#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pis s LEU 2 N 0.00 5.01 0.00 0.00 1.02 -1.26 -0.34 118.68 123.12 1pis s LEU 2 Ca 0.00 -1.60 0.00 0.00 0.02 0.00 0.00 54.13 52.55 1pis s LEU 2 Cb 0.00 -2.37 0.00 0.00 0.02 0.00 0.00 46.19 43.84 1pis s LEU 2 CO 0.00 -1.17 0.00 -2.67 0.02 0.00 0.00 176.35 172.53 1pis n TRP 3 N 6.73 0.00 0.20 0.29 4.27 -1.26 -4.87 117.44 122.80 1pis n TRP 3 Ca 0.07 0.00 0.05 0.00 -3.89 0.00 0.00 57.50 53.72 1pis n TRP 3 Cb 0.46 0.00 0.41 0.00 -1.36 0.00 0.00 31.31 30.82 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 -6.69 -2.67 5.75 -1.84 -3.38 115.11 106.28 1pis h GLN 4 Ca 0.00 0.00 -0.57 0.00 -0.15 0.00 0.00 58.65 57.93 1pis h GLN 4 Cb 0.00 0.00 0.17 0.00 1.07 0.00 0.00 27.48 28.72 1pis h GLN 4 CO 0.00 0.34 -0.15 0.34 -2.65 0.00 0.00 178.83 176.71 1pis n PHE 5 N -3.90 -0.02 0.00 3.99 7.35 -1.26 -0.93 117.46 122.70 1pis n PHE 5 Ca -0.02 0.42 0.00 0.00 -0.76 0.00 0.00 57.45 57.10 1pis n PHE 5 Cb 0.41 -2.03 0.00 0.00 0.35 0.00 0.00 39.48 38.21 1pis n PHE 5 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1pis n ARG 6 N -0.69 0.00 -0.33 -4.13 3.00 -1.26 -4.46 116.66 108.79 1pis n ARG 6 Ca 0.12 0.00 0.29 0.00 -0.01 0.00 0.00 57.85 58.26 1pis n ARG 6 Cb 0.48 0.00 0.50 0.00 0.00 0.00 0.00 32.46 33.44 1pis n ARG 6 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1pis n SER 7 N 4.82 0.18 0.08 0.55 2.88 -1.22 -1.70 113.62 119.21 1pis n SER 7 Ca 0.00 1.11 -0.04 0.00 -1.33 0.00 0.00 58.87 58.61 1pis n SER 7 Cb 0.00 -0.54 -0.02 0.00 -0.75 0.00 0.00 64.21 62.90 1pis n SER 7 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 1pis h MET 8 N 0.00 -0.24 -0.02 -1.46 -1.53 -1.25 -3.26 114.93 107.18 1pis h MET 8 Ca 0.67 0.02 0.00 0.00 -3.44 0.00 0.00 59.70 56.95 1pis h MET 8 Cb 2.07 0.05 -0.00 0.00 -0.55 0.00 0.00 31.60 33.17 1pis h MET 8 CO -0.41 -0.16 0.01 0.82 0.14 0.00 0.00 176.91 177.32 1pis h ILE 9 N -0.52 0.82 -0.09 1.77 2.04 -1.70 -1.96 117.51 117.87 1pis h ILE 9 Ca -0.03 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.85 1pis h ILE 9 Cb 0.19 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 1pis h ILE 9 CO 0.04 0.00 -0.03 0.11 0.00 0.00 0.00 178.15 178.27 1pis h LYS 10 N 0.00 -0.01 -0.72 2.37 6.56 -1.48 -1.83 116.57 121.47 1pis h LYS 10 Ca 0.01 0.00 0.12 0.00 -1.06 0.00 0.00 60.65 59.72 1pis h LYS 10 Cb 0.04 0.00 -0.13 0.00 -0.57 0.00 0.00 32.23 31.57 1pis h LYS 10 CO -0.00 -0.00 -0.34 0.00 -2.06 0.00 0.00 179.45 177.04 1pis n ALA 12 N -3.25 2.85 -3.90 0.00 0.00 -1.13 -4.68 120.51 110.40 1pis n ALA 12 Ca 0.06 -0.28 -0.28 0.00 0.00 0.00 0.00 53.44 52.95 1pis n ALA 12 Cb 0.37 -1.30 -0.12 0.00 0.00 0.00 0.00 19.45 18.40 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 -2.61 2.91 -0.46 0.00 1.01 -0.70 -4.49 121.20 116.86 1pis s ILE 13 Ca 0.24 -4.27 -0.26 0.00 0.00 0.00 0.00 60.65 56.36 1pis s ILE 13 Cb 0.19 -2.91 -0.06 0.00 0.01 0.00 0.00 42.46 39.69 1pis s ILE 13 CO 0.52 -1.00 2.34 -2.84 0.00 0.00 0.00 174.94 173.95 1pis s PRO 14 N -1.44 2.27 0.00 2.79 0.01 -1.26 -4.17 135.00 133.20 1pis s PRO 14 Ca 0.25 1.43 0.00 0.00 0.01 0.00 0.00 61.00 62.68 1pis s PRO 14 Cb -0.05 -4.54 0.00 0.00 0.01 0.00 0.00 34.50 29.92 1pis s PRO 14 CO -0.16 -3.09 0.00 0.41 0.01 0.00 0.00 177.00 174.17 1pis n GLY 15 N 5.95 2.31 3.74 0.52 0.00 -1.26 -5.07 105.19 111.37 1pis n GLY 15 Ca 0.35 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 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 4.88 -0.34 1.61 0.01 -1.26 -5.03 113.70 109.57 1pis s SER 16 Ca 0.00 2.38 -0.15 0.00 1.31 0.00 0.00 55.95 59.48 1pis s SER 16 Cb 0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.62 1pis s SER 16 CO 0.00 -1.80 0.37 -1.00 0.41 0.00 0.00 173.24 171.21 1pis s HIS 17 N -1.72 3.21 0.21 2.43 3.76 -1.26 -4.88 115.29 117.04 1pis s HIS 17 Ca 0.76 0.01 0.00 0.00 -0.15 0.00 0.00 55.06 55.69 1pis s HIS 17 Cb -0.30 -2.67 0.00 0.00 1.11 0.00 0.00 32.58 30.72 1pis s HIS 17 CO 0.37 -0.42 0.00 -2.30 -0.85 0.00 0.00 174.74 171.54 1pis n PRO 18 N 5.39 0.97 0.00 8.40 -0.02 -1.26 -3.64 135.00 144.84 1pis n PRO 18 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 1pis n PRO 18 Cb 0.49 -0.41 0.00 0.00 -0.02 0.00 0.00 33.50 33.56 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 -1.01 117.00 125.20 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 0.86 0.24 -1.51 0.00 0.00 177.39 176.98 1pis h MET 20 N 0.00 0.02 0.07 3.23 2.86 -1.93 -1.50 114.93 117.68 1pis h MET 20 Ca 0.00 -0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.43 1pis h MET 20 Cb 0.00 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1pis h MET 20 CO 0.00 0.06 -1.05 -0.44 1.06 0.00 0.00 176.91 176.53 1pis h ASP 21 N -0.02 0.23 -0.58 1.22 5.19 -1.45 -3.43 116.42 117.58 1pis h ASP 21 Ca 0.01 -0.81 -0.08 0.00 -0.62 0.00 0.00 57.03 55.53 1pis h ASP 21 Cb 0.04 -0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.45 1pis h ASP 21 CO -0.00 1.45 0.07 -0.26 -3.12 0.00 0.00 179.24 177.38 1pis h PHE 22 N -0.60 1.05 -4.07 4.55 0.04 -1.12 -3.45 116.94 113.34 1pis h PHE 22 Ca -0.24 -0.16 -0.52 0.00 2.80 0.00 0.00 57.97 59.86 1pis h PHE 22 Cb 1.50 -0.28 0.09 0.00 2.20 0.00 0.00 35.95 39.46 1pis h PHE 22 CO 0.16 0.92 0.47 1.21 -0.60 0.00 0.00 178.31 180.47 1pis s ASN 23 N -6.40 5.57 0.00 2.17 2.47 -0.57 -3.41 114.94 114.78 1pis s ASN 23 Ca -0.12 2.33 0.00 0.00 0.42 0.00 0.00 52.86 55.49 1pis s ASN 23 Cb 0.13 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 37.33 1pis s ASN 23 CO 0.83 -1.33 0.00 0.59 -3.72 0.00 0.00 177.10 173.47 1pis n ASN 24 N -1.23 0.00 -4.74 -4.21 3.02 -1.26 -4.94 115.26 101.90 1pis n ASN 24 Ca 0.11 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.35 1pis n ASN 24 Cb 0.49 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.77 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 -0.86 2.30 0.41 3.10 -0.85 -1.22 -4.52 117.35 115.71 1pis s TYR 25 Ca 0.00 1.62 0.00 0.00 -0.52 0.00 0.00 57.07 58.17 1pis s TYR 25 Cb 0.00 -3.15 0.00 0.00 0.38 0.00 0.00 41.96 39.19 1pis s TYR 25 CO 0.00 -2.10 0.00 0.41 -1.52 0.00 0.00 175.55 172.34 1pis n GLY 26 N -0.71 -2.42 0.10 5.49 0.00 -0.18 -4.78 105.19 102.69 1pis n GLY 26 Ca 0.10 -1.15 -0.03 0.00 0.00 0.00 0.00 46.02 44.95 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 -3.17 -0.55 0.09 0.00 4.11 -1.26 -4.93 117.16 111.45 1pis n TYR 28 Ca -0.04 -3.45 0.04 0.00 -0.00 0.00 0.00 57.90 54.46 1pis n TYR 28 Cb 0.87 -0.04 -0.06 0.00 -0.00 0.00 0.00 39.34 40.11 1pis n TYR 28 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1pis s GLY 30 N -2.70 1.86 -0.30 0.00 0.00 -1.26 -4.93 107.32 99.98 1pis s GLY 30 Ca -0.02 0.05 -0.28 0.00 0.00 0.00 0.00 44.72 44.47 1pis s GLY 30 CO 0.35 0.33 1.93 1.08 0.00 0.00 0.00 173.10 176.79 1pis s LEU 31 N -4.67 3.48 0.00 0.66 1.02 -1.26 -3.94 118.68 113.97 1pis s LEU 31 Ca 0.57 1.47 0.00 0.00 0.02 0.00 0.00 54.13 56.19 1pis s LEU 31 Cb -0.11 -3.49 0.00 0.00 0.02 0.00 0.00 46.19 42.61 1pis s LEU 31 CO 0.43 -1.81 0.00 0.61 0.02 0.00 0.00 176.35 175.61 1pis n GLY 32 N 5.54 1.56 3.09 -3.19 0.00 -1.26 -5.06 105.19 105.86 1pis n GLY 32 Ca 0.25 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 2.10 3.55 -0.02 0.00 -1.25 -4.93 105.19 104.63 1pis n GLY 33 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 1.68 0.00 1.61 3.41 -1.26 -4.74 113.62 114.31 1pis n SER 34 Ca 0.00 -1.17 0.00 0.00 -0.26 0.00 0.00 58.87 57.44 1pis n SER 34 Cb 0.00 -1.56 0.00 0.00 -0.26 0.00 0.00 64.21 62.39 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 6.54 0.72 0.00 5.00 0.00 -1.26 -5.16 105.19 111.02 1pis n GLY 35 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.49 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 -0.57 2.61 5.66 -1.26 -5.14 114.28 115.58 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 0.35 0.00 1.09 -0.02 -1.26 -4.66 135.00 130.49 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 -1.24 0.00 -3.54 -1.45 0.24 -1.17 -4.33 118.33 106.85 1pis n VAL 38 Ca 0.00 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.09 1pis n VAL 38 Cb 0.00 -0.80 -0.01 0.00 -1.47 0.00 0.00 33.84 31.56 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 -0.60 6.12 0.00 -1.34 2.15 -1.26 -5.01 116.67 116.72 1pis s ASP 39 Ca 0.00 0.08 0.02 0.00 0.43 0.00 0.00 52.55 53.08 1pis s ASP 39 Cb 0.00 -1.62 0.09 0.00 -0.30 0.00 0.00 42.92 41.09 1pis s ASP 39 CO 0.00 -0.34 0.45 -1.84 -0.17 0.00 0.00 175.17 173.27 1pis n GLU 40 N -1.66 0.07 0.16 4.34 0.00 -1.26 -2.44 120.64 119.85 1pis n GLU 40 Ca -0.04 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.25 1pis n GLU 40 Cb 0.57 -1.34 0.26 0.00 0.00 0.00 0.00 31.44 30.94 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 -1.12 -1.84 5.85 -1.81 -0.48 115.31 115.90 1pis h LEU 41 Ca 0.00 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.62 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 0.01 -0.39 -0.78 -0.34 0.00 0.00 178.44 176.94 1pis h ASP 42 N 0.00 0.09 0.33 1.25 3.58 -1.80 -3.27 116.42 116.60 1pis h ASP 42 Ca 0.00 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.41 1pis h ASP 42 Cb 0.87 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.90 1pis h ASP 42 CO 0.00 0.48 0.00 -0.09 -2.88 0.00 0.00 179.24 176.75 1pis h ARG 43 N 0.08 0.00 0.08 0.28 1.12 -1.30 -0.77 114.38 113.87 1pis h ARG 43 Ca 0.01 0.00 -0.25 0.00 -1.11 0.00 0.00 59.98 58.63 1pis h ARG 43 Cb 0.73 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.68 1pis h ARG 43 CO 0.05 0.00 -1.16 0.00 -3.11 0.00 0.00 179.97 175.76 1pis n GLU 46 N -0.06 0.55 0.02 0.00 0.00 -0.35 -4.24 120.64 116.57 1pis n GLU 46 Ca 0.00 0.55 -0.10 0.00 0.00 0.00 0.00 57.16 57.62 1pis n GLU 46 Cb 0.20 -1.73 -0.07 0.00 0.00 0.00 0.00 31.44 29.84 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 -1.00 0.87 -0.78 6.31 2.02 -1.62 -1.29 112.91 117.43 1pis h THR 47 Ca -0.32 -1.29 0.10 0.00 0.77 0.00 0.00 66.41 65.66 1pis h THR 47 Cb 1.22 1.53 -0.05 0.00 -1.74 0.00 0.00 68.15 69.10 1pis h THR 47 CO -0.20 0.25 0.51 -0.74 0.37 0.00 0.00 175.52 175.71 1pis h HIS 48 N -0.90 0.73 0.11 3.16 -0.00 -1.79 -1.01 115.15 115.45 1pis h HIS 48 Ca -0.02 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.37 1pis h HIS 48 Cb 0.53 -0.24 0.00 0.00 -0.00 0.00 0.00 27.41 27.70 1pis h HIS 48 CO 0.10 0.34 -0.05 0.22 -0.00 0.00 0.00 177.93 178.54 1pis h ASP 49 N 0.68 -0.12 1.28 3.26 1.82 -1.73 -1.76 116.42 119.85 1pis h ASP 49 Ca 0.36 -0.12 0.00 0.00 -0.39 0.00 0.00 57.03 56.88 1pis h ASP 49 Cb 0.49 0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.53 1pis h ASP 49 CO -0.14 0.04 0.00 0.78 -1.61 0.00 0.00 179.24 178.32 1pis h ASN 50 N -0.28 0.00 -0.03 2.28 2.35 -1.09 0.10 115.58 118.91 1pis h ASN 50 Ca -0.01 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.63 1pis h ASN 50 Cb 0.23 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.61 1pis h ASN 50 CO 0.02 0.00 -0.38 0.00 -1.65 0.00 0.00 177.43 175.43 1pis h TYR 52 N -0.22 0.14 0.10 0.00 -1.99 -1.25 -1.68 116.97 112.07 1pis h TYR 52 Ca -0.04 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.69 1pis h TYR 52 Cb 1.07 -0.05 0.00 0.00 2.00 0.00 0.00 36.73 39.76 1pis h TYR 52 CO 0.15 0.06 -0.05 0.00 -0.00 0.00 0.00 178.16 178.32 1pis h ARG 53 N 0.13 -0.13 0.00 4.88 2.47 -1.02 -3.19 114.38 117.52 1pis h ARG 53 Ca 0.25 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.98 1pis h ARG 53 Cb 0.80 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.15 1pis h ARG 53 CO -0.03 0.04 0.00 -0.44 0.56 0.00 0.00 179.97 180.10 1pis h ASP 54 N -0.27 0.00 -0.62 7.04 3.32 -1.17 -2.66 116.42 122.05 1pis h ASP 54 Ca -0.01 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 1pis h ASP 54 Cb 0.23 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1pis h ASP 54 CO 0.02 0.00 0.02 0.00 -1.72 0.00 0.00 179.24 177.56 1pis h ALA 55 N 2.03 0.84 -0.73 3.45 0.00 -1.31 -3.24 119.26 120.30 1pis h ALA 55 Ca 0.00 -0.31 0.11 0.00 0.00 0.00 0.00 54.91 54.71 1pis h ALA 55 Cb 0.21 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 1pis h ALA 55 CO 0.00 0.66 0.48 1.57 0.00 0.00 0.00 179.25 181.96 1pis h LYS 56 N 0.99 0.56 0.00 0.00 5.09 -1.49 -2.31 116.57 119.41 1pis h LYS 56 Ca 0.18 -0.03 0.00 0.00 0.09 0.00 0.00 60.65 60.89 1pis h LYS 56 Cb 0.54 -0.13 0.00 0.00 0.10 0.00 0.00 32.23 32.74 1pis h LYS 56 CO 0.03 0.37 0.00 -1.71 -2.09 0.00 0.00 179.45 176.05 1pis n ASN 57 N -4.49 0.20 -4.63 7.07 5.15 -1.22 -4.22 115.26 113.11 1pis n ASN 57 Ca 0.12 0.55 -0.43 0.00 -0.60 0.00 0.00 54.58 54.22 1pis n ASN 57 Cb 0.38 -0.59 -0.02 0.00 -0.53 0.00 0.00 39.78 39.01 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 -3.44 3.88 0.47 1.20 2.96 -0.87 -4.96 118.68 117.92 1pis s LEU 58 Ca 0.07 0.99 0.19 0.00 -0.22 0.00 0.00 54.13 55.16 1pis s LEU 58 Cb 0.10 -3.54 1.18 0.00 0.50 0.00 0.00 46.19 44.43 1pis s LEU 58 CO 0.33 -0.96 1.97 0.44 -1.32 0.00 0.00 176.35 176.81 1pis h ASP 59 N 8.44 0.23 -0.00 3.68 3.32 -1.91 -3.10 116.42 127.07 1pis h ASP 59 Ca -0.22 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 56.84 1pis h ASP 59 Cb 1.07 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.58 1pis h ASP 59 CO 1.05 0.13 0.00 0.28 -1.72 0.00 0.00 179.24 178.97 1pis h SER 60 N 0.25 0.01 -3.38 6.45 0.02 -1.94 -3.40 113.55 111.55 1pis h SER 60 Ca 0.29 -0.23 -0.54 0.00 -0.84 0.00 0.00 61.79 60.46 1pis h SER 60 Cb 0.79 -0.00 -0.39 0.00 0.14 0.00 0.00 62.40 62.94 1pis h SER 60 CO -0.06 0.23 -0.77 0.00 -1.14 0.00 0.00 176.83 175.09 1pis s LYS 62 N 1.70 3.94 -0.05 0.00 -0.14 -1.20 -4.60 119.74 119.39 1pis s LYS 62 Ca -0.02 0.30 -0.00 0.00 -1.36 0.00 0.00 55.97 54.89 1pis s LYS 62 Cb -0.17 -3.27 0.04 0.00 -1.68 0.00 0.00 37.83 32.76 1pis s LYS 62 CO -0.07 0.59 1.77 1.19 -0.76 0.00 0.00 175.35 178.06 1pis n PHE 63 N 2.26 0.28 0.31 3.18 3.01 -1.26 -1.12 117.46 124.11 1pis n PHE 63 Ca -0.14 -1.03 0.14 0.00 1.01 0.00 0.00 57.45 57.43 1pis n PHE 63 Cb 0.53 -0.51 0.65 0.00 -0.01 0.00 0.00 39.48 40.13 1pis n PHE 63 CO 0.00 0.00 0.00 1.37 1.01 0.00 0.00 176.76 179.14 1pis h LEU 64 N 2.42 0.00 -1.93 4.37 8.10 -1.94 -3.19 115.31 123.15 1pis h LEU 64 Ca 0.05 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 58.03 1pis h LEU 64 Cb 1.03 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 41.25 1pis h LEU 64 CO 0.13 0.00 -0.09 -0.37 -4.11 0.00 0.00 178.44 174.00 1pis h VAL 65 N 0.00 0.37 0.00 0.15 -1.51 -1.48 -3.48 116.25 110.30 1pis h VAL 65 Ca 0.00 -0.50 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 1pis h VAL 65 Cb 0.28 1.36 0.00 0.00 -2.13 0.00 0.00 31.29 30.79 1pis h VAL 65 CO 0.00 0.08 0.00 -0.67 -1.23 0.00 0.00 177.57 175.75 1pis n ASP 66 N -3.42 0.00 -3.25 4.19 2.03 -1.21 -4.47 116.55 110.41 1pis n ASP 66 Ca -0.01 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 55.05 1pis n ASP 66 Cb 0.24 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.56 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 4.60 -0.36 -4.10 1.67 6.94 -1.26 -4.99 115.26 117.76 1pis n ASN 67 Ca 0.00 -2.57 -0.43 0.00 -0.02 0.00 0.00 54.58 51.56 1pis n ASN 67 Cb 0.00 -0.44 0.00 0.00 -2.36 0.00 0.00 39.78 36.98 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 2.12 3.25 0.00 -0.53 -0.04 -1.26 -4.78 135.00 133.76 1pis n PRO 68 Ca 0.25 -3.26 0.00 0.00 -0.04 0.00 0.00 63.50 60.45 1pis n PRO 68 Cb 0.51 -3.19 0.00 0.00 -0.04 0.00 0.00 33.50 30.79 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 5.90 0.00 0.97 0.54 4.01 -1.26 -4.92 117.16 122.39 1pis n TYR 69 Ca 0.45 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 58.29 1pis n TYR 69 Cb 0.41 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.40 1pis n TYR 69 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1pis n THR 70 N 0.00 0.00 -1.39 -0.72 -2.24 0.54 -4.20 114.28 106.28 1pis n THR 70 Ca 0.00 -0.20 -0.27 0.00 -2.27 0.00 0.00 64.05 61.31 1pis n THR 70 Cb 0.00 1.19 -0.08 0.00 -2.10 0.00 0.00 70.33 69.34 1pis n THR 70 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1pis n GLU 71 N -0.41 2.95 0.06 -0.78 1.02 -1.26 -4.22 120.64 117.99 1pis n GLU 71 Ca 0.08 -2.09 0.00 0.00 -0.02 0.00 0.00 57.16 55.12 1pis n GLU 71 Cb 0.42 -2.32 0.00 0.00 -0.02 0.00 0.00 31.44 29.52 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 2.10 -1.02 -4.96 1.62 7.64 -1.26 -5.03 113.62 112.70 1pis n SER 72 Ca 0.56 0.26 -0.22 0.00 1.01 0.00 0.00 58.87 60.48 1pis n SER 72 Cb 0.55 1.24 -0.01 0.00 -1.01 0.00 0.00 64.21 64.98 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 -1.31 3.34 0.04 1.43 -0.85 -1.26 -5.14 117.35 113.59 1pis s TYR 73 Ca 0.00 0.07 0.00 0.00 -0.52 0.00 0.00 57.07 56.62 1pis s TYR 73 Cb 0.00 -1.89 -0.00 0.00 0.38 0.00 0.00 41.96 40.45 1pis s TYR 73 CO 0.00 0.11 0.01 -1.13 -1.52 0.00 0.00 175.55 173.02 1pis n SER 74 N -1.68 1.00 -3.48 -0.18 3.41 -1.26 -4.93 113.62 106.50 1pis n SER 74 Ca -0.04 -1.20 -0.15 0.00 -0.26 0.00 0.00 58.87 57.22 1pis n SER 74 Cb 0.57 0.09 -0.06 0.00 -0.26 0.00 0.00 64.21 64.55 1pis n SER 74 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1pis s TYR 75 N -1.66 1.19 0.40 7.33 1.13 -1.26 -1.89 117.35 122.59 1pis s TYR 75 Ca 0.02 -1.35 0.07 0.00 -1.41 0.00 0.00 57.07 54.41 1pis s TYR 75 Cb 0.00 -0.29 -0.07 0.00 -1.10 0.00 0.00 41.96 40.50 1pis s TYR 75 CO 0.01 -0.99 0.03 -1.12 -2.51 0.00 0.00 175.55 170.97 1pis s SER 76 N -3.24 3.96 0.12 -0.18 0.01 -1.22 -4.66 113.70 108.50 1pis s SER 76 Ca 0.34 -1.29 -0.15 0.00 1.31 0.00 0.00 55.95 56.15 1pis s SER 76 Cb 0.01 -0.41 0.03 0.00 0.21 0.00 0.00 66.02 65.86 1pis s SER 76 CO 0.20 -0.43 0.38 0.00 0.41 0.00 0.00 173.24 173.80 1pis n SER 78 N -0.21 0.00 0.00 0.00 7.64 -1.16 -4.84 113.62 115.05 1pis n SER 78 Ca -0.16 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.72 1pis n SER 78 Cb 0.64 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.84 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 -0.02 6.43 2.85 -1.26 -4.78 115.26 118.48 1pis n ASN 79 Ca 0.00 0.06 -0.22 0.00 -0.11 0.00 0.00 54.58 54.31 1pis n ASN 79 Cb 0.00 0.00 -0.13 0.00 1.24 0.00 0.00 39.78 40.89 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 0.83 -4.47 -0.44 1.35 -1.86 -3.45 112.91 104.87 1pis h THR 80 Ca 0.00 -2.32 0.00 0.00 -0.55 0.00 0.00 66.41 63.54 1pis h THR 80 Cb 0.00 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 1pis h THR 80 CO 0.00 0.69 0.00 1.21 -0.25 0.00 0.00 175.52 177.17 1pis n GLU 81 N -3.87 -0.47 -3.46 4.72 4.07 -1.26 -4.19 120.64 116.18 1pis n GLU 81 Ca -0.30 -0.23 -0.38 0.00 -0.06 0.00 0.00 57.16 56.19 1pis n GLU 81 Cb 0.91 0.42 -0.06 0.00 -0.06 0.00 0.00 31.44 32.64 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 -2.67 5.13 0.00 6.31 1.01 -1.26 -2.99 121.20 126.73 1pis s ILE 82 Ca 0.00 0.81 0.00 0.00 0.00 0.00 0.00 60.65 61.46 1pis s ILE 82 Cb 0.00 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.75 1pis s ILE 82 CO 0.00 0.47 0.00 1.07 0.00 0.00 0.00 174.94 176.48 1pis n THR 83 N 2.71 0.00 -3.76 2.92 5.66 -1.24 -4.84 114.28 115.73 1pis n THR 83 Ca -0.12 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.80 1pis n THR 83 Cb 0.52 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 69.33 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 -2.98 6.66 0.45 0.00 3.84 -0.79 -3.44 114.94 118.68 1pis s ASN 85 Ca 0.15 2.27 0.24 0.00 0.21 0.00 0.00 52.86 55.74 1pis s ASN 85 Cb -0.05 -2.54 1.01 0.00 -0.55 0.00 0.00 41.25 39.12 1pis s ASN 85 CO 0.11 -0.92 1.87 -1.28 -2.79 0.00 0.00 177.10 174.09 1pis h SER 86 N 9.37 0.00 0.00 -4.21 0.87 -1.94 0.23 113.55 117.87 1pis h SER 86 Ca -0.40 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1pis h SER 86 Cb 1.18 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 1pis h SER 86 CO 0.95 0.23 0.47 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 -2.03 -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 0.67 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 1pis h LYS 87 CO 0.03 0.00 0.00 -1.71 -2.00 0.00 0.00 179.45 175.77 1pis n ASN 88 N -2.21 0.00 -0.79 7.07 5.15 0.80 -5.03 115.26 120.25 1pis n ASN 88 Ca -0.01 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.97 1pis n ASN 88 Cb 0.49 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.74 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 0.03 0.00 0.00 1.20 2.85 -1.26 -4.90 115.26 113.18 1pis n ASN 89 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1pis n ASN 89 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 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 0.00 -0.04 5.20 0.00 -1.26 -4.36 120.51 117.06 1pis n ALA 90 Ca 0.00 -0.10 -0.15 0.00 0.00 0.00 0.00 53.44 53.19 1pis n ALA 90 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 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 -0.08 0.38 -0.47 0.00 5.08 -1.91 -2.91 114.58 114.66 1pis h GLU 92 Ca -0.02 -0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1pis h GLU 92 Cb 0.96 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.07 1pis h GLU 92 CO 0.07 0.25 0.20 0.00 -1.00 0.00 0.00 179.01 178.53 1pis h ALA 93 N 1.50 0.58 0.49 3.43 0.00 -1.75 -1.85 119.26 121.65 1pis h ALA 93 Ca 0.36 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.29 1pis h ALA 93 Cb 0.52 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1pis h ALA 93 CO -0.38 -0.17 -0.30 0.35 0.00 0.00 0.00 179.25 178.75 1pis h PHE 94 N 0.40 -0.79 -0.40 0.00 3.04 -1.41 -0.58 116.94 117.21 1pis h PHE 94 Ca 0.21 -0.01 -0.11 0.00 3.98 0.00 0.00 57.97 62.05 1pis h PHE 94 Cb 0.17 0.28 -0.02 0.00 2.56 0.00 0.00 35.95 38.94 1pis h PHE 94 CO -0.13 -0.46 -0.19 0.82 -2.02 0.00 0.00 178.31 176.33 1pis h ILE 95 N -0.75 1.27 0.00 1.41 5.03 -1.57 -2.24 117.51 120.66 1pis h ILE 95 Ca -0.06 -1.29 0.00 0.00 -0.12 0.00 0.00 64.86 63.39 1pis h ILE 95 Cb 0.61 1.17 0.00 0.00 -3.03 0.00 0.00 36.82 35.57 1pis h ILE 95 CO 0.06 0.43 0.00 0.00 -0.68 0.00 0.00 178.15 177.96 1pis h ASN 97 N 0.00 0.71 0.55 0.00 2.35 -0.69 -1.38 115.58 117.11 1pis h ASN 97 Ca 0.00 -0.46 -0.03 0.00 -0.55 0.00 0.00 56.30 55.26 1pis h ASN 97 Cb 0.44 -0.21 0.01 0.00 0.05 0.00 0.00 38.32 38.60 1pis h ASN 97 CO 0.00 1.23 -0.26 0.00 -1.65 0.00 0.00 177.43 176.75 1pis h ASP 99 N -0.88 0.00 0.48 0.00 3.58 -1.50 -2.15 116.42 115.94 1pis h ASP 99 Ca -0.07 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.35 1pis h ASP 99 Cb 0.62 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.67 1pis h ASP 99 CO 0.12 0.00 -0.23 0.08 -2.88 0.00 0.00 179.24 176.33 1pis h ARG 100 N 0.00 -0.61 -0.28 0.28 0.11 -1.17 -3.01 114.38 109.69 1pis h ARG 100 Ca 0.00 0.04 0.01 0.00 0.10 0.00 0.00 59.98 60.13 1pis h ARG 100 Cb 0.24 0.14 -0.02 0.00 1.11 0.00 0.00 29.97 31.44 1pis h ARG 100 CO 0.00 -0.41 0.17 -0.97 0.10 0.00 0.00 179.97 178.86 1pis h ASN 101 N -0.90 0.29 -0.15 0.08 -0.73 -1.30 0.22 115.58 113.08 1pis h ASN 101 Ca -0.07 -0.00 0.01 0.00 1.87 0.00 0.00 56.30 58.12 1pis h ASN 101 Cb 0.49 -0.06 -0.02 0.00 0.27 0.00 0.00 38.32 39.00 1pis h ASN 101 CO 0.11 0.21 -0.09 0.00 -0.37 0.00 0.00 177.43 177.28 1pis n ALA 102 N -2.19 -0.10 0.20 1.57 0.00 -0.88 -0.03 120.51 119.10 1pis n ALA 102 Ca -0.02 0.13 -0.12 0.00 0.00 0.00 0.00 53.44 53.43 1pis n ALA 102 Cb 0.04 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.42 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 0.03 -0.56 -0.51 0.00 0.00 -0.85 -3.07 119.26 114.30 1pis h ALA 103 Ca 0.02 -0.18 0.10 0.00 0.00 0.00 0.00 54.91 54.85 1pis h ALA 103 Cb 0.06 0.22 -0.10 0.00 0.00 0.00 0.00 17.79 17.97 1pis h ALA 103 CO -0.14 -0.60 -0.16 0.82 0.00 0.00 0.00 179.25 179.17 1pis h ILE 104 N -0.98 0.44 0.00 0.00 2.04 -1.18 -3.30 117.51 114.53 1pis h ILE 104 Ca -0.06 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.73 1pis h ILE 104 Cb 0.55 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1pis h ILE 104 CO 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 178.15 177.89 1pis h PHE 106 N 0.00 0.00 0.06 0.00 0.04 -1.61 0.78 116.94 116.21 1pis h PHE 106 Ca -0.00 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.49 1pis h PHE 106 Cb 0.93 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.05 1pis h PHE 106 CO 0.00 0.04 -1.46 1.03 -0.60 0.00 0.00 178.31 177.32 1pis h SER 107 N 0.00 0.20 -0.05 2.17 0.87 -1.50 -3.41 113.55 111.83 1pis h SER 107 Ca -0.00 -0.28 -0.02 0.00 -1.23 0.00 0.00 61.79 60.26 1pis h SER 107 Cb 0.19 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1pis h SER 107 CO 0.00 1.24 -0.05 0.11 -0.53 0.00 0.00 176.83 177.60 1pis h LYS 108 N 0.03 0.12 -6.85 2.24 1.57 -0.61 -3.47 116.57 109.61 1pis h LYS 108 Ca -0.20 -0.06 -0.50 0.00 -1.87 0.00 0.00 60.65 58.01 1pis h LYS 108 Cb 1.95 0.00 0.03 0.00 0.08 0.00 0.00 32.23 34.29 1pis h LYS 108 CO 0.13 0.57 0.48 0.00 -0.57 0.00 0.00 179.45 180.07 1pis s ALA 109 N -4.28 3.34 0.03 3.86 0.00 0.22 -5.05 121.76 119.87 1pis s ALA 109 Ca -0.15 0.91 -0.38 0.00 0.00 0.00 0.00 51.96 52.33 1pis s ALA 109 Cb 0.03 -3.34 -0.20 0.00 0.00 0.00 0.00 23.12 19.62 1pis s ALA 109 CO 0.70 -0.25 1.01 -2.30 0.00 0.00 0.00 175.76 174.92 1pis n PRO 110 N 0.84 0.04 -4.58 0.00 -0.02 -1.26 -4.84 135.00 125.19 1pis n PRO 110 Ca 0.00 0.02 -0.31 0.00 -2.02 0.00 0.00 63.50 61.19 1pis n PRO 110 Cb 0.45 -1.46 -0.12 0.00 -0.02 0.00 0.00 33.50 32.36 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 -0.11 2.71 -0.21 6.00 5.04 -1.26 -2.51 117.35 127.02 1pis s TYR 111 Ca 0.87 -0.16 0.01 0.00 -2.44 0.00 0.00 57.07 55.35 1pis s TYR 111 Cb -1.22 -1.53 0.03 0.00 0.35 0.00 0.00 41.96 39.59 1pis s TYR 111 CO 0.57 0.30 -0.15 -0.80 -1.34 0.00 0.00 175.55 174.13 1pis s ASN 112 N -1.41 3.65 0.00 4.32 0.02 -1.26 -5.04 114.94 115.22 1pis s ASN 112 Ca 0.16 -0.81 -0.01 0.00 -1.02 0.00 0.00 52.86 51.17 1pis s ASN 112 Cb -0.11 -1.54 -0.04 0.00 0.02 0.00 0.00 41.25 39.58 1pis s ASN 112 CO 0.06 -0.06 1.75 2.29 0.02 0.00 0.00 177.10 181.16 1pis n LYS 113 N 4.60 0.89 0.11 -0.60 2.85 -1.26 -3.96 118.16 120.80 1pis n LYS 113 Ca -0.19 -0.14 0.00 0.00 -1.05 0.00 0.00 58.31 56.93 1pis n LYS 113 Cb 0.48 -1.27 0.00 0.00 -0.65 0.00 0.00 35.03 33.59 1pis n LYS 113 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1pis n GLU 114 N 1.82 0.00 0.00 -1.58 -0.58 -1.26 -4.50 120.64 114.54 1pis n GLU 114 Ca 0.06 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 56.86 1pis n GLU 114 Cb 0.43 0.00 0.38 0.00 -0.57 0.00 0.00 31.44 31.68 1pis n GLU 114 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1pis n HIS 115 N -3.18 0.00 0.27 -0.32 8.25 -1.26 -4.43 115.22 114.56 1pis n HIS 115 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.60 1pis n HIS 115 Cb 0.00 0.00 0.77 0.00 1.12 0.00 0.00 29.99 31.88 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 0.00 0.00 -2.30 -0.41 3.64 -1.79 -0.40 116.57 115.31 1pis h LYS 116 Ca 0.00 0.00 -0.43 0.00 -1.27 0.00 0.00 60.65 58.95 1pis h LYS 116 Cb 0.00 0.00 -0.35 0.00 -0.41 0.00 0.00 32.23 31.47 1pis h LYS 116 CO 0.00 0.09 -0.72 1.21 -2.27 0.00 0.00 179.45 177.76 1pis s ASN 117 N -6.02 2.14 0.75 4.20 3.84 -1.26 -3.47 114.94 115.12 1pis s ASN 117 Ca -0.03 -1.41 -0.10 0.00 0.21 0.00 0.00 52.86 51.53 1pis s ASN 117 Cb 0.13 0.17 0.06 0.00 -0.55 0.00 0.00 41.25 41.06 1pis s ASN 117 CO 0.56 -0.34 1.10 -0.22 -2.79 0.00 0.00 177.10 175.41 1pis s LEU 118 N 1.75 2.71 0.03 3.21 2.96 -1.12 -5.04 118.68 123.18 1pis s LEU 118 Ca 0.13 0.76 -0.12 0.00 -0.22 0.00 0.00 54.13 54.68 1pis s LEU 118 Cb -0.17 -3.38 -0.33 0.00 0.50 0.00 0.00 46.19 42.81 1pis s LEU 118 CO -0.17 -1.66 0.98 0.44 -1.32 0.00 0.00 176.35 174.62 1pis h ASP 119 N -0.80 0.72 0.00 3.68 3.32 -1.87 -3.50 116.42 117.97 1pis h ASP 119 Ca -0.45 -0.81 0.00 0.00 0.02 0.00 0.00 57.03 55.79 1pis h ASP 119 Cb 1.31 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.62 1pis h ASP 119 CO 0.64 1.64 0.43 1.07 -1.72 0.00 0.00 179.24 181.30 1pis n THR 120 N -3.65 0.00 -0.51 0.35 5.66 -1.26 -4.61 114.28 110.26 1pis n THR 120 Ca -0.16 -0.43 -0.10 0.00 -3.05 0.00 0.00 64.05 60.31 1pis n THR 120 Cb 1.09 0.00 0.18 0.00 -1.55 0.00 0.00 70.33 70.04 1pis n THR 120 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 1pis n LYS 121 N 3.18 2.49 0.02 1.09 -0.00 -1.26 -4.78 118.16 118.89 1pis n LYS 121 Ca 0.00 -2.17 0.00 0.00 -0.00 0.00 0.00 58.31 56.14 1pis n LYS 121 Cb 0.22 -1.90 0.00 0.00 -0.00 0.00 0.00 35.03 33.34 1pis n LYS 121 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1pis n LYS 122 N -0.32 0.00 -0.93 -1.58 4.01 -1.26 -4.96 118.16 113.11 1pis n LYS 122 Ca 0.35 0.00 -0.05 0.00 -0.51 0.00 0.00 58.31 58.11 1pis n LYS 122 Cb 1.21 -0.02 0.28 0.00 -0.51 0.00 0.00 35.03 35.99 1pis n LYS 122 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 1pis n TYR 123 N -2.66 2.11 -0.83 2.13 4.01 -1.26 -5.12 117.16 115.53 1pis n TYR 123 Ca 0.00 -1.26 0.00 0.00 -0.16 0.00 0.00 57.90 56.48 1pis n TYR 123 Cb 0.00 -0.63 0.00 0.00 -0.31 0.00 0.00 39.34 38.40 1pis n TYR 123 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40