.96 40.35 1xgt s TYR 53 CO 0.07 -0.00 0.00 0.41 -1.11 0.00 0.00 175.55 174.92 1xgt n GLY 54 N 2.34 -2.19 0.34 0.71 0.00 -0.25 -0.86 105.19 105.28 1xgt n GLY 54 Ca -0.16 -1.50 0.18 0.00 0.00 0.00 0.00 46.02 44.54 1xgt n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1xgt h ILE 55 N 0.00 0.24 0.00 -0.61 2.10 -1.67 -1.32 117.51 116.25 1xgt h ILE 55 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1xgt h ILE 55 Cb 0.00 0.83 0.00 0.00 -1.09 0.00 0.00 36.82 36.56 1xgt h ILE 55 CO 0.00 0.00 -0.02 0.18 -1.08 0.00 0.00 178.15 177.23 1xgt n LEU 56 N -3.41 2.08 -3.90 2.19 4.77 -1.26 -4.18 117.00 113.29 1xgt n LEU 56 Ca -0.00 -2.56 -0.35 0.00 -0.03 0.00 0.00 56.01 53.07 1xgt n LEU 56 Cb 0.28 -0.25 0.01 0.00 -2.33 0.00 0.00 43.42 41.13 1xgt n LEU 56 CO 0.22 0.60 -0.18 0.00 -1.33 0.00 0.00 177.39 176.70 1xgt n GLN 57 N -1.02 -0.90 -2.98 3.23 1.13 -0.50 -4.92 117.38 111.42 1xgt n GLN 57 Ca 0.09 0.44 -0.41 0.00 -1.94 0.00 0.00 57.00 55.19 1xgt n GLN 57 Cb 0.51 -2.61 -0.05 0.00 0.11 0.00 0.00 30.24 28.20 1xgt n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1xgt s ILE 58 N -3.27 4.96 0.17 5.09 1.01 -0.04 -4.44 121.20 124.69 1xgt s ILE 58 Ca 0.26 1.50 -0.30 0.00 0.00 0.00 0.00 60.65 62.12 1xgt s ILE 58 Cb -0.14 -4.08 -0.08 0.00 0.01 0.00 0.00 42.46 38.18 1xgt s ILE 58 CO 0.93 0.13 1.16 0.21 0.00 0.00 0.00 174.94 177.36 1xgt s ASN 59 N 1.03 7.16 0.00 3.58 3.84 -1.26 -0.29 114.94 129.00 1xgt s ASN 59 Ca 0.37 2.16 0.25 0.00 0.21 0.00 0.00 52.86 55.85 1xgt s ASN 59 Cb -0.17 -2.60 1.50 0.00 -0.55 0.00 0.00 41.25 39.43 1xgt s ASN 59 CO 0.15 -0.32 1.92 -1.54 -2.79 0.00 0.00 177.10 174.52 1xgt n SER 60 N 2.56 0.00 0.09 -4.21 3.41 0.08 -1.88 113.62 113.66 1xgt n SER 60 Ca 0.04 -1.05 -0.16 0.00 -0.26 0.00 0.00 58.87 57.44 1xgt n SER 60 Cb 0.45 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.26 1xgt n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1xgt h ARG 61 N 0.00 0.26 0.00 4.33 1.12 -1.84 -3.42 114.38 114.83 1xgt h ARG 61 Ca 0.00 -0.44 0.00 0.00 -1.11 0.00 0.00 59.98 58.43 1xgt h ARG 61 Cb 0.00 0.16 0.00 0.00 -0.01 0.00 0.00 29.97 30.12 1xgt h ARG 61 CO 0.00 1.17 -0.91 0.91 -3.11 0.00 0.00 179.97 178.03 1xgt n TRP 62 N -3.49 0.00 -0.03 2.20 7.02 -1.21 -1.03 117.44 120.90 1xgt n TRP 62 Ca -0.12 0.00 -0.17 0.00 -1.02 0.00 0.00 57.50 56.20 1xgt n TRP 62 Cb 1.03 0.00 -0.14 0.00 -2.42 0.00 0.00 31.31 29.78 1xgt n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1xgt n TRP 63 N -2.30 0.88 -4.26 -5.99 7.02 -0.79 0.70 117.44 112.71 1xgt n TRP 63 Ca 0.00 0.22 -0.14 0.00 -1.02 0.00 0.00 57.50 56.56 1xgt n TRP 63 Cb 0.45 -1.13 -0.10 0.00 -2.42 0.00 0.00 31.31 28.11 1xgt n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1xgt s ASN 65 N -3.20 4.41 -0.06 0.00 2.47 -0.50 -4.46 114.94 113.60 1xgt s ASN 65 Ca 0.26 -0.23 0.08 0.00 0.42 0.00 0.00 52.86 53.39 1xgt s ASN 65 Cb 0.06 -1.70 0.12 0.00 -1.45 0.00 0.00 41.25 38.29 1xgt s ASN 65 CO 0.05 0.17 1.05 -0.90 -3.72 0.00 0.00 177.10 173.75 1xgt n ASP 66 N 3.53 2.06 -0.65 -4.21 5.68 -1.26 -0.58 116.55 121.12 1xgt n ASP 66 Ca -0.18 -2.44 -0.08 0.00 -0.50 0.00 0.00 54.79 51.59 1xgt n ASP 66 Cb 0.53 -0.19 -0.03 0.00 -1.14 0.00 0.00 41.12 40.28 1xgt n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xgt n GLY 67 N -0.88 0.76 1.88 6.12 0.00 -1.26 -4.75 105.19 107.06 1xgt n GLY 67 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.08 1xgt n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1xgt n ARG 68 N -0.41 0.63 -3.97 1.61 1.85 -1.26 -5.08 116.66 110.03 1xgt n ARG 68 Ca -0.08 -1.96 -0.27 0.00 -1.00 0.00 0.00 57.85 54.54 1xgt n ARG 68 Cb 0.53 -0.17 -0.17 0.00 -1.05 0.00 0.00 32.46 31.59 1xgt n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1xgt s THR 69 N -0.86 1.09 0.15 8.89 2.01 -1.26 -4.89 115.64 120.76 1xgt s THR 69 Ca 0.20 -0.33 -0.31 0.00 0.31 0.00 0.00 61.69 61.55 1xgt s THR 69 Cb 0.29 -1.08 -0.09 0.00 0.01 0.00 0.00 72.50 71.62 1xgt s THR 69 CO -0.09 0.38 1.44 -2.16 -0.69 0.00 0.00 174.62 173.50 1xgt s PRO 70 N 1.60 4.29 -0.47 4.92 0.04 -1.26 -3.02 135.00 141.10 1xgt s PRO 70 Ca 0.03 2.19 0.00 0.00 0.04 0.00 0.00 61.00 63.26 1xgt s PRO 70 Cb -0.13 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.21 1xgt s PRO 70 CO -0.08 -0.47 0.00 0.41 0.04 0.00 0.00 177.00 176.90 1xgt n GLY 71 N 3.36 0.30 3.76 0.56 0.00 -1.26 -4.87 105.19 107.05 1xgt n GLY 71 Ca 0.11 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 45.04 1xgt n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xgt s SER 72 N -2.81 5.87 -0.01 1.61 0.01 -1.17 -4.79 113.70 112.42 1xgt s SER 72 Ca 0.00 2.56 0.05 0.00 1.31 0.00 0.00 55.95 59.87 1xgt s SER 72 Cb 0.00 -2.62 -0.07 0.00 0.21 0.00 0.00 66.02 63.53 1xgt s SER 72 CO 0.00 -1.14 0.11 0.54 0.41 0.00 0.00 173.24 173.15 1xgt n ARG 73 N -0.54 0.18 -4.15 12.44 1.74 -0.20 -4.97 116.66 121.16 1xgt n ARG 73 Ca 0.08 -0.04 -0.38 0.00 -0.77 0.00 0.00 57.85 56.73 1xgt n ARG 73 Cb 0.46 -1.11 -0.03 0.00 -1.02 0.00 0.00 32.46 30.76 1xgt n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1xgt n ASN 74 N -1.66 -1.78 -0.05 0.55 5.15 -0.83 -4.87 115.26 111.77 1xgt n ASN 74 Ca -0.01 -1.26 0.05 0.00 -0.60 0.00 0.00 54.58 52.76 1xgt n ASN 74 Cb 0.12 -1.82 0.40 0.00 -0.53 0.00 0.00 39.78 37.96 1xgt n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1xgt h LEU 75 N -2.20 0.53 -0.38 1.20 4.07 0.27 -0.79 115.31 118.01 1xgt h LEU 75 Ca -0.68 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.27 1xgt h LEU 75 Cb 1.40 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 43.01 1xgt h LEU 75 CO 0.60 0.37 0.00 0.00 -1.08 0.00 0.00 178.44 178.34 1xgt n ASN 77 N -0.51 -3.46 -3.82 0.00 5.15 -0.30 -4.95 115.26 107.38 1xgt n ASN 77 Ca 0.21 -1.22 -0.12 0.00 -0.60 0.00 0.00 54.58 52.84 1xgt n ASN 77 Cb 0.20 -2.10 -0.10 0.00 -0.53 0.00 0.00 39.78 37.25 1xgt n ASN 77 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 1xgt s ILE 78 N -3.66 0.06 0.24 -1.44 1.10 -1.26 -5.07 121.20 111.17 1xgt s ILE 78 Ca 0.40 -0.47 -0.30 0.00 -0.51 0.00 0.00 60.65 59.77 1xgt s ILE 78 Cb -0.20 -0.48 -0.09 0.00 0.15 0.00 0.00 42.46 41.84 1xgt s ILE 78 CO 0.95 -0.26 1.09 -2.84 -2.11 0.00 0.00 174.94 171.77 1xgt s PRO 79 N -1.04 4.64 0.50 3.50 0.02 -1.26 -1.42 135.00 139.93 1xgt s PRO 79 Ca -0.11 1.76 0.19 0.00 0.02 0.00 0.00 61.00 62.86 1xgt s PRO 79 Cb -0.06 -3.22 1.24 0.00 0.02 0.00 0.00 34.50 32.48 1xgt s PRO 79 CO 0.02 0.18 2.04 0.00 -0.33 0.00 0.00 177.00 178.91 1xgt h SER 81 N 0.14 0.00 0.50 0.00 4.64 -1.91 0.53 113.55 117.45 1xgt h SER 81 Ca 0.18 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.48 1xgt h SER 81 Cb 0.54 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1xgt h SER 81 CO -0.02 0.00 -0.09 0.00 -0.87 0.00 0.00 176.83 175.85 1xgt h ALA 82 N 1.95 1.15 -0.05 5.18 0.00 -1.46 -1.93 119.26 124.10 1xgt h ALA 82 Ca 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1xgt h ALA 82 Cb 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1xgt h ALA 82 CO -0.00 0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.64 1xgt n LEU 83 N -3.42 0.71 -0.31 0.00 4.77 0.18 -3.34 117.00 115.59 1xgt n LEU 83 Ca -0.01 -0.28 0.07 0.00 -0.03 0.00 0.00 56.01 55.75 1xgt n LEU 83 Cb 0.25 -0.03 -0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1xgt n LEU 83 CO 0.28 0.14 0.24 0.18 -1.33 0.00 0.00 177.39 176.91 1xgt n LEU 84 N -0.36 1.45 -4.69 2.23 4.77 -0.73 -3.47 117.00 116.21 1xgt n LEU 84 Ca 0.17 -0.77 -0.32 0.00 -0.03 0.00 0.00 56.01 55.06 1xgt n LEU 84 Cb 0.19 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.43 1xgt n LEU 84 CO 0.13 0.28 0.73 -0.55 -1.33 0.00 0.00 177.39 176.66 1xgt s SER 85 N -1.64 3.32 0.41 -1.43 0.15 -1.21 -4.20 113.70 109.11 1xgt s SER 85 Ca 0.11 2.28 0.27 0.00 0.70 0.00 0.00 55.95 59.31 1xgt s SER 85 Cb 0.11 -2.58 0.83 0.00 -1.71 0.00 0.00 66.02 62.67 1xgt s SER 85 CO 0.33 -2.84 1.77 0.28 1.20 0.00 0.00 173.24 173.98 1xgt h SER 86 N -1.33 0.00 -3.54 5.45 0.02 -1.92 -3.41 113.55 108.82 1xgt h SER 86 Ca -0.45 0.00 -0.62 0.00 -0.84 0.00 0.00 61.79 59.89 1xgt h SER 86 Cb 1.28 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.70 1xgt h SER 86 CO 0.44 0.00 0.07 -0.62 -1.14 0.00 0.00 176.83 175.58 1xgt s ASP 87 N -5.51 6.48 0.00 3.07 2.15 -1.26 -4.95 116.67 116.65 1xgt s ASP 87 Ca 0.05 0.54 0.24 0.00 0.43 0.00 0.00 52.55 53.81 1xgt s ASP 87 Cb 0.08 -2.31 1.44 0.00 -0.30 0.00 0.00 42.92 41.83 1xgt s ASP 87 CO 0.58 -0.36 1.89 2.30 -0.17 0.00 0.00 175.17 179.41 1xgt n ILE 88 N 5.23 0.00 -0.20 4.11 -5.35 -1.26 -4.34 119.36 117.54 1xgt n ILE 88 Ca -0.02 0.00 -0.09 0.00 -0.27 0.00 0.00 62.75 62.36 1xgt n ILE 88 Cb 0.49 -0.43 -0.05 0.00 -1.74 0.00 0.00 39.64 37.91 1xgt n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1xgt h THR 89 N 0.00 0.07 -0.64 7.28 2.02 -1.93 -0.90 112.91 118.81 1xgt h THR 89 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1xgt h THR 89 Cb 0.00 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 66.45 1xgt h THR 89 CO 0.00 0.00 0.41 0.00 0.37 0.00 0.00 175.52 176.30 1xgt h ALA 90 N 0.51 0.82 -0.48 6.16 0.00 -1.82 -1.65 119.26 122.79 1xgt h ALA 90 Ca 0.16 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1xgt h ALA 90 Cb 0.56 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1xgt h ALA 90 CO -0.68 0.27 0.02 0.77 0.00 0.00 0.00 179.25 179.62 1xgt h SER 91 N 0.87 0.76 -0.13 0.00 0.02 -1.67 -2.17 113.55 111.22 1xgt h SER 91 Ca 0.23 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1xgt h SER 91 Cb -0.07 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.27 1xgt h SER 91 CO -0.05 0.82 -0.02 0.58 -1.14 0.00 0.00 176.83 177.02 1xgt h VAL 92 N 0.75 1.28 -0.72 2.27 2.07 -0.89 -0.28 116.25 120.72 1xgt h VAL 92 Ca 0.15 -0.93 0.04 0.00 0.82 0.00 0.00 66.70 66.78 1xgt h VAL 92 Cb 0.43 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 31.78 1xgt h VAL 92 CO 0.02 0.27 0.44 0.78 0.02 0.00 0.00 177.57 179.10 1xgt h ASN 93 N -0.05 0.71 -0.40 0.57 -0.26 -1.22 0.71 115.58 115.64 1xgt h ASN 93 Ca 0.04 0.01 -0.13 0.00 -0.56 0.00 0.00 56.30 55.65 1xgt h ASN 93 Cb 0.43 -0.14 -0.01 0.00 -1.06 0.00 0.00 38.32 37.54 1xgt h ASN 93 CO 0.01 0.48 -0.26 0.00 -1.06 0.00 0.00 177.43 176.60 1xgt h ALA 95 N 0.80 -0.11 -0.77 0.00 0.00 -0.45 0.19 119.26 118.92 1xgt h ALA 95 Ca 0.08 0.00 0.18 0.00 0.00 0.00 0.00 54.91 55.17 1xgt h ALA 95 Cb 0.84 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 1xgt h ALA 95 CO 0.07 -0.59 0.52 0.87 0.00 0.00 0.00 179.25 180.13 1xgt h LYS 96 N -0.16 0.29 0.06 0.00 1.57 -0.77 0.18 116.57 117.73 1xgt h LYS 96 Ca 0.03 -0.02 -0.27 0.00 -1.87 0.00 0.00 60.65 58.52 1xgt h LYS 96 Cb 0.19 -0.06 0.02 0.00 0.08 0.00 0.00 32.23 32.46 1xgt h LYS 96 CO -0.08 0.19 -1.12 -0.22 -0.57 0.00 0.00 179.45 177.65 1xgt h LYS 97 N 0.29 0.58 -0.19 3.15 3.64 -0.85 -2.87 116.57 120.33 1xgt h LYS 97 Ca 0.38 -0.70 -0.02 0.00 -1.27 0.00 0.00 60.65 59.05 1xgt h LYS 97 Cb 1.06 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 33.09 1xgt h LYS 97 CO -0.10 1.29 0.06 0.82 -2.27 0.00 0.00 179.45 179.25 1xgt h ILE 98 N 0.29 1.19 0.00 2.00 2.04 0.69 -2.37 117.51 121.35 1xgt h ILE 98 Ca -0.14 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.13 1xgt h ILE 98 Cb 1.79 1.22 0.00 0.00 -0.74 0.00 0.00 36.82 39.09 1xgt h ILE 98 CO 0.21 0.18 0.00 0.55 0.00 0.00 0.00 178.15 179.09 1xgt n VAL 99 N -4.81 0.99 1.71 1.67 3.14 -0.12 -2.15 118.33 118.77 1xgt n VAL 99 Ca -0.04 0.35 0.15 0.00 -2.96 0.00 0.00 64.34 61.84 1xgt n VAL 99 Cb 0.15 -1.26 0.85 0.00 -1.06 0.00 0.00 33.84 32.51 1xgt n VAL 99 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1xgt n SER 100 N -2.04 0.00 -4.91 6.55 7.64 -0.89 -3.89 113.62 116.09 1xgt n SER 100 Ca 0.02 -0.63 -0.28 0.00 1.01 0.00 0.00 58.87 58.98 1xgt n SER 100 Cb 0.16 -0.11 0.05 0.00 -1.01 0.00 0.00 64.21 63.30 1xgt n SER 100 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1xgt s ASP 101 N -2.23 5.23 0.56 6.43 2.15 -0.91 -4.95 116.67 122.95 1xgt s ASP 101 Ca 0.39 0.82 0.29 0.00 0.43 0.00 0.00 52.55 54.48 1xgt s ASP 101 Cb 0.21 -1.61 1.47 0.00 -0.30 0.00 0.00 42.92 42.68 1xgt s ASP 101 CO 0.39 -1.39 1.92 1.23 -0.17 0.00 0.00 175.17 177.16 1xgt h GLY 102 N -0.55 0.00 -2.81 2.66 0.00 -1.89 -2.21 103.07 98.27 1xgt h GLY 102 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1xgt h GLY 102 CO 0.63 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.33 1xgt n ASN 103 N -4.04 4.29 0.00 0.19 0.23 -1.26 -5.04 115.26 109.63 1xgt n ASN 103 Ca 0.12 -2.37 0.00 0.00 -0.53 0.00 0.00 54.58 51.80 1xgt n ASN 103 Cb 0.75 -0.54 0.00 0.00 -2.08 0.00 0.00 39.78 37.91 1xgt n ASN 103 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1xgt n GLY 104 N 1.11 1.52 0.00 4.83 0.00 -0.83 -1.17 105.19 110.64 1xgt n GLY 104 Ca 0.23 -0.16 0.04 0.00 0.00 0.00 0.00 46.02 46.13 1xgt n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1xgt n MET 105 N 12.51 0.07 0.00 1.61 2.81 -1.26 -2.64 117.12 130.21 1xgt n MET 105 Ca 0.00 0.27 0.04 0.00 -1.81 0.00 0.00 57.70 56.20 1xgt n MET 105 Cb 0.00 -1.50 0.19 0.00 -0.71 0.00 0.00 33.22 31.20 1xgt n MET 105 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1xgt n ASN 106 N -1.36 0.00 0.17 7.83 3.02 -0.32 -1.34 115.26 123.25 1xgt n ASN 106 Ca 0.03 0.10 0.01 0.00 -0.03 0.00 0.00 54.58 54.69 1xgt n ASN 106 Cb 0.07 -0.23 0.29 0.00 -0.61 0.00 0.00 39.78 39.31 1xgt n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xgt h ALA 107 N 2.37 1.22 -2.11 5.41 0.00 -1.64 -3.38 119.26 121.12 1xgt h ALA 107 Ca 0.00 -0.42 -0.68 0.00 0.00 0.00 0.00 54.91 53.81 1xgt h ALA 107 Cb 0.05 -0.07 -0.18 0.00 0.00 0.00 0.00 17.79 17.59 1xgt h ALA 107 CO 0.00 0.57 0.04 -1.58 0.00 0.00 0.00 179.25 178.28 1xgt s TRP 108 N -3.96 3.06 0.18 0.00 0.51 -0.45 -4.93 118.94 113.34 1xgt s TRP 108 Ca -0.02 -0.53 -0.14 0.00 -2.12 0.00 0.00 56.10 53.28 1xgt s TRP 108 Cb 0.14 -3.52 0.15 0.00 -0.81 0.00 0.00 33.47 29.43 1xgt s TRP 108 CO 0.74 -1.02 1.72 0.28 -0.51 0.00 0.00 176.95 178.15 1xgt h VAL 109 N 5.86 0.74 -0.67 4.03 2.07 -1.85 -1.37 116.25 125.06 1xgt h VAL 109 Ca -0.27 -0.07 0.14 0.00 0.82 0.00 0.00 66.70 67.31 1xgt h VAL 109 Cb 1.10 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 1xgt h VAL 109 CO 0.96 0.04 0.45 0.00 0.02 0.00 0.00 177.57 179.04 1xgt h ALA 110 N 1.35 2.17 -0.40 1.67 0.00 -1.95 0.75 119.26 122.85 1xgt h ALA 110 Ca 0.22 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 1xgt h ALA 110 Cb 0.29 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1xgt h ALA 110 CO -0.30 -0.34 -0.35 2.35 0.00 0.00 0.00 179.25 180.61 1xgt h TRP 111 N 0.33 1.10 -0.25 0.00 7.01 -1.58 -0.62 115.95 121.94 1xgt h TRP 111 Ca 0.32 -0.31 -0.05 0.00 2.11 0.00 0.00 58.89 60.96 1xgt h TRP 111 Cb 0.80 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.62 1xgt h TRP 111 CO -0.00 1.13 -0.05 0.00 -2.79 0.00 0.00 178.44 176.74 1xgt h ARG 112 N 0.77 0.47 -0.28 2.65 3.08 -0.59 2.09 114.38 122.56 1xgt h ARG 112 Ca 0.07 -0.17 -0.16 0.00 0.07 0.00 0.00 59.98 59.79 1xgt h ARG 112 Cb 0.93 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.95 1xgt h ARG 112 CO 0.09 0.68 -0.47 -0.91 -1.07 0.00 0.00 179.97 178.28 1xgt h ASN 113 N 0.21 0.83 0.00 7.04 -0.26 -1.00 -3.29 115.58 119.11 1xgt h ASN 113 Ca 0.06 -0.41 0.00 0.00 -0.56 0.00 0.00 56.30 55.39 1xgt h ASN 113 Cb 0.50 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 37.52 1xgt h ASN 113 CO 0.02 1.16 0.00 0.54 -1.06 0.00 0.00 177.43 178.10 1xgt n ARG 114 N -4.01 1.43 0.00 0.81 3.00 -0.24 -4.87 116.66 112.77 1xgt n ARG 114 Ca -0.03 -1.07 0.00 0.00 -0.01 0.00 0.00 57.85 56.74 1xgt n ARG 114 Cb 0.58 -0.96 0.00 0.00 0.00 0.00 0.00 32.46 32.08 1xgt n ARG 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1xgt n LYS 116 N -2.23 1.83 -3.02 0.00 4.81 0.67 -1.88 118.16 118.35 1xgt n LYS 116 Ca 0.00 0.67 -0.12 0.00 -0.87 0.00 0.00 58.31 57.98 1xgt n LYS 116 Cb 0.13 -2.43 0.04 0.00 0.02 0.00 0.00 35.03 32.79 1xgt n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xgt n GLY 117 N 3.72 0.15 3.30 3.14 0.00 -1.26 -4.90 105.19 109.35 1xgt n GLY 117 Ca 0.21 -0.20 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1xgt n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xgt s THR 118 N -3.13 0.54 -1.24 2.61 -4.23 -0.78 -5.04 115.64 104.37 1xgt s THR 118 Ca 0.29 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.63 1xgt s THR 118 Cb -0.13 -2.59 -0.02 0.00 1.34 0.00 0.00 72.50 71.10 1xgt s THR 118 CO 0.36 -0.04 2.12 -0.67 -0.54 0.00 0.00 174.62 175.85 1xgt n ASP 119 N -0.44 3.47 0.32 3.99 2.03 -1.26 -4.72 116.55 119.93 1xgt n ASP 119 Ca -0.00 -2.79 0.20 0.00 0.52 0.00 0.00 54.79 52.71 1xgt n ASP 119 Cb 0.66 -1.49 1.07 0.00 -0.72 0.00 0.00 41.12 40.64 1xgt n ASP 119 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 1xgt h VAL 120 N 4.22 0.18 0.00 5.18 -1.51 -1.92 -1.67 116.25 120.73 1xgt h VAL 120 Ca 0.52 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.99 1xgt h VAL 120 Cb 0.66 0.95 -0.00 0.00 -2.13 0.00 0.00 31.29 30.77 1xgt h VAL 120 CO 1.89 0.00 -0.00 -0.61 -1.23 0.00 0.00 177.57 177.62 1xgt h GLN 121 N 0.00 0.00 -0.75 5.19 4.15 -1.90 -1.13 115.11 120.66 1xgt h GLN 121 Ca 0.01 0.00 0.10 0.00 0.77 0.00 0.00 58.65 59.53 1xgt h GLN 121 Cb 0.11 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 27.75 1xgt h GLN 121 CO -0.00 0.00 0.50 0.00 -1.93 0.00 0.00 178.83 177.40 1xgt h ALA 122 N 2.00 1.85 -0.09 3.38 0.00 -1.66 0.26 119.26 125.00 1xgt h ALA 122 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1xgt h ALA 122 Cb 0.11 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1xgt h ALA 122 CO 0.00 -0.01 0.04 -1.49 0.00 0.00 0.00 179.25 177.79 1xgt h TRP 123 N 0.63 0.11 0.00 0.00 4.06 -1.42 -2.65 115.95 116.68 1xgt h TRP 123 Ca 0.35 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.30 1xgt h TRP 123 Cb 0.51 -0.04 0.00 0.00 -1.00 0.00 0.00 29.16 28.64 1xgt h TRP 123 CO -0.00 0.09 -1.08 0.44 -3.56 0.00 0.00 178.44 174.33 1xgt n ILE 124 N -4.51 0.00 -1.67 1.49 -5.35 -0.66 -4.90 119.36 103.76 1xgt n ILE 124 Ca -0.02 -0.24 -0.40 0.00 -0.27 0.00 0.00 62.75 61.83 1xgt n ILE 124 Cb 0.10 0.65 -0.03 0.00 -1.74 0.00 0.00 39.64 38.62 1xgt n ILE 124 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1xgt s ARG 125 N -2.60 2.71 0.00 6.28 3.52 0.82 -1.67 118.95 128.01 1xgt s ARG 125 Ca 0.01 1.60 0.00 0.00 -0.13 0.00 0.00 55.73 57.20 1xgt s ARG 125 Cb 0.10 -4.44 0.00 0.00 -1.56 0.00 0.00 34.95 29.05 1xgt s ARG 125 CO 0.58 -2.59 0.00 0.41 -0.81 0.00 0.00 175.30 172.89 1xgt n GLY 126 N 5.81 1.21 3.78 8.12 0.00 -1.26 -4.94 105.19 117.91 1xgt n GLY 126 Ca 0.31 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.96 1xgt n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xgt n ARG 128 N 0.14 3.96 0.00 0.00 5.12 -1.26 -5.11 116.66 119.51 1xgt n ARG 128 Ca 0.04 -4.30 0.00 0.00 -1.93 0.00 0.00 57.85 51.66 1xgt n ARG 128 Cb 0.50 -2.64 0.00 0.00 -1.16 0.00 0.00 32.46 29.16 1xgt n ARG 128 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17