#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pis n LEU 2 N 0.00 0.00 -0.32 0.00 4.32 -1.26 -2.99 117.00 116.75 1pis n LEU 2 Ca 0.00 0.41 0.35 0.00 -0.02 0.00 0.00 56.01 56.75 1pis n LEU 2 Cb 0.00 -0.41 0.75 0.00 -1.62 0.00 0.00 43.42 42.14 1pis n LEU 2 CO 0.00 -0.25 1.33 4.11 -1.22 0.00 0.00 177.39 181.35 1pis h TRP 3 N 0.00 0.00 0.00 -1.77 5.08 -1.95 -0.83 115.95 116.49 1pis h TRP 3 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1pis h TRP 3 Cb 0.15 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.31 1pis h TRP 3 CO 0.00 0.00 0.00 0.37 -1.28 0.00 0.00 178.44 177.53 1pis h GLN 4 N 0.00 0.00 -0.58 0.12 5.75 -1.91 -2.63 115.11 115.85 1pis h GLN 4 Ca 0.57 0.00 0.12 0.00 -0.15 0.00 0.00 58.65 59.18 1pis h GLN 4 Cb 2.33 0.00 -0.11 0.00 1.07 0.00 0.00 27.48 30.77 1pis h GLN 4 CO -0.01 0.00 -0.13 0.35 -2.65 0.00 0.00 178.83 176.40 1pis h PHE 5 N 0.00 -0.27 -0.58 3.99 3.57 -1.54 -1.84 116.94 120.27 1pis h PHE 5 Ca 0.00 0.05 0.09 0.00 3.53 0.00 0.00 57.97 61.64 1pis h PHE 5 Cb 0.10 0.21 -0.07 0.00 2.79 0.00 0.00 35.95 38.98 1pis h PHE 5 CO 0.00 -0.24 0.20 0.00 -2.23 0.00 0.00 178.31 176.04 1pis h ARG 6 N 0.01 0.36 -0.67 1.11 -0.00 -1.74 -0.91 114.38 112.55 1pis h ARG 6 Ca 0.28 -0.02 0.13 0.00 -0.50 0.00 0.00 59.98 59.87 1pis h ARG 6 Cb 0.43 -0.08 -0.13 0.00 0.00 0.00 0.00 29.97 30.19 1pis h ARG 6 CO -0.58 0.24 -0.18 1.03 0.00 0.00 0.00 179.97 180.48 1pis h SER 7 N 0.37 -0.66 -0.60 7.04 0.87 -1.68 -2.92 113.55 115.98 1pis h SER 7 Ca 0.29 0.20 0.12 0.00 -1.23 0.00 0.00 61.79 61.18 1pis h SER 7 Cb 0.36 0.43 -0.10 0.00 -0.44 0.00 0.00 62.40 62.65 1pis h SER 7 CO -0.30 -0.23 0.02 0.24 -0.53 0.00 0.00 176.83 176.03 1pis h MET 8 N -0.01 0.13 -0.22 2.24 2.86 -0.30 -2.96 114.93 116.66 1pis h MET 8 Ca 0.32 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.95 1pis h MET 8 Cb 0.50 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.13 1pis h MET 8 CO -0.70 0.09 0.00 0.44 1.06 0.00 0.00 176.91 177.80 1pis n ILE 9 N -5.25 0.29 -0.03 -1.22 -5.35 -1.00 -1.90 119.36 104.90 1pis n ILE 9 Ca 0.09 -0.38 -0.01 0.00 -0.27 0.00 0.00 62.75 62.17 1pis n ILE 9 Cb 0.34 0.33 -0.00 0.00 -1.74 0.00 0.00 39.64 38.56 1pis n ILE 9 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 1pis h LYS 10 N 2.16 0.00 0.00 6.28 1.79 -1.40 -3.06 116.57 122.34 1pis h LYS 10 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1pis h LYS 10 Cb 0.48 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 1pis h LYS 10 CO 0.00 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.37 1pis n ALA 12 N -1.24 3.38 -3.74 0.00 0.00 -0.80 -4.48 120.51 113.63 1pis n ALA 12 Ca 0.00 -0.42 -0.30 0.00 0.00 0.00 0.00 53.44 52.73 1pis n ALA 12 Cb 0.00 -1.08 -0.10 0.00 0.00 0.00 0.00 19.45 18.27 1pis n ALA 12 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1pis n ILE 13 N -0.94 2.12 -1.76 0.00 2.08 -0.99 -4.55 119.36 115.32 1pis n ILE 13 Ca 0.09 -5.01 -0.42 0.00 0.56 0.00 0.00 62.75 57.97 1pis n ILE 13 Cb 0.35 -2.21 -0.03 0.00 -0.75 0.00 0.00 39.64 37.01 1pis n ILE 13 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1pis s PRO 14 N -1.68 3.02 0.00 0.38 0.04 -1.26 -4.13 135.00 131.37 1pis s PRO 14 Ca 0.28 1.65 0.00 0.00 0.04 0.00 0.00 61.00 62.97 1pis s PRO 14 Cb -0.01 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 30.19 1pis s PRO 14 CO -0.13 -2.23 0.00 0.41 0.04 0.00 0.00 177.00 175.10 1pis n GLY 15 N 5.68 2.06 3.64 0.56 0.00 -1.26 -5.06 105.19 110.82 1pis n GLY 15 Ca 0.28 -0.65 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 1pis n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pis s SER 16 N -2.65 2.64 -0.22 1.61 0.01 -1.26 -5.05 113.70 108.77 1pis s SER 16 Ca 0.00 2.02 -0.01 0.00 1.31 0.00 0.00 55.95 59.28 1pis s SER 16 Cb 0.00 -2.51 0.02 0.00 0.21 0.00 0.00 66.02 63.75 1pis s SER 16 CO 0.00 -3.25 -0.11 -1.00 0.41 0.00 0.00 173.24 169.29 1pis s HIS 17 N -2.63 2.97 0.24 2.43 3.76 -1.26 -4.85 115.29 115.94 1pis s HIS 17 Ca 0.67 -1.56 0.00 0.00 -0.15 0.00 0.00 55.06 54.02 1pis s HIS 17 Cb -0.23 -2.01 0.00 0.00 1.11 0.00 0.00 32.58 31.45 1pis s HIS 17 CO 0.59 -0.74 0.00 -2.30 -0.85 0.00 0.00 174.74 171.44 1pis n PRO 18 N 4.65 1.19 0.00 8.40 -0.02 -1.26 -3.24 135.00 144.73 1pis n PRO 18 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1pis n PRO 18 Cb 0.48 -0.47 0.00 0.00 -0.02 0.00 0.00 33.50 33.49 1pis n PRO 18 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1pis n LEU 19 N 0.00 0.00 0.16 2.45 7.99 -1.26 -0.84 117.00 125.51 1pis n LEU 19 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 56.01 55.86 1pis n LEU 19 Cb 0.00 0.00 -0.08 0.00 -0.11 0.00 0.00 43.42 43.23 1pis n LEU 19 CO 0.00 0.00 0.68 0.24 -1.51 0.00 0.00 177.39 176.80 1pis h MET 20 N 0.00 -0.37 0.00 3.23 2.86 -1.93 -3.37 114.93 115.35 1pis h MET 20 Ca 0.00 0.03 -0.18 0.00 -2.06 0.00 0.00 59.70 57.49 1pis h MET 20 Cb 0.00 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.72 1pis h MET 20 CO 0.00 -0.14 -0.97 -0.44 1.06 0.00 0.00 176.91 176.42 1pis h ASP 21 N -0.54 0.01 -2.61 1.22 3.32 -1.33 -3.48 116.42 113.01 1pis h ASP 21 Ca -0.04 -0.64 -0.28 0.00 0.02 0.00 0.00 57.03 56.10 1pis h ASP 21 Cb 0.40 -0.00 0.15 0.00 0.22 0.00 0.00 39.33 40.10 1pis h ASP 21 CO 0.06 1.38 -0.03 0.49 -1.72 0.00 0.00 179.24 179.43 1pis n PHE 22 N -4.45 -3.47 -1.21 4.55 3.72 -0.02 -4.81 117.46 111.77 1pis n PHE 22 Ca -0.27 -0.65 0.00 0.00 -0.05 0.00 0.00 57.45 56.48 1pis n PHE 22 Cb 0.64 -0.87 0.00 0.00 -0.94 0.00 0.00 39.48 38.31 1pis n PHE 22 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1pis n ASN 23 N -4.75 -6.83 0.00 4.37 5.15 -1.26 -4.12 115.26 107.82 1pis n ASN 23 Ca 0.10 0.89 0.00 0.00 -0.60 0.00 0.00 54.58 54.98 1pis n ASN 23 Cb 0.43 -3.05 0.00 0.00 -0.53 0.00 0.00 39.78 36.63 1pis n ASN 23 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1pis n ASN 24 N -0.11 0.00 -4.75 1.20 3.02 -1.26 -4.97 115.26 108.39 1pis n ASN 24 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.20 1pis n ASN 24 Cb 0.00 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.23 1pis n ASN 24 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1pis s TYR 25 N 0.00 2.33 0.39 3.10 1.13 -1.22 -4.33 117.35 118.75 1pis s TYR 25 Ca 0.00 1.56 0.00 0.00 -1.41 0.00 0.00 57.07 57.22 1pis s TYR 25 Cb 0.00 -3.39 0.00 0.00 -1.10 0.00 0.00 41.96 37.47 1pis s TYR 25 CO 0.00 -2.21 0.00 0.41 -2.51 0.00 0.00 175.55 171.24 1pis n GLY 26 N 0.19 -2.46 0.07 5.49 0.00 0.04 -4.79 105.19 103.73 1pis n GLY 26 Ca 0.13 -1.18 -0.06 0.00 0.00 0.00 0.00 46.02 44.91 1pis n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pis n TYR 28 N -3.32 0.70 0.03 0.00 4.11 -1.26 -4.93 117.16 112.50 1pis n TYR 28 Ca -0.00 -3.74 0.05 0.00 -0.00 0.00 0.00 57.90 54.20 1pis n TYR 28 Cb 0.91 -0.41 0.10 0.00 -0.00 0.00 0.00 39.34 39.95 1pis n TYR 28 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1pis n GLY 30 N 0.42 0.86 3.42 0.00 0.00 -1.26 -4.99 105.19 103.64 1pis n GLY 30 Ca 0.08 -0.20 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 1pis n GLY 30 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pis s LEU 31 N 0.00 3.06 0.00 0.99 2.01 -1.26 -4.75 118.68 118.73 1pis s LEU 31 Ca 0.00 -0.25 0.00 0.00 0.01 0.00 0.00 54.13 53.89 1pis s LEU 31 Cb 0.00 -1.75 0.00 0.00 0.01 0.00 0.00 46.19 44.45 1pis s LEU 31 CO 0.00 0.10 0.00 0.61 1.01 0.00 0.00 176.35 178.07 1pis n GLY 32 N 4.00 1.65 1.19 -3.19 0.00 -1.26 -4.99 105.19 102.60 1pis n GLY 32 Ca -0.18 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1pis n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pis n GLY 33 N 0.00 2.51 0.00 -0.02 0.00 -1.26 -4.89 105.19 101.52 1pis n GLY 33 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1pis n GLY 33 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pis n SER 34 N 1.25 0.00 0.00 1.61 3.41 -1.26 -4.82 113.62 113.81 1pis n SER 34 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1pis n SER 34 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1pis n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pis n GLY 35 N 0.00 2.24 0.00 5.00 0.00 -1.26 -4.70 105.19 106.47 1pis n GLY 35 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1pis n GLY 35 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1pis n THR 36 N 0.00 0.00 0.00 2.61 5.66 -1.26 -5.15 114.28 116.14 1pis n THR 36 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1pis n THR 36 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1pis n THR 36 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1pis n PRO 37 N 0.00 3.31 0.00 1.09 -0.02 -1.26 -4.68 135.00 133.44 1pis n PRO 37 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1pis n PRO 37 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1pis n PRO 37 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1pis n VAL 38 N 0.00 0.00 -3.88 -1.45 0.24 -1.25 -4.36 118.33 107.63 1pis n VAL 38 Ca 0.00 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.05 1pis n VAL 38 Cb 0.00 -0.12 -0.03 0.00 -1.47 0.00 0.00 33.84 32.22 1pis n VAL 38 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1pis s ASP 39 N 0.19 6.34 0.00 -1.34 2.15 -1.26 -5.05 116.67 117.69 1pis s ASP 39 Ca 0.00 0.19 0.00 0.00 0.43 0.00 0.00 52.55 53.17 1pis s ASP 39 Cb 0.00 -1.92 0.00 0.00 -0.30 0.00 0.00 42.92 40.70 1pis s ASP 39 CO 0.00 -0.02 0.34 -1.84 -0.17 0.00 0.00 175.17 173.48 1pis n GLU 40 N -0.89 0.00 0.19 4.34 0.00 -1.26 -2.50 120.64 120.51 1pis n GLU 40 Ca -0.07 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.21 1pis n GLU 40 Cb 0.55 -1.38 0.22 0.00 0.00 0.00 0.00 31.44 30.84 1pis n GLU 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 1pis h LEU 41 N 0.00 0.00 -1.32 -1.84 5.85 -1.91 -0.50 115.31 115.59 1pis h LEU 41 Ca 0.00 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1pis h LEU 41 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1pis h LEU 41 CO 0.00 0.00 -0.25 -0.78 -0.34 0.00 0.00 178.44 177.07 1pis h ASP 42 N 0.00 0.00 0.41 1.25 1.82 -1.80 -3.19 116.42 114.91 1pis h ASP 42 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1pis h ASP 42 Cb 0.94 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.95 1pis h ASP 42 CO 0.00 0.25 0.00 -0.09 -1.61 0.00 0.00 179.24 177.79 1pis h ARG 43 N 0.00 0.00 0.00 0.28 1.12 -1.25 -1.63 114.38 112.90 1pis h ARG 43 Ca -0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1pis h ARG 43 Cb 0.66 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.62 1pis h ARG 43 CO 0.03 0.00 -0.33 0.00 -3.11 0.00 0.00 179.97 176.56 1pis n GLU 46 N -4.82 -0.20 -0.02 0.00 0.00 -0.66 -1.03 120.64 113.92 1pis n GLU 46 Ca -0.05 1.15 -0.13 0.00 0.00 0.00 0.00 57.16 58.14 1pis n GLU 46 Cb 0.16 -1.71 -0.10 0.00 0.00 0.00 0.00 31.44 29.78 1pis n GLU 46 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.13 178.28 1pis h THR 47 N 0.00 1.38 -0.59 6.31 2.02 -1.73 -2.86 112.91 117.44 1pis h THR 47 Ca 0.24 -1.54 0.06 0.00 0.77 0.00 0.00 66.41 65.93 1pis h THR 47 Cb 0.43 2.37 -0.03 0.00 -1.74 0.00 0.00 68.15 69.18 1pis h THR 47 CO -0.74 0.38 0.39 -0.74 0.37 0.00 0.00 175.52 175.18 1pis h HIS 48 N -0.75 0.59 -0.17 3.16 -0.00 -1.60 -0.88 115.15 115.49 1pis h HIS 48 Ca -0.00 0.01 -0.21 0.00 -0.00 0.00 0.00 60.37 60.17 1pis h HIS 48 Cb 0.66 -0.19 0.01 0.00 -0.00 0.00 0.00 27.41 27.88 1pis h HIS 48 CO 0.15 0.32 -0.72 0.38 -0.00 0.00 0.00 177.93 178.07 1pis h ASP 49 N 0.59 0.87 1.75 3.26 3.04 -1.18 -1.68 116.42 123.07 1pis h ASP 49 Ca 0.25 -0.55 0.00 0.00 -3.24 0.00 0.00 57.03 53.50 1pis h ASP 49 Cb 0.25 -0.26 0.00 0.00 -1.04 0.00 0.00 39.33 38.28 1pis h ASP 49 CO -0.07 1.33 0.00 -1.13 -2.04 0.00 0.00 179.24 177.33 1pis h ASN 50 N 0.53 0.00 -0.03 4.15 -1.24 -1.45 -1.19 115.58 116.35 1pis h ASN 50 Ca -0.03 0.00 -0.14 0.00 0.71 0.00 0.00 56.30 56.83 1pis h ASN 50 Cb 1.33 0.00 0.01 0.00 0.73 0.00 0.00 38.32 40.39 1pis h ASN 50 CO 0.15 0.00 -0.54 0.00 -1.29 0.00 0.00 177.43 175.74 1pis h TYR 52 N -0.06 0.41 0.16 0.00 -1.99 -1.34 -0.81 116.97 113.33 1pis h TYR 52 Ca -0.06 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.69 1pis h TYR 52 Cb 1.23 -0.13 -0.01 0.00 2.00 0.00 0.00 36.73 39.82 1pis h TYR 52 CO 0.14 0.17 -0.14 0.00 -0.00 0.00 0.00 178.16 178.33 1pis h ARG 53 N 0.37 -0.30 0.00 4.88 2.47 -1.28 -2.07 114.38 118.44 1pis h ARG 53 Ca 0.31 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 59.05 1pis h ARG 53 Cb 0.72 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.11 1pis h ARG 53 CO -0.09 -0.20 0.00 0.22 0.56 0.00 0.00 179.97 180.46 1pis h ASP 54 N -0.32 0.00 0.33 7.04 1.82 -1.39 -2.86 116.42 121.05 1pis h ASP 54 Ca -0.00 0.00 -0.15 0.00 -0.39 0.00 0.00 57.03 56.49 1pis h ASP 54 Cb 0.29 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.29 1pis h ASP 54 CO -0.03 0.00 -0.62 0.00 -1.61 0.00 0.00 179.24 176.98 1pis h ALA 55 N 2.09 0.80 -0.32 -0.78 0.00 -1.10 -3.32 119.26 116.64 1pis h ALA 55 Ca 0.00 -0.55 -0.42 0.00 0.00 0.00 0.00 54.91 53.94 1pis h ALA 55 Cb 0.51 -0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.10 1pis h ALA 55 CO 0.00 0.73 0.47 0.36 0.00 0.00 0.00 179.25 180.82 1pis n LYS 56 N -3.87 2.51 0.00 0.00 2.85 -0.78 -3.97 118.16 114.90 1pis n LYS 56 Ca -0.03 -1.95 0.00 0.00 -1.05 0.00 0.00 58.31 55.29 1pis n LYS 56 Cb 0.63 -2.17 0.00 0.00 -0.65 0.00 0.00 35.03 32.84 1pis n LYS 56 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1pis n ASN 57 N 1.68 0.00 -4.58 -5.58 2.85 -1.26 -4.98 115.26 103.39 1pis n ASN 57 Ca 0.50 0.00 -0.42 0.00 -0.11 0.00 0.00 54.58 54.54 1pis n ASN 57 Cb 0.64 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.62 1pis n ASN 57 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 1pis s LEU 58 N 0.00 4.08 0.36 1.20 2.96 -1.25 -4.98 118.68 121.05 1pis s LEU 58 Ca 0.00 0.35 0.05 0.00 -0.22 0.00 0.00 54.13 54.31 1pis s LEU 58 Cb 0.00 -3.12 0.72 0.00 0.50 0.00 0.00 46.19 44.29 1pis s LEU 58 CO 0.00 -0.84 1.96 0.44 -1.32 0.00 0.00 176.35 176.59 1pis h ASP 59 N 8.61 0.68 0.17 3.68 3.32 -1.96 -2.80 116.42 128.13 1pis h ASP 59 Ca -0.24 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.80 1pis h ASP 59 Cb 1.09 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.49 1pis h ASP 59 CO 0.96 0.45 -0.08 -1.28 -1.72 0.00 0.00 179.24 177.56 1pis h SER 60 N 0.78 -0.20 -3.19 6.45 0.87 -1.96 -3.39 113.55 112.91 1pis h SER 60 Ca 0.31 -0.02 -0.59 0.00 -1.23 0.00 0.00 61.79 60.26 1pis h SER 60 Cb 0.24 0.05 -0.40 0.00 -0.44 0.00 0.00 62.40 61.85 1pis h SER 60 CO -0.10 -0.11 -0.77 0.00 -0.53 0.00 0.00 176.83 175.32 1pis s LYS 62 N 0.96 4.34 0.00 0.00 -0.14 -1.07 -4.69 119.74 119.14 1pis s LYS 62 Ca 0.15 1.11 0.00 0.00 -1.36 0.00 0.00 55.97 55.87 1pis s LYS 62 Cb -0.22 -3.56 0.00 0.00 -1.68 0.00 0.00 37.83 32.38 1pis s LYS 62 CO -0.09 -0.29 0.00 1.19 -0.76 0.00 0.00 175.35 175.40 1pis n PHE 63 N 5.06 0.00 -3.68 3.18 3.01 -1.26 -4.97 117.46 118.80 1pis n PHE 63 Ca 0.05 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.13 1pis n PHE 63 Cb 0.49 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.86 1pis n PHE 63 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1pis s LEU 64 N 0.00 5.44 -0.25 4.37 1.02 -1.26 -4.93 118.68 123.07 1pis s LEU 64 Ca 0.00 -2.33 -0.28 0.00 0.02 0.00 0.00 54.13 51.54 1pis s LEU 64 Cb 0.00 -1.90 -0.05 0.00 0.02 0.00 0.00 46.19 44.26 1pis s LEU 64 CO 0.00 -0.52 2.25 0.52 0.02 0.00 0.00 176.35 178.62 1pis n VAL 65 N 4.25 0.30 -3.16 -1.59 0.31 -1.26 -4.97 118.33 112.22 1pis n VAL 65 Ca 0.01 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.84 1pis n VAL 65 Cb 0.40 -2.59 0.00 0.00 -0.91 0.00 0.00 33.84 30.74 1pis n VAL 65 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1pis n ASP 66 N 12.13 1.43 -3.33 4.52 2.03 -1.26 -4.88 116.55 127.19 1pis n ASP 66 Ca 0.31 -0.44 -0.22 0.00 0.52 0.00 0.00 54.79 54.96 1pis n ASP 66 Cb 0.46 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.77 1pis n ASP 66 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1pis s ASN 67 N -0.20 1.38 -0.39 1.67 6.03 -1.26 -4.25 114.94 117.91 1pis s ASN 67 Ca 0.00 -2.27 -0.28 0.00 -1.03 0.00 0.00 52.86 49.29 1pis s ASN 67 Cb 0.00 0.14 0.02 0.00 -3.03 0.00 0.00 41.25 38.38 1pis s ASN 67 CO 0.00 -0.22 1.03 -2.16 -2.03 0.00 0.00 177.10 173.72 1pis s PRO 68 N 0.80 3.84 0.00 3.55 0.04 -1.26 -4.97 135.00 137.00 1pis s PRO 68 Ca 0.24 0.67 0.00 0.00 0.04 0.00 0.00 61.00 61.95 1pis s PRO 68 Cb -0.09 -3.83 0.00 0.00 0.04 0.00 0.00 34.50 30.63 1pis s PRO 68 CO -0.08 -1.08 0.00 0.66 0.04 0.00 0.00 177.00 176.54 1pis n TYR 69 N 7.14 0.00 -0.03 0.56 4.01 -1.26 -4.80 117.16 122.78 1pis n TYR 69 Ca 0.10 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.71 1pis n TYR 69 Cb 0.48 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.42 1pis n TYR 69 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1pis h THR 70 N 0.00 1.38 -1.34 -0.72 1.03 -1.73 -3.31 112.91 108.22 1pis h THR 70 Ca 0.00 -1.23 -0.75 0.00 -0.01 0.00 0.00 66.41 64.42 1pis h THR 70 Cb 0.00 2.07 -0.15 0.00 -1.07 0.00 0.00 68.15 69.00 1pis h THR 70 CO 0.00 0.34 2.10 -0.62 -0.01 0.00 0.00 175.52 177.33 1pis n GLU 71 N -4.73 3.81 0.05 0.00 1.02 -1.26 -3.85 120.64 115.67 1pis n GLU 71 Ca -0.08 -3.51 0.00 0.00 -0.02 0.00 0.00 57.16 53.55 1pis n GLU 71 Cb 0.30 -2.87 0.00 0.00 -0.02 0.00 0.00 31.44 28.85 1pis n GLU 71 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1pis n SER 72 N 3.44 -0.90 -4.62 1.62 3.41 -1.26 -5.09 113.62 110.22 1pis n SER 72 Ca 0.44 0.54 -0.27 0.00 -0.26 0.00 0.00 58.87 59.32 1pis n SER 72 Cb 0.34 1.19 -0.08 0.00 -0.26 0.00 0.00 64.21 65.40 1pis n SER 72 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1pis s TYR 73 N -1.90 2.73 0.00 7.33 -0.85 -1.25 -4.90 117.35 118.52 1pis s TYR 73 Ca 0.00 -0.18 0.00 0.00 -0.52 0.00 0.00 57.07 56.37 1pis s TYR 73 Cb 0.00 -1.32 0.00 0.00 0.38 0.00 0.00 41.96 41.02 1pis s TYR 73 CO 0.00 0.52 0.00 -1.13 -1.52 0.00 0.00 175.55 173.42 1pis n SER 74 N -0.07 1.54 0.00 -0.18 3.41 -1.26 -4.82 113.62 112.24 1pis n SER 74 Ca -0.10 -0.48 0.00 0.00 -0.26 0.00 0.00 58.87 58.03 1pis n SER 74 Cb 0.55 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 1pis n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pis n TYR 75 N 0.00 0.00 -3.54 7.33 4.11 -1.26 -2.08 117.16 121.72 1pis n TYR 75 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.90 57.89 1pis n TYR 75 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 39.34 39.29 1pis n TYR 75 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.86 175.74 1pis s SER 76 N 1.13 -0.77 0.41 9.48 0.01 -1.25 -4.42 113.70 118.29 1pis s SER 76 Ca 0.00 1.10 0.07 0.00 1.31 0.00 0.00 55.95 58.44 1pis s SER 76 Cb 0.00 1.75 -0.05 0.00 0.21 0.00 0.00 66.02 67.93 1pis s SER 76 CO 0.00 -0.16 0.20 0.00 0.41 0.00 0.00 173.24 173.70 1pis n SER 78 N -1.27 0.00 0.00 0.00 2.88 -1.13 -4.73 113.62 109.37 1pis n SER 78 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 1pis n SER 78 Cb 0.64 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 1pis n SER 78 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1pis n ASN 79 N 0.00 0.00 -1.05 -3.46 4.13 -1.26 -4.56 115.26 109.05 1pis n ASN 79 Ca 0.00 0.29 -0.03 0.00 1.68 0.00 0.00 54.58 56.52 1pis n ASN 79 Cb 0.00 0.00 0.18 0.00 -1.54 0.00 0.00 39.78 38.42 1pis n ASN 79 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1pis n THR 80 N -0.39 2.44 -1.84 3.41 -2.24 -1.26 -4.76 114.28 109.64 1pis n THR 80 Ca 0.00 -3.11 -0.40 0.00 -2.27 0.00 0.00 64.05 58.27 1pis n THR 80 Cb 0.00 -0.38 -0.03 0.00 -2.10 0.00 0.00 70.33 67.82 1pis n THR 80 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1pis n GLU 81 N -1.08 2.37 -3.04 -0.78 4.07 -1.26 -4.39 120.64 116.53 1pis n GLU 81 Ca 0.29 -2.55 -0.38 0.00 -0.06 0.00 0.00 57.16 54.47 1pis n GLU 81 Cb 0.89 -3.32 -0.06 0.00 -0.06 0.00 0.00 31.44 28.89 1pis n GLU 81 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1pis s ILE 82 N 5.27 4.47 0.00 6.31 1.09 -1.24 -2.85 121.20 134.25 1pis s ILE 82 Ca 0.55 1.50 0.00 0.00 -1.10 0.00 0.00 60.65 61.60 1pis s ILE 82 Cb 0.09 -4.00 0.00 0.00 -1.06 0.00 0.00 42.46 37.50 1pis s ILE 82 CO 0.04 0.37 0.00 1.07 -0.10 0.00 0.00 174.94 176.32 1pis n THR 83 N 1.16 0.00 -3.83 2.92 5.66 -0.99 -4.86 114.28 114.34 1pis n THR 83 Ca -0.04 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.89 1pis n THR 83 Cb 0.50 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 69.30 1pis n THR 83 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1pis s ASN 85 N -3.12 5.68 0.08 0.00 3.84 -0.88 -3.83 114.94 116.72 1pis s ASN 85 Ca 0.16 0.51 0.25 0.00 0.21 0.00 0.00 52.86 53.99 1pis s ASN 85 Cb -0.05 -2.53 0.98 0.00 -0.55 0.00 0.00 41.25 39.10 1pis s ASN 85 CO 0.09 -2.02 1.77 -0.24 -2.79 0.00 0.00 177.10 173.91 1pis n SER 86 N 11.18 0.28 0.33 -4.21 2.88 -1.26 -0.22 113.62 122.60 1pis n SER 86 Ca 0.18 0.54 0.09 0.00 -1.33 0.00 0.00 58.87 58.35 1pis n SER 86 Cb 0.50 -0.61 0.48 0.00 -0.75 0.00 0.00 64.21 63.83 1pis n SER 86 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 1pis h LYS 87 N 0.00 0.00 0.00 -1.46 2.10 -2.03 -3.49 116.57 111.69 1pis h LYS 87 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1pis h LYS 87 Cb 0.49 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.82 1pis h LYS 87 CO 0.00 0.00 0.00 0.27 -2.00 0.00 0.00 179.45 177.72 1pis n ASN 88 N -2.74 0.00 -4.40 7.07 0.23 0.69 -5.05 115.26 111.07 1pis n ASN 88 Ca -0.01 0.00 -0.31 0.00 -0.53 0.00 0.00 54.58 53.73 1pis n ASN 88 Cb 0.64 0.00 -0.14 0.00 -2.08 0.00 0.00 39.78 38.20 1pis n ASN 88 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 1pis s ASN 89 N 0.00 3.55 0.54 0.53 2.47 -1.26 -4.90 114.94 115.88 1pis s ASN 89 Ca 0.00 -0.39 0.44 0.00 0.42 0.00 0.00 52.86 53.33 1pis s ASN 89 Cb 0.00 -0.56 1.65 0.00 -1.45 0.00 0.00 41.25 40.89 1pis s ASN 89 CO 0.00 0.31 1.66 0.00 -3.72 0.00 0.00 177.10 175.35 1pis h ALA 90 N 5.13 3.52 0.25 1.71 0.00 -1.94 0.63 119.26 128.55 1pis h ALA 90 Ca -0.46 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1pis h ALA 90 Cb 1.14 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1pis h ALA 90 CO 0.48 -2.01 -0.12 0.00 0.00 0.00 0.00 179.25 177.60 1pis h GLU 92 N -0.54 0.00 0.11 0.00 4.11 -1.70 -3.42 114.58 113.14 1pis h GLU 92 Ca -0.03 0.00 -0.36 0.00 0.07 0.00 0.00 59.36 59.04 1pis h GLU 92 Cb 0.40 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1pis h GLU 92 CO 0.06 0.59 -1.97 0.00 0.07 0.00 0.00 179.01 177.76 1pis n ALA 93 N -2.39 0.96 -0.03 1.06 0.00 0.14 -2.95 120.51 117.30 1pis n ALA 93 Ca -0.01 -0.61 -0.10 0.00 0.00 0.00 0.00 53.44 52.72 1pis n ALA 93 Cb 0.61 -0.70 -0.04 0.00 0.00 0.00 0.00 19.45 19.33 1pis n ALA 93 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1pis h PHE 94 N 0.06 0.17 -0.49 0.00 3.04 -1.77 -1.68 116.94 116.27 1pis h PHE 94 Ca -0.41 0.01 -0.12 0.00 3.98 0.00 0.00 57.97 61.43 1pis h PHE 94 Cb 2.03 -0.05 -0.02 0.00 2.56 0.00 0.00 35.95 40.48 1pis h PHE 94 CO 0.07 0.10 -0.17 0.82 -2.02 0.00 0.00 178.31 177.11 1pis h ILE 95 N 0.19 1.27 0.00 1.41 1.08 -1.81 -1.85 117.51 117.81 1pis h ILE 95 Ca 0.07 -1.32 -0.03 0.00 -0.39 0.00 0.00 64.86 63.19 1pis h ILE 95 Cb 0.00 1.07 -0.00 0.00 -3.07 0.00 0.00 36.82 34.82 1pis h ILE 95 CO -0.04 0.46 -0.15 0.00 -0.69 0.00 0.00 178.15 177.73 1pis h ASN 97 N 0.00 0.00 0.00 0.00 2.35 -0.74 0.23 115.58 117.42 1pis h ASN 97 Ca -0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 1pis h ASN 97 Cb 0.58 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.94 1pis h ASN 97 CO 0.02 0.00 -0.29 0.00 -1.65 0.00 0.00 177.43 175.51 1pis n ASP 99 N -4.62 0.00 0.07 0.00 2.03 -0.86 -2.34 116.55 110.83 1pis n ASP 99 Ca -0.11 0.49 -0.10 0.00 0.52 0.00 0.00 54.79 55.59 1pis n ASP 99 Cb 0.37 -0.49 -0.07 0.00 -0.72 0.00 0.00 41.12 40.22 1pis n ASP 99 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 1pis h ARG 100 N 0.00 -0.26 -0.16 -0.67 0.11 -1.09 -3.05 114.38 109.26 1pis h ARG 100 Ca 0.00 0.02 0.01 0.00 0.10 0.00 0.00 59.98 60.11 1pis h ARG 100 Cb 0.04 0.06 -0.02 0.00 1.11 0.00 0.00 29.97 31.17 1pis h ARG 100 CO 0.00 0.11 0.06 -0.97 0.10 0.00 0.00 179.97 179.27 1pis h ASN 101 N -0.93 0.08 -0.34 0.08 -0.73 -1.57 0.25 115.58 112.42 1pis h ASN 101 Ca -0.03 0.01 0.04 0.00 1.87 0.00 0.00 56.30 58.19 1pis h ASN 101 Cb 0.49 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 39.03 1pis h ASN 101 CO 0.04 0.07 -0.19 0.00 -0.37 0.00 0.00 177.43 176.99 1pis n ALA 102 N -2.20 -0.18 -0.38 1.57 0.00 -1.03 -0.01 120.51 118.28 1pis n ALA 102 Ca -0.04 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1pis n ALA 102 Cb 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.44 1pis n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pis n ALA 103 N -3.76 -0.31 -0.37 0.00 0.00 -0.09 -3.11 120.51 112.87 1pis n ALA 103 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.46 1pis n ALA 103 Cb 0.10 0.01 0.07 0.00 0.00 0.00 0.00 19.45 19.62 1pis n ALA 103 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1pis n ILE 104 N -1.44 -0.49 0.22 0.00 5.41 -0.24 -3.08 119.36 119.73 1pis n ILE 104 Ca 0.00 2.30 0.09 0.00 1.00 0.00 0.00 62.75 66.15 1pis n ILE 104 Cb 0.00 -3.08 0.43 0.00 -0.71 0.00 0.00 39.64 36.28 1pis n ILE 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1pis h PHE 106 N 0.00 0.00 0.00 0.00 0.04 -1.48 0.36 116.94 115.86 1pis h PHE 106 Ca -0.00 0.00 -0.30 0.00 2.80 0.00 0.00 57.97 60.47 1pis h PHE 106 Cb 0.79 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.88 1pis h PHE 106 CO 0.00 0.00 -1.85 0.45 -0.60 0.00 0.00 178.31 176.31 1pis n SER 107 N -2.82 0.65 0.14 2.17 2.88 -0.77 -4.62 113.62 111.26 1pis n SER 107 Ca -0.01 0.31 -0.12 0.00 -1.33 0.00 0.00 58.87 57.72 1pis n SER 107 Cb 0.15 0.24 -0.07 0.00 -0.75 0.00 0.00 64.21 63.78 1pis n SER 107 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1pis h LYS 108 N 0.00 -0.40 -7.28 -1.46 1.57 -0.69 -3.47 116.57 104.84 1pis h LYS 108 Ca -0.34 0.03 -0.51 0.00 -1.87 0.00 0.00 60.65 57.96 1pis h LYS 108 Cb 2.03 0.09 0.13 0.00 0.08 0.00 0.00 32.23 34.56 1pis h LYS 108 CO 0.06 -0.07 0.33 0.00 -0.57 0.00 0.00 179.45 179.20 1pis s ALA 109 N -4.31 2.26 0.00 3.86 0.00 0.07 -5.07 121.76 118.57 1pis s ALA 109 Ca -0.13 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.20 1pis s ALA 109 Cb 0.01 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.83 1pis s ALA 109 CO 0.46 -1.72 0.00 -2.30 0.00 0.00 0.00 175.76 172.21 1pis n PRO 110 N -3.29 3.16 -3.62 0.00 -0.02 -1.26 -4.90 135.00 125.06 1pis n PRO 110 Ca 0.10 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.42 1pis n PRO 110 Cb 0.53 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.93 1pis n PRO 110 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1pis s TYR 111 N 0.00 -0.49 -0.64 6.00 6.14 -1.26 -4.62 117.35 122.48 1pis s TYR 111 Ca 0.00 0.89 -0.21 0.00 0.64 0.00 0.00 57.07 58.39 1pis s TYR 111 Cb 0.00 0.28 0.08 0.00 0.42 0.00 0.00 41.96 42.74 1pis s TYR 111 CO 0.00 -0.49 0.87 -0.80 0.64 0.00 0.00 175.55 175.77 1pis s ASN 112 N -1.02 6.19 -0.13 4.32 0.01 -1.26 -4.89 114.94 118.16 1pis s ASN 112 Ca -0.10 -1.19 0.08 0.00 -0.71 0.00 0.00 52.86 50.94 1pis s ASN 112 Cb -0.02 -2.37 0.46 0.00 0.41 0.00 0.00 41.25 39.72 1pis s ASN 112 CO 0.07 -1.31 1.21 1.17 -1.51 0.00 0.00 177.10 176.73 1pis n LYS 113 N 7.16 3.16 0.03 -0.60 3.00 -1.26 -4.19 118.16 125.46 1pis n LYS 113 Ca -0.05 -1.78 0.00 0.00 -0.00 0.00 0.00 58.31 56.48 1pis n LYS 113 Cb 0.44 -1.91 0.00 0.00 0.00 0.00 0.00 35.03 33.56 1pis n LYS 113 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1pis n GLU 114 N 0.37 0.00 0.00 1.64 0.28 -1.26 -4.69 120.64 116.98 1pis n GLU 114 Ca 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.16 1pis n GLU 114 Cb 0.77 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.64 1pis n GLU 114 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1pis n HIS 115 N -2.42 0.00 0.29 -1.84 8.25 -1.26 -4.64 115.22 113.60 1pis n HIS 115 Ca 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 57.72 57.64 1pis n HIS 115 Cb 0.00 -0.03 0.80 0.00 1.12 0.00 0.00 29.99 31.87 1pis n HIS 115 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 1pis h LYS 116 N 0.07 0.00 -2.20 -0.41 3.64 -1.84 0.18 116.57 116.00 1pis h LYS 116 Ca 0.00 0.00 -0.39 0.00 -1.27 0.00 0.00 60.65 58.99 1pis h LYS 116 Cb 0.16 0.00 -0.34 0.00 -0.41 0.00 0.00 32.23 31.64 1pis h LYS 116 CO 0.00 0.02 -0.69 1.21 -2.27 0.00 0.00 179.45 177.72 1pis s ASN 117 N -5.63 1.86 0.70 4.20 2.47 -1.26 -3.38 114.94 113.91 1pis s ASN 117 Ca -0.00 -1.21 -0.08 0.00 0.42 0.00 0.00 52.86 51.99 1pis s ASN 117 Cb 0.10 0.34 0.05 0.00 -1.45 0.00 0.00 41.25 40.29 1pis s ASN 117 CO 0.52 -0.35 1.03 -0.22 -3.72 0.00 0.00 177.10 174.37 1pis s LEU 118 N 1.92 2.84 0.00 3.21 2.96 -1.15 -5.04 118.68 123.42 1pis s LEU 118 Ca 0.12 0.64 0.24 0.00 -0.22 0.00 0.00 54.13 54.91 1pis s LEU 118 Cb -0.15 -3.31 0.31 0.00 0.50 0.00 0.00 46.19 43.54 1pis s LEU 118 CO -0.21 -1.53 1.28 0.47 -1.32 0.00 0.00 176.35 175.04 1pis n ASP 119 N -2.94 1.05 -2.13 3.68 8.00 -1.26 -5.02 116.55 117.92 1pis n ASP 119 Ca 0.07 -0.84 -0.03 0.00 0.71 0.00 0.00 54.79 54.71 1pis n ASP 119 Cb 0.60 0.43 -0.04 0.00 -0.02 0.00 0.00 41.12 42.09 1pis n ASP 119 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 1pis n THR 120 N -0.99 1.03 -0.31 -3.53 5.66 -1.26 -3.49 114.28 111.40 1pis n THR 120 Ca 0.08 -0.45 0.12 0.00 -3.05 0.00 0.00 64.05 60.74 1pis n THR 120 Cb 0.36 -1.52 0.29 0.00 -1.55 0.00 0.00 70.33 67.91 1pis n THR 120 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 175.07 172.52 1pis h LYS 121 N 4.14 0.47 0.20 1.09 3.64 -1.95 -3.39 116.57 120.77 1pis h LYS 121 Ca 0.05 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1pis h LYS 121 Cb 0.52 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1pis h LYS 121 CO 0.26 0.31 -0.10 0.87 -2.27 0.00 0.00 179.45 178.52 1pis h LYS 122 N 0.49 -0.26 -0.50 1.90 1.57 -2.02 -3.42 116.57 114.33 1pis h LYS 122 Ca 0.53 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.33 1pis h LYS 122 Cb 0.94 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.31 1pis h LYS 122 CO -0.47 -0.17 0.00 0.66 -0.57 0.00 0.00 179.45 178.89 1pis n TYR 123 N -3.53 0.66 -0.86 -1.35 4.01 -1.26 -5.14 117.16 109.69 1pis n TYR 123 Ca -0.03 -0.33 0.00 0.00 -0.16 0.00 0.00 57.90 57.38 1pis n TYR 123 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 1pis n TYR 123 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40