#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 0.07 0.00 7.94 -1.26 -4.79 117.00 118.96 1pis n LEU 2 Ca 0.00 0.00 0.08 0.00 -1.11 0.00 0.00 56.01 54.98 1pis n LEU 2 Cb 0.00 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 1pis n LEU 2 CO 0.00 0.00 -0.17 -2.67 -1.11 0.00 0.00 177.39 173.44 1pis n TRP 3 N -0.05 0.87 0.26 1.96 4.27 -1.26 -3.70 117.44 119.79 1pis n TRP 3 Ca 0.00 0.26 0.13 0.00 -3.89 0.00 0.00 57.50 54.00 1pis n TRP 3 Cb 0.00 -0.96 0.73 0.00 -1.36 0.00 0.00 31.31 29.72 1pis n TRP 3 CO 0.00 0.00 0.00 0.37 -2.29 0.00 0.00 177.69 175.77 1pis h GLN 4 N 0.00 0.00 -0.99 -2.67 5.75 -1.85 -1.84 115.11 113.52 1pis h GLN 4 Ca -0.06 0.00 0.03 0.00 -0.15 0.00 0.00 58.65 58.47 1pis h GLN 4 Cb 1.19 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 29.69 1pis h GLN 4 CO 0.01 0.11 0.65 0.35 -2.65 0.00 0.00 178.83 177.30 1pis h PHE 5 N 0.00 1.22 -0.56 3.99 3.57 -1.87 0.18 116.94 123.46 1pis h PHE 5 Ca -0.00 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.42 1pis h PHE 5 Cb 0.31 -0.41 -0.02 0.00 2.79 0.00 0.00 35.95 38.62 1pis h PHE 5 CO 0.00 0.72 -0.07 0.00 -2.23 0.00 0.00 178.31 176.73 1pis h ARG 6 N 1.27 1.03 -0.92 1.11 -0.00 -1.51 -1.50 114.38 113.86 1pis h ARG 6 Ca 0.39 -0.36 0.15 0.00 -0.50 0.00 0.00 59.98 59.65 1pis h ARG 6 Cb -0.03 -0.08 -0.09 0.00 0.00 0.00 0.00 29.97 29.77 1pis h ARG 6 CO -0.11 1.05 0.53 1.03 0.00 0.00 0.00 179.97 182.47 1pis h SER 7 N 0.93 0.70 0.98 7.04 0.87 -1.50 -3.31 113.55 119.26 1pis h SER 7 Ca 0.15 0.08 -0.05 0.00 -1.23 0.00 0.00 61.79 60.74 1pis h SER 7 Cb 0.63 -0.05 0.01 0.00 -0.44 0.00 0.00 62.40 62.55 1pis h SER 7 CO 0.04 0.32 -0.47 -0.03 -0.53 0.00 0.00 176.83 176.16 1pis h MET 8 N 0.76 -1.27 0.00 2.24 -1.53 -0.35 -3.31 114.93 111.48 1pis h MET 8 Ca 0.49 0.09 0.00 0.00 -3.44 0.00 0.00 59.70 56.84 1pis h MET 8 Cb 0.65 0.29 0.00 0.00 -0.55 0.00 0.00 31.60 31.98 1pis h MET 8 CO -0.33 -0.85 0.00 0.82 0.14 0.00 0.00 176.91 176.69 1pis h ILE 9 N -1.34 0.00 0.65 1.77 2.04 -1.38 -2.68 117.51 116.57 1pis h ILE 9 Ca -0.13 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1pis h ILE 9 Cb 1.01 0.99 0.01 0.00 -0.74 0.00 0.00 36.82 38.08 1pis h ILE 9 CO 0.22 0.00 -0.31 0.11 0.00 0.00 0.00 178.15 178.17 1pis h LYS 10 N 0.00 -0.84 -0.73 2.37 1.79 -1.65 -2.66 116.57 114.85 1pis h LYS 10 Ca 0.00 0.06 0.12 0.00 -2.18 0.00 0.00 60.65 58.64 1pis h LYS 10 Cb 0.33 0.19 -0.12 0.00 -1.58 0.00 0.00 32.23 31.06 1pis h LYS 10 CO 0.00 -0.52 -0.28 0.00 -1.08 0.00 0.00 179.45 177.57 1pis n ALA 12 N -3.62 3.35 -3.88 0.00 0.00 -1.17 -4.73 120.51 110.46 1pis n ALA 12 Ca 0.08 -0.35 -0.29 0.00 0.00 0.00 0.00 53.44 52.88 1pis n ALA 12 Cb 0.30 -1.15 -0.12 0.00 0.00 0.00 0.00 19.45 18.49 1pis n ALA 12 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1pis s ILE 13 N -2.86 3.00 -0.64 0.00 1.01 -1.00 -4.48 121.20 116.22 1pis s ILE 13 Ca 0.15 -4.04 -0.26 0.00 0.00 0.00 0.00 60.65 56.50 1pis s ILE 13 Cb 0.18 -2.97 -0.10 0.00 0.01 0.00 0.00 42.46 39.58 1pis s ILE 13 CO 0.64 -0.97 2.37 -2.84 0.00 0.00 0.00 174.94 174.14 1pis s PRO 14 N -1.20 1.92 0.00 2.79 0.02 -1.26 -4.11 135.00 133.15 1pis s PRO 14 Ca 0.23 0.92 0.00 0.00 0.02 0.00 0.00 61.00 62.18 1pis s PRO 14 Cb -0.09 -4.68 0.00 0.00 0.02 0.00 0.00 34.50 29.75 1pis s PRO 14 CO -0.13 -3.77 0.00 0.41 -0.33 0.00 0.00 177.00 173.19 1pis n GLY 15 N 6.37 2.28 3.76 0.52 0.00 -1.26 -5.10 105.19 111.75 1pis n GLY 15 Ca 0.40 -0.73 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 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 -4.00 5.74 -0.23 1.61 0.01 -1.26 -5.02 113.70 110.55 1pis s SER 16 Ca 0.00 2.71 -0.19 0.00 1.31 0.00 0.00 55.95 59.78 1pis s SER 16 Cb 0.00 -2.64 -0.03 0.00 0.21 0.00 0.00 66.02 63.57 1pis s SER 16 CO 0.00 -1.24 0.57 -1.00 0.41 0.00 0.00 173.24 171.98 1pis s HIS 17 N -1.31 3.32 0.13 2.43 3.76 -1.26 -4.84 115.29 117.52 1pis s HIS 17 Ca 0.65 0.78 0.00 0.00 -0.15 0.00 0.00 55.06 56.34 1pis s HIS 17 Cb -0.39 -2.76 0.00 0.00 1.11 0.00 0.00 32.58 30.54 1pis s HIS 17 CO 0.48 -0.22 0.00 -2.30 -0.85 0.00 0.00 174.74 171.85 1pis n PRO 18 N 5.29 1.13 0.00 8.40 -0.02 -1.26 -4.16 135.00 144.38 1pis n PRO 18 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 1pis n PRO 18 Cb 0.50 -0.27 0.00 0.00 -0.02 0.00 0.00 33.50 33.71 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 0.03 2.45 7.99 -1.26 -1.27 117.00 124.93 1pis n LEU 19 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 56.01 55.88 1pis n LEU 19 Cb 0.00 0.00 -0.07 0.00 -0.11 0.00 0.00 43.42 43.24 1pis n LEU 19 CO 0.00 0.00 0.88 0.24 -1.51 0.00 0.00 177.39 177.00 1pis h MET 20 N 0.00 0.04 0.11 3.23 2.86 -2.01 -1.68 114.93 117.49 1pis h MET 20 Ca 0.00 -0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.32 1pis h MET 20 Cb 0.00 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 1pis h MET 20 CO 0.00 0.04 -1.65 0.38 1.06 0.00 0.00 176.91 176.74 1pis h ASP 21 N 0.03 0.38 0.13 1.22 3.04 -1.77 -3.44 116.42 116.01 1pis h ASP 21 Ca 0.01 -0.86 -0.02 0.00 -3.24 0.00 0.00 57.03 52.93 1pis h ASP 21 Cb 0.01 -0.12 -0.00 0.00 -1.04 0.00 0.00 39.33 38.17 1pis h ASP 21 CO -0.00 1.71 -0.09 -0.26 -2.04 0.00 0.00 179.24 178.56 1pis h PHE 22 N -0.21 0.00 0.08 4.15 0.04 -1.17 -3.29 116.94 116.55 1pis h PHE 22 Ca -0.36 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.23 1pis h PHE 22 Cb 1.85 0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.00 1pis h PHE 22 CO 0.10 0.09 -0.88 -0.97 -0.60 0.00 0.00 178.31 176.06 1pis h ASN 23 N 0.00 0.28 0.10 2.17 -1.24 -1.56 -3.37 115.58 111.96 1pis h ASN 23 Ca -0.00 -0.88 0.00 0.00 0.71 0.00 0.00 56.30 56.13 1pis h ASN 23 Cb 0.18 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.14 1pis h ASN 23 CO 0.01 1.39 0.00 0.59 -1.29 0.00 0.00 177.43 178.13 1pis n ASN 24 N -4.21 0.00 0.00 1.15 3.02 -1.25 -4.81 115.26 109.17 1pis n ASN 24 Ca -0.19 -0.54 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 1pis n ASN 24 Cb 0.75 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.85 1pis n ASN 24 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pis n TYR 25 N -1.07 0.00 0.00 3.10 0.18 -1.24 -3.94 117.16 114.18 1pis n TYR 25 Ca 0.15 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.93 1pis n TYR 25 Cb 0.10 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.06 1pis n TYR 25 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1pis n GLY 26 N 5.00 -3.41 0.13 -7.48 0.00 -1.17 -3.56 105.19 94.70 1pis n GLY 26 Ca 0.00 -1.13 -0.10 0.00 0.00 0.00 0.00 46.02 44.80 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 -4.91 3.60 -3.16 0.00 4.11 -1.26 -4.97 117.16 110.56 1pis n TYR 28 Ca -0.07 -3.40 -0.45 0.00 -0.00 0.00 0.00 57.90 53.98 1pis n TYR 28 Cb 0.25 -0.59 -0.04 0.00 -0.00 0.00 0.00 39.34 38.97 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 4.96 1.34 3.55 0.00 0.00 -1.26 -5.10 105.19 108.68 1pis n GLY 30 Ca 0.02 -1.15 -0.39 0.00 0.00 0.00 0.00 46.02 44.50 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 3.25 0.00 0.99 1.43 -1.26 -4.40 118.68 118.69 1pis s LEU 31 Ca 0.00 -0.38 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 1pis s LEU 31 Cb 0.00 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.67 1pis s LEU 31 CO 0.00 -2.05 0.00 0.61 0.23 0.00 0.00 176.35 175.14 1pis n GLY 32 N 5.86 1.47 3.69 -3.19 0.00 -1.26 -5.03 105.19 106.73 1pis n GLY 32 Ca 0.17 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 1.14 3.56 -0.02 0.00 -1.26 -4.88 105.19 103.73 1pis n GLY 33 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1pis n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pis s SER 34 N -2.85 4.25 0.00 1.61 1.04 -1.26 -4.75 113.70 111.74 1pis s SER 34 Ca 0.00 0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.64 1pis s SER 34 Cb 0.00 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.58 1pis s SER 34 CO 0.00 -3.42 0.00 0.61 0.98 0.00 0.00 173.24 171.41 1pis n GLY 35 N 6.57 0.88 0.00 7.32 0.00 -1.26 -5.17 105.19 113.53 1pis n GLY 35 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.44 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 2.80 0.00 1.09 -0.02 -1.26 -4.56 135.00 133.05 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 -3.93 -1.45 0.24 -1.25 -4.39 118.33 107.55 1pis n VAL 38 Ca 0.00 0.00 -0.26 0.00 -2.04 0.00 0.00 64.34 62.04 1pis n VAL 38 Cb 0.00 -0.19 -0.03 0.00 -1.47 0.00 0.00 33.84 32.15 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 0.13 6.34 0.00 -1.34 2.15 -1.26 -5.05 116.67 117.64 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 0.05 0.28 -1.84 -0.17 0.00 0.00 175.17 173.49 1pis n GLU 40 N -0.54 0.00 0.09 4.34 0.00 -1.26 -2.40 120.64 120.87 1pis n GLU 40 Ca -0.07 0.00 0.13 0.00 0.00 0.00 0.00 57.16 57.22 1pis n GLU 40 Cb 0.54 -1.30 0.30 0.00 0.00 0.00 0.00 31.44 30.98 1pis n GLU 40 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 1pis n LEU 41 N -0.77 0.79 0.18 -1.84 7.94 -1.26 -1.16 117.00 120.89 1pis n LEU 41 Ca 0.00 0.44 0.02 0.00 -1.11 0.00 0.00 56.01 55.36 1pis n LEU 41 Cb 0.00 -0.26 0.35 0.00 0.53 0.00 0.00 43.42 44.05 1pis n LEU 41 CO 0.00 -0.13 0.71 -0.78 -1.11 0.00 0.00 177.39 176.08 1pis h ASP 42 N 0.00 0.00 0.15 1.96 1.82 -1.86 -3.30 116.42 115.18 1pis h ASP 42 Ca 0.00 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.62 1pis h ASP 42 Cb 0.75 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.76 1pis h ASP 42 CO 0.00 0.38 -0.10 -0.09 -1.61 0.00 0.00 179.24 177.82 1pis h ARG 43 N 0.00 0.00 -0.00 0.28 1.12 -1.29 -0.31 114.38 114.17 1pis h ARG 43 Ca -0.00 0.00 -0.15 0.00 -1.11 0.00 0.00 59.98 58.72 1pis h ARG 43 Cb 0.69 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 30.63 1pis h ARG 43 CO 0.05 0.10 -0.68 0.00 -3.11 0.00 0.00 179.97 176.33 1pis h GLU 46 N 0.68 -0.06 0.19 0.00 4.57 -0.98 -1.48 114.58 117.50 1pis h GLU 46 Ca 0.14 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.31 1pis h GLU 46 Cb 0.40 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1pis h GLU 46 CO 0.01 -0.04 -0.09 1.15 -1.18 0.00 0.00 179.01 178.86 1pis h THR 47 N -0.06 0.91 -0.53 0.32 2.02 -1.56 -2.68 112.91 111.32 1pis h THR 47 Ca 0.24 -0.68 -0.04 0.00 0.77 0.00 0.00 66.41 66.71 1pis h THR 47 Cb 0.43 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 68.11 1pis h THR 47 CO -0.56 0.15 0.16 -0.74 0.37 0.00 0.00 175.52 174.90 1pis h HIS 48 N -0.61 0.80 -0.25 3.16 -0.00 -1.55 -1.38 115.15 115.33 1pis h HIS 48 Ca -0.03 -0.06 -0.13 0.00 -0.00 0.00 0.00 60.37 60.15 1pis h HIS 48 Cb 0.44 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.60 1pis h HIS 48 CO 0.03 0.65 -0.39 0.38 -0.00 0.00 0.00 177.93 178.61 1pis h ASP 49 N 0.77 0.61 1.66 3.26 3.04 -1.36 -1.64 116.42 122.77 1pis h ASP 49 Ca 0.18 -0.27 -0.07 0.00 -3.24 0.00 0.00 57.03 53.63 1pis h ASP 49 Cb 0.23 -0.17 -0.01 0.00 -1.04 0.00 0.00 39.33 38.34 1pis h ASP 49 CO -0.01 0.94 -0.32 -1.13 -2.04 0.00 0.00 179.24 176.68 1pis h ASN 50 N 0.48 0.00 -0.35 4.15 -1.24 -1.43 -0.81 115.58 116.38 1pis h ASN 50 Ca 0.04 0.00 -0.17 0.00 0.71 0.00 0.00 56.30 56.89 1pis h ASN 50 Cb 0.89 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.94 1pis h ASN 50 CO 0.08 0.32 -0.43 0.00 -1.29 0.00 0.00 177.43 176.11 1pis h TYR 52 N 0.73 0.74 -0.28 0.00 -1.99 -1.28 -1.14 116.97 113.75 1pis h TYR 52 Ca 0.05 -0.02 0.06 0.00 2.00 0.00 0.00 58.73 60.81 1pis h TYR 52 Cb 1.03 -0.23 -0.05 0.00 2.00 0.00 0.00 36.73 39.47 1pis h TYR 52 CO 0.06 0.55 -0.06 0.00 -0.00 0.00 0.00 178.16 178.72 1pis h ARG 53 N 0.75 0.01 0.00 4.88 2.47 -1.20 -2.31 114.38 118.97 1pis h ARG 53 Ca 0.18 -0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.89 1pis h ARG 53 Cb 0.10 -0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.42 1pis h ARG 53 CO -0.02 0.01 -0.06 0.22 0.56 0.00 0.00 179.97 180.67 1pis h ASP 54 N 0.01 0.00 0.05 7.04 3.58 -1.35 -2.98 116.42 122.77 1pis h ASP 54 Ca 0.13 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.37 1pis h ASP 54 Cb 0.20 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.26 1pis h ASP 54 CO -0.28 0.06 -0.81 0.00 -2.88 0.00 0.00 179.24 175.33 1pis h ALA 55 N 1.94 0.39 -0.85 -0.78 0.00 -1.01 -3.15 119.26 115.79 1pis h ALA 55 Ca -0.00 -0.62 -0.03 0.00 0.00 0.00 0.00 54.91 54.25 1pis h ALA 55 Cb 0.56 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1pis h ALA 55 CO 0.01 0.72 0.41 1.57 0.00 0.00 0.00 179.25 181.96 1pis h LYS 56 N 0.41 1.23 0.00 0.00 2.10 -1.44 -3.25 116.57 115.62 1pis h LYS 56 Ca -0.06 -0.18 0.00 0.00 -2.00 0.00 0.00 60.65 58.41 1pis h LYS 56 Cb 1.43 -0.22 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1pis h LYS 56 CO 0.15 0.95 0.00 -1.71 -2.00 0.00 0.00 179.45 176.84 1pis n ASN 57 N -4.30 0.00 -4.60 7.07 5.15 -1.13 -4.65 115.26 112.80 1pis n ASN 57 Ca 0.08 -0.70 -0.42 0.00 -0.60 0.00 0.00 54.58 52.94 1pis n ASN 57 Cb 0.14 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.35 1pis n ASN 57 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1pis s LEU 58 N -1.74 4.08 0.44 1.20 2.96 -1.19 -4.97 118.68 119.46 1pis s LEU 58 Ca 0.20 0.55 0.15 0.00 -0.22 0.00 0.00 54.13 54.81 1pis s LEU 58 Cb 0.09 -3.10 1.05 0.00 0.50 0.00 0.00 46.19 44.73 1pis s LEU 58 CO 0.15 -0.70 1.98 -2.24 -1.32 0.00 0.00 176.35 174.22 1pis h ASP 59 N 8.30 0.35 0.71 3.68 2.03 -1.94 -3.21 116.42 126.34 1pis h ASP 59 Ca -0.24 0.01 -0.03 0.00 -0.73 0.00 0.00 57.03 56.04 1pis h ASP 59 Cb 1.09 -0.06 -0.01 0.00 -0.83 0.00 0.00 39.33 39.52 1pis h ASP 59 CO 0.91 0.21 -0.48 0.28 -1.03 0.00 0.00 179.24 179.13 1pis h SER 60 N 0.38 -1.23 -3.74 4.15 0.02 -1.95 -3.35 113.55 107.84 1pis h SER 60 Ca 0.28 0.07 -0.66 0.00 -0.84 0.00 0.00 61.79 60.65 1pis h SER 60 Cb 0.59 0.37 -0.39 0.00 0.14 0.00 0.00 62.40 63.11 1pis h SER 60 CO -0.08 -0.71 -0.76 0.00 -1.14 0.00 0.00 176.83 174.14 1pis s LYS 62 N 1.06 4.03 0.00 0.00 2.47 -1.21 -4.82 119.74 121.26 1pis s LYS 62 Ca 0.01 0.54 0.00 0.00 -1.56 0.00 0.00 55.97 54.96 1pis s LYS 62 Cb -0.19 -3.23 0.00 0.00 -1.46 0.00 0.00 37.83 32.95 1pis s LYS 62 CO -0.07 0.67 1.62 1.19 0.16 0.00 0.00 175.35 178.92 1pis n PHE 63 N 1.79 0.00 0.34 4.03 3.01 -1.26 -1.80 117.46 123.57 1pis n PHE 63 Ca -0.13 -0.81 0.14 0.00 1.01 0.00 0.00 57.45 57.67 1pis n PHE 63 Cb 0.52 -0.42 0.59 0.00 -0.01 0.00 0.00 39.48 40.15 1pis n PHE 63 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1pis h LEU 64 N 2.63 0.00 -0.14 4.37 4.07 -1.96 -3.39 115.31 120.89 1pis h LEU 64 Ca 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.93 1pis h LEU 64 Cb 0.91 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.65 1pis h LEU 64 CO 0.00 0.00 -0.04 -0.37 -1.08 0.00 0.00 178.44 176.95 1pis h VAL 65 N 0.00 1.30 -5.00 1.22 -1.51 -1.68 -3.50 116.25 107.07 1pis h VAL 65 Ca 0.00 -1.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.47 1pis h VAL 65 Cb 0.42 1.68 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 1pis h VAL 65 CO 0.00 0.29 -0.39 -0.67 -1.23 0.00 0.00 177.57 175.57 1pis n ASP 66 N -4.71 -7.20 -3.33 4.19 2.03 -1.26 -5.07 116.55 101.20 1pis n ASP 66 Ca -0.06 0.41 -0.26 0.00 0.52 0.00 0.00 54.79 55.40 1pis n ASP 66 Cb 0.26 -4.85 -0.09 0.00 -0.72 0.00 0.00 41.12 35.72 1pis n ASP 66 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1pis n ASN 67 N -0.48 -0.19 0.00 1.67 6.94 -1.26 -5.12 115.26 116.82 1pis n ASN 67 Ca 0.09 -2.50 0.00 0.00 -0.02 0.00 0.00 54.58 52.16 1pis n ASN 67 Cb 0.41 -0.58 0.00 0.00 -2.36 0.00 0.00 39.78 37.25 1pis n ASN 67 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 1pis n PRO 68 N 2.33 0.00 -0.06 -0.53 -0.04 -1.26 -4.97 135.00 130.48 1pis n PRO 68 Ca 0.27 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.61 1pis n PRO 68 Cb 0.49 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.92 1pis n PRO 68 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1pis n TYR 69 N 0.00 0.00 -0.01 0.54 4.01 -1.26 -4.83 117.16 115.61 1pis n TYR 69 Ca 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1pis n TYR 69 Cb 0.00 -0.43 -0.00 0.00 -0.31 0.00 0.00 39.34 38.60 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 -0.55 0.00 -2.71 -0.72 1.03 -1.94 -3.43 112.91 104.60 1pis h THR 70 Ca -0.22 -0.23 -0.80 0.00 -0.01 0.00 0.00 66.41 65.14 1pis h THR 70 Cb 1.00 0.00 -0.26 0.00 -1.07 0.00 0.00 68.15 67.82 1pis h THR 70 CO -0.14 0.00 0.96 -0.62 -0.01 0.00 0.00 175.52 175.72 1pis n GLU 71 N -2.71 4.33 0.08 0.00 1.02 -1.26 -4.28 120.64 117.82 1pis n GLU 71 Ca -0.01 -4.40 0.00 0.00 -0.02 0.00 0.00 57.16 52.73 1pis n GLU 71 Cb 0.02 -2.57 0.00 0.00 -0.02 0.00 0.00 31.44 28.87 1pis n GLU 71 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1pis n SER 72 N 1.75 -1.39 -4.20 1.62 7.64 -1.26 -4.87 113.62 112.90 1pis n SER 72 Ca 0.28 0.30 -0.25 0.00 1.01 0.00 0.00 58.87 60.21 1pis n SER 72 Cb 0.34 1.61 -0.09 0.00 -1.01 0.00 0.00 64.21 65.06 1pis n SER 72 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1pis s TYR 73 N -2.00 1.81 0.12 1.43 -0.85 -1.26 -5.07 117.35 111.53 1pis s TYR 73 Ca 0.00 -1.21 -0.00 0.00 -0.52 0.00 0.00 57.07 55.34 1pis s TYR 73 Cb 0.00 -1.19 0.00 0.00 0.38 0.00 0.00 41.96 41.15 1pis s TYR 73 CO 0.00 -0.23 0.16 0.45 -1.52 0.00 0.00 175.55 174.41 1pis n SER 74 N -1.18 -0.44 -2.72 -0.18 2.88 -1.26 -4.97 113.62 105.75 1pis n SER 74 Ca -0.06 -1.68 -0.14 0.00 -1.33 0.00 0.00 58.87 55.65 1pis n SER 74 Cb 0.65 0.84 -0.05 0.00 -0.75 0.00 0.00 64.21 64.90 1pis n SER 74 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pis n TYR 75 N -0.21 -0.79 -4.52 0.66 4.11 -1.26 -1.92 117.16 113.24 1pis n TYR 75 Ca 0.01 -2.13 -0.25 0.00 -0.00 0.00 0.00 57.90 55.54 1pis n TYR 75 Cb 0.21 0.28 -0.11 0.00 -0.00 0.00 0.00 39.34 39.73 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 -2.81 3.34 -0.21 9.48 0.01 -1.20 -4.63 113.70 117.68 1pis s SER 76 Ca 0.29 -1.25 -0.15 0.00 1.31 0.00 0.00 55.95 56.16 1pis s SER 76 Cb 0.01 -0.28 0.06 0.00 0.21 0.00 0.00 66.02 66.02 1pis s SER 76 CO 0.21 -0.34 0.52 0.00 0.41 0.00 0.00 173.24 174.04 1pis n SER 78 N 3.62 0.00 0.00 0.00 7.64 -0.91 -4.94 113.62 119.04 1pis n SER 78 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.70 1pis n SER 78 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 1pis n SER 78 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1pis n ASN 79 N 0.00 0.00 0.10 6.43 2.85 -1.26 -4.26 115.26 119.12 1pis n ASN 79 Ca 0.00 0.00 -0.20 0.00 -0.11 0.00 0.00 54.58 54.27 1pis n ASN 79 Cb 0.00 0.00 -0.15 0.00 1.24 0.00 0.00 39.78 40.87 1pis n ASN 79 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 1pis h THR 80 N 0.00 1.25 -1.86 -0.44 1.35 -1.88 -3.45 112.91 107.87 1pis h THR 80 Ca 0.00 -2.79 0.00 0.00 -0.55 0.00 0.00 66.41 63.07 1pis h THR 80 Cb 0.00 2.90 0.00 0.00 -1.73 0.00 0.00 68.15 69.32 1pis h THR 80 CO 0.00 0.84 0.00 1.21 -0.25 0.00 0.00 175.52 177.32 1pis n GLU 81 N -3.58 -0.05 -3.55 4.72 4.07 -1.26 -4.21 120.64 116.78 1pis n GLU 81 Ca -0.16 -0.03 -0.36 0.00 -0.06 0.00 0.00 57.16 56.55 1pis n GLU 81 Cb 1.07 0.05 -0.06 0.00 -0.06 0.00 0.00 31.44 32.43 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 -0.84 5.07 0.00 6.31 1.01 -1.26 -2.14 121.20 129.35 1pis s ILE 82 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 60.65 61.28 1pis s ILE 82 Cb 0.00 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.80 1pis s ILE 82 CO 0.00 0.43 0.00 1.07 0.00 0.00 0.00 174.94 176.44 1pis n THR 83 N 1.36 0.00 -3.85 2.92 5.66 -1.23 -4.90 114.28 114.24 1pis n THR 83 Ca -0.11 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.83 1pis n THR 83 Cb 0.52 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 69.32 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 -3.25 6.51 0.49 0.00 3.84 -0.81 -3.26 114.94 118.46 1pis s ASN 85 Ca 0.19 2.60 0.28 0.00 0.21 0.00 0.00 52.86 56.14 1pis s ASN 85 Cb -0.04 -2.55 1.02 0.00 -0.55 0.00 0.00 41.25 39.14 1pis s ASN 85 CO 0.08 -0.97 1.86 -1.28 -2.79 0.00 0.00 177.10 173.99 1pis h SER 86 N 9.16 0.00 -0.07 -4.21 0.87 -1.93 0.16 113.55 117.53 1pis h SER 86 Ca -0.45 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.13 1pis h SER 86 Cb 1.21 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.17 1pis h SER 86 CO 0.94 0.09 0.60 0.07 -0.53 0.00 0.00 176.83 178.01 1pis h LYS 87 N 0.00 0.00 0.00 2.24 2.10 -2.04 -3.48 116.57 115.39 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 0.69 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.02 1pis h LYS 87 CO 0.01 0.00 0.00 -1.71 -2.00 0.00 0.00 179.45 175.75 1pis n ASN 88 N -2.82 0.00 0.00 7.07 5.15 0.56 -5.03 115.26 120.19 1pis n ASN 88 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1pis n ASN 88 Cb 0.65 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.90 1pis n ASN 88 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1pis n ASN 89 N 0.01 0.00 -0.09 1.20 2.85 -1.26 -4.86 115.26 113.11 1pis n ASN 89 Ca 0.00 0.00 -0.10 0.00 -0.11 0.00 0.00 54.58 54.37 1pis n ASN 89 Cb 0.00 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 40.98 1pis n ASN 89 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pis n ALA 90 N -3.00 0.78 -0.04 5.20 0.00 -1.26 -4.35 120.51 117.83 1pis n ALA 90 Ca 0.00 -0.71 -0.08 0.00 0.00 0.00 0.00 53.44 52.64 1pis n ALA 90 Cb 0.00 0.01 -0.07 0.00 0.00 0.00 0.00 19.45 19.39 1pis n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pis h GLU 92 N -0.98 0.08 -0.17 0.00 4.57 -1.93 -3.05 114.58 113.10 1pis h GLU 92 Ca -0.00 -0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 1pis h GLU 92 Cb 0.56 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.13 1pis h GLU 92 CO 0.01 0.05 0.05 0.00 -1.18 0.00 0.00 179.01 177.93 1pis h ALA 93 N 1.87 0.23 0.22 2.92 0.00 -1.76 -3.26 119.26 119.48 1pis h ALA 93 Ca 0.55 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.33 1pis h ALA 93 Cb 1.12 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1pis h ALA 93 CO -0.79 -0.14 -0.31 0.35 0.00 0.00 0.00 179.25 178.36 1pis h PHE 94 N 0.09 -0.83 -0.54 0.00 3.04 -1.29 -0.44 116.94 116.97 1pis h PHE 94 Ca 0.05 0.01 -0.12 0.00 3.98 0.00 0.00 57.97 61.90 1pis h PHE 94 Cb 0.25 0.34 -0.02 0.00 2.56 0.00 0.00 35.95 39.08 1pis h PHE 94 CO 0.01 -0.43 -0.13 0.82 -2.02 0.00 0.00 178.31 176.56 1pis h ILE 95 N -0.59 1.27 0.00 1.41 1.08 -1.72 -2.17 117.51 116.79 1pis h ILE 95 Ca 0.01 -1.29 -0.02 0.00 -0.39 0.00 0.00 64.86 63.16 1pis h ILE 95 Cb 0.57 0.99 -0.00 0.00 -3.07 0.00 0.00 36.82 35.31 1pis h ILE 95 CO -0.12 0.46 -0.09 0.00 -0.69 0.00 0.00 178.15 177.71 1pis h ASN 97 N 0.00 0.00 0.00 0.00 2.35 -0.45 -0.66 115.58 116.82 1pis h ASN 97 Ca -0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1pis h ASN 97 Cb 0.39 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.75 1pis h ASN 97 CO 0.01 0.00 -0.42 0.00 -1.65 0.00 0.00 177.43 175.37 1pis h ASP 99 N -1.00 0.00 0.60 0.00 1.82 -1.66 -1.93 116.42 114.25 1pis h ASP 99 Ca -0.05 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.56 1pis h ASP 99 Cb 0.51 0.00 0.01 0.00 0.68 0.00 0.00 39.33 40.53 1pis h ASP 99 CO -0.03 0.00 -0.29 0.08 -1.61 0.00 0.00 179.24 177.39 1pis h ARG 100 N 0.00 -0.78 -0.48 0.28 0.11 -1.25 -2.40 114.38 109.86 1pis h ARG 100 Ca 0.49 0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.63 1pis h ARG 100 Cb 2.19 0.18 0.00 0.00 1.11 0.00 0.00 29.97 33.44 1pis h ARG 100 CO -0.01 -0.52 0.00 -1.71 0.10 0.00 0.00 179.97 177.84 1pis n ASN 101 N -4.51 0.48 -0.05 0.08 2.85 -0.96 -0.95 115.26 112.21 1pis n ASN 101 Ca -0.10 -1.17 -0.03 0.00 -0.11 0.00 0.00 54.58 53.17 1pis n ASN 101 Cb 0.32 -0.24 -0.01 0.00 1.24 0.00 0.00 39.78 41.08 1pis n ASN 101 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pis n ALA 102 N 0.09 0.32 0.18 5.20 0.00 -0.77 -4.19 120.51 121.34 1pis n ALA 102 Ca 0.00 -0.36 -0.14 0.00 0.00 0.00 0.00 53.44 52.94 1pis n ALA 102 Cb 0.12 0.01 -0.08 0.00 0.00 0.00 0.00 19.45 19.50 1pis n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pis h ALA 103 N -1.39 -0.42 -0.51 0.00 0.00 -0.51 -1.96 119.26 114.48 1pis h ALA 103 Ca 0.00 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 54.88 1pis h ALA 103 Cb 0.36 0.16 -0.09 0.00 0.00 0.00 0.00 17.79 18.23 1pis h ALA 103 CO 0.00 -0.67 -0.05 0.82 0.00 0.00 0.00 179.25 179.34 1pis h ILE 104 N -0.55 0.55 0.00 0.00 2.04 -1.36 -3.29 117.51 114.90 1pis h ILE 104 Ca -0.04 -0.02 -0.09 0.00 1.00 0.00 0.00 64.86 65.71 1pis h ILE 104 Cb 0.41 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1pis h ILE 104 CO 0.07 0.01 -0.42 0.00 0.00 0.00 0.00 178.15 177.81 1pis h PHE 106 N 0.00 0.00 0.00 0.00 0.04 -1.43 0.28 116.94 115.83 1pis h PHE 106 Ca -0.00 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.59 1pis h PHE 106 Cb 0.79 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.91 1pis h PHE 106 CO 0.00 0.01 -1.49 0.45 -0.60 0.00 0.00 178.31 176.68 1pis n SER 107 N -3.28 0.80 0.09 2.17 2.88 -0.82 -4.59 113.62 110.87 1pis n SER 107 Ca -0.03 0.35 -0.11 0.00 -1.33 0.00 0.00 58.87 57.76 1pis n SER 107 Cb 0.11 0.24 -0.07 0.00 -0.75 0.00 0.00 64.21 63.74 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 -0.29 -7.26 -1.46 1.57 -0.30 -3.47 116.57 105.37 1pis h LYS 108 Ca -0.18 0.02 -0.52 0.00 -1.87 0.00 0.00 60.65 58.10 1pis h LYS 108 Cb 1.62 0.07 0.13 0.00 0.08 0.00 0.00 32.23 34.13 1pis h LYS 108 CO 0.05 0.08 0.33 0.00 -0.57 0.00 0.00 179.45 179.33 1pis s ALA 109 N -3.91 2.19 0.00 3.86 0.00 0.01 -5.07 121.76 118.84 1pis s ALA 109 Ca -0.12 0.47 0.00 0.00 0.00 0.00 0.00 51.96 52.31 1pis s ALA 109 Cb 0.01 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.79 1pis s ALA 109 CO 0.45 -1.77 0.00 -2.30 0.00 0.00 0.00 175.76 172.14 1pis n PRO 110 N -3.19 2.74 -3.70 0.00 -0.02 -1.26 -4.91 135.00 124.66 1pis n PRO 110 Ca 0.10 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.44 1pis n PRO 110 Cb 0.52 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.92 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 -0.32 -0.62 6.00 5.04 -1.26 -4.59 117.35 121.60 1pis s TYR 111 Ca 0.00 0.55 -0.21 0.00 -2.44 0.00 0.00 57.07 54.97 1pis s TYR 111 Cb 0.00 0.18 0.09 0.00 0.35 0.00 0.00 41.96 42.57 1pis s TYR 111 CO 0.00 -0.43 0.82 -0.80 -1.34 0.00 0.00 175.55 173.80 1pis s ASN 112 N -1.17 6.18 -0.02 4.32 0.01 -1.26 -4.89 114.94 118.12 1pis s ASN 112 Ca -0.12 -1.21 0.11 0.00 -0.71 0.00 0.00 52.86 50.93 1pis s ASN 112 Cb -0.04 -2.35 0.34 0.00 0.41 0.00 0.00 41.25 39.61 1pis s ASN 112 CO 0.05 -1.25 1.25 2.29 -1.51 0.00 0.00 177.10 177.93 1pis n LYS 113 N 6.94 2.03 0.10 -0.60 -0.00 -1.26 -4.08 118.16 121.29 1pis n LYS 113 Ca -0.07 -1.38 0.00 0.00 -0.00 0.00 0.00 58.31 56.86 1pis n LYS 113 Cb 0.44 -1.38 0.00 0.00 -0.00 0.00 0.00 35.03 34.09 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 0.55 0.00 0.00 -1.58 0.28 -1.26 -4.51 120.64 114.12 1pis n GLU 114 Ca 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.13 1pis n GLU 114 Cb 0.38 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.25 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 -2.98 0.00 0.31 -1.84 8.25 -1.26 -4.58 115.22 113.11 1pis n HIS 115 Ca 0.00 0.00 0.19 0.00 -0.26 0.00 0.00 57.72 57.65 1pis n HIS 115 Cb 0.00 -0.02 0.91 0.00 1.12 0.00 0.00 29.99 32.00 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 0.08 0.00 -2.17 -0.41 3.64 -1.79 -2.83 116.57 113.10 1pis h LYS 116 Ca 0.00 0.00 -0.40 0.00 -1.27 0.00 0.00 60.65 58.98 1pis h LYS 116 Cb 0.08 0.00 -0.34 0.00 -0.41 0.00 0.00 32.23 31.57 1pis h LYS 116 CO 0.00 0.00 -0.70 1.21 -2.27 0.00 0.00 179.45 177.69 1pis s ASN 117 N -5.24 1.76 0.74 4.20 2.47 -1.26 -3.81 114.94 113.80 1pis s ASN 117 Ca -0.02 -1.38 -0.12 0.00 0.42 0.00 0.00 52.86 51.77 1pis s ASN 117 Cb 0.11 0.34 0.04 0.00 -1.45 0.00 0.00 41.25 40.28 1pis s ASN 117 CO 0.45 -0.32 1.12 -0.22 -3.72 0.00 0.00 177.10 174.41 1pis s LEU 118 N 1.73 2.77 0.00 3.21 2.96 -1.07 -5.04 118.68 123.24 1pis s LEU 118 Ca 0.14 1.02 0.24 0.00 -0.22 0.00 0.00 54.13 55.31 1pis s LEU 118 Cb -0.16 -3.72 0.23 0.00 0.50 0.00 0.00 46.19 43.04 1pis s LEU 118 CO -0.15 -1.52 1.23 0.47 -1.32 0.00 0.00 176.35 175.06 1pis n ASP 119 N -3.11 1.16 -3.39 3.68 8.00 -1.26 -5.04 116.55 116.58 1pis n ASP 119 Ca 0.07 -0.93 -0.32 0.00 0.71 0.00 0.00 54.79 54.32 1pis n ASP 119 Cb 0.58 0.49 -0.05 0.00 -0.02 0.00 0.00 41.12 42.12 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 -0.92 1.55 0.10 -3.53 5.66 -1.26 -3.90 114.28 111.99 1pis n THR 120 Ca 0.08 -1.15 -0.03 0.00 -3.05 0.00 0.00 64.05 59.90 1pis n THR 120 Cb 0.37 -2.12 0.19 0.00 -1.55 0.00 0.00 70.33 67.22 1pis n THR 120 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 1pis h LYS 121 N 7.70 0.20 0.52 1.09 6.56 -1.98 -3.43 116.57 127.23 1pis h LYS 121 Ca 0.37 -0.11 -0.03 0.00 -1.06 0.00 0.00 60.65 59.82 1pis h LYS 121 Cb 0.44 0.01 0.01 0.00 -0.57 0.00 0.00 32.23 32.11 1pis h LYS 121 CO 1.70 0.66 -0.25 0.87 -2.06 0.00 0.00 179.45 180.37 1pis h LYS 122 N 0.16 -0.67 -0.44 3.15 1.57 -2.03 -3.40 116.57 114.90 1pis h LYS 122 Ca 0.01 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1pis h LYS 122 Cb 0.94 0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.41 1pis h LYS 122 CO 0.08 -0.45 0.00 0.66 -0.57 0.00 0.00 179.45 179.17 1pis n TYR 123 N -4.72 0.58 -0.95 -1.35 4.01 -1.26 -5.14 117.16 108.33 1pis n TYR 123 Ca -0.09 -0.29 0.00 0.00 -0.16 0.00 0.00 57.90 57.36 1pis n TYR 123 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.31 1pis n TYR 123 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40