#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j1o s VAL 2 N 0.00 3.42 0.52 3.15 1.01 -1.26 -0.62 120.40 126.62 1j1o s VAL 2 Ca 0.00 -1.21 -0.19 0.00 0.00 0.00 0.00 61.98 60.57 1j1o s VAL 2 Cb 0.00 -2.93 -0.07 0.00 0.00 0.00 0.00 36.38 33.38 1j1o s VAL 2 CO 0.00 -0.12 1.06 -0.36 0.00 0.00 0.00 175.10 175.67 1j1o s PHE 3 N 1.34 2.94 0.50 5.22 0.40 -0.25 -5.00 117.98 123.13 1j1o s PHE 3 Ca -0.03 1.56 -0.08 0.00 -0.60 0.00 0.00 56.93 57.78 1j1o s PHE 3 Cb -0.19 -3.09 -0.04 0.00 0.51 0.00 0.00 43.02 40.20 1j1o s PHE 3 CO 0.01 -1.01 0.85 0.20 0.70 0.00 0.00 175.22 175.96 1j1o s GLY 4 N -2.13 1.65 0.12 4.36 0.00 -1.26 -4.84 107.32 105.22 1j1o s GLY 4 Ca 0.67 -0.32 -0.25 0.00 0.00 0.00 0.00 44.72 44.82 1j1o s GLY 4 CO 0.25 -0.12 1.65 -0.09 0.00 0.00 0.00 173.10 174.79 1j1o h ARG 5 N 0.34 -0.35 -0.18 2.90 2.43 -1.96 -0.88 114.38 116.69 1j1o h ARG 5 Ca -0.46 0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 58.63 1j1o h ARG 5 Cb 1.20 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.81 1j1o h ARG 5 CO 0.62 -0.23 -0.33 0.00 -1.51 0.00 0.00 179.97 178.52 1j1o h GLU 7 N 0.31 0.86 -0.29 0.00 4.81 -1.84 -1.47 114.58 116.97 1j1o h GLU 7 Ca 0.04 -0.10 -0.16 0.00 -0.13 0.00 0.00 59.36 59.01 1j1o h GLU 7 Cb 0.74 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 1j1o h GLU 7 CO 0.06 0.65 -0.47 1.25 -0.73 0.00 0.00 179.01 179.77 1j1o h LEU 8 N 0.84 0.83 -0.38 1.64 5.85 -0.97 -1.83 115.31 121.30 1j1o h LEU 8 Ca 0.22 -0.41 0.03 0.00 0.84 0.00 0.00 57.88 58.57 1j1o h LEU 8 Cb 0.04 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 1j1o h LEU 8 CO -0.04 1.16 0.17 0.00 -0.34 0.00 0.00 178.44 179.40 1j1o h ALA 9 N 0.86 0.46 -0.54 1.25 0.00 -0.98 0.27 119.26 120.59 1j1o h ALA 9 Ca 0.03 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1j1o h ALA 9 Cb 1.04 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1j1o h ALA 9 CO 0.10 -0.21 0.06 0.00 0.00 0.00 0.00 179.25 179.20 1j1o h ALA 10 N 1.21 0.72 -0.40 0.00 0.00 -1.22 -1.56 119.26 118.02 1j1o h ALA 10 Ca 0.16 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1j1o h ALA 10 Cb 0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1j1o h ALA 10 CO -0.13 0.49 0.15 0.00 0.00 0.00 0.00 179.25 179.76 1j1o h ALA 11 N 0.98 0.52 -0.11 0.00 0.00 -0.85 -1.25 119.26 118.54 1j1o h ALA 11 Ca 0.16 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1j1o h ALA 11 Cb 0.45 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1j1o h ALA 11 CO 0.02 0.13 -0.25 0.52 0.00 0.00 0.00 179.25 179.66 1j1o h MET 12 N 0.49 0.20 -0.44 0.00 2.86 -0.37 0.13 114.93 117.81 1j1o h MET 12 Ca 0.13 -0.06 -0.14 0.00 -2.06 0.00 0.00 59.70 57.57 1j1o h MET 12 Cb 0.20 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1j1o h MET 12 CO -0.01 0.44 -0.26 -0.22 1.06 0.00 0.00 176.91 177.92 1j1o h LYS 13 N 0.18 0.94 -0.10 1.72 3.64 -0.96 -0.77 116.57 121.22 1j1o h LYS 13 Ca 0.03 -0.42 -0.07 0.00 -1.27 0.00 0.00 60.65 58.91 1j1o h LYS 13 Cb 0.54 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1j1o h LYS 13 CO 0.04 1.09 -0.27 -0.09 -2.27 0.00 0.00 179.45 177.95 1j1o h ARG 14 N 0.80 0.18 -0.77 1.90 2.43 -0.65 -2.15 114.38 116.12 1j1o h ARG 14 Ca 0.09 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1j1o h ARG 14 Cb 0.84 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 1j1o h ARG 14 CO 0.07 0.44 0.00 0.72 -1.51 0.00 0.00 179.97 179.69 1j1o n HIS 15 N -4.16 0.92 -2.52 2.20 8.25 -0.02 -4.92 115.22 114.97 1j1o n HIS 15 Ca -0.01 -0.33 -0.12 0.00 -0.26 0.00 0.00 57.72 57.00 1j1o n HIS 15 Cb 0.36 -0.27 0.01 0.00 1.12 0.00 0.00 29.99 31.21 1j1o n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1j1o n GLY 16 N 0.36 -0.03 1.08 -1.41 0.00 -0.81 -4.95 105.19 99.42 1j1o n GLY 16 Ca 0.13 -0.32 0.08 0.00 0.00 0.00 0.00 46.02 45.91 1j1o n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1j1o n LEU 17 N -2.12 4.07 0.09 0.99 4.77 -0.34 -4.43 117.00 120.03 1j1o n LEU 17 Ca -0.09 -2.70 0.01 0.00 -0.03 0.00 0.00 56.01 53.20 1j1o n LEU 17 Cb 0.58 -0.50 0.35 0.00 -2.33 0.00 0.00 43.42 41.52 1j1o n LEU 17 CO 0.23 0.70 0.87 -0.78 -1.33 0.00 0.00 177.39 177.08 1j1o h ASP 18 N 2.51 0.29 -0.03 -1.43 3.58 -1.82 -3.28 116.42 116.23 1j1o h ASP 18 Ca 0.00 -0.06 -0.22 0.00 0.42 0.00 0.00 57.03 57.17 1j1o h ASP 18 Cb 1.37 -0.08 -0.16 0.00 1.72 0.00 0.00 39.33 42.18 1j1o h ASP 18 CO 0.21 0.45 -0.37 -3.20 -2.88 0.00 0.00 179.24 173.46 1j1o n ASN 19 N -4.25 -1.70 -4.68 2.28 5.15 -1.24 -1.86 115.26 108.96 1j1o n ASN 19 Ca -0.00 -2.42 -0.43 0.00 -0.60 0.00 0.00 54.58 51.13 1j1o n ASN 19 Cb 0.29 0.90 -0.02 0.00 -0.53 0.00 0.00 39.78 40.42 1j1o n ASN 19 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1j1o s TYR 20 N 0.06 3.22 -1.56 1.20 5.04 -1.14 -3.92 117.35 120.24 1j1o s TYR 20 Ca 0.20 1.31 -0.06 0.00 -2.44 0.00 0.00 57.07 56.08 1j1o s TYR 20 Cb 0.41 -3.35 0.06 0.00 0.35 0.00 0.00 41.96 39.42 1j1o s TYR 20 CO -0.09 -0.97 0.38 0.54 -1.34 0.00 0.00 175.55 174.06 1j1o n ARG 21 N 5.69 -2.25 -0.98 4.97 5.12 -1.26 -1.47 116.66 126.48 1j1o n ARG 21 Ca 0.11 0.27 0.00 0.00 -1.93 0.00 0.00 57.85 56.30 1j1o n ARG 21 Cb 0.46 -4.37 0.00 0.00 -1.16 0.00 0.00 32.46 27.40 1j1o n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1j1o n GLY 22 N -1.96 0.76 3.37 -0.13 0.00 -1.25 -5.02 105.19 100.96 1j1o n GLY 22 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 1j1o n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1j1o s TYR 23 N -3.03 3.09 0.73 1.61 2.02 -0.54 -5.08 117.35 116.14 1j1o s TYR 23 Ca 0.00 -0.79 -0.14 0.00 -0.37 0.00 0.00 57.07 55.78 1j1o s TYR 23 Cb 0.00 -2.22 0.04 0.00 -0.40 0.00 0.00 41.96 39.38 1j1o s TYR 23 CO 0.00 -0.50 1.13 -1.54 -1.57 0.00 0.00 175.55 173.07 1j1o s SER 24 N 1.53 4.52 0.29 2.29 1.04 -1.26 -2.89 113.70 119.21 1j1o s SER 24 Ca 0.04 2.07 0.04 0.00 0.48 0.00 0.00 55.95 58.58 1j1o s SER 24 Cb -0.16 -2.56 0.69 0.00 0.10 0.00 0.00 66.02 64.09 1j1o s SER 24 CO 0.02 -2.03 1.75 0.25 0.98 0.00 0.00 173.24 174.20 1j1o h LEU 25 N -0.50 0.59 -1.75 2.42 5.85 -1.42 -1.72 115.31 118.77 1j1o h LEU 25 Ca -0.46 0.11 0.16 0.00 0.84 0.00 0.00 57.88 58.54 1j1o h LEU 25 Cb 1.26 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.27 1j1o h LEU 25 CO 0.51 0.18 0.48 1.23 -0.34 0.00 0.00 178.44 180.49 1j1o h GLY 26 N 0.62 0.42 0.85 3.75 0.00 -1.90 -1.61 103.07 105.20 1j1o h GLY 26 Ca 0.55 -0.10 0.03 0.00 0.00 0.00 0.00 47.33 47.80 1j1o h GLY 26 CO -0.42 0.03 0.26 3.43 0.00 0.00 0.00 176.54 179.84 1j1o h ASN 27 N 0.24 0.41 -0.41 0.19 2.35 -1.53 -0.19 115.58 116.64 1j1o h ASN 27 Ca 0.34 0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.95 1j1o h ASN 27 Cb 0.99 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.28 1j1o h ASN 27 CO -0.07 0.29 -0.33 -0.50 -1.65 0.00 0.00 177.43 175.17 1j1o h TRP 28 N 0.53 1.13 -0.31 1.19 4.06 -1.43 0.14 115.95 121.26 1j1o h TRP 28 Ca 0.19 -0.32 -0.06 0.00 2.06 0.00 0.00 58.89 60.75 1j1o h TRP 28 Cb 0.04 -0.25 -0.01 0.00 -1.00 0.00 0.00 29.16 27.95 1j1o h TRP 28 CO -0.08 1.15 -0.06 0.28 -3.56 0.00 0.00 178.44 176.18 1j1o h VAL 29 N 0.79 1.28 -0.44 1.49 2.07 -1.36 -1.41 116.25 118.67 1j1o h VAL 29 Ca 0.08 -1.08 -0.01 0.00 0.82 0.00 0.00 66.70 66.51 1j1o h VAL 29 Cb 0.92 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1j1o h VAL 29 CO 0.09 0.35 0.24 0.00 0.02 0.00 0.00 177.57 178.27 1j1o h ALA 31 N 1.09 0.48 -0.78 0.00 0.00 -0.83 -2.07 119.26 117.15 1j1o h ALA 31 Ca 0.15 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1j1o h ALA 31 Cb 0.05 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1j1o h ALA 31 CO -0.03 -0.19 0.49 0.00 0.00 0.00 0.00 179.25 179.52 1j1o h ALA 32 N 1.22 0.99 -0.06 0.00 0.00 -0.98 0.21 119.26 120.63 1j1o h ALA 32 Ca 0.17 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1j1o h ALA 32 Cb 0.10 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1j1o h ALA 32 CO -0.14 0.43 -0.11 -0.22 0.00 0.00 0.00 179.25 179.21 1j1o h LYS 33 N 1.06 -0.16 0.00 0.00 1.63 -0.66 -0.99 116.57 117.44 1j1o h LYS 33 Ca 0.28 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.09 1j1o h LYS 33 Cb -0.08 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.59 1j1o h LYS 33 CO -0.06 -0.11 -0.39 0.74 -3.45 0.00 0.00 179.45 176.19 1j1o h PHE 34 N -0.17 0.00 0.15 1.91 0.04 -1.18 0.55 116.94 118.24 1j1o h PHE 34 Ca 0.06 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.58 1j1o h PHE 34 Cb 0.25 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.41 1j1o h PHE 34 CO -0.20 0.00 -1.22 0.93 -0.60 0.00 0.00 178.31 177.22 1j1o h GLU 35 N 0.00 0.31 0.00 1.51 4.39 -0.49 -3.43 114.58 116.87 1j1o h GLU 35 Ca 0.00 -0.53 0.00 0.00 0.34 0.00 0.00 59.36 59.17 1j1o h GLU 35 Cb 0.94 0.20 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 1j1o h GLU 35 CO 0.00 1.25 0.00 -1.13 -1.16 0.00 0.00 179.01 177.97 1j1o n SER 36 N -3.96 0.29 -3.57 1.42 3.41 -0.46 -4.81 113.62 105.94 1j1o n SER 36 Ca -0.20 -1.04 -0.24 0.00 -0.26 0.00 0.00 58.87 57.12 1j1o n SER 36 Cb 0.91 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.93 1j1o n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1j1o n ASN 37 N -0.02 -6.23 -0.58 4.04 5.15 0.19 -2.08 115.26 115.73 1j1o n ASN 37 Ca 0.00 -0.54 -0.08 0.00 -0.60 0.00 0.00 54.58 53.37 1j1o n ASN 37 Cb 0.23 -4.92 -0.03 0.00 -0.53 0.00 0.00 39.78 34.53 1j1o n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1j1o n PHE 38 N -4.94 0.00 -3.36 1.20 3.72 -1.10 -4.84 117.46 108.15 1j1o n PHE 38 Ca 0.00 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.99 1j1o n PHE 38 Cb 0.56 -1.98 -0.09 0.00 -0.94 0.00 0.00 39.48 37.03 1j1o n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1j1o s ASN 39 N -2.45 6.20 0.59 4.37 2.47 -0.88 -1.09 114.94 124.15 1j1o s ASN 39 Ca 0.00 -0.34 0.37 0.00 0.42 0.00 0.00 52.86 53.31 1j1o s ASN 39 Cb 0.00 -2.21 1.74 0.00 -1.45 0.00 0.00 41.25 39.33 1j1o s ASN 39 CO 0.00 -0.43 2.12 0.71 -3.72 0.00 0.00 177.10 175.79 1j1o h THR 40 N 5.60 0.04 -0.17 -5.21 1.35 -1.20 -2.70 112.91 110.63 1j1o h THR 40 Ca -0.29 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.23 1j1o h THR 40 Cb 1.13 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 1j1o h THR 40 CO 0.73 0.01 0.00 0.00 -0.25 0.00 0.00 175.52 176.01 1j1o n GLN 41 N -3.12 2.21 -1.76 4.72 1.13 -1.26 -3.95 117.38 115.35 1j1o n GLN 41 Ca -0.01 -1.79 -0.41 0.00 -1.94 0.00 0.00 57.00 52.85 1j1o n GLN 41 Cb 0.22 -1.47 -0.01 0.00 0.11 0.00 0.00 30.24 29.09 1j1o n GLN 41 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1j1o n ALA 42 N 1.08 2.58 -2.99 -1.58 0.00 -1.02 -4.78 120.51 113.79 1j1o n ALA 42 Ca 0.17 0.36 -0.10 0.00 0.00 0.00 0.00 53.44 53.87 1j1o n ALA 42 Cb 0.53 -2.46 -0.11 0.00 0.00 0.00 0.00 19.45 17.40 1j1o n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1j1o s THR 43 N -0.39 0.08 -0.23 0.00 -4.23 -1.26 -0.94 115.64 108.67 1j1o s THR 43 Ca 0.60 -0.64 -0.03 0.00 -1.18 0.00 0.00 61.69 60.44 1j1o s THR 43 Cb -0.48 -0.25 0.10 0.00 1.34 0.00 0.00 72.50 73.22 1j1o s THR 43 CO 0.54 -0.35 0.23 0.21 -0.54 0.00 0.00 174.62 174.70 1j1o s ASN 44 N -1.08 1.69 0.09 3.99 2.47 -0.68 -4.96 114.94 116.46 1j1o s ASN 44 Ca -0.12 -0.48 -0.31 0.00 0.42 0.00 0.00 52.86 52.37 1j1o s ASN 44 Cb -0.07 0.33 -0.07 0.00 -1.45 0.00 0.00 41.25 39.99 1j1o s ASN 44 CO -0.00 -0.36 1.34 -0.60 -3.72 0.00 0.00 177.10 173.77 1j1o s ARG 45 N 2.31 4.34 0.47 0.43 3.52 -1.26 -1.24 118.95 127.52 1j1o s ARG 45 Ca 0.08 2.00 0.07 0.00 -0.13 0.00 0.00 55.73 57.74 1j1o s ARG 45 Cb -0.15 -3.29 0.03 0.00 -1.56 0.00 0.00 34.95 29.97 1j1o s ARG 45 CO -0.20 -0.40 0.65 -0.80 -0.81 0.00 0.00 175.30 173.74 1j1o s ASN 46 N 1.14 5.47 0.11 -2.12 0.01 0.20 -4.97 114.94 114.79 1j1o s ASN 46 Ca 0.63 -0.39 -0.18 0.00 -0.71 0.00 0.00 52.86 52.22 1j1o s ASN 46 Cb -0.35 -0.57 -0.05 0.00 0.41 0.00 0.00 41.25 40.70 1j1o s ASN 46 CO 0.30 -0.94 1.65 0.74 -1.51 0.00 0.00 177.10 177.34 1j1o h THR 47 N 0.43 1.18 0.00 1.60 2.02 -1.96 -2.79 112.91 113.40 1j1o h THR 47 Ca -0.39 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 66.23 1j1o h THR 47 Cb 1.28 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 1j1o h THR 47 CO 0.46 0.19 0.00 -0.90 0.37 0.00 0.00 175.52 175.64 1j1o n ASP 48 N -4.73 0.00 0.00 4.18 5.75 -1.26 -4.75 116.55 115.74 1j1o n ASP 48 Ca -0.02 -0.78 0.00 0.00 -0.01 0.00 0.00 54.79 53.98 1j1o n ASP 48 Cb 0.14 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.23 1j1o n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1j1o n GLY 49 N -0.11 1.59 3.91 6.12 0.00 -1.05 -4.71 105.19 110.95 1j1o n GLY 49 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1j1o n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1j1o s SER 50 N -3.19 5.21 0.02 1.61 1.04 -1.26 -4.57 113.70 112.55 1j1o s SER 50 Ca 0.00 0.73 0.02 0.00 0.48 0.00 0.00 55.95 57.19 1j1o s SER 50 Cb 0.00 -1.53 -0.01 0.00 0.10 0.00 0.00 66.02 64.58 1j1o s SER 50 CO 0.00 -1.38 -0.08 -0.89 0.98 0.00 0.00 173.24 171.88 1j1o s THR 51 N -3.21 0.57 -0.17 2.02 2.01 -1.26 0.58 115.64 116.18 1j1o s THR 51 Ca 0.58 -0.63 -0.14 0.00 0.31 0.00 0.00 61.69 61.81 1j1o s THR 51 Cb -0.11 -0.54 -0.05 0.00 0.01 0.00 0.00 72.50 71.81 1j1o s THR 51 CO 0.47 -0.06 0.28 -1.81 -0.69 0.00 0.00 174.62 172.81 1j1o s ASP 52 N -0.75 6.40 -0.02 3.53 1.11 -0.37 -0.73 116.67 125.84 1j1o s ASP 52 Ca -0.02 0.47 0.08 0.00 0.18 0.00 0.00 52.55 53.26 1j1o s ASP 52 Cb -0.06 -2.18 -0.02 0.00 1.07 0.00 0.00 42.92 41.74 1j1o s ASP 52 CO 0.00 0.09 -0.25 -0.31 1.18 0.00 0.00 175.17 175.88 1j1o s TYR 53 N 0.55 2.36 0.00 4.23 1.51 0.89 -1.69 117.35 125.19 1j1o s TYR 53 Ca 0.16 -0.41 0.00 0.00 -1.01 0.00 0.00 57.07 55.80 1j1o s TYR 53 Cb -0.13 -1.50 0.00 0.00 -0.11 0.00 0.00 41.96 40.22 1j1o s TYR 53 CO 0.04 -0.01 0.00 0.41 -1.11 0.00 0.00 175.55 174.88 1j1o n GLY 54 N 2.39 -2.23 0.31 0.71 0.00 -0.12 -0.84 105.19 105.41 1j1o n GLY 54 Ca -0.16 -1.51 0.15 0.00 0.00 0.00 0.00 46.02 44.49 1j1o n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1j1o h ILE 55 N 0.00 0.59 -0.19 -0.61 2.10 -1.68 -1.12 117.51 116.60 1j1o h ILE 55 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1j1o h ILE 55 Cb 0.00 0.93 0.00 0.00 -1.09 0.00 0.00 36.82 36.66 1j1o h ILE 55 CO 0.00 0.00 0.00 0.18 -1.08 0.00 0.00 178.15 177.25 1j1o n LEU 56 N -3.96 3.16 -4.06 2.19 4.77 -1.26 -4.02 117.00 113.81 1j1o n LEU 56 Ca -0.01 -2.72 -0.46 0.00 -0.03 0.00 0.00 56.01 52.79 1j1o n LEU 56 Cb 0.20 -0.40 0.02 0.00 -2.33 0.00 0.00 43.42 40.91 1j1o n LEU 56 CO 0.29 0.68 -0.17 0.00 -1.33 0.00 0.00 177.39 176.86 1j1o n GLN 57 N -0.51 -0.32 -2.64 3.23 1.13 -0.42 -4.89 117.38 112.96 1j1o n GLN 57 Ca 0.16 0.11 -0.42 0.00 -1.94 0.00 0.00 57.00 54.91 1j1o n GLN 57 Cb 0.68 -2.51 -0.03 0.00 0.11 0.00 0.00 30.24 28.49 1j1o n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1j1o s ILE 58 N -3.49 4.68 0.20 5.09 1.01 -0.02 -4.37 121.20 124.29 1j1o s ILE 58 Ca 0.47 1.93 -0.30 0.00 0.00 0.00 0.00 60.65 62.75 1j1o s ILE 58 Cb -0.26 -4.24 -0.08 0.00 0.01 0.00 0.00 42.46 37.90 1j1o s ILE 58 CO 0.97 0.12 1.08 0.21 0.00 0.00 0.00 174.94 177.32 1j1o s ASN 59 N 1.05 7.31 0.00 3.58 2.47 -1.26 -0.08 114.94 128.01 1j1o s ASN 59 Ca 0.53 2.10 0.26 0.00 0.42 0.00 0.00 52.86 56.16 1j1o s ASN 59 Cb -0.22 -2.61 1.15 0.00 -1.45 0.00 0.00 41.25 38.12 1j1o s ASN 59 CO 0.27 -0.17 1.83 -1.54 -3.72 0.00 0.00 177.10 173.78 1j1o n SER 60 N 2.09 0.00 0.08 -4.21 3.41 0.09 -1.68 113.62 113.41 1j1o n SER 60 Ca 0.02 0.35 -0.17 0.00 -0.26 0.00 0.00 58.87 58.81 1j1o n SER 60 Cb 0.46 -0.45 -0.14 0.00 -0.26 0.00 0.00 64.21 63.82 1j1o n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1j1o h ARG 61 N 0.00 0.27 0.00 4.33 2.43 -1.84 -3.41 114.38 116.16 1j1o h ARG 61 Ca 0.00 -0.45 -0.17 0.00 -0.81 0.00 0.00 59.98 58.55 1j1o h ARG 61 Cb 0.39 0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 1j1o h ARG 61 CO 0.00 1.16 -1.63 0.91 -1.51 0.00 0.00 179.97 178.90 1j1o n TRP 62 N -3.49 0.00 -0.13 2.20 7.02 -1.23 -1.29 117.44 120.52 1j1o n TRP 62 Ca -0.13 0.00 -0.24 0.00 -1.02 0.00 0.00 57.50 56.11 1j1o n TRP 62 Cb 1.04 -0.43 -0.11 0.00 -2.42 0.00 0.00 31.31 29.38 1j1o n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1j1o n TRP 63 N -2.65 0.00 -4.38 -5.99 7.02 -0.67 0.31 117.44 111.08 1j1o n TRP 63 Ca -0.18 0.00 -0.20 0.00 -1.02 0.00 0.00 57.50 56.10 1j1o n TRP 63 Cb 0.74 -1.00 -0.10 0.00 -2.42 0.00 0.00 31.31 28.53 1j1o n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1j1o s ASN 65 N -3.37 5.41 0.00 0.00 2.47 -0.63 -4.39 114.94 114.43 1j1o s ASN 65 Ca 0.25 -0.37 0.10 0.00 0.42 0.00 0.00 52.86 53.25 1j1o s ASN 65 Cb -0.01 -1.97 0.21 0.00 -1.45 0.00 0.00 41.25 38.02 1j1o s ASN 65 CO 0.09 -0.12 1.10 -0.90 -3.72 0.00 0.00 177.10 173.54 1j1o n ASP 66 N 4.96 2.51 -1.10 -4.21 5.75 -1.26 -1.62 116.55 121.58 1j1o n ASP 66 Ca -0.15 -1.81 -0.14 0.00 -0.01 0.00 0.00 54.79 52.67 1j1o n ASP 66 Cb 0.50 -0.14 -0.06 0.00 -1.03 0.00 0.00 41.12 40.39 1j1o n ASP 66 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1j1o n GLY 67 N 0.45 1.40 0.04 6.12 0.00 -1.26 -4.79 105.19 107.15 1j1o n GLY 67 Ca 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1j1o n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j1o n ARG 68 N -1.65 0.63 -4.42 1.61 1.74 -1.26 -5.06 116.66 108.25 1j1o n ARG 68 Ca -0.14 -0.78 -0.34 0.00 -0.77 0.00 0.00 57.85 55.82 1j1o n ARG 68 Cb 0.59 -0.62 -0.14 0.00 -1.02 0.00 0.00 32.46 31.26 1j1o n ARG 68 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1j1o s THR 69 N -0.26 3.13 0.00 0.55 2.01 -1.26 -4.87 115.64 114.95 1j1o s THR 69 Ca 0.01 -0.61 0.00 0.00 0.31 0.00 0.00 61.69 61.40 1j1o s THR 69 Cb 0.01 -2.36 0.00 0.00 0.01 0.00 0.00 72.50 70.16 1j1o s THR 69 CO 0.00 0.49 0.00 -2.65 -0.69 0.00 0.00 174.62 171.77 1j1o n PRO 70 N 4.02 0.00 -0.86 4.92 -0.02 -1.26 -2.97 135.00 138.82 1j1o n PRO 70 Ca -0.18 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.20 1j1o n PRO 70 Cb 0.52 0.00 -0.14 0.00 -0.02 0.00 0.00 33.50 33.86 1j1o n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j1o n GLY 71 N 0.00 2.76 3.77 -1.23 0.00 -1.26 -4.94 105.19 104.30 1j1o n GLY 71 Ca 0.00 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.61 1j1o n GLY 71 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1j1o s SER 72 N 2.10 6.15 -0.01 1.61 0.15 -1.16 -4.82 113.70 117.72 1j1o s SER 72 Ca 0.56 3.03 0.03 0.00 0.70 0.00 0.00 55.95 60.26 1j1o s SER 72 Cb 0.27 -2.66 -0.04 0.00 -1.71 0.00 0.00 66.02 61.87 1j1o s SER 72 CO 0.00 -1.00 0.05 0.54 1.20 0.00 0.00 173.24 174.03 1j1o n ARG 73 N 0.20 0.44 -3.88 5.44 1.74 -0.41 -5.00 116.66 115.18 1j1o n ARG 73 Ca 0.02 -0.02 -0.27 0.00 -0.77 0.00 0.00 57.85 56.82 1j1o n ARG 73 Cb 0.40 -1.06 -0.00 0.00 -1.02 0.00 0.00 32.46 30.77 1j1o n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1j1o n ASN 74 N -1.64 -1.38 0.25 0.55 4.05 -1.15 -4.84 115.26 111.10 1j1o n ASN 74 Ca -0.01 -1.00 0.17 0.00 0.45 0.00 0.00 54.58 54.19 1j1o n ASN 74 Cb 0.12 -3.16 0.88 0.00 1.23 0.00 0.00 39.78 38.85 1j1o n ASN 74 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1j1o h LEU 75 N -1.87 0.00 -1.06 1.20 3.38 -0.06 -0.53 115.31 116.37 1j1o h LEU 75 Ca -0.64 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.33 1j1o h LEU 75 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 1j1o h LEU 75 CO 0.59 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 179.09 1j1o n ASN 77 N 0.26 -2.08 -3.59 0.00 5.03 -0.21 -4.97 115.26 109.71 1j1o n ASN 77 Ca 0.17 -1.00 -0.16 0.00 0.87 0.00 0.00 54.58 54.46 1j1o n ASN 77 Cb 0.39 -3.24 -0.07 0.00 -1.02 0.00 0.00 39.78 35.85 1j1o n ASN 77 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 1j1o s ILE 78 N -3.76 0.01 0.20 2.41 2.07 -1.26 -5.09 121.20 115.78 1j1o s ILE 78 Ca 0.16 -0.08 -0.30 0.00 -1.41 0.00 0.00 60.65 59.02 1j1o s ILE 78 Cb -0.06 -0.91 -0.08 0.00 0.13 0.00 0.00 42.46 41.53 1j1o s ILE 78 CO 0.87 -0.04 1.06 -2.16 -1.91 0.00 0.00 174.94 172.75 1j1o s PRO 79 N -0.95 4.66 0.53 3.50 0.04 -1.26 -1.60 135.00 139.93 1j1o s PRO 79 Ca -0.10 1.66 0.26 0.00 0.04 0.00 0.00 61.00 62.87 1j1o s PRO 79 Cb -0.02 -3.27 1.41 0.00 0.04 0.00 0.00 34.50 32.66 1j1o s PRO 79 CO 0.07 0.19 1.99 0.00 0.04 0.00 0.00 177.00 179.29 1j1o h SER 81 N 0.00 0.37 0.52 0.00 4.64 -1.92 0.52 113.55 117.68 1j1o h SER 81 Ca 0.27 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1j1o h SER 81 Cb 1.08 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1j1o h SER 81 CO -0.00 0.23 -0.01 0.00 -0.87 0.00 0.00 176.83 176.18 1j1o h ALA 82 N 1.71 1.03 -0.23 5.18 0.00 -1.53 -1.60 119.26 123.83 1j1o h ALA 82 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1j1o h ALA 82 Cb 0.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1j1o h ALA 82 CO -0.07 0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.48 1j1o n LEU 83 N -3.14 1.88 -0.73 0.00 4.77 0.17 -3.77 117.00 116.18 1j1o n LEU 83 Ca -0.01 -0.82 0.06 0.00 -0.03 0.00 0.00 56.01 55.21 1j1o n LEU 83 Cb 0.20 -0.15 0.18 0.00 -2.33 0.00 0.00 43.42 41.32 1j1o n LEU 83 CO 0.24 0.41 0.65 -0.11 -1.33 0.00 0.00 177.39 177.25 1j1o n LEU 84 N 0.47 3.07 -4.87 2.23 7.94 -0.60 -3.59 117.00 121.66 1j1o n LEU 84 Ca 0.16 -2.02 -0.31 0.00 -1.11 0.00 0.00 56.01 52.72 1j1o n LEU 84 Cb 0.35 -0.27 -0.00 0.00 0.53 0.00 0.00 43.42 44.03 1j1o n LEU 84 CO 0.12 0.76 0.69 -0.55 -1.11 0.00 0.00 177.39 177.30 1j1o s SER 85 N -1.02 6.33 0.28 1.96 0.15 -1.25 -4.45 113.70 115.71 1j1o s SER 85 Ca 0.27 1.42 0.25 0.00 0.70 0.00 0.00 55.95 58.59 1j1o s SER 85 Cb 0.14 -2.46 0.92 0.00 -1.71 0.00 0.00 66.02 62.90 1j1o s SER 85 CO 0.18 -0.78 1.76 0.28 1.20 0.00 0.00 173.24 175.88 1j1o h SER 86 N 0.04 0.00 -3.52 5.45 0.02 -1.94 -3.40 113.55 110.19 1j1o h SER 86 Ca -0.45 0.00 -0.62 0.00 -0.84 0.00 0.00 61.79 59.88 1j1o h SER 86 Cb 1.19 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.61 1j1o h SER 86 CO 0.62 0.00 0.23 -0.62 -1.14 0.00 0.00 176.83 175.92 1j1o s ASP 87 N -4.61 6.52 0.00 3.07 -1.08 -1.26 -4.95 116.67 114.36 1j1o s ASP 87 Ca 0.06 0.38 0.26 0.00 -0.52 0.00 0.00 52.55 52.73 1j1o s ASP 87 Cb 0.10 -2.35 1.53 0.00 -1.46 0.00 0.00 42.92 40.74 1j1o s ASP 87 CO 0.50 -0.58 1.98 2.30 0.52 0.00 0.00 175.17 179.89 1j1o n ILE 88 N 5.54 0.00 -0.22 4.11 -5.35 -1.26 -4.39 119.36 117.79 1j1o n ILE 88 Ca 0.00 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.37 1j1o n ILE 88 Cb 0.49 -0.41 -0.08 0.00 -1.74 0.00 0.00 39.64 37.90 1j1o n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1j1o h THR 89 N 0.00 0.02 -0.83 7.28 2.02 -1.94 -0.47 112.91 118.99 1j1o h THR 89 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1j1o h THR 89 Cb 0.00 0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 66.39 1j1o h THR 89 CO 0.00 0.00 0.43 0.00 0.37 0.00 0.00 175.52 176.32 1j1o h ALA 90 N 0.26 1.07 -0.71 6.16 0.00 -1.83 -0.84 119.26 123.38 1j1o h ALA 90 Ca 0.12 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1j1o h ALA 90 Cb 0.55 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1j1o h ALA 90 CO -0.70 0.60 0.21 0.77 0.00 0.00 0.00 179.25 180.13 1j1o h SER 91 N 1.17 1.03 -0.31 0.00 0.02 -1.68 -1.44 113.55 112.34 1j1o h SER 91 Ca 0.29 -0.21 -0.06 0.00 -0.84 0.00 0.00 61.79 60.97 1j1o h SER 91 Cb 0.07 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 1j1o h SER 91 CO -0.04 0.97 -0.03 0.58 -1.14 0.00 0.00 176.83 177.17 1j1o h VAL 92 N 1.04 1.27 -0.50 2.27 2.07 -0.78 0.68 116.25 122.30 1j1o h VAL 92 Ca 0.23 -1.03 0.05 0.00 0.82 0.00 0.00 66.70 66.77 1j1o h VAL 92 Cb 0.31 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 1j1o h VAL 92 CO -0.01 0.33 0.23 0.78 0.02 0.00 0.00 177.57 178.93 1j1o h ASN 93 N 0.36 0.30 -0.33 0.57 2.35 -0.92 -0.94 115.58 116.98 1j1o h ASN 93 Ca 0.08 0.04 -0.17 0.00 -0.55 0.00 0.00 56.30 55.70 1j1o h ASN 93 Cb 0.50 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.86 1j1o h ASN 93 CO 0.02 0.21 -0.46 0.00 -1.65 0.00 0.00 177.43 175.56 1j1o h ALA 95 N 0.72 1.72 -0.32 0.00 0.00 -0.45 -0.97 119.26 119.95 1j1o h ALA 95 Ca 0.04 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1j1o h ALA 95 Cb 1.06 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1j1o h ALA 95 CO 0.11 0.26 -0.21 0.87 0.00 0.00 0.00 179.25 180.28 1j1o h LYS 96 N 0.54 0.61 -0.25 0.00 1.57 -1.05 -1.13 116.57 116.86 1j1o h LYS 96 Ca 0.15 -0.22 -0.14 0.00 -1.87 0.00 0.00 60.65 58.56 1j1o h LYS 96 Cb -0.06 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1j1o h LYS 96 CO -0.03 0.78 -0.39 -0.22 -0.57 0.00 0.00 179.45 179.02 1j1o h LYS 97 N 0.54 0.71 -0.01 3.15 3.64 -1.16 -2.58 116.57 120.85 1j1o h LYS 97 Ca 0.08 -0.42 0.02 0.00 -1.27 0.00 0.00 60.65 59.06 1j1o h LYS 97 Cb 0.66 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 1j1o h LYS 97 CO 0.05 1.04 -0.11 0.82 -2.27 0.00 0.00 179.45 178.98 1j1o h ILE 98 N 0.43 0.72 0.00 2.00 2.04 -1.00 -2.09 117.51 119.61 1j1o h ILE 98 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.88 1j1o h ILE 98 Cb 0.98 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 1j1o h ILE 98 CO 0.09 0.00 0.00 0.55 0.00 0.00 0.00 178.15 178.79 1j1o n VAL 99 N -5.24 0.88 1.80 1.67 3.14 -0.45 -2.22 118.33 117.91 1j1o n VAL 99 Ca -0.05 0.29 0.16 0.00 -2.96 0.00 0.00 64.34 61.77 1j1o n VAL 99 Cb 0.16 -1.21 0.88 0.00 -1.06 0.00 0.00 33.84 32.61 1j1o n VAL 99 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1j1o n SER 100 N -2.16 0.00 -4.90 6.55 7.64 -0.79 -4.03 113.62 115.92 1j1o n SER 100 Ca 0.02 -0.70 -0.28 0.00 1.01 0.00 0.00 58.87 58.92 1j1o n SER 100 Cb 0.20 -0.10 -0.01 0.00 -1.01 0.00 0.00 64.21 63.29 1j1o n SER 100 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1j1o s ASP 101 N -2.20 6.30 0.61 6.43 2.15 -0.94 -4.95 116.67 124.07 1j1o s ASP 101 Ca 0.41 0.97 0.30 0.00 0.43 0.00 0.00 52.55 54.67 1j1o s ASP 101 Cb 0.21 -2.27 1.65 0.00 -0.30 0.00 0.00 42.92 42.22 1j1o s ASP 101 CO 0.40 -0.56 2.02 1.23 -0.17 0.00 0.00 175.17 178.10 1j1o h GLY 102 N 0.39 0.00 2.00 2.66 0.00 -1.88 -0.19 103.07 106.04 1j1o h GLY 102 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1j1o h GLY 102 CO 0.62 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.86 1j1o n ASN 103 N -3.53 0.65 0.00 0.19 3.02 -1.26 -4.96 115.26 109.36 1j1o n ASN 103 Ca 0.02 0.62 0.00 0.00 -0.03 0.00 0.00 54.58 55.19 1j1o n ASN 103 Cb 0.41 -0.77 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 1j1o n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1j1o n GLY 104 N 0.51 2.46 0.00 7.41 0.00 -0.09 -1.67 105.19 113.81 1j1o n GLY 104 Ca 0.04 -0.31 0.11 0.00 0.00 0.00 0.00 46.02 45.85 1j1o n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1j1o n MET 105 N 14.00 0.50 0.00 1.61 2.81 -1.26 -3.08 117.12 131.71 1j1o n MET 105 Ca 0.00 0.04 0.03 0.00 -1.81 0.00 0.00 57.70 55.96 1j1o n MET 105 Cb 0.00 -1.50 0.14 0.00 -0.71 0.00 0.00 33.22 31.15 1j1o n MET 105 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1j1o n ASN 106 N -1.14 0.00 0.25 7.83 3.02 -0.67 -1.14 115.26 123.40 1j1o n ASN 106 Ca 0.14 0.40 0.12 0.00 -0.03 0.00 0.00 54.58 55.20 1j1o n ASN 106 Cb 0.13 -0.43 0.63 0.00 -0.61 0.00 0.00 39.78 39.50 1j1o n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1j1o h ALA 107 N 2.24 1.15 -2.19 5.41 0.00 -1.72 -3.38 119.26 120.78 1j1o h ALA 107 Ca 0.00 -0.14 -0.71 0.00 0.00 0.00 0.00 54.91 54.05 1j1o h ALA 107 Cb 0.09 -0.02 -0.20 0.00 0.00 0.00 0.00 17.79 17.65 1j1o h ALA 107 CO 0.00 0.19 -0.14 -1.58 0.00 0.00 0.00 179.25 177.72 1j1o s TRP 108 N -3.95 3.15 0.23 0.00 0.51 -0.29 -4.94 118.94 113.64 1j1o s TRP 108 Ca -0.01 -0.77 -0.06 0.00 -2.12 0.00 0.00 56.10 53.13 1j1o s TRP 108 Cb 0.12 -3.39 0.31 0.00 -0.81 0.00 0.00 33.47 29.70 1j1o s TRP 108 CO 0.60 -0.93 1.84 0.28 -0.51 0.00 0.00 176.95 178.23 1j1o h VAL 109 N 5.81 1.01 -0.66 4.03 2.07 -1.85 -0.70 116.25 125.96 1j1o h VAL 109 Ca -0.28 -0.30 -0.09 0.00 0.82 0.00 0.00 66.70 66.85 1j1o h VAL 109 Cb 1.10 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 1j1o h VAL 109 CO 0.93 0.16 0.08 0.00 0.02 0.00 0.00 177.57 178.76 1j1o h ALA 110 N 1.39 0.87 -0.47 1.67 0.00 -1.92 -0.28 119.26 120.53 1j1o h ALA 110 Ca 0.36 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1j1o h ALA 110 Cb 0.19 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1j1o h ALA 110 CO -0.18 0.67 0.23 2.35 0.00 0.00 0.00 179.25 182.32 1j1o h TRP 111 N 1.02 0.67 -0.67 0.00 7.01 -1.69 0.26 115.95 122.55 1j1o h TRP 111 Ca 0.20 -0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.14 1j1o h TRP 111 Cb 0.48 -0.21 -0.03 0.00 -2.10 0.00 0.00 29.16 27.30 1j1o h TRP 111 CO 0.04 0.53 0.32 -0.09 -2.79 0.00 0.00 178.44 176.45 1j1o h ARG 112 N 0.61 0.97 0.03 2.65 2.43 -0.84 0.43 114.38 120.65 1j1o h ARG 112 Ca 0.16 -0.14 -0.22 0.00 -0.81 0.00 0.00 59.98 58.97 1j1o h ARG 112 Cb 0.11 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1j1o h ARG 112 CO -0.02 0.77 -1.02 -0.91 -1.51 0.00 0.00 179.97 177.28 1j1o h ASN 113 N 0.93 0.11 0.00 -3.80 -0.26 -0.76 -3.37 115.58 108.43 1j1o h ASN 113 Ca 0.23 -0.11 0.00 0.00 -0.56 0.00 0.00 56.30 55.86 1j1o h ASN 113 Cb 0.12 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.34 1j1o h ASN 113 CO -0.03 1.05 -0.14 0.54 -1.06 0.00 0.00 177.43 177.80 1j1o n ARG 114 N -3.44 6.07 -0.03 0.81 5.12 0.90 -4.89 116.66 121.20 1j1o n ARG 114 Ca -0.02 -0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.84 1j1o n ARG 114 Cb 0.93 -0.60 -0.02 0.00 -1.16 0.00 0.00 32.46 31.61 1j1o n ARG 114 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1j1o n LYS 116 N -3.10 2.24 -0.25 0.00 4.81 0.15 -1.06 118.16 120.95 1j1o n LYS 116 Ca -0.11 0.82 0.00 0.00 -0.87 0.00 0.00 58.31 58.15 1j1o n LYS 116 Cb 0.58 -2.64 0.00 0.00 0.02 0.00 0.00 35.03 33.00 1j1o n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1j1o n GLY 117 N 3.96 0.91 3.90 3.14 0.00 -1.26 -4.93 105.19 110.91 1j1o n GLY 117 Ca 0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 1j1o n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j1o s THR 118 N -2.67 2.71 -1.25 2.61 -4.23 -0.22 -5.00 115.64 107.58 1j1o s THR 118 Ca 0.00 -1.29 -0.18 0.00 -1.18 0.00 0.00 61.69 59.03 1j1o s THR 118 Cb 0.00 -3.00 0.00 0.00 1.34 0.00 0.00 72.50 70.85 1j1o s THR 118 CO 0.00 0.00 1.92 -0.67 -0.54 0.00 0.00 174.62 175.33 1j1o n ASP 119 N -1.59 4.02 0.30 3.99 2.03 -1.26 -4.75 116.55 119.29 1j1o n ASP 119 Ca 0.04 -2.83 0.16 0.00 0.52 0.00 0.00 54.79 52.68 1j1o n ASP 119 Cb 0.61 -1.65 0.95 0.00 -0.72 0.00 0.00 41.12 40.32 1j1o n ASP 119 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 1j1o h VAL 120 N 5.17 0.47 -0.04 5.18 -1.51 -1.91 -1.63 116.25 121.98 1j1o h VAL 120 Ca 0.43 0.00 0.01 0.00 -1.23 0.00 0.00 66.70 65.91 1j1o h VAL 120 Cb 0.80 1.00 -0.00 0.00 -2.13 0.00 0.00 31.29 30.96 1j1o h VAL 120 CO 1.58 0.00 0.04 -0.61 -1.23 0.00 0.00 177.57 177.35 1j1o h GLN 121 N 0.00 0.00 -0.18 5.19 5.75 -1.87 -1.37 115.11 122.63 1j1o h GLN 121 Ca 0.00 0.00 0.05 0.00 -0.15 0.00 0.00 58.65 58.55 1j1o h GLN 121 Cb 0.01 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 1j1o h GLN 121 CO -0.00 0.00 0.14 0.00 -2.65 0.00 0.00 178.83 176.32 1j1o h ALA 122 N 1.96 2.10 0.00 3.38 0.00 -1.69 -1.80 119.26 123.21 1j1o h ALA 122 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1j1o h ALA 122 Cb 0.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1j1o h ALA 122 CO -0.00 -0.23 0.00 0.91 0.00 0.00 0.00 179.25 179.93 1j1o n TRP 123 N -4.36 0.53 0.10 0.00 7.02 -0.52 -2.53 117.44 117.68 1j1o n TRP 123 Ca 0.01 0.21 0.01 0.00 -1.02 0.00 0.00 57.50 56.72 1j1o n TRP 123 Cb 0.27 -0.85 0.02 0.00 -2.42 0.00 0.00 31.31 28.33 1j1o n TRP 123 CO 0.00 0.00 0.00 0.44 -2.02 0.00 0.00 177.69 176.11 1j1o n ILE 124 N -1.99 0.15 -2.52 -0.99 -5.35 -0.69 -4.82 119.36 103.15 1j1o n ILE 124 Ca 0.02 -0.58 -0.36 0.00 -0.27 0.00 0.00 62.75 61.56 1j1o n ILE 124 Cb 0.19 0.97 -0.04 0.00 -1.74 0.00 0.00 39.64 39.03 1j1o n ILE 124 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1j1o s ARG 125 N -0.36 4.11 -0.73 6.28 3.52 -1.05 -3.49 118.95 127.23 1j1o s ARG 125 Ca 0.04 1.53 0.00 0.00 -0.13 0.00 0.00 55.73 57.16 1j1o s ARG 125 Cb 0.03 -2.51 0.00 0.00 -1.56 0.00 0.00 34.95 30.91 1j1o s ARG 125 CO 0.04 -0.19 0.00 0.41 -0.81 0.00 0.00 175.30 174.75 1j1o n GLY 126 N 0.31 0.37 3.26 8.12 0.00 -1.26 -5.03 105.19 110.96 1j1o n GLY 126 Ca 0.05 -0.60 -0.26 0.00 0.00 0.00 0.00 46.02 45.21 1j1o n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1o s ARG 128 N -1.16 3.70 0.00 0.00 1.81 -1.26 -5.13 118.95 116.91 1j1o s ARG 128 Ca 0.08 0.30 0.15 0.00 -1.72 0.00 0.00 55.73 54.53 1j1o s ARG 128 Cb -0.09 -3.84 0.12 0.00 -0.45 0.00 0.00 34.95 30.69 1j1o s ARG 128 CO 0.02 -0.94 0.97 1.28 -0.68 0.00 0.00 175.30 175.95