#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f4g s VAL 2 N 0.00 3.13 0.63 3.15 1.01 -1.26 -0.79 120.40 126.27 2f4g s VAL 2 Ca 0.00 -1.14 -0.13 0.00 0.00 0.00 0.00 61.98 60.72 2f4g s VAL 2 Cb 0.00 -2.69 -0.02 0.00 0.00 0.00 0.00 36.38 33.67 2f4g s VAL 2 CO 0.00 0.03 1.04 -0.36 0.00 0.00 0.00 175.10 175.81 2f4g s PHE 3 N 1.32 3.23 0.49 5.22 0.40 -0.53 -5.00 117.98 123.11 2f4g s PHE 3 Ca -0.02 1.43 -0.05 0.00 -0.60 0.00 0.00 56.93 57.69 2f4g s PHE 3 Cb -0.18 -2.87 -0.03 0.00 0.51 0.00 0.00 43.02 40.45 2f4g s PHE 3 CO -0.02 -0.98 0.79 0.20 0.70 0.00 0.00 175.22 175.91 2f4g s GLY 4 N -3.52 1.50 0.15 4.36 0.00 -1.26 -4.86 107.32 103.69 2f4g s GLY 4 Ca 0.59 -0.55 -0.17 0.00 0.00 0.00 0.00 44.72 44.59 2f4g s GLY 4 CO 0.47 -0.37 1.75 -0.09 0.00 0.00 0.00 173.10 174.85 2f4g h ARG 5 N 0.20 0.23 0.03 2.90 2.43 -1.97 0.40 114.38 118.60 2f4g h ARG 5 Ca -0.47 -0.01 -0.21 0.00 -0.81 0.00 0.00 59.98 58.47 2f4g h ARG 5 Cb 1.21 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 2f4g h ARG 5 CO 0.61 0.15 -0.97 0.00 -1.51 0.00 0.00 179.97 178.26 2f4g h GLU 7 N 0.09 0.24 -0.24 0.00 4.81 -1.90 -0.84 114.58 116.74 2f4g h GLU 7 Ca -0.06 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.04 2f4g h GLU 7 Cb 1.63 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.96 2f4g h GLU 7 CO 0.15 0.16 -0.29 1.25 -0.73 0.00 0.00 179.01 179.54 2f4g h LEU 8 N 0.25 0.68 -0.71 1.64 5.85 -0.79 -2.10 115.31 120.13 2f4g h LEU 8 Ca 0.20 -0.49 0.12 0.00 0.84 0.00 0.00 57.88 58.54 2f4g h LEU 8 Cb 0.22 -0.19 -0.08 0.00 0.37 0.00 0.00 40.66 40.97 2f4g h LEU 8 CO -0.24 1.04 0.29 0.00 -0.34 0.00 0.00 178.44 179.19 2f4g h ALA 9 N 0.66 0.97 -0.47 1.25 0.00 -1.02 0.14 119.26 120.80 2f4g h ALA 9 Ca 0.03 0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 2f4g h ALA 9 Cb 0.87 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2f4g h ALA 9 CO 0.07 -0.17 -0.20 0.00 0.00 0.00 0.00 179.25 178.95 2f4g h ALA 10 N 1.49 0.74 -0.57 0.00 0.00 -1.02 -0.79 119.26 119.11 2f4g h ALA 10 Ca 0.37 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2f4g h ALA 10 Cb 0.50 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2f4g h ALA 10 CO -0.35 0.67 0.17 0.00 0.00 0.00 0.00 179.25 179.74 2f4g h ALA 11 N 0.93 0.74 -0.09 0.00 0.00 -0.64 -0.86 119.26 119.34 2f4g h ALA 11 Ca 0.11 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 2f4g h ALA 11 Cb 0.77 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2f4g h ALA 11 CO 0.06 0.42 -0.41 0.52 0.00 0.00 0.00 179.25 179.84 2f4g h MET 12 N 0.80 0.20 -0.26 0.00 2.86 -0.46 -2.12 114.93 115.95 2f4g h MET 12 Ca 0.18 -0.10 -0.05 0.00 -2.06 0.00 0.00 59.70 57.68 2f4g h MET 12 Cb 0.30 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2f4g h MET 12 CO -0.00 0.58 -0.04 -0.22 1.06 0.00 0.00 176.91 178.29 2f4g h LYS 13 N 0.17 0.48 0.00 1.72 3.11 -0.74 -1.82 116.57 119.49 2f4g h LYS 13 Ca 0.02 -0.17 -0.01 0.00 -2.81 0.00 0.00 60.65 57.68 2f4g h LYS 13 Cb 0.80 -0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 32.00 2f4g h LYS 13 CO 0.06 0.68 -0.03 0.00 -2.81 0.00 0.00 179.45 177.35 2f4g h ARG 14 N 0.24 0.00 -0.59 1.90 3.08 -0.86 -1.58 114.38 116.56 2f4g h ARG 14 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2f4g h ARG 14 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 2f4g h ARG 14 CO 0.02 0.03 0.00 0.72 -1.07 0.00 0.00 179.97 179.67 2f4g n HIS 15 N -3.96 0.79 -0.67 3.04 8.25 -0.82 -4.95 115.22 116.89 2f4g n HIS 15 Ca -0.03 -0.39 0.00 0.00 -0.26 0.00 0.00 57.72 57.04 2f4g n HIS 15 Cb 0.11 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.22 2f4g n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2f4g n GLY 16 N 1.44 0.61 0.01 -1.41 0.00 -0.60 -4.98 105.19 100.27 2f4g n GLY 16 Ca 0.20 -0.57 0.12 0.00 0.00 0.00 0.00 46.02 45.77 2f4g n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2f4g n LEU 17 N 0.00 0.42 -4.64 0.99 4.77 -0.74 -4.46 117.00 113.34 2f4g n LEU 17 Ca 0.00 0.15 -0.43 0.00 -0.03 0.00 0.00 56.01 55.70 2f4g n LEU 17 Cb 0.00 -0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 40.77 2f4g n LEU 17 CO 0.00 0.07 1.40 -0.62 -1.33 0.00 0.00 177.39 176.91 2f4g s ASP 18 N -3.18 6.43 -0.20 -1.43 -1.08 -1.26 -1.64 116.67 114.30 2f4g s ASP 18 Ca 0.11 1.89 0.00 0.00 -0.52 0.00 0.00 52.55 54.03 2f4g s ASP 18 Cb 0.17 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 39.10 2f4g s ASP 18 CO 0.66 -1.17 0.00 -3.20 0.52 0.00 0.00 175.17 171.98 2f4g n ASN 19 N 8.14 -4.13 -4.68 -0.34 5.15 -0.50 -4.89 115.26 114.01 2f4g n ASN 19 Ca 0.19 0.05 -0.42 0.00 -0.60 0.00 0.00 54.58 53.80 2f4g n ASN 19 Cb 0.44 -1.80 -0.03 0.00 -0.53 0.00 0.00 39.78 37.86 2f4g n ASN 19 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 2f4g s TYR 20 N -1.77 1.74 -1.16 1.20 5.04 -0.65 -1.44 117.35 120.31 2f4g s TYR 20 Ca 0.00 -0.24 -0.02 0.00 -2.44 0.00 0.00 57.07 54.37 2f4g s TYR 20 Cb 0.00 -4.22 0.01 0.00 0.35 0.00 0.00 41.96 38.10 2f4g s TYR 20 CO 0.00 -5.23 0.13 0.54 -1.34 0.00 0.00 175.55 169.64 2f4g n ARG 21 N 6.54 -2.58 -0.50 4.97 5.12 -1.26 -1.58 116.66 127.36 2f4g n ARG 21 Ca 0.19 0.61 0.00 0.00 -1.93 0.00 0.00 57.85 56.72 2f4g n ARG 21 Cb 0.39 -5.25 0.00 0.00 -1.16 0.00 0.00 32.46 26.44 2f4g n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2f4g n GLY 22 N -0.93 0.75 3.41 -0.13 0.00 -0.52 -5.03 105.19 102.75 2f4g n GLY 22 Ca -0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 2f4g n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2f4g s TYR 23 N -2.63 3.22 0.76 1.61 2.02 -0.61 -4.95 117.35 116.77 2f4g s TYR 23 Ca 0.00 -0.77 -0.12 0.00 -0.37 0.00 0.00 57.07 55.81 2f4g s TYR 23 Cb 0.00 -2.43 0.05 0.00 -0.40 0.00 0.00 41.96 39.19 2f4g s TYR 23 CO 0.00 -0.57 1.12 -1.54 -1.57 0.00 0.00 175.55 172.99 2f4g s SER 24 N 1.59 4.38 0.38 2.29 1.04 -1.26 -1.41 113.70 120.70 2f4g s SER 24 Ca 0.03 1.98 0.11 0.00 0.48 0.00 0.00 55.95 58.56 2f4g s SER 24 Cb -0.18 -2.54 0.90 0.00 0.10 0.00 0.00 66.02 64.29 2f4g s SER 24 CO 0.07 -2.12 1.87 0.25 0.98 0.00 0.00 173.24 174.29 2f4g h LEU 25 N -0.86 0.57 -1.27 2.42 5.85 -1.90 -0.46 115.31 119.66 2f4g h LEU 25 Ca -0.45 0.04 0.14 0.00 0.84 0.00 0.00 57.88 58.46 2f4g h LEU 25 Cb 1.25 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 42.13 2f4g h LEU 25 CO 0.50 0.28 0.58 1.23 -0.34 0.00 0.00 178.44 180.69 2f4g h GLY 26 N 0.60 1.23 1.01 3.75 0.00 -1.90 -1.63 103.07 106.13 2f4g h GLY 26 Ca 0.44 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 2f4g h GLY 26 CO -0.19 0.09 0.41 3.43 0.00 0.00 0.00 176.54 180.27 2f4g h ASN 27 N 0.70 0.95 -0.15 0.19 2.35 -1.33 -0.64 115.58 117.65 2f4g h ASN 27 Ca 0.45 -0.10 -0.15 0.00 -0.55 0.00 0.00 56.30 55.95 2f4g h ASN 27 Cb 0.71 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.85 2f4g h ASN 27 CO -0.21 0.78 -0.49 -0.50 -1.65 0.00 0.00 177.43 175.36 2f4g h TRP 28 N 1.05 0.79 -0.47 1.19 4.06 -1.40 0.51 115.95 121.67 2f4g h TRP 28 Ca 0.26 -0.32 -0.06 0.00 2.06 0.00 0.00 58.89 60.83 2f4g h TRP 28 Cb 0.05 -0.13 -0.02 0.00 -1.00 0.00 0.00 29.16 28.06 2f4g h TRP 28 CO 0.00 1.10 0.05 0.28 -3.56 0.00 0.00 178.44 176.31 2f4g h VAL 29 N 0.25 1.25 -0.32 1.49 2.07 -1.33 -1.46 116.25 118.21 2f4g h VAL 29 Ca -0.02 -0.97 0.03 0.00 0.82 0.00 0.00 66.70 66.56 2f4g h VAL 29 Cb 1.12 0.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.82 2f4g h VAL 29 CO 0.10 0.34 0.12 0.00 0.02 0.00 0.00 177.57 178.16 2f4g h ALA 31 N 1.19 0.56 -0.77 0.00 0.00 -0.69 -2.34 119.26 117.21 2f4g h ALA 31 Ca 0.14 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2f4g h ALA 31 Cb 0.10 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2f4g h ALA 31 CO -0.13 -0.11 0.47 0.00 0.00 0.00 0.00 179.25 179.47 2f4g h ALA 32 N 1.23 1.37 0.01 0.00 0.00 -0.95 0.13 119.26 121.05 2f4g h ALA 32 Ca 0.19 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2f4g h ALA 32 Cb 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2f4g h ALA 32 CO -0.12 0.55 -0.01 -0.22 0.00 0.00 0.00 179.25 179.45 2f4g h LYS 33 N 1.06 -0.02 0.00 0.00 1.63 -0.65 -1.66 116.57 116.93 2f4g h LYS 33 Ca 0.28 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.08 2f4g h LYS 33 Cb -0.05 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.59 2f4g h LYS 33 CO -0.05 0.06 -0.43 0.74 -3.45 0.00 0.00 179.45 176.32 2f4g h PHE 34 N -0.09 0.00 0.20 1.91 0.04 -1.20 0.28 116.94 118.08 2f4g h PHE 34 Ca -0.00 0.00 -0.29 0.00 2.80 0.00 0.00 57.97 60.48 2f4g h PHE 34 Cb 0.08 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.26 2f4g h PHE 34 CO -0.05 0.00 -1.34 0.93 -0.60 0.00 0.00 178.31 177.25 2f4g h GLU 35 N 0.00 0.42 0.00 1.51 4.39 -0.66 -3.43 114.58 116.81 2f4g h GLU 35 Ca 0.00 -0.72 0.00 0.00 0.34 0.00 0.00 59.36 58.98 2f4g h GLU 35 Cb 0.82 0.27 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 2f4g h GLU 35 CO 0.00 1.34 0.00 -1.13 -1.16 0.00 0.00 179.01 178.06 2f4g n SER 36 N -3.84 0.39 -3.03 1.42 3.41 -0.63 -4.87 113.62 106.47 2f4g n SER 36 Ca -0.18 -1.13 -0.21 0.00 -0.26 0.00 0.00 58.87 57.09 2f4g n SER 36 Cb 1.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.96 2f4g n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2f4g n ASN 37 N -0.06 -4.89 -0.80 4.04 2.85 0.09 -1.59 115.26 114.89 2f4g n ASN 37 Ca 0.00 -0.24 -0.10 0.00 -0.11 0.00 0.00 54.58 54.12 2f4g n ASN 37 Cb 0.31 -4.01 -0.04 0.00 1.24 0.00 0.00 39.78 37.27 2f4g n ASN 37 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 2f4g n PHE 38 N -4.11 0.00 -3.34 1.20 3.72 -1.19 -4.79 117.46 108.95 2f4g n PHE 38 Ca -0.09 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.91 2f4g n PHE 38 Cb 0.59 -2.10 -0.09 0.00 -0.94 0.00 0.00 39.48 36.95 2f4g n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2f4g s ASN 39 N -2.73 6.26 0.55 4.37 3.84 -0.62 -1.45 114.94 125.16 2f4g s ASN 39 Ca 0.00 0.02 0.35 0.00 0.21 0.00 0.00 52.86 53.44 2f4g s ASN 39 Cb 0.00 -2.23 1.56 0.00 -0.55 0.00 0.00 41.25 40.04 2f4g s ASN 39 CO 0.00 -0.34 2.04 0.71 -2.79 0.00 0.00 177.10 176.73 2f4g h THR 40 N 5.51 0.00 -0.32 -5.21 1.35 -1.29 -2.86 112.91 110.10 2f4g h THR 40 Ca -0.30 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 2f4g h THR 40 Cb 1.14 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 2f4g h THR 40 CO 0.71 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.98 2f4g n GLN 41 N -3.02 2.22 -1.69 4.72 1.13 -1.26 -4.03 117.38 115.44 2f4g n GLN 41 Ca -0.00 -1.84 -0.44 0.00 -1.94 0.00 0.00 57.00 52.78 2f4g n GLN 41 Cb 0.25 -1.46 -0.04 0.00 0.11 0.00 0.00 30.24 29.10 2f4g n GLN 41 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2f4g n ALA 42 N 1.05 2.00 -3.23 -1.58 0.00 -1.08 -4.76 120.51 112.91 2f4g n ALA 42 Ca 0.18 0.42 -0.19 0.00 0.00 0.00 0.00 53.44 53.85 2f4g n ALA 42 Cb 0.50 -2.44 -0.16 0.00 0.00 0.00 0.00 19.45 17.35 2f4g n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2f4g s THR 43 N 1.20 0.58 -0.22 0.00 -4.23 -1.26 -0.09 115.64 111.62 2f4g s THR 43 Ca 0.78 -0.22 0.00 0.00 -1.18 0.00 0.00 61.69 61.07 2f4g s THR 43 Cb -0.60 -0.55 0.06 0.00 1.34 0.00 0.00 72.50 72.75 2f4g s THR 43 CO 0.36 0.21 -0.05 0.21 -0.54 0.00 0.00 174.62 174.81 2f4g s ASN 44 N 0.43 3.67 -0.30 3.99 2.47 -0.46 -4.98 114.94 119.76 2f4g s ASN 44 Ca -0.06 -1.09 -0.16 0.00 0.42 0.00 0.00 52.86 51.97 2f4g s ASN 44 Cb -0.10 -1.10 -0.03 0.00 -1.45 0.00 0.00 41.25 38.58 2f4g s ASN 44 CO 0.00 -0.24 0.40 -0.13 -3.72 0.00 0.00 177.10 173.42 2f4g s ARG 45 N 1.46 3.85 0.26 0.43 0.52 -1.26 -0.73 118.95 123.48 2f4g s ARG 45 Ca -0.05 -0.09 -0.06 0.00 -0.52 0.00 0.00 55.73 55.02 2f4g s ARG 45 Cb -0.18 -3.72 -0.06 0.00 0.52 0.00 0.00 34.95 31.52 2f4g s ARG 45 CO -0.07 -0.40 0.53 -0.80 0.02 0.00 0.00 175.30 174.59 2f4g s ASN 46 N 1.68 6.48 0.44 0.23 0.01 -0.52 -4.98 114.94 118.27 2f4g s ASN 46 Ca 0.15 0.73 0.30 0.00 -0.71 0.00 0.00 52.86 53.34 2f4g s ASN 46 Cb -0.16 -2.15 1.44 0.00 0.41 0.00 0.00 41.25 40.79 2f4g s ASN 46 CO 0.11 -0.15 1.91 0.71 -1.51 0.00 0.00 177.10 178.17 2f4g h THR 47 N 1.54 0.00 -0.01 1.60 1.35 -1.97 -2.84 112.91 112.57 2f4g h THR 47 Ca -0.47 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 2f4g h THR 47 Cb 1.18 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 2f4g h THR 47 CO 0.67 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 175.04 2f4g n ASP 48 N -2.64 0.25 0.00 5.36 5.75 -1.26 -4.87 116.55 119.14 2f4g n ASP 48 Ca -0.00 -1.28 0.00 0.00 -0.01 0.00 0.00 54.79 53.50 2f4g n ASP 48 Cb 0.16 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 2f4g n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2f4g n GLY 49 N 0.93 1.92 3.96 6.12 0.00 -1.07 -4.90 105.19 112.15 2f4g n GLY 49 Ca 0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 2f4g n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2f4g s SER 50 N -1.49 6.19 0.03 1.61 1.04 -1.26 -4.46 113.70 115.37 2f4g s SER 50 Ca 0.00 0.25 0.05 0.00 0.48 0.00 0.00 55.95 56.73 2f4g s SER 50 Cb 0.00 -1.82 -0.02 0.00 0.10 0.00 0.00 66.02 64.28 2f4g s SER 50 CO 0.00 -0.31 -0.14 -0.89 0.98 0.00 0.00 173.24 172.88 2f4g s THR 51 N -2.24 1.14 -0.16 2.02 2.01 -1.26 -1.44 115.64 115.71 2f4g s THR 51 Ca 0.40 -0.92 -0.07 0.00 0.31 0.00 0.00 61.69 61.41 2f4g s THR 51 Cb -0.09 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.36 2f4g s THR 51 CO 0.34 0.08 0.08 -1.81 -0.69 0.00 0.00 174.62 172.62 2f4g s ASP 52 N -0.96 5.80 -0.09 3.53 1.01 0.09 -1.47 116.67 124.59 2f4g s ASP 52 Ca 0.03 0.19 0.03 0.00 0.71 0.00 0.00 52.55 53.50 2f4g s ASP 52 Cb -0.07 -1.93 0.01 0.00 1.01 0.00 0.00 42.92 41.93 2f4g s ASP 52 CO 0.01 0.25 -0.17 -0.31 0.21 0.00 0.00 175.17 175.16 2f4g s TYR 53 N -0.09 1.97 0.00 4.23 1.51 -0.10 -1.36 117.35 123.51 2f4g s TYR 53 Ca 0.08 -0.82 0.00 0.00 -1.01 0.00 0.00 57.07 55.32 2f4g s TYR 53 Cb -0.12 -1.38 0.00 0.00 -0.11 0.00 0.00 41.96 40.35 2f4g s TYR 53 CO 0.01 -0.38 0.00 0.41 -1.11 0.00 0.00 175.55 174.48 2f4g n GLY 54 N 3.82 -1.88 0.26 0.71 0.00 0.88 -1.62 105.19 107.36 2f4g n GLY 54 Ca -0.21 -1.45 0.09 0.00 0.00 0.00 0.00 46.02 44.46 2f4g n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2f4g h ILE 55 N 0.00 0.89 -0.27 -0.61 2.10 -1.70 -1.19 117.51 116.73 2f4g h ILE 55 Ca 0.00 -0.27 0.00 0.00 1.08 0.00 0.00 64.86 65.67 2f4g h ILE 55 Cb 0.00 1.15 0.00 0.00 -1.09 0.00 0.00 36.82 36.88 2f4g h ILE 55 CO 0.00 0.07 0.00 0.18 -1.08 0.00 0.00 178.15 177.32 2f4g n LEU 56 N -4.21 3.31 -3.91 2.19 4.77 -1.26 -4.08 117.00 113.81 2f4g n LEU 56 Ca -0.03 -2.55 -0.25 0.00 -0.03 0.00 0.00 56.01 53.15 2f4g n LEU 56 Cb 0.16 -0.38 -0.01 0.00 -2.33 0.00 0.00 43.42 40.85 2f4g n LEU 56 CO 0.33 0.69 -0.21 0.00 -1.33 0.00 0.00 177.39 176.87 2f4g n GLN 57 N -0.14 -3.32 -2.53 3.23 1.13 -0.45 -4.89 117.38 110.42 2f4g n GLN 57 Ca 0.16 0.43 -0.41 0.00 -1.94 0.00 0.00 57.00 55.23 2f4g n GLN 57 Cb 0.65 -4.56 -0.04 0.00 0.11 0.00 0.00 30.24 26.41 2f4g n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2f4g s ILE 58 N -3.90 4.10 0.20 5.09 1.01 -0.64 -4.30 121.20 122.76 2f4g s ILE 58 Ca 0.03 1.66 -0.18 0.00 0.00 0.00 0.00 60.65 62.16 2f4g s ILE 58 Cb -0.01 -4.06 -0.08 0.00 0.01 0.00 0.00 42.46 38.32 2f4g s ILE 58 CO 0.88 0.22 0.67 0.21 0.00 0.00 0.00 174.94 176.91 2f4g s ASN 59 N 0.40 6.99 0.00 3.58 3.84 -1.26 -0.93 114.94 127.57 2f4g s ASN 59 Ca 0.52 1.32 0.28 0.00 0.21 0.00 0.00 52.86 55.19 2f4g s ASN 59 Cb -0.28 -2.38 1.13 0.00 -0.55 0.00 0.00 41.25 39.17 2f4g s ASN 59 CO 0.32 0.06 1.79 -1.54 -2.79 0.00 0.00 177.10 174.94 2f4g n SER 60 N 0.78 0.94 -0.02 -4.21 3.41 -0.54 -2.12 113.62 111.86 2f4g n SER 60 Ca -0.03 -1.05 -0.16 0.00 -0.26 0.00 0.00 58.87 57.37 2f4g n SER 60 Cb 0.51 0.01 -0.13 0.00 -0.26 0.00 0.00 64.21 64.35 2f4g n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2f4g h ARG 61 N 1.32 0.16 0.00 4.33 2.43 -1.84 -3.42 114.38 117.37 2f4g h ARG 61 Ca 0.00 -0.22 -0.36 0.00 -0.81 0.00 0.00 59.98 58.59 2f4g h ARG 61 Cb 0.40 0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 29.96 2f4g h ARG 61 CO 0.00 1.02 -2.35 0.91 -1.51 0.00 0.00 179.97 178.04 2f4g n TRP 62 N -4.44 0.00 -0.08 2.20 7.02 -1.25 -1.47 117.44 119.43 2f4g n TRP 62 Ca -0.11 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.27 2f4g n TRP 62 Cb 0.57 -0.96 -0.08 0.00 -2.42 0.00 0.00 31.31 28.43 2f4g n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 2f4g n TRP 63 N -2.82 0.00 -4.33 -5.99 7.02 -0.90 -1.17 117.44 109.25 2f4g n TRP 63 Ca -0.34 0.00 -0.17 0.00 -1.02 0.00 0.00 57.50 55.97 2f4g n TRP 63 Cb 1.10 -0.62 -0.10 0.00 -2.42 0.00 0.00 31.31 29.27 2f4g n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2f4g s ASN 65 N -3.30 5.45 0.00 0.00 2.47 -0.31 -4.49 114.94 114.76 2f4g s ASN 65 Ca 0.25 -0.10 0.07 0.00 0.42 0.00 0.00 52.86 53.49 2f4g s ASN 65 Cb 0.04 -1.98 0.10 0.00 -1.45 0.00 0.00 41.25 37.95 2f4g s ASN 65 CO 0.07 -0.00 0.85 -0.90 -3.72 0.00 0.00 177.10 173.40 2f4g n ASP 66 N 4.71 1.88 0.00 -4.21 5.68 -1.26 -1.33 116.55 122.01 2f4g n ASP 66 Ca -0.16 -1.50 0.00 0.00 -0.50 0.00 0.00 54.79 52.63 2f4g n ASP 66 Cb 0.52 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 2f4g n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2f4g n GLY 67 N 0.30 0.72 0.00 6.12 0.00 -1.26 -4.75 105.19 106.33 2f4g n GLY 67 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2f4g n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f4g n ARG 68 N -2.00 0.57 -3.86 1.61 1.74 -1.26 -5.04 116.66 108.42 2f4g n ARG 68 Ca 0.00 -0.35 -0.36 0.00 -0.77 0.00 0.00 57.85 56.38 2f4g n ARG 68 Cb 0.00 -0.83 -0.10 0.00 -1.02 0.00 0.00 32.46 30.50 2f4g n ARG 68 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2f4g s THR 69 N -0.18 4.80 0.44 0.55 2.01 -1.26 -4.93 115.64 117.07 2f4g s THR 69 Ca 0.00 -0.02 -0.24 0.00 0.31 0.00 0.00 61.69 61.74 2f4g s THR 69 Cb 0.00 -3.21 -0.08 0.00 0.01 0.00 0.00 72.50 69.23 2f4g s THR 69 CO 0.00 0.40 1.25 -2.84 -0.69 0.00 0.00 174.62 172.74 2f4g s PRO 70 N 0.89 3.80 -0.48 4.92 0.02 -1.26 -3.35 135.00 139.55 2f4g s PRO 70 Ca 0.05 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.09 2f4g s PRO 70 Cb -0.14 -2.58 0.00 0.00 0.02 0.00 0.00 34.50 31.81 2f4g s PRO 70 CO 0.03 -0.59 0.00 0.41 -0.33 0.00 0.00 177.00 176.52 2f4g n GLY 71 N 0.61 0.73 3.69 0.52 0.00 -1.26 -4.88 105.19 104.60 2f4g n GLY 71 Ca 0.06 -0.77 -0.44 0.00 0.00 0.00 0.00 46.02 44.86 2f4g n GLY 71 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2f4g n SER 72 N 1.09 3.71 -0.05 1.61 2.88 -1.21 -4.83 113.62 116.82 2f4g n SER 72 Ca -0.05 1.02 -0.01 0.00 -1.33 0.00 0.00 58.87 58.51 2f4g n SER 72 Cb 0.16 -1.50 -0.15 0.00 -0.75 0.00 0.00 64.21 61.97 2f4g n SER 72 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2f4g n ARG 73 N 4.85 0.67 -3.98 -1.46 1.74 -0.54 -5.02 116.66 112.93 2f4g n ARG 73 Ca 0.18 -0.03 -0.28 0.00 -0.77 0.00 0.00 57.85 56.94 2f4g n ARG 73 Cb 0.34 -1.57 -0.02 0.00 -1.02 0.00 0.00 32.46 30.18 2f4g n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2f4g n ASN 74 N -2.61 -1.04 0.24 0.55 5.15 -1.02 -4.86 115.26 111.67 2f4g n ASN 74 Ca -0.19 -1.07 0.16 0.00 -0.60 0.00 0.00 54.58 52.87 2f4g n ASN 74 Cb 0.91 -2.80 0.57 0.00 -0.53 0.00 0.00 39.78 37.94 2f4g n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2f4g h LEU 75 N -1.89 0.00 -0.45 1.20 3.38 -1.10 -1.26 115.31 115.18 2f4g h LEU 75 Ca -0.65 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.32 2f4g h LEU 75 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2f4g h LEU 75 CO 0.61 0.00 -0.17 0.00 0.09 0.00 0.00 178.44 178.97 2f4g n ASN 77 N -0.66 -1.70 -3.86 0.00 5.15 -0.48 -4.99 115.26 108.74 2f4g n ASN 77 Ca 0.14 -0.85 -0.11 0.00 -0.60 0.00 0.00 54.58 53.16 2f4g n ASN 77 Cb 0.32 -3.97 -0.10 0.00 -0.53 0.00 0.00 39.78 35.50 2f4g n ASN 77 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2f4g s ILE 78 N -3.66 0.08 0.39 -1.44 -4.36 -1.26 -5.07 121.20 105.87 2f4g s ILE 78 Ca 0.06 -0.65 -0.26 0.00 -0.26 0.00 0.00 60.65 59.54 2f4g s ILE 78 Cb -0.02 -0.45 -0.09 0.00 1.25 0.00 0.00 42.46 43.15 2f4g s ILE 78 CO 0.82 -0.36 1.25 -2.16 0.24 0.00 0.00 174.94 174.73 2f4g s PRO 79 N -1.35 4.05 0.52 0.37 0.04 -1.26 -1.16 135.00 136.20 2f4g s PRO 79 Ca -0.14 2.04 0.23 0.00 0.04 0.00 0.00 61.00 63.17 2f4g s PRO 79 Cb -0.07 -2.77 1.41 0.00 0.04 0.00 0.00 34.50 33.10 2f4g s PRO 79 CO 0.02 -0.39 2.12 0.00 0.04 0.00 0.00 177.00 178.78 2f4g h SER 81 N 0.00 0.00 0.37 0.00 4.64 -1.90 -1.28 113.55 115.38 2f4g h SER 81 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2f4g h SER 81 Cb 0.18 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2f4g h SER 81 CO 0.01 0.00 -0.08 0.00 -0.87 0.00 0.00 176.83 175.89 2f4g h ALA 82 N 1.92 1.23 0.00 5.18 0.00 -1.73 -1.83 119.26 124.04 2f4g h ALA 82 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2f4g h ALA 82 Cb 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2f4g h ALA 82 CO -0.00 0.10 0.00 1.28 0.00 0.00 0.00 179.25 180.63 2f4g n LEU 83 N -3.52 0.00 -1.18 0.00 4.77 -0.48 -3.46 117.00 113.13 2f4g n LEU 83 Ca -0.02 0.13 0.10 0.00 -0.03 0.00 0.00 56.01 56.20 2f4g n LEU 83 Cb 0.21 -0.13 0.28 0.00 -2.33 0.00 0.00 43.42 41.45 2f4g n LEU 83 CO 0.28 -0.00 0.74 0.18 -1.33 0.00 0.00 177.39 177.26 2f4g n LEU 84 N -1.13 3.71 -4.83 2.23 4.77 -0.69 -4.08 117.00 116.98 2f4g n LEU 84 Ca 0.19 -2.00 -0.32 0.00 -0.03 0.00 0.00 56.01 53.85 2f4g n LEU 84 Cb 0.17 -0.43 -0.00 0.00 -2.33 0.00 0.00 43.42 40.83 2f4g n LEU 84 CO 0.20 0.93 0.70 -0.94 -1.33 0.00 0.00 177.39 176.95 2f4g s SER 85 N -1.00 6.13 0.48 -1.43 1.04 -1.22 -4.51 113.70 113.18 2f4g s SER 85 Ca 0.43 1.66 0.27 0.00 0.48 0.00 0.00 55.95 58.79 2f4g s SER 85 Cb 0.22 -2.51 1.12 0.00 0.10 0.00 0.00 66.02 64.95 2f4g s SER 85 CO 0.29 -0.93 1.91 0.77 0.98 0.00 0.00 173.24 176.26 2f4g h SER 86 N 0.46 0.00 -3.15 7.02 4.64 -1.94 -3.41 113.55 117.18 2f4g h SER 86 Ca -0.46 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.27 2f4g h SER 86 Cb 1.20 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.23 2f4g h SER 86 CO 0.59 0.16 0.69 -0.62 -0.87 0.00 0.00 176.83 176.79 2f4g s ASP 87 N -6.07 7.03 0.00 4.97 2.15 -1.26 -4.96 116.67 118.52 2f4g s ASP 87 Ca -0.00 1.29 0.29 0.00 0.43 0.00 0.00 52.55 54.55 2f4g s ASP 87 Cb 0.11 -2.51 1.47 0.00 -0.30 0.00 0.00 42.92 41.68 2f4g s ASP 87 CO 0.61 -0.61 1.97 2.30 -0.17 0.00 0.00 175.17 179.27 2f4g n ILE 88 N 5.26 0.01 -0.08 4.11 -5.35 -1.26 -4.43 119.36 117.61 2f4g n ILE 88 Ca 0.10 -0.11 -0.07 0.00 -0.27 0.00 0.00 62.75 62.40 2f4g n ILE 88 Cb 0.47 -0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.29 2f4g n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2f4g h THR 89 N 0.95 0.87 -0.80 7.28 2.02 -1.94 -0.58 112.91 120.72 2f4g h THR 89 Ca 0.00 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.08 2f4g h THR 89 Cb 0.20 0.66 -0.04 0.00 -1.74 0.00 0.00 68.15 67.24 2f4g h THR 89 CO 0.00 0.04 0.38 0.00 0.37 0.00 0.00 175.52 176.31 2f4g h ALA 90 N 1.22 1.17 -0.52 6.16 0.00 -1.85 -0.50 119.26 124.93 2f4g h ALA 90 Ca 0.14 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2f4g h ALA 90 Cb 0.14 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2f4g h ALA 90 CO -0.17 0.63 0.02 0.77 0.00 0.00 0.00 179.25 180.50 2f4g h SER 91 N 1.14 0.88 -0.44 0.00 0.02 -1.59 -1.17 113.55 112.39 2f4g h SER 91 Ca 0.27 -0.30 -0.04 0.00 -0.84 0.00 0.00 61.79 60.88 2f4g h SER 91 Cb 0.12 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 2f4g h SER 91 CO -0.03 0.96 0.10 0.58 -1.14 0.00 0.00 176.83 177.30 2f4g h VAL 92 N 0.78 1.24 -0.70 2.27 2.07 -0.88 0.46 116.25 121.49 2f4g h VAL 92 Ca 0.15 -0.83 0.04 0.00 0.82 0.00 0.00 66.70 66.88 2f4g h VAL 92 Cb 0.50 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 2f4g h VAL 92 CO 0.02 0.29 0.43 0.78 0.02 0.00 0.00 177.57 179.11 2f4g h ASN 93 N 0.58 0.69 -0.26 0.57 2.35 -0.99 -0.71 115.58 117.82 2f4g h ASN 93 Ca 0.14 0.01 -0.19 0.00 -0.55 0.00 0.00 56.30 55.71 2f4g h ASN 93 Cb 0.33 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.56 2f4g h ASN 93 CO 0.00 0.47 -0.56 0.00 -1.65 0.00 0.00 177.43 175.69 2f4g h ALA 95 N 0.65 1.65 -0.80 0.00 0.00 -0.37 -0.87 119.26 119.51 2f4g h ALA 95 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2f4g h ALA 95 Cb 1.18 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 2f4g h ALA 95 CO 0.12 0.23 0.40 0.87 0.00 0.00 0.00 179.25 180.88 2f4g h LYS 96 N 0.84 1.15 -0.53 0.00 1.57 -0.98 -1.94 116.57 116.68 2f4g h LYS 96 Ca 0.34 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 2f4g h LYS 96 Cb 0.24 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 2f4g h LYS 96 CO -0.12 0.88 0.12 -0.22 -0.57 0.00 0.00 179.45 179.54 2f4g h LYS 97 N 1.13 0.85 -0.84 3.15 1.63 -0.93 -2.41 116.57 119.14 2f4g h LYS 97 Ca 0.28 -0.21 0.01 0.00 -0.85 0.00 0.00 60.65 59.88 2f4g h LYS 97 Cb 0.10 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.57 2f4g h LYS 97 CO -0.04 0.82 0.56 0.82 -3.45 0.00 0.00 179.45 178.16 2f4g h ILE 98 N 0.74 1.21 0.01 2.00 2.04 -0.84 0.53 117.51 123.20 2f4g h ILE 98 Ca 0.16 -0.39 -0.20 0.00 1.00 0.00 0.00 64.86 65.43 2f4g h ILE 98 Cb 0.35 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 2f4g h ILE 98 CO 0.00 0.21 -0.91 -0.37 0.00 0.00 0.00 178.15 177.09 2f4g h VAL 99 N 1.14 1.49 -0.19 1.67 -1.51 -1.33 -3.25 116.25 114.26 2f4g h VAL 99 Ca 0.31 -2.64 -0.01 0.00 -1.23 0.00 0.00 66.70 63.13 2f4g h VAL 99 Cb -0.12 2.49 -0.01 0.00 -2.13 0.00 0.00 31.29 31.52 2f4g h VAL 99 CO -0.07 0.77 0.08 0.28 -1.23 0.00 0.00 177.57 177.40 2f4g h SER 100 N 0.12 0.27 0.00 4.19 0.02 -0.95 -3.16 113.55 114.04 2f4g h SER 100 Ca -0.05 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 2f4g h SER 100 Cb 1.54 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 64.01 2f4g h SER 100 CO 0.14 0.36 0.00 0.47 -1.14 0.00 0.00 176.83 176.67 2f4g n ASP 101 N -4.83 2.68 -3.08 3.07 8.00 0.13 -4.72 116.55 117.80 2f4g n ASP 101 Ca -0.04 -1.60 -0.03 0.00 0.71 0.00 0.00 54.79 53.83 2f4g n ASP 101 Cb 0.13 -0.53 0.01 0.00 -0.02 0.00 0.00 41.12 40.71 2f4g n ASP 101 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2f4g n GLY 102 N 1.29 -1.21 0.00 0.44 0.00 -1.25 -5.00 105.19 99.46 2f4g n GLY 102 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.51 2f4g n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2f4g n ASN 103 N -2.06 0.54 -0.80 1.61 3.02 -1.24 -5.11 115.26 111.22 2f4g n ASN 103 Ca -0.01 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.54 2f4g n ASN 103 Cb 0.52 0.07 -0.00 0.00 -0.61 0.00 0.00 39.78 39.77 2f4g n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2f4g n GLY 104 N 0.57 -1.21 0.00 7.41 0.00 -1.19 -3.37 105.19 107.39 2f4g n GLY 104 Ca 0.00 -1.09 0.09 0.00 0.00 0.00 0.00 46.02 45.02 2f4g n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2f4g n MET 105 N -1.65 0.81 0.07 1.61 2.81 -1.26 -3.33 117.12 116.19 2f4g n MET 105 Ca 0.00 0.00 0.09 0.00 -1.81 0.00 0.00 57.70 55.98 2f4g n MET 105 Cb 0.02 -1.36 0.38 0.00 -0.71 0.00 0.00 33.22 31.55 2f4g n MET 105 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2f4g n ASN 106 N -0.86 0.33 0.28 7.83 4.13 -1.22 -1.34 115.26 124.42 2f4g n ASN 106 Ca 0.14 0.60 0.17 0.00 1.68 0.00 0.00 54.58 57.17 2f4g n ASN 106 Cb 0.06 -0.66 0.94 0.00 -1.54 0.00 0.00 39.78 38.58 2f4g n ASN 106 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2f4g h ALA 107 N 2.29 1.52 -2.66 5.41 0.00 -1.75 -3.39 119.26 120.68 2f4g h ALA 107 Ca 0.00 -0.00 -0.71 0.00 0.00 0.00 0.00 54.91 54.20 2f4g h ALA 107 Cb 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 17.81 2f4g h ALA 107 CO 0.00 -0.10 -0.47 -1.58 0.00 0.00 0.00 179.25 177.09 2f4g s TRP 108 N -4.54 3.24 0.31 0.00 0.51 -0.45 -4.95 118.94 113.06 2f4g s TRP 108 Ca -0.05 -0.69 0.04 0.00 -2.12 0.00 0.00 56.10 53.28 2f4g s TRP 108 Cb 0.15 -2.51 0.52 0.00 -0.81 0.00 0.00 33.47 30.82 2f4g s TRP 108 CO 0.51 -0.58 1.79 -0.24 -0.51 0.00 0.00 176.95 177.92 2f4g h VAL 109 N 5.71 1.24 -0.61 4.03 3.04 -1.85 -1.28 116.25 126.53 2f4g h VAL 109 Ca -0.27 -1.08 -0.04 0.00 -1.01 0.00 0.00 66.70 64.29 2f4g h VAL 109 Cb 1.12 1.25 -0.03 0.00 -2.01 0.00 0.00 31.29 31.62 2f4g h VAL 109 CO 0.69 0.35 0.21 0.00 -1.01 0.00 0.00 177.57 177.81 2f4g h ALA 110 N 1.42 1.23 -0.10 3.17 0.00 -1.92 -1.20 119.26 121.87 2f4g h ALA 110 Ca 0.07 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2f4g h ALA 110 Cb 0.54 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2f4g h ALA 110 CO 0.04 0.55 0.05 2.35 0.00 0.00 0.00 179.25 182.24 2f4g h TRP 111 N 0.88 0.13 -0.96 0.00 7.01 -1.56 -0.40 115.95 121.06 2f4g h TRP 111 Ca 0.20 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.22 2f4g h TRP 111 Cb 0.22 -0.04 -0.05 0.00 -2.10 0.00 0.00 29.16 27.19 2f4g h TRP 111 CO 0.02 0.17 0.63 -0.09 -2.79 0.00 0.00 178.44 176.38 2f4g h ARG 112 N 0.05 1.24 0.00 2.65 2.43 -1.07 0.02 114.38 119.69 2f4g h ARG 112 Ca 0.03 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.09 2f4g h ARG 112 Cb 0.09 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 2f4g h ARG 112 CO -0.01 0.82 -1.39 0.09 -1.51 0.00 0.00 179.97 177.98 2f4g n ASN 113 N -4.40 0.59 0.00 -3.80 3.02 -0.48 -4.26 115.26 105.92 2f4g n ASN 113 Ca 0.12 0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.90 2f4g n ASN 113 Cb 0.04 0.86 0.00 0.00 -0.61 0.00 0.00 39.78 40.06 2f4g n ASN 113 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2f4g n ARG 114 N -2.59 4.02 -0.02 3.52 1.74 -0.17 -4.86 116.66 118.30 2f4g n ARG 114 Ca -0.04 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.02 2f4g n ARG 114 Cb 0.62 -0.57 -0.02 0.00 -1.02 0.00 0.00 32.46 31.46 2f4g n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2f4g n LYS 116 N -2.54 2.66 -0.55 0.00 4.81 -0.13 -1.36 118.16 121.05 2f4g n LYS 116 Ca -0.07 0.95 0.00 0.00 -0.87 0.00 0.00 58.31 58.32 2f4g n LYS 116 Cb 0.58 -2.76 0.00 0.00 0.02 0.00 0.00 35.03 32.88 2f4g n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2f4g n GLY 117 N 3.03 1.00 3.98 3.14 0.00 -1.26 -4.95 105.19 110.12 2f4g n GLY 117 Ca 0.12 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 2f4g n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2f4g s THR 118 N -2.65 2.30 -1.09 2.61 -4.23 -0.46 -4.99 115.64 107.13 2f4g s THR 118 Ca 0.00 -0.56 -0.18 0.00 -1.18 0.00 0.00 61.69 59.78 2f4g s THR 118 Cb 0.00 -2.74 0.13 0.00 1.34 0.00 0.00 72.50 71.23 2f4g s THR 118 CO 0.00 0.00 1.36 -0.62 -0.54 0.00 0.00 174.62 174.82 2f4g s ASP 119 N -4.63 6.79 0.37 3.99 2.15 -1.26 -4.82 116.67 119.26 2f4g s ASP 119 Ca 0.63 -2.34 0.27 0.00 0.43 0.00 0.00 52.55 51.55 2f4g s ASP 119 Cb -0.07 -2.45 1.01 0.00 -0.30 0.00 0.00 42.92 41.11 2f4g s ASP 119 CO 0.43 -1.03 1.80 -0.37 -0.17 0.00 0.00 175.17 175.83 2f4g h VAL 120 N 5.53 0.00 -0.00 1.11 -1.51 -1.92 -2.63 116.25 116.83 2f4g h VAL 120 Ca 0.26 -0.45 0.00 0.00 -1.23 0.00 0.00 66.70 65.28 2f4g h VAL 120 Cb 0.95 1.34 -0.00 0.00 -2.13 0.00 0.00 31.29 31.45 2f4g h VAL 120 CO 1.25 0.00 0.00 -0.61 -1.23 0.00 0.00 177.57 176.98 2f4g h GLN 121 N 0.00 0.00 -0.19 5.19 5.75 -1.90 -0.92 115.11 123.04 2f4g h GLN 121 Ca 0.00 0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.56 2f4g h GLN 121 Cb 0.54 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.08 2f4g h GLN 121 CO 0.00 0.00 0.15 0.00 -2.65 0.00 0.00 178.83 176.33 2f4g h ALA 122 N 2.00 2.08 0.00 3.38 0.00 -1.88 -1.72 119.26 123.13 2f4g h ALA 122 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2f4g h ALA 122 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2f4g h ALA 122 CO -0.00 -0.25 0.00 -1.49 0.00 0.00 0.00 179.25 177.51 2f4g h TRP 123 N 0.00 0.00 -0.03 0.00 4.06 -1.39 -2.81 115.95 115.78 2f4g h TRP 123 Ca 0.09 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.04 2f4g h TRP 123 Cb 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.55 2f4g h TRP 123 CO 0.00 0.00 0.00 0.44 -3.56 0.00 0.00 178.44 175.32 2f4g n ILE 124 N -2.30 0.63 -2.01 1.49 -5.35 -0.68 -4.80 119.36 106.35 2f4g n ILE 124 Ca 0.02 -0.81 -0.41 0.00 -0.27 0.00 0.00 62.75 61.28 2f4g n ILE 124 Cb 0.26 0.70 -0.02 0.00 -1.74 0.00 0.00 39.64 38.83 2f4g n ILE 124 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2f4g s ARG 125 N -0.68 4.27 0.00 6.28 3.52 -1.01 -1.95 118.95 129.37 2f4g s ARG 125 Ca 0.03 2.31 0.00 0.00 -0.13 0.00 0.00 55.73 57.93 2f4g s ARG 125 Cb 0.01 -3.10 0.00 0.00 -1.56 0.00 0.00 34.95 30.30 2f4g s ARG 125 CO 0.02 -0.41 0.00 0.41 -0.81 0.00 0.00 175.30 174.51 2f4g n GLY 126 N 2.04 1.86 3.79 8.12 0.00 -1.26 -5.02 105.19 114.72 2f4g n GLY 126 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 2f4g n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f4g s ARG 128 N -0.41 4.22 0.00 0.00 0.52 -1.26 -5.11 118.95 116.91 2f4g s ARG 128 Ca 0.25 1.22 0.21 0.00 -0.52 0.00 0.00 55.73 56.88 2f4g s ARG 128 Cb -0.16 -3.65 0.16 0.00 0.52 0.00 0.00 34.95 31.82 2f4g s ARG 128 CO 0.12 -0.63 1.15 1.28 0.02 0.00 0.00 175.30 177.25