#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lsy s VAL 2 N 0.00 4.99 0.48 3.15 1.01 -1.26 -1.10 120.40 127.67 1lsy s VAL 2 Ca 0.00 -0.20 -0.18 0.00 0.00 0.00 0.00 61.98 61.60 1lsy s VAL 2 Cb 0.00 -3.50 -0.09 0.00 0.00 0.00 0.00 36.38 32.79 1lsy s VAL 2 CO 0.00 0.10 0.97 -0.36 0.00 0.00 0.00 175.10 175.81 1lsy s PHE 3 N 1.69 3.40 0.65 5.22 0.40 -0.46 -5.01 117.98 123.87 1lsy s PHE 3 Ca 0.06 1.52 -0.10 0.00 -0.60 0.00 0.00 56.93 57.81 1lsy s PHE 3 Cb -0.17 -2.81 -0.00 0.00 0.51 0.00 0.00 43.02 40.55 1lsy s PHE 3 CO 0.09 -0.27 1.03 0.20 0.70 0.00 0.00 175.22 176.97 1lsy s GLY 4 N -2.72 1.62 0.07 4.36 0.00 -1.26 -4.86 107.32 104.53 1lsy s GLY 4 Ca 0.60 -0.35 -0.29 0.00 0.00 0.00 0.00 44.72 44.68 1lsy s GLY 4 CO 0.24 -0.04 1.60 -0.09 0.00 0.00 0.00 173.10 174.82 1lsy h ARG 5 N -0.43 -0.55 0.00 2.90 2.43 -1.98 -1.12 114.38 115.63 1lsy h ARG 5 Ca -0.45 0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 58.62 1lsy h ARG 5 Cb 1.24 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.89 1lsy h ARG 5 CO 0.63 -0.34 -0.67 0.00 -1.51 0.00 0.00 179.97 178.07 1lsy h GLU 7 N 0.00 0.53 -0.50 0.00 4.81 -1.95 -1.43 114.58 116.05 1lsy h GLU 7 Ca -0.01 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.03 1lsy h GLU 7 Cb 1.19 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 1lsy h GLU 7 CO 0.09 0.45 -0.17 1.25 -0.73 0.00 0.00 179.01 179.90 1lsy h LEU 8 N 0.47 1.01 -0.67 1.64 5.85 -1.06 -1.76 115.31 120.78 1lsy h LEU 8 Ca 0.13 -0.38 0.08 0.00 0.84 0.00 0.00 57.88 58.55 1lsy h LEU 8 Cb 0.09 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 40.78 1lsy h LEU 8 CO -0.02 1.15 0.34 0.00 -0.34 0.00 0.00 178.44 179.57 1lsy h ALA 9 N 0.88 0.91 -0.41 1.25 0.00 -1.10 -1.07 119.26 119.73 1lsy h ALA 9 Ca 0.12 0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 1lsy h ALA 9 Cb 0.74 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1lsy h ALA 9 CO 0.06 -0.04 -0.24 0.00 0.00 0.00 0.00 179.25 179.02 1lsy h ALA 10 N 1.40 0.58 -0.71 0.00 0.00 -1.18 -0.85 119.26 118.50 1lsy h ALA 10 Ca 0.32 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1lsy h ALA 10 Cb 0.31 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1lsy h ALA 10 CO -0.24 0.58 0.21 0.00 0.00 0.00 0.00 179.25 179.80 1lsy h ALA 11 N 0.81 0.93 -0.68 0.00 0.00 -0.99 -2.27 119.26 117.07 1lsy h ALA 11 Ca 0.08 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1lsy h ALA 11 Cb 0.82 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1lsy h ALA 11 CO 0.07 0.62 0.15 0.52 0.00 0.00 0.00 179.25 180.61 1lsy h MET 12 N 1.05 1.09 -0.34 0.00 2.86 -1.10 -2.02 114.93 116.47 1lsy h MET 12 Ca 0.23 -0.26 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1lsy h MET 12 Cb 0.32 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 1lsy h MET 12 CO -0.01 0.97 0.11 -0.22 1.06 0.00 0.00 176.91 178.82 1lsy h LYS 13 N 1.03 0.53 -0.27 1.72 3.64 -1.05 -1.57 116.57 120.60 1lsy h LYS 13 Ca 0.21 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1lsy h LYS 13 Cb 0.38 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1lsy h LYS 13 CO 0.00 0.56 0.04 -0.09 -2.27 0.00 0.00 179.45 177.70 1lsy h ARG 14 N 0.40 0.39 -0.12 1.90 2.43 -1.33 -0.80 114.38 117.26 1lsy h ARG 14 Ca 0.11 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1lsy h ARG 14 Cb 0.25 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1lsy h ARG 14 CO -0.00 0.38 0.00 0.72 -1.51 0.00 0.00 179.97 179.56 1lsy n HIS 15 N -4.36 0.16 -0.77 2.20 8.25 -0.77 -4.92 115.22 115.01 1lsy n HIS 15 Ca 0.01 -0.08 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1lsy n HIS 15 Cb 0.18 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.29 1lsy n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lsy n GLY 16 N 0.76 0.52 0.14 -1.41 0.00 -0.30 -4.99 105.19 99.91 1lsy n GLY 16 Ca 0.07 -0.83 0.10 0.00 0.00 0.00 0.00 46.02 45.36 1lsy n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1lsy h LEU 17 N 0.00 0.00 -9.32 0.99 3.38 -1.46 -3.40 115.31 105.50 1lsy h LEU 17 Ca 0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 1lsy h LEU 17 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1lsy h LEU 17 CO 0.00 0.07 1.11 -0.62 0.09 0.00 0.00 178.44 179.09 1lsy s ASP 18 N -5.66 6.60 -1.72 -0.43 2.15 -1.26 -1.54 116.67 114.82 1lsy s ASP 18 Ca 0.01 2.39 0.00 0.00 0.43 0.00 0.00 52.55 55.38 1lsy s ASP 18 Cb 0.08 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.16 1lsy s ASP 18 CO 0.76 -0.95 0.00 0.59 -0.17 0.00 0.00 175.17 175.40 1lsy n ASN 19 N 6.96 -5.11 -4.68 -0.34 4.13 -0.51 -4.90 115.26 110.83 1lsy n ASN 19 Ca 0.18 0.26 -0.42 0.00 1.68 0.00 0.00 54.58 56.28 1lsy n ASN 19 Cb 0.42 -4.16 -0.03 0.00 -1.54 0.00 0.00 39.78 34.47 1lsy n ASN 19 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1lsy s TYR 20 N -2.73 2.70 -1.33 3.10 5.04 -0.59 -1.54 117.35 122.00 1lsy s TYR 20 Ca 0.00 0.74 0.00 0.00 -2.44 0.00 0.00 57.07 55.37 1lsy s TYR 20 Cb 0.00 -3.68 0.00 0.00 0.35 0.00 0.00 41.96 38.63 1lsy s TYR 20 CO 0.00 -2.56 0.00 0.54 -1.34 0.00 0.00 175.55 172.19 1lsy n ARG 21 N 5.90 -2.02 -0.77 4.97 5.12 -1.26 -1.96 116.66 126.64 1lsy n ARG 21 Ca 0.14 0.75 0.00 0.00 -1.93 0.00 0.00 57.85 56.81 1lsy n ARG 21 Cb 0.44 -5.37 0.00 0.00 -1.16 0.00 0.00 32.46 26.36 1lsy n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1lsy n GLY 22 N -0.88 0.75 3.56 -0.13 0.00 -0.59 -5.05 105.19 102.87 1lsy n GLY 22 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 1lsy n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1lsy s TYR 23 N -2.80 3.22 0.90 1.61 1.51 -0.83 -4.88 117.35 116.08 1lsy s TYR 23 Ca 0.00 0.05 -0.10 0.00 -1.01 0.00 0.00 57.07 56.00 1lsy s TYR 23 Cb 0.00 -2.55 0.14 0.00 -0.11 0.00 0.00 41.96 39.44 1lsy s TYR 23 CO 0.00 -0.32 1.15 -1.54 -1.11 0.00 0.00 175.55 173.73 1lsy s SER 24 N 1.72 3.02 0.29 2.29 1.04 -1.26 -1.42 113.70 119.38 1lsy s SER 24 Ca 0.10 2.21 0.03 0.00 0.48 0.00 0.00 55.95 58.77 1lsy s SER 24 Cb -0.16 -2.57 0.65 0.00 0.10 0.00 0.00 66.02 64.04 1lsy s SER 24 CO 0.11 -3.04 1.77 0.25 0.98 0.00 0.00 173.24 173.31 1lsy h LEU 25 N -1.75 0.70 -1.81 2.42 5.85 -1.91 -0.26 115.31 118.55 1lsy h LEU 25 Ca -0.43 0.09 0.18 0.00 0.84 0.00 0.00 57.88 58.55 1lsy h LEU 25 Cb 1.27 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.23 1lsy h LEU 25 CO 0.42 0.27 0.49 1.23 -0.34 0.00 0.00 178.44 180.51 1lsy h GLY 26 N 0.73 0.33 0.93 3.75 0.00 -1.91 -1.49 103.07 105.41 1lsy h GLY 26 Ca 0.53 -0.08 -0.04 0.00 0.00 0.00 0.00 47.33 47.75 1lsy h GLY 26 CO -0.37 0.02 0.09 3.43 0.00 0.00 0.00 176.54 179.71 1lsy h ASN 27 N 0.18 0.57 -0.36 0.19 2.35 -1.27 -0.76 115.58 116.48 1lsy h ASN 27 Ca 0.34 -0.23 -0.13 0.00 -0.55 0.00 0.00 56.30 55.73 1lsy h ASN 27 Cb 1.09 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.31 1lsy h ASN 27 CO -0.06 0.65 -0.30 -0.50 -1.65 0.00 0.00 177.43 175.57 1lsy h TRP 28 N 0.46 0.98 -0.32 1.19 4.06 -1.46 0.20 115.95 121.06 1lsy h TRP 28 Ca 0.12 -0.28 -0.17 0.00 2.06 0.00 0.00 58.89 60.62 1lsy h TRP 28 Cb 0.30 -0.21 -0.00 0.00 -1.00 0.00 0.00 29.16 28.25 1lsy h TRP 28 CO 0.02 1.06 -0.47 0.28 -3.56 0.00 0.00 178.44 175.77 1lsy h VAL 29 N 0.62 1.28 -0.37 1.49 2.07 -1.26 -2.09 116.25 117.98 1lsy h VAL 29 Ca 0.06 -1.65 -0.01 0.00 0.82 0.00 0.00 66.70 65.92 1lsy h VAL 29 Cb 0.87 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 1lsy h VAL 29 CO 0.08 0.54 0.20 0.00 0.02 0.00 0.00 177.57 178.41 1lsy h ALA 31 N 1.06 0.93 -0.61 0.00 0.00 -0.85 -1.83 119.26 117.96 1lsy h ALA 31 Ca 0.13 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1lsy h ALA 31 Cb 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1lsy h ALA 31 CO -0.02 0.42 0.03 0.00 0.00 0.00 0.00 179.25 179.68 1lsy h ALA 32 N 1.22 0.90 0.02 0.00 0.00 -1.27 0.75 119.26 120.88 1lsy h ALA 32 Ca 0.26 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1lsy h ALA 32 Cb -0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1lsy h ALA 32 CO -0.05 0.66 -0.14 -0.22 0.00 0.00 0.00 179.25 179.50 1lsy h LYS 33 N 0.96 -0.23 0.00 0.00 1.63 -0.81 -1.67 116.57 116.45 1lsy h LYS 33 Ca 0.18 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.99 1lsy h LYS 33 Cb 0.51 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.19 1lsy h LYS 33 CO 0.02 -0.16 -0.50 0.74 -3.45 0.00 0.00 179.45 176.11 1lsy h PHE 34 N -0.24 0.00 0.14 1.91 0.04 -1.18 -1.11 116.94 116.50 1lsy h PHE 34 Ca 0.04 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.58 1lsy h PHE 34 Cb 0.29 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.46 1lsy h PHE 34 CO -0.19 0.00 -1.09 0.93 -0.60 0.00 0.00 178.31 177.36 1lsy h GLU 35 N 0.00 0.31 0.00 1.51 4.39 -0.76 -3.43 114.58 116.60 1lsy h GLU 35 Ca 0.00 -0.52 0.00 0.00 0.34 0.00 0.00 59.36 59.18 1lsy h GLU 35 Cb 0.80 0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.64 1lsy h GLU 35 CO 0.00 1.25 0.00 -1.13 -1.16 0.00 0.00 179.01 177.97 1lsy n SER 36 N -4.01 0.17 -3.43 1.42 3.41 -0.66 -4.84 113.62 105.67 1lsy n SER 36 Ca -0.18 -0.50 -0.24 0.00 -0.26 0.00 0.00 58.87 57.68 1lsy n SER 36 Cb 0.88 0.36 0.06 0.00 -0.26 0.00 0.00 64.21 65.25 1lsy n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1lsy n ASN 37 N -0.36 -6.09 -1.05 4.04 5.15 -0.42 -2.25 115.26 114.28 1lsy n ASN 37 Ca 0.00 -0.47 -0.13 0.00 -0.60 0.00 0.00 54.58 53.37 1lsy n ASN 37 Cb 0.04 -4.84 -0.05 0.00 -0.53 0.00 0.00 39.78 34.39 1lsy n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1lsy n PHE 38 N -4.79 -0.05 -3.65 1.20 3.72 -1.21 -4.85 117.46 107.84 1lsy n PHE 38 Ca -0.03 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 56.99 1lsy n PHE 38 Cb 0.58 -2.42 -0.12 0.00 -0.94 0.00 0.00 39.48 36.58 1lsy n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1lsy s ASN 39 N -2.83 5.62 0.52 4.37 2.47 -0.95 -1.35 114.94 122.79 1lsy s ASN 39 Ca 0.00 -0.31 0.26 0.00 0.42 0.00 0.00 52.86 53.24 1lsy s ASN 39 Cb 0.00 -2.03 1.44 0.00 -1.45 0.00 0.00 41.25 39.21 1lsy s ASN 39 CO 0.00 -0.12 2.08 0.71 -3.72 0.00 0.00 177.10 176.05 1lsy h THR 40 N 5.54 0.62 -0.03 -5.21 1.35 -1.42 -2.96 112.91 110.80 1lsy h THR 40 Ca -0.34 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 1lsy h THR 40 Cb 1.17 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 1lsy h THR 40 CO 0.59 0.11 0.00 0.00 -0.25 0.00 0.00 175.52 175.97 1lsy n GLN 41 N -3.73 1.61 -1.89 4.72 6.02 -1.26 -3.95 117.38 118.90 1lsy n GLN 41 Ca -0.02 -0.89 -0.42 0.00 -0.01 0.00 0.00 57.00 55.67 1lsy n GLN 41 Cb 0.22 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 29.99 1lsy n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1lsy s ALA 42 N -1.97 3.79 0.04 -1.58 0.00 -1.12 -4.79 121.76 116.13 1lsy s ALA 42 Ca 0.38 1.43 0.05 0.00 0.00 0.00 0.00 51.96 53.82 1lsy s ALA 42 Cb 0.21 -3.63 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 1lsy s ALA 42 CO 0.33 -0.82 -0.14 0.95 0.00 0.00 0.00 175.76 176.07 1lsy s THR 43 N 0.89 1.12 -0.13 0.00 -4.23 -1.26 -0.57 115.64 111.46 1lsy s THR 43 Ca 0.69 -1.04 -0.06 0.00 -1.18 0.00 0.00 61.69 60.09 1lsy s THR 43 Cb -0.45 -1.02 0.05 0.00 1.34 0.00 0.00 72.50 72.42 1lsy s THR 43 CO 0.34 -0.02 0.30 0.20 -0.54 0.00 0.00 174.62 174.90 1lsy s ASN 44 N -1.22 -0.31 0.14 3.99 0.01 -0.77 -4.98 114.94 111.82 1lsy s ASN 44 Ca 0.01 0.65 -0.25 0.00 -0.71 0.00 0.00 52.86 52.57 1lsy s ASN 44 Cb -0.08 0.55 -0.08 0.00 0.41 0.00 0.00 41.25 42.06 1lsy s ASN 44 CO 0.01 -0.18 0.75 -0.60 -1.51 0.00 0.00 177.10 175.58 1lsy s ARG 45 N 1.40 4.52 0.49 -0.60 6.06 -1.26 -0.44 118.95 129.12 1lsy s ARG 45 Ca -0.09 1.10 0.06 0.00 -2.50 0.00 0.00 55.73 54.31 1lsy s ARG 45 Cb -0.10 -3.27 0.03 0.00 0.06 0.00 0.00 34.95 31.67 1lsy s ARG 45 CO -0.10 0.54 0.68 -0.80 -2.50 0.00 0.00 175.30 173.12 1lsy s ASN 46 N -1.00 5.40 0.17 -2.12 -0.87 0.10 -4.95 114.94 111.68 1lsy s ASN 46 Ca 0.35 -0.39 -0.07 0.00 -1.57 0.00 0.00 52.86 51.18 1lsy s ASN 46 Cb -0.22 -0.52 0.05 0.00 -0.02 0.00 0.00 41.25 40.54 1lsy s ASN 46 CO 0.25 -1.01 1.51 0.71 -2.57 0.00 0.00 177.10 175.99 1lsy h THR 47 N 0.36 1.29 0.00 1.60 1.35 -1.98 -2.37 112.91 113.16 1lsy h THR 47 Ca -0.39 -1.61 0.00 0.00 -0.55 0.00 0.00 66.41 63.87 1lsy h THR 47 Cb 1.28 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 69.20 1lsy h THR 47 CO 0.46 0.52 0.00 -0.90 -0.25 0.00 0.00 175.52 175.35 1lsy n ASP 48 N -4.03 0.00 0.00 5.36 5.68 -1.26 -4.80 116.55 117.49 1lsy n ASP 48 Ca -0.02 -0.35 0.00 0.00 -0.50 0.00 0.00 54.79 53.92 1lsy n ASP 48 Cb 0.55 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.53 1lsy n ASP 48 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1lsy n GLY 49 N -0.32 0.99 3.91 6.12 0.00 -0.89 -5.05 105.19 109.95 1lsy n GLY 49 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1lsy n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lsy s SER 50 N -3.04 4.12 0.06 1.61 1.04 -1.26 -4.81 113.70 111.42 1lsy s SER 50 Ca 0.00 0.61 0.06 0.00 0.48 0.00 0.00 55.95 57.10 1lsy s SER 50 Cb 0.00 -0.98 -0.03 0.00 0.10 0.00 0.00 66.02 65.11 1lsy s SER 50 CO 0.00 -2.13 -0.16 -0.89 0.98 0.00 0.00 173.24 171.04 1lsy s THR 51 N -3.65 1.25 -0.10 2.02 2.01 -1.26 -0.72 115.64 115.19 1lsy s THR 51 Ca 0.65 -1.18 -0.03 0.00 0.31 0.00 0.00 61.69 61.44 1lsy s THR 51 Cb -0.09 -1.14 -0.04 0.00 0.01 0.00 0.00 72.50 71.24 1lsy s THR 51 CO 0.50 -0.05 0.04 -0.44 -0.69 0.00 0.00 174.62 173.98 1lsy s SER 52 N -1.41 5.56 -0.05 3.53 0.01 0.41 -0.86 113.70 120.89 1lsy s SER 52 Ca 0.02 0.23 0.03 0.00 1.31 0.00 0.00 55.95 57.54 1lsy s SER 52 Cb -0.09 -1.64 0.01 0.00 0.21 0.00 0.00 66.02 64.51 1lsy s SER 52 CO 0.02 0.39 -0.12 -0.31 0.41 0.00 0.00 173.24 173.63 1lsy s TYR 53 N -0.91 1.30 0.00 2.43 1.51 0.20 -1.84 117.35 120.05 1lsy s TYR 53 Ca 0.14 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.79 1lsy s TYR 53 Cb -0.12 -0.93 0.00 0.00 -0.11 0.00 0.00 41.96 40.80 1lsy s TYR 53 CO 0.03 -0.19 0.00 0.41 -1.11 0.00 0.00 175.55 174.69 1lsy n GLY 54 N 3.50 -1.99 0.37 0.71 0.00 0.27 -1.85 105.19 106.19 1lsy n GLY 54 Ca -0.20 -1.56 0.08 0.00 0.00 0.00 0.00 46.02 44.34 1lsy n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1lsy h ILE 55 N 0.00 0.90 -0.23 -0.61 6.09 -1.70 -0.66 117.51 121.31 1lsy h ILE 55 Ca 0.00 -0.31 0.00 0.00 -1.37 0.00 0.00 64.86 63.18 1lsy h ILE 55 Cb 0.00 -0.08 0.00 0.00 0.47 0.00 0.00 36.82 37.21 1lsy h ILE 55 CO 0.00 0.17 0.00 0.18 -3.07 0.00 0.00 178.15 175.43 1lsy n LEU 56 N -4.59 3.30 -3.96 2.19 4.77 -1.26 -3.99 117.00 113.46 1lsy n LEU 56 Ca 0.18 -2.71 -0.42 0.00 -0.03 0.00 0.00 56.01 53.03 1lsy n LEU 56 Cb 0.38 -0.41 0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1lsy n LEU 56 CO 0.28 0.68 -0.14 0.00 -1.33 0.00 0.00 177.39 176.89 1lsy n GLN 57 N -0.39 -0.53 -2.80 3.23 1.13 -0.26 -4.92 117.38 112.84 1lsy n GLN 57 Ca 0.17 0.19 -0.40 0.00 -1.94 0.00 0.00 57.00 55.01 1lsy n GLN 57 Cb 0.70 -3.01 -0.05 0.00 0.11 0.00 0.00 30.24 27.99 1lsy n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1lsy s ILE 58 N -3.51 4.45 0.03 5.09 1.01 -0.77 -4.40 121.20 123.09 1lsy s ILE 58 Ca 0.49 1.96 -0.09 0.00 0.00 0.00 0.00 60.65 63.01 1lsy s ILE 58 Cb -0.24 -4.27 -0.05 0.00 0.01 0.00 0.00 42.46 37.90 1lsy s ILE 58 CO 0.94 0.38 0.33 0.21 0.00 0.00 0.00 174.94 176.80 1lsy s ASN 59 N -0.35 6.59 0.13 3.58 3.84 -1.26 -0.62 114.94 126.85 1lsy s ASN 59 Ca 0.43 0.71 0.25 0.00 0.21 0.00 0.00 52.86 54.46 1lsy s ASN 59 Cb -0.23 -2.15 0.95 0.00 -0.55 0.00 0.00 41.25 39.26 1lsy s ASN 59 CO 0.29 0.24 1.77 -1.54 -2.79 0.00 0.00 177.10 175.07 1lsy n SER 60 N 1.20 0.45 -0.17 -4.21 3.41 -0.04 -2.16 113.62 112.10 1lsy n SER 60 Ca -0.11 0.56 -0.09 0.00 -0.26 0.00 0.00 58.87 58.97 1lsy n SER 60 Cb 0.53 -0.67 0.04 0.00 -0.26 0.00 0.00 64.21 63.84 1lsy n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1lsy h ARG 61 N 0.00 0.98 0.00 4.33 9.65 -1.84 -3.40 114.38 124.10 1lsy h ARG 61 Ca 0.00 -0.36 -0.07 0.00 -1.10 0.00 0.00 59.98 58.46 1lsy h ARG 61 Cb 0.54 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.04 1lsy h ARG 61 CO 0.00 1.03 -1.25 0.91 2.80 0.00 0.00 179.97 183.45 1lsy n TRP 62 N -4.15 0.00 -0.03 2.20 7.02 -1.24 -0.95 117.44 120.29 1lsy n TRP 62 Ca 0.02 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.47 1lsy n TRP 62 Cb 0.40 -0.18 -0.06 0.00 -2.42 0.00 0.00 31.31 29.04 1lsy n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1lsy n TRP 63 N -2.14 0.00 -4.04 -5.99 7.02 -0.92 -0.58 117.44 110.80 1lsy n TRP 63 Ca -0.06 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.34 1lsy n TRP 63 Cb 0.62 -0.36 -0.09 0.00 -2.42 0.00 0.00 31.31 29.05 1lsy n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1lsy s ASN 65 N -2.91 5.95 0.00 0.00 2.47 0.26 -4.43 114.94 116.28 1lsy s ASN 65 Ca 0.07 0.14 0.00 0.00 0.42 0.00 0.00 52.86 53.49 1lsy s ASN 65 Cb 0.07 -2.04 0.00 0.00 -1.45 0.00 0.00 41.25 37.83 1lsy s ASN 65 CO -0.10 0.15 0.85 -0.90 -3.72 0.00 0.00 177.10 173.38 1lsy n ASP 66 N 3.73 1.69 0.00 -4.21 5.68 -1.26 -0.84 116.55 121.33 1lsy n ASP 66 Ca -0.16 -1.72 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 1lsy n ASP 66 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1lsy n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1lsy n GLY 67 N -0.36 0.35 0.46 6.12 0.00 -1.26 -4.80 105.19 105.70 1lsy n GLY 67 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1lsy n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1lsy n ARG 68 N -1.40 0.11 -3.79 1.61 1.85 -1.26 -4.99 116.66 108.79 1lsy n ARG 68 Ca 0.00 -1.14 -0.36 0.00 -1.00 0.00 0.00 57.85 55.36 1lsy n ARG 68 Cb 0.15 -0.59 -0.12 0.00 -1.05 0.00 0.00 32.46 30.85 1lsy n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1lsy s THR 69 N -0.25 3.24 0.08 8.89 2.01 -1.26 -4.94 115.64 123.41 1lsy s THR 69 Ca 0.03 -2.13 -0.36 0.00 0.31 0.00 0.00 61.69 59.54 1lsy s THR 69 Cb 0.02 -3.22 -0.16 0.00 0.01 0.00 0.00 72.50 69.15 1lsy s THR 69 CO 0.00 -0.70 1.43 -2.65 -0.69 0.00 0.00 174.62 172.01 1lsy n PRO 70 N 4.51 1.41 -1.93 4.92 -0.02 -1.26 -2.89 135.00 139.74 1lsy n PRO 70 Ca -0.01 0.51 -0.12 0.00 -2.02 0.00 0.00 63.50 61.85 1lsy n PRO 70 Cb 0.41 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.68 1lsy n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lsy n GLY 71 N 2.86 0.38 3.84 -1.23 0.00 -1.26 -5.01 105.19 104.77 1lsy n GLY 71 Ca 0.18 -0.39 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 1lsy n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lsy s SER 72 N -2.59 6.77 0.03 1.61 1.04 -1.14 -5.00 113.70 114.42 1lsy s SER 72 Ca 0.00 1.45 0.24 0.00 0.48 0.00 0.00 55.95 58.11 1lsy s SER 72 Cb 0.00 -2.44 0.23 0.00 0.10 0.00 0.00 66.02 63.90 1lsy s SER 72 CO 0.00 -0.34 1.20 0.54 0.98 0.00 0.00 173.24 175.61 1lsy n ARG 73 N -0.77 0.14 -4.00 4.02 5.12 -0.12 -4.96 116.66 116.08 1lsy n ARG 73 Ca 0.05 0.01 -0.29 0.00 -1.93 0.00 0.00 57.85 55.69 1lsy n ARG 73 Cb 0.54 -1.56 -0.06 0.00 -1.16 0.00 0.00 32.46 30.22 1lsy n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1lsy n ASN 74 N -1.74 -0.18 0.27 0.55 5.15 -1.10 -4.88 115.26 113.33 1lsy n ASN 74 Ca 0.04 -1.06 0.12 0.00 -0.60 0.00 0.00 54.58 53.08 1lsy n ASN 74 Cb 0.38 -1.30 0.80 0.00 -0.53 0.00 0.00 39.78 39.12 1lsy n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1lsy h LEU 75 N -1.38 0.00 -0.46 1.20 4.07 -0.81 -0.79 115.31 117.14 1lsy h LEU 75 Ca -0.55 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.41 1lsy h LEU 75 Cb 1.15 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.89 1lsy h LEU 75 CO 0.55 0.00 -0.19 0.00 -1.08 0.00 0.00 178.44 177.72 1lsy n ASN 77 N -0.67 -3.98 -3.79 0.00 5.15 -0.30 -4.99 115.26 106.68 1lsy n ASN 77 Ca 0.14 -0.79 -0.13 0.00 -0.60 0.00 0.00 54.58 53.20 1lsy n ASN 77 Cb 0.33 -4.50 -0.10 0.00 -0.53 0.00 0.00 39.78 34.98 1lsy n ASN 77 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 1lsy s ILE 78 N -3.48 0.03 0.35 -1.44 1.10 -1.26 -5.05 121.20 111.44 1lsy s ILE 78 Ca 0.25 -0.23 -0.28 0.00 -0.51 0.00 0.00 60.65 59.88 1lsy s ILE 78 Cb -0.05 -0.46 -0.11 0.00 0.15 0.00 0.00 42.46 41.99 1lsy s ILE 78 CO 0.78 -0.12 1.36 -2.16 -2.11 0.00 0.00 174.94 172.69 1lsy s PRO 79 N -0.46 4.28 0.47 3.50 0.04 -1.26 -0.58 135.00 140.99 1lsy s PRO 79 Ca -0.06 2.32 0.14 0.00 0.04 0.00 0.00 61.00 63.45 1lsy s PRO 79 Cb -0.04 -3.04 1.12 0.00 0.04 0.00 0.00 34.50 32.58 1lsy s PRO 79 CO 0.02 -0.29 2.07 0.00 0.04 0.00 0.00 177.00 178.84 1lsy h SER 81 N 0.24 0.00 0.34 0.00 4.64 -1.92 -0.95 113.55 115.90 1lsy h SER 81 Ca 0.13 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1lsy h SER 81 Cb 0.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1lsy h SER 81 CO -0.02 0.00 -0.02 0.00 -0.87 0.00 0.00 176.83 175.91 1lsy h ALA 82 N 1.93 1.09 -0.00 5.18 0.00 -1.62 -1.87 119.26 123.96 1lsy h ALA 82 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1lsy h ALA 82 Cb 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1lsy h ALA 82 CO -0.00 0.03 -0.01 1.28 0.00 0.00 0.00 179.25 180.54 1lsy n LEU 83 N -3.24 0.11 -0.85 0.00 4.77 -0.36 -3.52 117.00 113.91 1lsy n LEU 83 Ca -0.02 0.10 0.10 0.00 -0.03 0.00 0.00 56.01 56.17 1lsy n LEU 83 Cb 0.16 -0.14 0.10 0.00 -2.33 0.00 0.00 43.42 41.22 1lsy n LEU 83 CO 0.24 0.02 0.59 0.18 -1.33 0.00 0.00 177.39 177.09 1lsy n LEU 84 N -1.07 2.79 -4.75 2.23 4.77 -0.70 -4.15 117.00 116.12 1lsy n LEU 84 Ca 0.19 -1.10 -0.36 0.00 -0.03 0.00 0.00 56.01 54.70 1lsy n LEU 84 Cb 0.19 -0.04 0.04 0.00 -2.33 0.00 0.00 43.42 41.28 1lsy n LEU 84 CO 0.21 0.51 0.85 -0.55 -1.33 0.00 0.00 177.39 177.08 1lsy s SER 85 N -1.62 5.11 0.57 -1.43 0.15 -1.23 -4.06 113.70 111.19 1lsy s SER 85 Ca 0.26 2.43 0.32 0.00 0.70 0.00 0.00 55.95 59.65 1lsy s SER 85 Cb 0.17 -2.60 1.74 0.00 -1.71 0.00 0.00 66.02 63.62 1lsy s SER 85 CO 0.26 -1.65 2.17 0.77 1.20 0.00 0.00 173.24 175.99 1lsy h SER 86 N 0.86 0.00 -3.53 5.45 4.64 -1.93 -3.39 113.55 115.64 1lsy h SER 86 Ca -0.51 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.20 1lsy h SER 86 Cb 1.30 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.27 1lsy h SER 86 CO 0.55 0.06 0.10 -0.62 -0.87 0.00 0.00 176.83 176.05 1lsy s ASP 87 N -5.93 6.49 0.00 4.97 2.15 -1.26 -4.95 116.67 118.15 1lsy s ASP 87 Ca -0.03 0.49 0.25 0.00 0.43 0.00 0.00 52.55 53.69 1lsy s ASP 87 Cb 0.13 -2.32 1.50 0.00 -0.30 0.00 0.00 42.92 41.94 1lsy s ASP 87 CO 0.54 -0.41 1.96 2.30 -0.17 0.00 0.00 175.17 179.39 1lsy n ILE 88 N 5.30 0.00 -0.14 4.11 -5.35 -1.26 -4.35 119.36 117.67 1lsy n ILE 88 Ca -0.02 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.43 1lsy n ILE 88 Cb 0.49 -0.41 0.03 0.00 -1.74 0.00 0.00 39.64 38.02 1lsy n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1lsy h THR 89 N 0.00 0.60 -0.40 7.28 2.02 -1.94 -0.76 112.91 119.71 1lsy h THR 89 Ca 0.00 -0.02 -0.08 0.00 0.77 0.00 0.00 66.41 67.08 1lsy h THR 89 Cb 0.00 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 1lsy h THR 89 CO 0.00 0.01 -0.09 0.00 0.37 0.00 0.00 175.52 175.81 1lsy h ALA 90 N 1.42 1.10 -0.35 6.16 0.00 -1.86 -0.88 119.26 124.85 1lsy h ALA 90 Ca 0.22 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1lsy h ALA 90 Cb 0.33 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1lsy h ALA 90 CO -0.42 0.56 0.19 0.77 0.00 0.00 0.00 179.25 180.35 1lsy h SER 91 N 0.64 0.44 -0.23 0.00 0.02 -1.64 -1.53 113.55 111.23 1lsy h SER 91 Ca 0.12 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 1lsy h SER 91 Cb 0.53 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 1lsy h SER 91 CO 0.03 0.41 0.07 0.58 -1.14 0.00 0.00 176.83 176.78 1lsy h VAL 92 N 0.43 1.19 -0.55 2.27 2.07 -0.88 -0.42 116.25 120.36 1lsy h VAL 92 Ca 0.12 -0.62 -0.04 0.00 0.82 0.00 0.00 66.70 66.99 1lsy h VAL 92 Cb 0.07 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 1lsy h VAL 92 CO -0.02 0.20 0.20 0.78 0.02 0.00 0.00 177.57 178.75 1lsy h ASN 93 N 0.21 0.74 -0.22 0.57 -0.26 -1.06 -1.57 115.58 113.99 1lsy h ASN 93 Ca 0.08 -0.10 -0.19 0.00 -0.56 0.00 0.00 56.30 55.52 1lsy h ASN 93 Cb 0.24 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.31 1lsy h ASN 93 CO -0.00 0.68 -0.59 0.00 -1.06 0.00 0.00 177.43 176.46 1lsy h ALA 95 N 0.70 1.62 -0.91 0.00 0.00 -0.64 -1.69 119.26 118.34 1lsy h ALA 95 Ca 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1lsy h ALA 95 Cb 1.20 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 1lsy h ALA 95 CO 0.13 0.35 0.60 0.87 0.00 0.00 0.00 179.25 181.20 1lsy h LYS 96 N 0.70 1.17 -0.30 0.00 1.57 -1.28 0.05 116.57 118.49 1lsy h LYS 96 Ca 0.19 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.81 1lsy h LYS 96 Cb -0.07 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 31.97 1lsy h LYS 96 CO -0.04 0.77 -0.17 -0.22 -0.57 0.00 0.00 179.45 179.22 1lsy h LYS 97 N 1.20 0.64 -0.11 3.15 1.63 -1.37 -2.71 116.57 119.00 1lsy h LYS 97 Ca 0.34 -0.29 -0.00 0.00 -0.85 0.00 0.00 60.65 59.85 1lsy h LYS 97 Cb -0.09 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.52 1lsy h LYS 97 CO -0.09 0.88 0.07 0.82 -3.45 0.00 0.00 179.45 177.68 1lsy h ILE 98 N 0.39 1.06 0.00 2.00 2.04 -0.91 -2.86 117.51 119.23 1lsy h ILE 98 Ca 0.06 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 1lsy h ILE 98 Cb 0.71 0.96 -0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1lsy h ILE 98 CO 0.05 0.06 -0.14 1.62 0.00 0.00 0.00 178.15 179.74 1lsy h VAL 99 N 0.12 0.48 0.00 1.67 3.04 -1.06 -1.41 116.25 119.09 1lsy h VAL 99 Ca 0.04 -0.70 0.00 0.00 -1.01 0.00 0.00 66.70 65.03 1lsy h VAL 99 Cb 0.03 1.48 0.00 0.00 -2.01 0.00 0.00 31.29 30.79 1lsy h VAL 99 CO -0.01 0.14 0.00 -1.20 -1.01 0.00 0.00 177.57 175.49 1lsy n SER 100 N -3.48 0.00 0.00 3.17 7.64 -1.02 -3.59 113.62 116.33 1lsy n SER 100 Ca -0.01 -0.26 0.09 0.00 1.01 0.00 0.00 58.87 59.70 1lsy n SER 100 Cb 0.30 -0.24 0.55 0.00 -1.01 0.00 0.00 64.21 63.80 1lsy n SER 100 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1lsy n ASP 101 N -1.24 0.00 0.00 6.43 2.03 -0.53 -4.84 116.55 118.40 1lsy n ASP 101 Ca 0.15 -0.75 0.00 0.00 0.52 0.00 0.00 54.79 54.71 1lsy n ASP 101 Cb 0.21 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.61 1lsy n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1lsy n GLY 102 N 0.31 1.66 0.78 0.27 0.00 -1.26 -4.90 105.19 102.04 1lsy n GLY 102 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.24 1lsy n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1lsy n ASN 103 N 0.00 2.79 0.00 1.61 3.02 -1.26 -5.07 115.26 116.35 1lsy n ASN 103 Ca 0.00 -1.82 0.00 0.00 -0.03 0.00 0.00 54.58 52.73 1lsy n ASN 103 Cb 0.00 -0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 1lsy n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lsy n GLY 104 N 0.96 2.20 0.07 7.41 0.00 -1.24 -2.42 105.19 112.17 1lsy n GLY 104 Ca 0.13 -0.51 0.14 0.00 0.00 0.00 0.00 46.02 45.78 1lsy n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1lsy n MET 105 N 11.01 1.10 0.19 1.61 2.81 -1.26 -3.26 117.12 129.32 1lsy n MET 105 Ca 0.00 -0.15 0.14 0.00 -1.81 0.00 0.00 57.70 55.88 1lsy n MET 105 Cb 0.00 -1.45 0.61 0.00 -0.71 0.00 0.00 33.22 31.67 1lsy n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1lsy h ASN 106 N 0.35 0.00 -0.11 7.83 2.35 -1.90 -1.27 115.58 122.83 1lsy h ASN 106 Ca 0.00 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.78 1lsy h ASN 106 Cb 0.07 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.44 1lsy h ASN 106 CO 0.00 0.00 0.13 0.00 -1.65 0.00 0.00 177.43 175.91 1lsy h ALA 107 N 2.14 1.68 -2.53 -0.83 0.00 -1.72 -3.38 119.26 114.62 1lsy h ALA 107 Ca 0.00 -0.00 -0.71 0.00 0.00 0.00 0.00 54.91 54.19 1lsy h ALA 107 Cb 0.30 0.01 -0.21 0.00 0.00 0.00 0.00 17.79 17.89 1lsy h ALA 107 CO 0.00 -0.18 -0.43 -1.58 0.00 0.00 0.00 179.25 177.06 1lsy s TRP 108 N -4.62 3.24 0.39 0.00 0.51 -0.48 -4.96 118.94 113.02 1lsy s TRP 108 Ca -0.05 -0.52 0.11 0.00 -2.12 0.00 0.00 56.10 53.52 1lsy s TRP 108 Cb 0.15 -2.58 0.80 0.00 -0.81 0.00 0.00 33.47 31.03 1lsy s TRP 108 CO 0.54 -0.56 1.91 -0.24 -0.51 0.00 0.00 176.95 178.09 1lsy h VAL 109 N 5.61 1.18 0.00 4.03 3.04 -1.85 -1.49 116.25 126.78 1lsy h VAL 109 Ca -0.28 -0.84 -0.07 0.00 -1.01 0.00 0.00 66.70 64.50 1lsy h VAL 109 Cb 1.13 1.31 -0.01 0.00 -2.01 0.00 0.00 31.29 31.70 1lsy h VAL 109 CO 0.72 0.25 -0.36 0.00 -1.01 0.00 0.00 177.57 177.18 1lsy h ALA 110 N 1.66 0.99 -0.15 3.17 0.00 -1.93 -1.68 119.26 121.33 1lsy h ALA 110 Ca 0.03 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 1lsy h ALA 110 Cb 0.42 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1lsy h ALA 110 CO 0.03 0.44 -0.09 2.35 0.00 0.00 0.00 179.25 181.98 1lsy h TRP 111 N 0.00 0.37 -0.79 0.00 7.01 -1.59 -0.67 115.95 120.28 1lsy h TRP 111 Ca -0.00 -0.10 0.05 0.00 2.11 0.00 0.00 58.89 60.95 1lsy h TRP 111 Cb 0.89 -0.08 -0.06 0.00 -2.10 0.00 0.00 29.16 27.81 1lsy h TRP 111 CO 0.00 0.66 0.48 -0.09 -2.79 0.00 0.00 178.44 176.71 1lsy h ARG 112 N -0.03 0.88 0.00 2.65 2.43 -1.21 0.32 114.38 119.42 1lsy h ARG 112 Ca 0.03 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.07 1lsy h ARG 112 Cb 0.58 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 1lsy h ARG 112 CO 0.03 0.58 -1.24 0.09 -1.51 0.00 0.00 179.97 177.92 1lsy n ASN 113 N -4.65 0.82 0.00 -3.80 3.02 -0.65 -4.19 115.26 105.81 1lsy n ASN 113 Ca 0.10 0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.99 1lsy n ASN 113 Cb 0.15 0.38 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 1lsy n ASN 113 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1lsy n ARG 114 N -2.76 3.32 -0.03 3.52 1.74 -0.27 -4.88 116.66 117.31 1lsy n ARG 114 Ca -0.05 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 56.99 1lsy n ARG 114 Cb 0.69 -0.66 -0.02 0.00 -1.02 0.00 0.00 32.46 31.45 1lsy n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1lsy n LYS 116 N -2.67 2.38 -1.08 0.00 4.81 0.88 -1.61 118.16 120.87 1lsy n LYS 116 Ca -0.09 0.86 -0.03 0.00 -0.87 0.00 0.00 58.31 58.18 1lsy n LYS 116 Cb 0.60 -2.68 -0.01 0.00 0.02 0.00 0.00 35.03 32.95 1lsy n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1lsy n GLY 117 N 3.87 0.60 3.85 3.14 0.00 -1.26 -4.95 105.19 110.44 1lsy n GLY 117 Ca 0.18 -0.64 -0.27 0.00 0.00 0.00 0.00 46.02 45.29 1lsy n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1lsy s THR 118 N -2.05 1.66 -1.15 2.61 -4.23 -0.63 -5.00 115.64 106.85 1lsy s THR 118 Ca 0.00 -1.62 -0.20 0.00 -1.18 0.00 0.00 61.69 58.69 1lsy s THR 118 Cb 0.00 -2.28 0.07 0.00 1.34 0.00 0.00 72.50 71.63 1lsy s THR 118 CO 0.00 0.00 1.57 -0.62 -0.54 0.00 0.00 174.62 175.03 1lsy s ASP 119 N -4.15 6.68 0.26 3.99 2.15 -1.26 -4.75 116.67 119.59 1lsy s ASP 119 Ca 0.29 -1.98 0.25 0.00 0.43 0.00 0.00 52.55 51.54 1lsy s ASP 119 Cb -0.01 -2.56 0.94 0.00 -0.30 0.00 0.00 42.92 40.99 1lsy s ASP 119 CO 0.18 -1.31 1.74 -0.37 -0.17 0.00 0.00 175.17 175.24 1lsy h VAL 120 N 6.13 0.00 0.00 1.11 -1.51 -1.90 -2.98 116.25 117.09 1lsy h VAL 120 Ca 0.32 -0.34 -0.02 0.00 -1.23 0.00 0.00 66.70 65.43 1lsy h VAL 120 Cb 0.94 1.17 -0.00 0.00 -2.13 0.00 0.00 31.29 31.27 1lsy h VAL 120 CO 1.42 0.00 -0.08 -0.61 -1.23 0.00 0.00 177.57 177.08 1lsy h GLN 121 N 0.00 0.00 -0.33 5.19 -0.00 -1.88 -2.20 115.11 115.89 1lsy h GLN 121 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 58.65 58.75 1lsy h GLN 121 Cb 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.97 1lsy h GLN 121 CO 0.00 0.08 0.24 0.00 0.00 0.00 0.00 178.83 179.15 1lsy h ALA 122 N 1.92 2.29 0.00 3.38 0.00 -1.93 -1.93 119.26 123.00 1lsy h ALA 122 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1lsy h ALA 122 Cb 0.18 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1lsy h ALA 122 CO 0.01 -0.41 0.00 -1.49 0.00 0.00 0.00 179.25 177.36 1lsy h TRP 123 N 0.00 0.00 -0.07 0.00 4.06 -1.63 -2.79 115.95 115.52 1lsy h TRP 123 Ca 0.16 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.11 1lsy h TRP 123 Cb 0.64 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.80 1lsy h TRP 123 CO 0.00 0.00 0.00 0.44 -3.56 0.00 0.00 178.44 175.32 1lsy n ILE 124 N -2.95 0.41 -1.85 1.49 -5.35 -0.76 -4.81 119.36 105.54 1lsy n ILE 124 Ca 0.00 -0.70 -0.42 0.00 -0.27 0.00 0.00 62.75 61.37 1lsy n ILE 124 Cb 0.27 0.87 -0.02 0.00 -1.74 0.00 0.00 39.64 39.01 1lsy n ILE 124 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1lsy s ARG 125 N -0.68 4.17 0.00 6.28 3.52 -1.02 -2.08 118.95 129.15 1lsy s ARG 125 Ca 0.08 2.48 0.00 0.00 -0.13 0.00 0.00 55.73 58.17 1lsy s ARG 125 Cb 0.05 -3.08 0.00 0.00 -1.56 0.00 0.00 34.95 30.36 1lsy s ARG 125 CO 0.07 -0.61 0.00 0.41 -0.81 0.00 0.00 175.30 174.36 1lsy n GLY 126 N 2.88 2.53 3.81 8.12 0.00 -1.26 -5.04 105.19 116.22 1lsy n GLY 126 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1lsy n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lsy s ARG 128 N -2.91 3.41 0.00 0.00 3.52 -1.26 -5.14 118.95 116.57 1lsy s ARG 128 Ca 0.60 -0.18 0.00 0.00 -0.13 0.00 0.00 55.73 56.02 1lsy s ARG 128 Cb -0.12 -3.92 0.00 0.00 -1.56 0.00 0.00 34.95 29.35 1lsy s ARG 128 CO 0.16 -1.00 0.29 1.28 -0.81 0.00 0.00 175.30 175.22