#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yss s VAL 2 N 0.00 1.77 0.53 3.15 1.01 -1.26 -1.25 120.40 124.35 2yss s VAL 2 Ca 0.00 -0.82 -0.07 0.00 0.00 0.00 0.00 61.98 61.09 2yss s VAL 2 Cb 0.00 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 2yss s VAL 2 CO 0.00 0.50 0.86 -0.36 0.00 0.00 0.00 175.10 176.10 2yss s PHE 3 N 0.73 3.54 0.36 5.22 0.40 -0.39 -5.01 117.98 122.82 2yss s PHE 3 Ca -0.11 0.91 0.03 0.00 -0.60 0.00 0.00 56.93 57.16 2yss s PHE 3 Cb -0.16 -2.46 -0.02 0.00 0.51 0.00 0.00 43.02 40.89 2yss s PHE 3 CO 0.02 -0.45 0.54 0.20 0.70 0.00 0.00 175.22 176.22 2yss s GLY 4 N -4.15 1.47 0.12 4.36 0.00 -1.26 -4.85 107.32 103.01 2yss s GLY 4 Ca 0.50 -1.17 -0.24 0.00 0.00 0.00 0.00 44.72 43.82 2yss s GLY 4 CO 0.47 -1.08 1.67 -0.09 0.00 0.00 0.00 173.10 174.07 2yss h ARG 5 N 0.74 -0.24 -0.18 2.90 2.43 -1.98 -2.27 114.38 115.78 2yss h ARG 5 Ca -0.48 0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 58.57 2yss h ARG 5 Cb 1.24 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.84 2yss h ARG 5 CO 0.57 -0.16 -0.49 0.00 -1.51 0.00 0.00 179.97 178.38 2yss h GLU 7 N 0.37 1.15 -0.17 0.00 4.81 -1.93 -1.82 114.58 117.00 2yss h GLU 7 Ca 0.02 -0.17 -0.20 0.00 -0.13 0.00 0.00 59.36 58.88 2yss h GLU 7 Cb 1.00 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.17 2yss h GLU 7 CO 0.09 0.89 -0.71 1.25 -0.73 0.00 0.00 179.01 179.80 2yss h LEU 8 N 1.14 0.83 -0.58 1.64 5.85 -1.37 -1.80 115.31 121.01 2yss h LEU 8 Ca 0.28 -0.52 0.07 0.00 0.84 0.00 0.00 57.88 58.55 2yss h LEU 8 Cb 0.12 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 40.84 2yss h LEU 8 CO -0.03 1.30 0.25 0.00 -0.34 0.00 0.00 178.44 179.61 2yss h ALA 9 N 0.70 0.75 -0.47 1.25 0.00 -1.17 0.13 119.26 120.44 2yss h ALA 9 Ca -0.03 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2yss h ALA 9 Cb 1.31 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 2yss h ALA 9 CO 0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 179.25 179.24 2yss h ALA 10 N 1.36 0.63 -0.60 0.00 0.00 -1.23 -2.07 119.26 117.36 2yss h ALA 10 Ca 0.28 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2yss h ALA 10 Cb 0.28 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2yss h ALA 10 CO -0.24 0.45 0.01 0.00 0.00 0.00 0.00 179.25 179.47 2yss h ALA 11 N 0.91 0.88 -0.09 0.00 0.00 -0.50 -1.72 119.26 118.74 2yss h ALA 11 Ca 0.13 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 2yss h ALA 11 Cb 0.53 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2yss h ALA 11 CO 0.03 0.66 -0.47 0.52 0.00 0.00 0.00 179.25 179.99 2yss h MET 12 N 0.96 0.22 -0.41 0.00 2.86 -0.72 -1.09 114.93 116.75 2yss h MET 12 Ca 0.17 -0.12 -0.11 0.00 -2.06 0.00 0.00 59.70 57.58 2yss h MET 12 Cb 0.53 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 2yss h MET 12 CO 0.03 0.65 -0.19 -0.22 1.06 0.00 0.00 176.91 178.24 2yss h LYS 13 N 0.18 0.86 0.00 1.72 3.11 -1.22 -0.45 116.57 120.77 2yss h LYS 13 Ca 0.01 -0.37 -0.02 0.00 -2.81 0.00 0.00 60.65 57.46 2yss h LYS 13 Cb 0.90 -0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 32.10 2yss h LYS 13 CO 0.07 1.01 -0.09 -0.09 -2.81 0.00 0.00 179.45 177.54 2yss h ARG 14 N 0.67 0.00 -0.62 1.90 2.43 -1.05 -2.53 114.38 115.18 2yss h ARG 14 Ca 0.09 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2yss h ARG 14 Cb 0.75 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 2yss h ARG 14 CO 0.06 0.09 0.00 0.72 -1.51 0.00 0.00 179.97 179.33 2yss n HIS 15 N -3.24 1.14 -2.62 2.20 8.25 -0.44 -4.94 115.22 115.57 2yss n HIS 15 Ca 0.00 -0.47 -0.13 0.00 -0.26 0.00 0.00 57.72 56.86 2yss n HIS 15 Cb 0.34 -0.17 0.02 0.00 1.12 0.00 0.00 29.99 31.29 2yss n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2yss n GLY 16 N 1.06 -0.06 0.08 -1.41 0.00 -0.95 -4.95 105.19 98.97 2yss n GLY 16 Ca 0.21 -0.26 0.01 0.00 0.00 0.00 0.00 46.02 45.97 2yss n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2yss n LEU 17 N -2.37 0.51 -4.61 0.99 4.77 -0.23 -4.54 117.00 111.52 2yss n LEU 17 Ca -0.08 0.22 -0.43 0.00 -0.03 0.00 0.00 56.01 55.69 2yss n LEU 17 Cb 0.58 0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.78 2yss n LEU 17 CO 0.26 0.18 1.82 -0.62 -1.33 0.00 0.00 177.39 177.70 2yss s ASP 18 N -5.46 5.57 -0.89 -1.43 2.15 -1.26 -1.76 116.67 113.58 2yss s ASP 18 Ca -0.05 1.98 -0.00 0.00 0.43 0.00 0.00 52.55 54.90 2yss s ASP 18 Cb 0.09 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 2yss s ASP 18 CO 0.83 -1.86 0.06 0.59 -0.17 0.00 0.00 175.17 174.63 2yss n ASN 19 N 11.22 -3.60 -4.66 -0.34 3.02 -0.65 -4.85 115.26 115.40 2yss n ASN 19 Ca 0.29 -0.04 -0.43 0.00 -0.03 0.00 0.00 54.58 54.37 2yss n ASN 19 Cb 0.45 -2.78 -0.02 0.00 -0.61 0.00 0.00 39.78 36.82 2yss n ASN 19 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2yss s TYR 20 N -2.60 3.34 -1.50 3.10 5.04 -0.72 -3.61 117.35 120.39 2yss s TYR 20 Ca 0.03 1.47 -0.12 0.00 -2.44 0.00 0.00 57.07 56.00 2yss s TYR 20 Cb -0.01 -3.27 0.07 0.00 0.35 0.00 0.00 41.96 39.09 2yss s TYR 20 CO 0.04 -0.49 0.95 0.54 -1.34 0.00 0.00 175.55 175.25 2yss n ARG 21 N 6.33 -5.68 -0.85 4.97 5.12 -1.26 -2.30 116.66 122.98 2yss n ARG 21 Ca 0.12 0.64 0.00 0.00 -1.93 0.00 0.00 57.85 56.68 2yss n ARG 21 Cb 0.46 -5.54 0.00 0.00 -1.16 0.00 0.00 32.46 26.22 2yss n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2yss n GLY 22 N -1.69 0.67 3.24 -0.13 0.00 -1.24 -5.04 105.19 101.02 2yss n GLY 22 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 2yss n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2yss s TYR 23 N -2.48 3.31 0.70 1.61 2.02 -0.97 -4.98 117.35 116.56 2yss s TYR 23 Ca 0.00 -1.61 -0.16 0.00 -0.37 0.00 0.00 57.07 54.93 2yss s TYR 23 Cb 0.00 -2.52 0.02 0.00 -0.40 0.00 0.00 41.96 39.06 2yss s TYR 23 CO 0.00 -0.79 1.26 -1.54 -1.57 0.00 0.00 175.55 172.91 2yss s SER 24 N 1.59 4.32 0.36 2.29 1.04 -1.26 -1.63 113.70 120.40 2yss s SER 24 Ca 0.00 2.52 0.17 0.00 0.48 0.00 0.00 55.95 59.12 2yss s SER 24 Cb -0.21 -2.61 1.10 0.00 0.10 0.00 0.00 66.02 64.41 2yss s SER 24 CO 0.01 -2.19 1.69 0.25 0.98 0.00 0.00 173.24 173.98 2yss h LEU 25 N 0.09 0.50 -2.09 2.42 5.85 -1.89 -0.21 115.31 119.98 2yss h LEU 25 Ca -0.49 0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.43 2yss h LEU 25 Cb 1.32 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.44 2yss h LEU 25 CO 0.51 -0.06 0.14 1.23 -0.34 0.00 0.00 178.44 179.92 2yss h GLY 26 N 0.35 0.00 0.91 3.75 0.00 -1.91 -1.80 103.07 104.37 2yss h GLY 26 Ca 0.71 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.94 2yss h GLY 26 CO -0.50 0.00 -0.21 3.43 0.00 0.00 0.00 176.54 179.26 2yss h ASN 27 N 0.00 0.65 -0.14 0.19 2.35 -1.25 -1.96 115.58 115.42 2yss h ASN 27 Ca 0.08 -0.45 -0.12 0.00 -0.55 0.00 0.00 56.30 55.26 2yss h ASN 27 Cb 0.35 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 2yss h ASN 27 CO -0.00 0.96 -0.30 -0.50 -1.65 0.00 0.00 177.43 175.94 2yss h TRP 28 N 0.34 0.72 -0.28 1.19 4.06 -1.44 0.84 115.95 121.37 2yss h TRP 28 Ca 0.05 -0.18 -0.19 0.00 2.06 0.00 0.00 58.89 60.63 2yss h TRP 28 Cb 0.76 -0.17 0.00 0.00 -1.00 0.00 0.00 29.16 28.75 2yss h TRP 28 CO 0.07 0.85 -0.56 0.28 -3.56 0.00 0.00 178.44 175.53 2yss h VAL 29 N 0.54 1.27 -0.19 1.49 2.07 -1.40 -1.55 116.25 118.48 2yss h VAL 29 Ca 0.07 -1.74 -0.03 0.00 0.82 0.00 0.00 66.70 65.82 2yss h VAL 29 Cb 0.78 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 2yss h VAL 29 CO 0.06 0.57 0.01 0.00 0.02 0.00 0.00 177.57 178.23 2yss h ALA 31 N 0.79 0.97 -0.63 0.00 0.00 -0.79 -1.59 119.26 118.02 2yss h ALA 31 Ca 0.06 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2yss h ALA 31 Cb 0.38 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 2yss h ALA 31 CO 0.01 0.03 0.11 0.00 0.00 0.00 0.00 179.25 179.40 2yss h ALA 32 N 1.39 1.01 0.06 0.00 0.00 -1.07 -1.88 119.26 118.77 2yss h ALA 32 Ca 0.33 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2yss h ALA 32 Cb 0.27 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2yss h ALA 32 CO -0.22 0.63 -0.08 -0.22 0.00 0.00 0.00 179.25 179.36 2yss h LYS 33 N 0.96 -0.17 0.00 0.00 1.63 -0.27 -1.76 116.57 116.96 2yss h LYS 33 Ca 0.19 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.01 2yss h LYS 33 Cb 0.40 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 2yss h LYS 33 CO 0.01 -0.11 -0.35 1.19 -3.45 0.00 0.00 179.45 176.74 2yss n PHE 34 N -5.20 0.26 -0.07 1.91 3.72 -0.83 -0.78 117.46 116.47 2yss n PHE 34 Ca -0.07 0.08 -0.21 0.00 -0.05 0.00 0.00 57.45 57.19 2yss n PHE 34 Cb 0.12 -0.50 -0.12 0.00 -0.94 0.00 0.00 39.48 38.04 2yss n PHE 34 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2yss h GLU 35 N 0.00 0.08 0.00 -1.08 4.39 -1.30 -3.44 114.58 113.23 2yss h GLU 35 Ca 0.00 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.57 2yss h GLU 35 Cb 0.59 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 2yss h GLU 35 CO 0.00 1.06 0.00 -1.13 -1.16 0.00 0.00 179.01 177.78 2yss n SER 36 N -4.21 0.36 -3.56 1.42 3.41 -0.74 -4.78 113.62 105.52 2yss n SER 36 Ca -0.30 -0.84 -0.22 0.00 -0.26 0.00 0.00 58.87 57.25 2yss n SER 36 Cb 0.76 0.10 0.08 0.00 -0.26 0.00 0.00 64.21 64.89 2yss n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2yss n ASN 37 N -0.10 -4.41 -0.91 4.04 5.15 0.04 -2.39 115.26 116.68 2yss n ASN 37 Ca 0.00 -0.60 -0.12 0.00 -0.60 0.00 0.00 54.58 53.26 2yss n ASN 37 Cb 0.11 -4.95 -0.05 0.00 -0.53 0.00 0.00 39.78 34.36 2yss n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2yss n PHE 38 N -4.63 0.00 -3.35 1.20 3.72 -1.15 -4.85 117.46 108.41 2yss n PHE 38 Ca -0.12 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.88 2yss n PHE 38 Cb 0.60 -2.40 -0.09 0.00 -0.94 0.00 0.00 39.48 36.66 2yss n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2yss s ASN 39 N -2.66 6.23 0.44 4.37 3.84 -1.01 -1.27 114.94 124.89 2yss s ASN 39 Ca 0.00 -0.14 0.29 0.00 0.21 0.00 0.00 52.86 53.22 2yss s ASN 39 Cb 0.00 -2.22 1.11 0.00 -0.55 0.00 0.00 41.25 39.59 2yss s ASN 39 CO 0.00 -0.38 1.86 0.71 -2.79 0.00 0.00 177.10 176.50 2yss h THR 40 N 5.56 0.00 -0.00 -5.21 1.35 -1.49 -2.87 112.91 110.25 2yss h THR 40 Ca -0.29 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 2yss h THR 40 Cb 1.14 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 2yss h THR 40 CO 0.72 0.00 -0.68 0.00 -0.25 0.00 0.00 175.52 175.31 2yss n GLN 41 N -2.81 0.20 -1.64 4.72 1.13 -1.26 -3.94 117.38 113.78 2yss n GLN 41 Ca 0.02 -0.14 -0.41 0.00 -1.94 0.00 0.00 57.00 54.53 2yss n GLN 41 Cb 0.32 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 29.19 2yss n GLN 41 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2yss n ALA 42 N -1.28 0.53 -3.54 -1.58 0.00 -1.14 -4.74 120.51 108.76 2yss n ALA 42 Ca 0.06 0.20 -0.11 0.00 0.00 0.00 0.00 53.44 53.58 2yss n ALA 42 Cb 0.35 -2.15 -0.10 0.00 0.00 0.00 0.00 19.45 17.55 2yss n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2yss s THR 43 N -1.30 -0.01 -0.07 0.00 -4.23 -1.26 -0.76 115.64 108.01 2yss s THR 43 Ca 0.65 0.04 0.01 0.00 -1.18 0.00 0.00 61.69 61.21 2yss s THR 43 Cb -0.51 -0.68 0.02 0.00 1.34 0.00 0.00 72.50 72.67 2yss s THR 43 CO 0.55 0.02 -0.07 0.21 -0.54 0.00 0.00 174.62 174.79 2yss s ASN 44 N 0.91 1.57 -0.21 3.99 2.47 -0.44 -4.97 114.94 118.27 2yss s ASN 44 Ca -0.05 -0.21 -0.24 0.00 0.42 0.00 0.00 52.86 52.78 2yss s ASN 44 Cb -0.06 -0.65 -0.01 0.00 -1.45 0.00 0.00 41.25 39.08 2yss s ASN 44 CO -0.08 -0.07 0.78 -0.60 -3.72 0.00 0.00 177.10 173.42 2yss s ARG 45 N 1.19 4.23 0.70 0.43 3.52 -1.26 -0.41 118.95 127.35 2yss s ARG 45 Ca -0.06 0.89 -0.11 0.00 -0.13 0.00 0.00 55.73 56.32 2yss s ARG 45 Cb -0.14 -3.60 0.02 0.00 -1.56 0.00 0.00 34.95 29.67 2yss s ARG 45 CO -0.02 -0.38 1.08 -0.80 -0.81 0.00 0.00 175.30 174.37 2yss s ASN 46 N 1.25 5.37 0.03 -2.12 0.01 0.83 -4.96 114.94 115.34 2yss s ASN 46 Ca 0.34 1.05 0.16 0.00 -0.71 0.00 0.00 52.86 53.70 2yss s ASN 46 Cb -0.16 -1.84 0.66 0.00 0.41 0.00 0.00 41.25 40.33 2yss s ASN 46 CO 0.10 -1.36 1.49 0.35 -1.51 0.00 0.00 177.10 176.17 2yss n THR 47 N -2.99 0.98 -1.03 1.60 -2.24 -1.26 -2.89 114.28 106.45 2yss n THR 47 Ca 0.07 0.25 0.03 0.00 -2.27 0.00 0.00 64.05 62.12 2yss n THR 47 Cb 0.58 -1.02 0.31 0.00 -2.10 0.00 0.00 70.33 68.10 2yss n THR 47 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2yss n ASP 48 N -1.59 4.57 0.00 3.42 5.68 -1.26 -4.92 116.55 122.45 2yss n ASP 48 Ca 0.03 -3.13 0.00 0.00 -0.50 0.00 0.00 54.79 51.19 2yss n ASP 48 Cb 0.18 -0.65 0.00 0.00 -1.14 0.00 0.00 41.12 39.50 2yss n ASP 48 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2yss n GLY 49 N -0.16 1.98 3.95 6.12 0.00 -1.14 -4.94 105.19 111.00 2yss n GLY 49 Ca 0.30 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.08 2yss n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yss s SER 50 N -3.40 4.93 -0.05 1.61 1.04 -1.26 -4.65 113.70 111.92 2yss s SER 50 Ca 0.00 0.24 -0.05 0.00 0.48 0.00 0.00 55.95 56.62 2yss s SER 50 Cb 0.00 -0.96 0.01 0.00 0.10 0.00 0.00 66.02 65.18 2yss s SER 50 CO 0.00 -1.46 0.14 -0.89 0.98 0.00 0.00 173.24 172.01 2yss s THR 51 N -3.08 -0.00 -0.12 2.02 2.01 -1.26 -0.12 115.64 115.09 2yss s THR 51 Ca 0.60 0.00 -0.17 0.00 0.31 0.00 0.00 61.69 62.42 2yss s THR 51 Cb -0.10 -0.21 -0.04 0.00 0.01 0.00 0.00 72.50 72.16 2yss s THR 51 CO 0.42 0.00 0.45 -1.81 -0.69 0.00 0.00 174.62 172.99 2yss s ASP 52 N 0.09 6.65 -0.02 3.53 1.01 0.45 -0.58 116.67 127.80 2yss s ASP 52 Ca -0.00 0.77 0.08 0.00 0.71 0.00 0.00 52.55 54.10 2yss s ASP 52 Cb -0.01 -2.27 -0.02 0.00 1.01 0.00 0.00 42.92 41.63 2yss s ASP 52 CO 0.00 0.02 -0.25 -0.31 0.21 0.00 0.00 175.17 174.85 2yss s TYR 53 N 0.57 2.21 0.00 4.23 1.51 -0.37 -1.32 117.35 124.17 2yss s TYR 53 Ca 0.24 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.89 2yss s TYR 53 Cb -0.15 -1.41 0.00 0.00 -0.11 0.00 0.00 41.96 40.29 2yss s TYR 53 CO 0.09 -0.03 0.00 0.41 -1.11 0.00 0.00 175.55 174.91 2yss n GLY 54 N 2.44 -0.86 0.26 0.71 0.00 0.06 -1.24 105.19 106.55 2yss n GLY 54 Ca -0.16 -1.68 0.12 0.00 0.00 0.00 0.00 46.02 44.30 2yss n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2yss h ILE 55 N 0.00 0.00 0.00 -0.61 2.10 -1.63 0.18 117.51 117.54 2yss h ILE 55 Ca 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.93 2yss h ILE 55 Cb 0.00 0.51 -0.03 0.00 -1.09 0.00 0.00 36.82 36.21 2yss h ILE 55 CO 0.00 0.00 -0.30 0.18 -1.08 0.00 0.00 178.15 176.95 2yss n LEU 56 N -2.53 2.07 -3.32 2.19 4.77 -1.26 -4.11 117.00 114.81 2yss n LEU 56 Ca -0.02 -3.00 -0.16 0.00 -0.03 0.00 0.00 56.01 52.81 2yss n LEU 56 Cb 0.33 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2yss n LEU 56 CO 0.10 0.85 -0.16 0.00 -1.33 0.00 0.00 177.39 176.86 2yss n GLN 57 N -1.01 -0.96 -3.07 3.23 1.13 0.61 -4.86 117.38 112.46 2yss n GLN 57 Ca 0.14 0.46 -0.41 0.00 -1.94 0.00 0.00 57.00 55.25 2yss n GLN 57 Cb 0.70 -1.37 -0.06 0.00 0.11 0.00 0.00 30.24 29.62 2yss n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2yss s ILE 58 N -2.62 4.95 0.24 5.09 1.01 -0.37 -4.53 121.20 124.96 2yss s ILE 58 Ca 0.00 1.19 -0.31 0.00 0.00 0.00 0.00 60.65 61.53 2yss s ILE 58 Cb -0.00 -3.97 -0.12 0.00 0.01 0.00 0.00 42.46 38.38 2yss s ILE 58 CO 0.56 -0.01 1.67 0.21 0.00 0.00 0.00 174.94 177.37 2yss s ASN 59 N 1.46 6.39 0.00 3.58 3.04 -1.26 -1.24 114.94 126.91 2yss s ASN 59 Ca 0.28 2.89 0.29 0.00 0.04 0.00 0.00 52.86 56.35 2yss s ASN 59 Cb -0.15 -2.61 1.50 0.00 -1.54 0.00 0.00 41.25 38.44 2yss s ASN 59 CO 0.09 -0.94 2.00 -1.54 -3.04 0.00 0.00 177.10 173.66 2yss n SER 60 N 3.29 0.00 0.11 -4.21 3.41 0.25 -2.37 113.62 114.10 2yss n SER 60 Ca 0.13 -0.29 -0.02 0.00 -0.26 0.00 0.00 58.87 58.43 2yss n SER 60 Cb 0.36 -0.22 -0.04 0.00 -0.26 0.00 0.00 64.21 64.05 2yss n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2yss h ARG 61 N 0.00 0.00 0.00 4.33 2.43 -1.83 -3.40 114.38 115.91 2yss h ARG 61 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2yss h ARG 61 Cb 0.21 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2yss h ARG 61 CO 0.00 0.71 -0.21 0.91 -1.51 0.00 0.00 179.97 179.88 2yss n TRP 62 N -3.28 0.00 -0.05 2.20 7.02 -1.23 0.09 117.44 122.20 2yss n TRP 62 Ca 0.01 0.00 -0.04 0.00 -1.02 0.00 0.00 57.50 56.45 2yss n TRP 62 Cb 0.82 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 29.63 2yss n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 2yss n TRP 63 N -0.55 0.00 -4.11 -5.99 7.02 -1.00 -1.42 117.44 111.39 2yss n TRP 63 Ca 0.00 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.37 2yss n TRP 63 Cb 0.00 -0.49 -0.08 0.00 -2.42 0.00 0.00 31.31 28.32 2yss n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2yss s ASN 65 N -3.10 3.79 0.00 0.00 2.47 -0.29 -4.56 114.94 113.25 2yss s ASN 65 Ca 0.32 -0.39 0.00 0.00 0.42 0.00 0.00 52.86 53.20 2yss s ASN 65 Cb 0.04 -1.57 0.00 0.00 -1.45 0.00 0.00 41.25 38.27 2yss s ASN 65 CO 0.10 0.15 0.60 -0.90 -3.72 0.00 0.00 177.10 173.34 2yss n ASP 66 N 3.60 1.19 0.00 -4.21 5.68 -1.26 -0.43 116.55 121.12 2yss n ASP 66 Ca -0.18 -1.24 0.00 0.00 -0.50 0.00 0.00 54.79 52.87 2yss n ASP 66 Cb 0.53 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 2yss n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2yss n GLY 67 N -0.12 0.29 0.80 6.12 0.00 -1.26 -4.79 105.19 106.24 2yss n GLY 67 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 2yss n GLY 67 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2yss n ARG 68 N -1.66 2.95 -4.78 1.61 0.63 -1.26 -4.96 116.66 109.19 2yss n ARG 68 Ca 0.00 -2.32 -0.32 0.00 -0.92 0.00 0.00 57.85 54.28 2yss n ARG 68 Cb 0.07 -1.46 -0.16 0.00 0.45 0.00 0.00 32.46 31.35 2yss n ARG 68 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2yss s THR 69 N -1.47 2.16 0.00 5.15 2.01 -1.26 -4.82 115.64 117.40 2yss s THR 69 Ca 0.31 -0.96 0.00 0.00 0.31 0.00 0.00 61.69 61.35 2yss s THR 69 Cb 0.19 -1.86 0.00 0.00 0.01 0.00 0.00 72.50 70.84 2yss s THR 69 CO 0.16 0.55 0.00 -2.65 -0.69 0.00 0.00 174.62 171.98 2yss n PRO 70 N 3.93 0.00 -1.83 4.92 -0.02 -1.26 -3.38 135.00 137.36 2yss n PRO 70 Ca -0.20 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 60.88 2yss n PRO 70 Cb 0.52 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.99 2yss n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2yss n GLY 71 N 0.00 4.88 3.77 -1.23 0.00 -1.26 -4.96 105.19 106.39 2yss n GLY 71 Ca 0.00 -1.89 -0.38 0.00 0.00 0.00 0.00 46.02 43.75 2yss n GLY 71 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yss s SER 72 N 1.02 7.29 0.27 1.61 0.15 -1.22 -5.02 113.70 117.80 2yss s SER 72 Ca 0.57 1.99 0.06 0.00 0.70 0.00 0.00 55.95 59.27 2yss s SER 72 Cb 0.17 -2.60 -0.03 0.00 -1.71 0.00 0.00 66.02 61.86 2yss s SER 72 CO -0.08 -0.11 0.30 -0.13 1.20 0.00 0.00 173.24 174.43 2yss s ARG 73 N -1.79 3.09 -0.36 5.44 1.81 0.11 -5.00 118.95 122.26 2yss s ARG 73 Ca 0.48 -0.99 0.13 0.00 -1.72 0.00 0.00 55.73 53.64 2yss s ARG 73 Cb -0.24 -2.69 0.38 0.00 -0.45 0.00 0.00 34.95 31.95 2yss s ARG 73 CO 0.30 0.32 0.79 -1.71 -0.68 0.00 0.00 175.30 174.32 2yss n ASN 74 N -1.35 1.05 -0.29 0.23 4.05 -1.25 -3.76 115.26 113.94 2yss n ASN 74 Ca -0.06 -2.94 0.16 0.00 0.45 0.00 0.00 54.58 52.18 2yss n ASN 74 Cb 0.58 -0.60 0.42 0.00 1.23 0.00 0.00 39.78 41.41 2yss n ASN 74 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 2yss h LEU 75 N 3.00 0.59 -0.14 1.20 4.07 -1.35 0.38 115.31 123.05 2yss h LEU 75 Ca 0.05 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.07 2yss h LEU 75 Cb 1.02 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.71 2yss h LEU 75 CO 0.51 0.24 -0.07 0.00 -1.08 0.00 0.00 178.44 178.04 2yss n ASN 77 N -1.07 -2.89 -3.78 0.00 4.13 0.13 -5.01 115.26 106.77 2yss n ASN 77 Ca 0.15 -0.89 -0.10 0.00 1.68 0.00 0.00 54.58 55.41 2yss n ASN 77 Cb 0.26 -3.83 -0.07 0.00 -1.54 0.00 0.00 39.78 34.59 2yss n ASN 77 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2yss s ILE 78 N -3.62 0.10 0.09 2.41 -4.36 -1.26 -5.07 121.20 109.49 2yss s ILE 78 Ca 0.20 -0.85 -0.30 0.00 -0.26 0.00 0.00 60.65 59.43 2yss s ILE 78 Cb -0.06 -1.09 -0.06 0.00 1.25 0.00 0.00 42.46 42.51 2yss s ILE 78 CO 0.83 -0.47 1.09 -2.16 0.24 0.00 0.00 174.94 174.47 2yss s PRO 79 N -3.13 4.54 0.66 0.37 0.04 -1.26 -1.14 135.00 135.08 2yss s PRO 79 Ca -0.01 1.64 0.26 0.00 0.04 0.00 0.00 61.00 62.93 2yss s PRO 79 Cb 0.01 -3.35 1.44 0.00 0.04 0.00 0.00 34.50 32.64 2yss s PRO 79 CO -0.07 -0.05 1.81 0.00 0.04 0.00 0.00 177.00 178.72 2yss h SER 81 N 0.00 0.00 0.44 0.00 4.64 -1.89 -2.43 113.55 114.30 2yss h SER 81 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2yss h SER 81 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 2yss h SER 81 CO 0.00 0.23 0.00 0.00 -0.87 0.00 0.00 176.83 176.19 2yss n ALA 82 N -2.48 1.47 1.05 5.18 0.00 0.34 -1.49 120.51 124.58 2yss n ALA 82 Ca -0.02 0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.59 2yss n ALA 82 Cb 0.29 -1.27 0.33 0.00 0.00 0.00 0.00 19.45 18.79 2yss n ALA 82 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2yss n LEU 83 N -1.90 0.50 -4.02 0.00 4.77 -0.91 -4.54 117.00 110.90 2yss n LEU 83 Ca 0.02 0.03 -0.39 0.00 -0.03 0.00 0.00 56.01 55.64 2yss n LEU 83 Cb 0.15 -0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 40.95 2yss n LEU 83 CO 0.13 0.12 0.64 0.18 -1.33 0.00 0.00 177.39 177.13 2yss n LEU 84 N -1.37 5.10 -3.82 2.23 4.77 -0.55 -4.15 117.00 119.22 2yss n LEU 84 Ca 0.07 -5.19 -0.10 0.00 -0.03 0.00 0.00 56.01 50.77 2yss n LEU 84 Cb 0.33 -1.17 -0.06 0.00 -2.33 0.00 0.00 43.42 40.20 2yss n LEU 84 CO 0.32 1.63 0.05 -0.94 -1.33 0.00 0.00 177.39 177.12 2yss s SER 85 N -0.70 -0.05 0.51 -1.43 1.04 -1.26 -4.95 113.70 106.87 2yss s SER 85 Ca 0.31 -0.61 0.32 0.00 0.48 0.00 0.00 55.95 56.44 2yss s SER 85 Cb -0.01 0.44 1.21 0.00 0.10 0.00 0.00 66.02 67.77 2yss s SER 85 CO -0.03 -0.86 1.92 0.77 0.98 0.00 0.00 173.24 176.02 2yss h SER 86 N 2.51 0.00 -3.58 7.02 4.64 -1.94 -3.40 113.55 118.80 2yss h SER 86 Ca -0.32 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.36 2yss h SER 86 Cb 1.23 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.18 2yss h SER 86 CO 0.49 0.00 0.07 -0.62 -0.87 0.00 0.00 176.83 175.90 2yss s ASP 87 N -5.60 6.38 0.00 4.97 2.15 -1.26 -4.96 116.67 118.36 2yss s ASP 87 Ca 0.02 0.06 0.26 0.00 0.43 0.00 0.00 52.55 53.33 2yss s ASP 87 Cb 0.09 -2.31 1.58 0.00 -0.30 0.00 0.00 42.92 41.98 2yss s ASP 87 CO 0.54 -0.56 1.97 2.30 -0.17 0.00 0.00 175.17 179.25 2yss n ILE 88 N 5.54 0.00 -0.26 4.11 -5.35 -1.26 -4.46 119.36 117.67 2yss n ILE 88 Ca -0.03 0.00 -0.02 0.00 -0.27 0.00 0.00 62.75 62.43 2yss n ILE 88 Cb 0.49 -0.49 0.04 0.00 -1.74 0.00 0.00 39.64 37.93 2yss n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2yss h THR 89 N 0.00 0.14 -0.55 7.28 2.02 -1.95 0.13 112.91 119.99 2yss h THR 89 Ca 0.00 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.07 2yss h THR 89 Cb 0.00 0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 66.53 2yss h THR 89 CO 0.00 0.00 -0.09 0.00 0.37 0.00 0.00 175.52 175.80 2yss h ALA 90 N 1.30 0.79 -0.71 6.16 0.00 -1.82 -1.35 119.26 123.62 2yss h ALA 90 Ca 0.30 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2yss h ALA 90 Cb 0.57 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2yss h ALA 90 CO -0.79 0.67 0.40 0.77 0.00 0.00 0.00 179.25 180.30 2yss h SER 91 N 0.92 0.88 -0.16 0.00 0.02 -1.48 -2.06 113.55 111.67 2yss h SER 91 Ca 0.15 -0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 2yss h SER 91 Cb 0.66 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.97 2yss h SER 91 CO 0.05 0.72 -0.04 0.58 -1.14 0.00 0.00 176.83 177.00 2yss h VAL 92 N 0.98 1.29 -0.90 2.27 2.07 -0.61 -1.49 116.25 119.86 2yss h VAL 92 Ca 0.25 -1.00 0.09 0.00 0.82 0.00 0.00 66.70 66.87 2yss h VAL 92 Cb 0.02 1.62 -0.07 0.00 -1.52 0.00 0.00 31.29 31.34 2yss h VAL 92 CO -0.04 0.29 0.54 0.78 0.02 0.00 0.00 177.57 179.17 2yss h ASN 93 N 0.02 0.80 0.16 0.57 2.35 -1.10 0.12 115.58 118.50 2yss h ASN 93 Ca 0.04 0.04 -0.21 0.00 -0.55 0.00 0.00 56.30 55.62 2yss h ASN 93 Cb 0.47 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2yss h ASN 93 CO 0.02 0.46 -0.83 0.00 -1.65 0.00 0.00 177.43 175.43 2yss h ALA 95 N 0.75 1.23 -0.55 0.00 0.00 -0.43 -1.24 119.26 119.01 2yss h ALA 95 Ca -0.06 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 2yss h ALA 95 Cb 1.44 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 2yss h ALA 95 CO 0.15 0.55 0.18 0.87 0.00 0.00 0.00 179.25 181.00 2yss h LYS 96 N 0.88 0.85 0.11 0.00 1.57 -0.70 -0.97 116.57 118.31 2yss h LYS 96 Ca 0.20 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2yss h LYS 96 Cb 0.22 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.41 2yss h LYS 96 CO -0.01 0.77 -0.05 -0.22 -0.57 0.00 0.00 179.45 179.37 2yss h LYS 97 N 0.77 -0.15 -0.43 3.15 3.64 -1.27 -2.50 116.57 119.79 2yss h LYS 97 Ca 0.18 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.65 2yss h LYS 97 Cb 0.27 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.04 2yss h LYS 97 CO -0.01 -0.06 -0.11 0.82 -2.27 0.00 0.00 179.45 177.82 2yss h ILE 98 N -0.20 0.56 0.00 2.00 2.04 -1.08 -0.80 117.51 120.03 2yss h ILE 98 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.84 2yss h ILE 98 Cb 0.16 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2yss h ILE 98 CO 0.03 0.00 0.00 0.55 0.00 0.00 0.00 178.15 178.73 2yss n VAL 99 N -5.33 0.43 1.43 1.67 3.14 -0.38 -2.62 118.33 116.66 2yss n VAL 99 Ca 0.03 0.11 0.14 0.00 -2.96 0.00 0.00 64.34 61.66 2yss n VAL 99 Cb 0.24 -0.76 0.67 0.00 -1.06 0.00 0.00 33.84 32.93 2yss n VAL 99 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2yss n SER 100 N -1.34 0.28 -4.79 6.55 7.64 -0.31 -4.24 113.62 117.42 2yss n SER 100 Ca 0.09 -0.43 -0.29 0.00 1.01 0.00 0.00 58.87 59.25 2yss n SER 100 Cb 0.18 -0.14 0.12 0.00 -1.01 0.00 0.00 64.21 63.36 2yss n SER 100 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2yss s ASP 101 N -2.50 3.80 0.48 6.43 2.15 -1.08 -4.95 116.67 121.01 2yss s ASP 101 Ca 0.29 1.06 0.21 0.00 0.43 0.00 0.00 52.55 54.55 2yss s ASP 101 Cb 0.20 -1.68 1.21 0.00 -0.30 0.00 0.00 42.92 42.35 2yss s ASP 101 CO 0.47 -2.38 2.01 1.23 -0.17 0.00 0.00 175.17 176.33 2yss h GLY 102 N -1.38 0.00 2.00 2.66 0.00 -1.89 -2.76 103.07 101.70 2yss h GLY 102 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2yss h GLY 102 CO 0.61 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.85 2yss n ASN 103 N -3.91 0.38 0.00 0.19 4.13 -1.26 -4.98 115.26 109.82 2yss n ASN 103 Ca -0.02 0.58 0.00 0.00 1.68 0.00 0.00 54.58 56.82 2yss n ASN 103 Cb 0.26 -0.67 0.00 0.00 -1.54 0.00 0.00 39.78 37.84 2yss n ASN 103 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2yss n GLY 104 N 0.25 2.89 0.00 7.41 0.00 -1.04 -2.00 105.19 112.70 2yss n GLY 104 Ca 0.03 -0.37 0.05 0.00 0.00 0.00 0.00 46.02 45.73 2yss n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2yss n MET 105 N 13.33 0.86 0.25 1.61 2.81 -1.26 -3.07 117.12 131.65 2yss n MET 105 Ca 0.00 0.00 0.16 0.00 -1.81 0.00 0.00 57.70 56.05 2yss n MET 105 Cb 0.00 -1.18 0.61 0.00 -0.71 0.00 0.00 33.22 31.94 2yss n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2yss h ASN 106 N 0.00 0.00 -0.46 7.83 2.35 -1.82 -2.60 115.58 120.88 2yss h ASN 106 Ca 0.00 0.00 0.13 0.00 -0.55 0.00 0.00 56.30 55.88 2yss h ASN 106 Cb 0.00 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 2yss h ASN 106 CO 0.00 0.00 0.38 0.00 -1.65 0.00 0.00 177.43 176.16 2yss h ALA 107 N 2.05 2.32 -2.25 -0.83 0.00 -1.72 -3.36 119.26 115.46 2yss h ALA 107 Ca 0.00 -0.02 -0.71 0.00 0.00 0.00 0.00 54.91 54.19 2yss h ALA 107 Cb 0.54 0.03 -0.20 0.00 0.00 0.00 0.00 17.79 18.16 2yss h ALA 107 CO 0.00 -0.62 -0.16 -1.58 0.00 0.00 0.00 179.25 176.89 2yss s TRP 108 N -4.86 3.15 0.28 0.00 0.51 -0.98 -4.96 118.94 112.08 2yss s TRP 108 Ca -0.05 -0.62 0.01 0.00 -2.12 0.00 0.00 56.10 53.33 2yss s TRP 108 Cb 0.18 -3.21 0.59 0.00 -0.81 0.00 0.00 33.47 30.22 2yss s TRP 108 CO 0.66 -0.85 1.79 0.28 -0.51 0.00 0.00 176.95 178.32 2yss h VAL 109 N 5.78 0.79 -0.41 4.03 2.07 -1.86 -0.87 116.25 125.79 2yss h VAL 109 Ca -0.27 -0.27 -0.07 0.00 0.82 0.00 0.00 66.70 66.91 2yss h VAL 109 Cb 1.10 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 2yss h VAL 109 CO 0.88 0.14 -0.03 0.00 0.02 0.00 0.00 177.57 178.59 2yss h ALA 110 N 1.57 1.18 -0.43 1.67 0.00 -1.93 -1.10 119.26 120.23 2yss h ALA 110 Ca 0.50 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 55.03 2yss h ALA 110 Cb 0.65 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2yss h ALA 110 CO -0.33 0.53 -0.22 2.35 0.00 0.00 0.00 179.25 181.58 2yss h TRP 111 N 0.64 1.05 -0.60 0.00 7.01 -1.50 0.67 115.95 123.22 2yss h TRP 111 Ca 0.13 -0.27 -0.05 0.00 2.11 0.00 0.00 58.89 60.81 2yss h TRP 111 Cb 0.44 -0.24 -0.03 0.00 -2.10 0.00 0.00 29.16 27.23 2yss h TRP 111 CO 0.02 1.06 0.17 -0.09 -2.79 0.00 0.00 178.44 176.82 2yss h ARG 112 N 0.74 0.91 0.05 2.65 2.43 -0.79 -0.08 114.38 120.29 2yss h ARG 112 Ca 0.09 -0.18 -0.29 0.00 -0.81 0.00 0.00 59.98 58.79 2yss h ARG 112 Cb 0.80 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.18 2yss h ARG 112 CO 0.07 0.80 -1.58 -0.91 -1.51 0.00 0.00 179.97 176.84 2yss h ASN 113 N 0.88 0.18 0.00 -3.80 -0.26 -1.10 -3.39 115.58 108.08 2yss h ASN 113 Ca 0.20 -0.29 0.00 0.00 -0.56 0.00 0.00 56.30 55.64 2yss h ASN 113 Cb 0.28 -0.06 0.00 0.00 -1.06 0.00 0.00 38.32 37.48 2yss h ASN 113 CO -0.01 1.25 -1.20 0.54 -1.06 0.00 0.00 177.43 176.96 2yss n ARG 114 N -3.28 0.99 -0.07 0.81 5.12 0.22 -4.87 116.66 115.57 2yss n ARG 114 Ca -0.16 -0.06 -0.15 0.00 -1.93 0.00 0.00 57.85 55.54 2yss n ARG 114 Cb 1.03 -1.14 -0.05 0.00 -1.16 0.00 0.00 32.46 31.14 2yss n ARG 114 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2yss n LYS 116 N -3.62 1.27 -0.93 0.00 4.81 -0.20 -1.40 118.16 118.10 2yss n LYS 116 Ca -0.29 0.46 0.00 0.00 -0.87 0.00 0.00 58.31 57.61 2yss n LYS 116 Cb 0.71 -2.08 0.00 0.00 0.02 0.00 0.00 35.03 33.67 2yss n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2yss n GLY 117 N 2.50 0.67 3.80 3.14 0.00 -1.26 -4.96 105.19 109.08 2yss n GLY 117 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2yss n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2yss s THR 118 N -2.58 1.58 -1.44 2.61 -4.23 -0.49 -5.01 115.64 106.07 2yss s THR 118 Ca 0.00 -1.77 -0.14 0.00 -1.18 0.00 0.00 61.69 58.60 2yss s THR 118 Cb 0.00 -2.35 0.04 0.00 1.34 0.00 0.00 72.50 71.53 2yss s THR 118 CO 0.00 0.00 2.21 -0.67 -0.54 0.00 0.00 174.62 175.62 2yss n ASP 119 N -1.42 3.89 0.32 3.99 2.03 -1.26 -4.71 116.55 119.39 2yss n ASP 119 Ca -0.09 -2.84 0.22 0.00 0.52 0.00 0.00 54.79 52.59 2yss n ASP 119 Cb 0.66 -1.66 1.13 0.00 -0.72 0.00 0.00 41.12 40.53 2yss n ASP 119 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2yss h VAL 120 N 4.07 0.00 0.00 5.18 -1.51 -1.90 -1.48 116.25 120.61 2yss h VAL 120 Ca 0.56 -0.07 -0.01 0.00 -1.23 0.00 0.00 66.70 65.95 2yss h VAL 120 Cb 0.65 1.05 -0.00 0.00 -2.13 0.00 0.00 31.29 30.86 2yss h VAL 120 CO 1.87 0.00 -0.03 -0.61 -1.23 0.00 0.00 177.57 177.57 2yss h GLN 121 N 0.00 0.00 0.00 5.19 5.75 -1.86 -2.21 115.11 121.98 2yss h GLN 121 Ca 0.00 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.46 2yss h GLN 121 Cb 0.07 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 2yss h GLN 121 CO 0.00 0.03 -0.18 0.00 -2.65 0.00 0.00 178.83 176.04 2yss h ALA 122 N 1.97 1.67 0.00 3.38 0.00 -1.65 -2.21 119.26 122.41 2yss h ALA 122 Ca -0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2yss h ALA 122 Cb 0.17 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2yss h ALA 122 CO 0.00 0.22 -0.01 -1.49 0.00 0.00 0.00 179.25 177.97 2yss h TRP 123 N 0.00 0.00 -0.00 0.00 4.06 -1.60 -2.93 115.95 115.48 2yss h TRP 123 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2yss h TRP 123 Cb 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.48 2yss h TRP 123 CO 0.00 0.01 -0.14 0.44 -3.56 0.00 0.00 178.44 175.19 2yss n ILE 124 N -3.12 0.00 -2.23 1.49 -5.35 -0.98 -4.78 119.36 104.39 2yss n ILE 124 Ca -0.01 -0.43 -0.42 0.00 -0.27 0.00 0.00 62.75 61.63 2yss n ILE 124 Cb 0.22 1.05 -0.03 0.00 -1.74 0.00 0.00 39.64 39.15 2yss n ILE 124 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2yss s ARG 125 N -1.07 4.38 0.00 6.28 3.52 -0.87 -3.09 118.95 128.09 2yss s ARG 125 Ca 0.04 2.03 0.00 0.00 -0.13 0.00 0.00 55.73 57.67 2yss s ARG 125 Cb 0.04 -3.23 0.00 0.00 -1.56 0.00 0.00 34.95 30.21 2yss s ARG 125 CO 0.16 -0.30 0.00 0.41 -0.81 0.00 0.00 175.30 174.76 2yss n GLY 126 N 2.75 0.73 0.00 8.12 0.00 -1.26 -5.00 105.19 110.54 2yss n GLY 126 Ca 0.08 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.42 2yss n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yss n ARG 128 N -0.69 -1.12 -0.54 0.00 1.85 -1.26 -5.17 116.66 109.74 2yss n ARG 128 Ca 0.00 0.83 0.00 0.00 -1.00 0.00 0.00 57.85 57.68 2yss n ARG 128 Cb 0.00 -1.16 0.00 0.00 -1.05 0.00 0.00 32.46 30.25 2yss n ARG 128 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90