#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 4.17 -0.01 0.00 7.94 -1.26 -4.48 117.00 123.37 1pis n LEU 2 Ca 0.00 -2.56 0.08 0.00 -1.11 0.00 0.00 56.01 52.42 1pis n LEU 2 Cb 0.00 -0.98 -0.11 0.00 0.53 0.00 0.00 43.42 42.86 1pis n LEU 2 CO 0.00 0.60 -0.52 -2.67 -1.11 0.00 0.00 177.39 173.70 1pis n TRP 3 N 3.76 0.00 0.19 1.96 4.27 -1.26 -4.20 117.44 122.16 1pis n TRP 3 Ca 0.37 0.00 0.04 0.00 -3.89 0.00 0.00 57.50 54.01 1pis n TRP 3 Cb 0.24 -0.27 0.42 0.00 -1.36 0.00 0.00 31.31 30.35 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 0.04 -0.67 -2.67 5.75 -1.79 -1.93 115.11 113.84 1pis h GLN 4 Ca 0.00 -0.01 0.14 0.00 -0.15 0.00 0.00 58.65 58.62 1pis h GLN 4 Cb 0.62 -0.00 -0.10 0.00 1.07 0.00 0.00 27.48 29.07 1pis h GLN 4 CO 0.00 0.29 0.16 0.35 -2.65 0.00 0.00 178.83 176.98 1pis h PHE 5 N 0.04 0.25 0.00 3.99 3.57 -1.85 0.25 116.94 123.19 1pis h PHE 5 Ca 0.01 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1pis h PHE 5 Cb 0.47 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.20 1pis h PHE 5 CO 0.00 -0.05 -0.05 0.00 -2.23 0.00 0.00 178.31 175.98 1pis h ARG 6 N 0.28 0.00 -0.26 1.11 -0.00 -1.53 -1.17 114.38 112.81 1pis h ARG 6 Ca 0.37 0.00 -0.05 0.00 -0.50 0.00 0.00 59.98 59.80 1pis h ARG 6 Cb 0.58 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.54 1pis h ARG 6 CO -0.45 0.05 -0.04 1.03 0.00 0.00 0.00 179.97 180.56 1pis h SER 7 N 0.00 0.48 -0.05 7.04 0.87 -1.22 -3.39 113.55 117.29 1pis h SER 7 Ca -0.00 -0.34 0.03 0.00 -1.23 0.00 0.00 61.79 60.25 1pis h SER 7 Cb 0.36 -0.13 -0.06 0.00 -0.44 0.00 0.00 62.40 62.13 1pis h SER 7 CO 0.01 0.71 -0.45 0.24 -0.53 0.00 0.00 176.83 176.81 1pis h MET 8 N 0.24 -0.55 -0.48 2.24 2.86 0.25 -3.21 114.93 116.30 1pis h MET 8 Ca 0.07 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1pis h MET 8 Cb 0.49 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.27 1pis h MET 8 CO 0.02 -0.36 0.00 -0.89 1.06 0.00 0.00 176.91 176.74 1pis n ILE 9 N -5.45 0.00 0.00 -1.22 5.41 -0.80 -3.21 119.36 114.10 1pis n ILE 9 Ca -0.05 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.70 1pis n ILE 9 Cb 0.37 -0.24 0.00 0.00 -0.71 0.00 0.00 39.64 39.06 1pis n ILE 9 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1pis n LYS 10 N -0.25 0.00 0.00 0.38 4.76 -1.21 -3.73 118.16 118.11 1pis n LYS 10 Ca 0.00 0.20 0.00 0.00 -2.87 0.00 0.00 58.31 55.64 1pis n LYS 10 Cb 0.12 -0.67 0.00 0.00 -1.84 0.00 0.00 35.03 32.64 1pis n LYS 10 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1pis n ALA 12 N -0.80 2.50 -3.74 0.00 0.00 -1.20 -4.47 120.51 112.80 1pis n ALA 12 Ca 0.00 -0.59 -0.30 0.00 0.00 0.00 0.00 53.44 52.55 1pis n ALA 12 Cb 0.00 -1.05 -0.10 0.00 0.00 0.00 0.00 19.45 18.31 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 0.48 2.16 -1.87 0.00 2.08 -0.95 -4.52 119.36 116.74 1pis n ILE 13 Ca 0.16 -5.02 -0.34 0.00 0.56 0.00 0.00 62.75 58.11 1pis n ILE 13 Cb 0.35 -2.21 -0.04 0.00 -0.75 0.00 0.00 39.64 37.00 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 -1.69 2.38 0.00 0.38 0.04 -1.26 -4.22 135.00 130.63 1pis s PRO 14 Ca 0.28 0.69 0.00 0.00 0.04 0.00 0.00 61.00 62.01 1pis s PRO 14 Cb -0.01 -4.58 0.00 0.00 0.04 0.00 0.00 34.50 29.95 1pis s PRO 14 CO -0.13 -3.13 0.00 0.41 0.04 0.00 0.00 177.00 174.19 1pis n GLY 15 N 6.05 2.13 3.65 0.56 0.00 -1.26 -5.11 105.19 111.22 1pis n GLY 15 Ca 0.30 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 1pis n GLY 15 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1pis n SER 16 N 0.00 0.39 -4.40 1.61 7.64 -1.26 -5.05 113.62 112.56 1pis n SER 16 Ca 0.00 0.48 -0.35 0.00 1.01 0.00 0.00 58.87 60.02 1pis n SER 16 Cb 0.00 -1.47 -0.13 0.00 -1.01 0.00 0.00 64.21 61.60 1pis n SER 16 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1pis s HIS 17 N -2.41 2.98 0.41 1.43 3.76 -1.26 -4.82 115.29 115.39 1pis s HIS 17 Ca 0.69 -0.62 -0.02 0.00 -0.15 0.00 0.00 55.06 54.95 1pis s HIS 17 Cb -0.25 -2.05 -0.02 0.00 1.11 0.00 0.00 32.58 31.37 1pis s HIS 17 CO 0.56 -0.32 -0.12 -2.30 -0.85 0.00 0.00 174.74 171.71 1pis n PRO 18 N 4.28 0.00 0.00 8.40 -0.02 -1.26 -3.30 135.00 143.11 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 0.52 -0.75 0.00 0.00 -0.02 0.00 0.00 33.50 33.25 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 2.28 0.00 0.14 2.45 7.99 -1.26 -0.94 117.00 127.66 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 0.06 0.00 -0.08 0.00 -0.11 0.00 0.00 43.42 43.29 1pis n LEU 19 CO 0.03 0.00 0.70 0.24 -1.51 0.00 0.00 177.39 176.86 1pis h MET 20 N 0.00 -0.31 0.00 3.23 2.86 -1.93 -3.36 114.93 115.42 1pis h MET 20 Ca 0.00 0.02 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 1pis h MET 20 Cb 0.00 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 1pis h MET 20 CO 0.00 -0.10 -0.34 -0.44 1.06 0.00 0.00 176.91 177.09 1pis h ASP 21 N -0.47 0.00 -2.26 1.22 5.19 -1.24 -3.48 116.42 115.38 1pis h ASP 21 Ca -0.03 -0.72 -0.20 0.00 -0.62 0.00 0.00 57.03 55.46 1pis h ASP 21 Cb 0.36 0.00 0.11 0.00 0.18 0.00 0.00 39.33 39.98 1pis h ASP 21 CO 0.05 1.06 -0.01 0.49 -3.12 0.00 0.00 179.24 177.71 1pis n PHE 22 N -4.59 -3.22 -1.43 4.55 3.72 -0.12 -4.82 117.46 111.56 1pis n PHE 22 Ca -0.14 -0.48 0.00 0.00 -0.05 0.00 0.00 57.45 56.78 1pis n PHE 22 Cb 0.47 -0.63 0.00 0.00 -0.94 0.00 0.00 39.48 38.37 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 -4.25 -7.75 0.00 4.37 5.15 -1.26 -4.17 115.26 107.35 1pis n ASN 23 Ca 0.08 1.06 0.00 0.00 -0.60 0.00 0.00 54.58 55.12 1pis n ASN 23 Cb 0.32 -3.82 0.00 0.00 -0.53 0.00 0.00 39.78 35.74 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 -0.09 0.00 -4.76 1.20 3.02 -1.26 -4.96 115.26 108.41 1pis n ASN 24 Ca 0.00 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.19 1pis n ASN 24 Cb 0.00 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.20 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 2.46 0.21 3.10 1.13 -1.22 -4.37 117.35 118.66 1pis s TYR 25 Ca 0.00 1.50 0.00 0.00 -1.41 0.00 0.00 57.07 57.16 1pis s TYR 25 Cb 0.00 -3.50 0.00 0.00 -1.10 0.00 0.00 41.96 37.36 1pis s TYR 25 CO 0.00 -2.16 0.00 0.41 -2.51 0.00 0.00 175.55 171.29 1pis n GLY 26 N 0.51 -1.99 0.07 5.49 0.00 0.09 -4.71 105.19 104.65 1pis n GLY 26 Ca 0.12 -1.32 -0.08 0.00 0.00 0.00 0.00 46.02 44.74 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 -3.27 -0.34 -4.07 0.00 4.11 -1.26 -5.03 117.16 107.30 1pis n TYR 28 Ca -0.06 -3.53 -0.30 0.00 -0.00 0.00 0.00 57.90 54.01 1pis n TYR 28 Cb 0.98 -0.23 -0.16 0.00 -0.00 0.00 0.00 39.34 39.93 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 4.71 3.33 3.58 0.00 0.00 -1.26 -5.00 105.19 110.55 1pis n GLY 30 Ca -0.17 -1.92 -0.41 0.00 0.00 0.00 0.00 46.02 43.52 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 3.41 0.00 0.99 1.43 -1.26 -4.62 118.68 118.63 1pis s LEU 31 Ca 0.00 0.93 0.00 0.00 -1.03 0.00 0.00 54.13 54.03 1pis s LEU 31 Cb 0.00 -3.04 0.00 0.00 0.03 0.00 0.00 46.19 43.18 1pis s LEU 31 CO 0.00 -2.08 0.00 0.61 0.23 0.00 0.00 176.35 175.11 1pis n GLY 32 N 5.59 -0.89 0.00 -3.19 0.00 -1.26 -5.12 105.19 100.32 1pis n GLY 32 Ca 0.23 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.63 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 -0.64 -0.23 0.00 -0.02 0.00 -1.26 -4.72 105.19 98.32 1pis n GLY 33 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 0.00 0.00 1.61 3.41 -1.26 -4.94 113.62 112.44 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 0.48 0.00 5.00 0.00 -1.26 -5.15 105.19 104.26 1pis n GLY 35 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -5.16 114.28 116.13 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 2.26 0.00 1.09 -0.02 -1.26 -4.63 135.00 132.44 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 -0.04 0.00 -3.81 -1.45 0.24 -1.25 -4.38 118.33 107.64 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 -0.39 -0.02 0.00 -1.47 0.00 0.00 33.84 31.97 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 0.62 6.24 0.00 -1.34 2.15 -1.26 -5.06 116.67 118.02 1pis s ASP 39 Ca 0.00 0.04 0.03 0.00 0.43 0.00 0.00 52.55 53.05 1pis s ASP 39 Cb 0.00 -1.73 0.19 0.00 -0.30 0.00 0.00 42.92 41.09 1pis s ASP 39 CO 0.00 -0.17 0.61 -1.84 -0.17 0.00 0.00 175.17 173.60 1pis n GLU 40 N -1.49 0.12 0.07 4.34 0.00 -1.26 -2.40 120.64 120.03 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 0.57 -1.41 0.43 0.00 0.00 0.00 0.00 31.44 31.03 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 -0.91 0.61 -0.18 -1.84 7.94 -0.93 -1.30 117.00 120.37 1pis n LEU 41 Ca 0.02 0.51 -0.09 0.00 -1.11 0.00 0.00 56.01 55.34 1pis n LEU 41 Cb 0.01 -0.35 0.03 0.00 0.53 0.00 0.00 43.42 43.65 1pis n LEU 41 CO 0.02 -0.12 0.78 -0.78 -1.11 0.00 0.00 177.39 176.17 1pis h ASP 42 N 0.00 1.01 0.00 1.96 1.82 -1.76 -3.31 116.42 116.15 1pis h ASP 42 Ca 0.00 -0.32 0.00 0.00 -0.39 0.00 0.00 57.03 56.32 1pis h ASP 42 Cb 0.68 -0.27 0.00 0.00 0.68 0.00 0.00 39.33 40.41 1pis h ASP 42 CO 0.00 1.10 0.07 -1.14 -1.61 0.00 0.00 179.24 177.67 1pis n ARG 43 N -4.15 0.12 0.05 0.28 0.00 -0.42 -1.73 116.66 110.79 1pis n ARG 43 Ca 0.02 0.61 -0.13 0.00 -0.00 0.00 0.00 57.85 58.35 1pis n ARG 43 Cb 0.38 -1.95 -0.09 0.00 0.00 0.00 0.00 32.46 30.80 1pis n ARG 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1pis h GLU 46 N 0.20 0.22 0.03 0.00 4.57 -1.34 -3.37 114.58 114.89 1pis h GLU 46 Ca 0.09 -0.38 -0.00 0.00 -1.18 0.00 0.00 59.36 57.89 1pis h GLU 46 Cb 1.25 0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.98 1pis h GLU 46 CO 0.16 1.18 -0.02 1.15 -1.18 0.00 0.00 179.01 180.30 1pis h THR 47 N -0.52 1.13 0.00 0.32 2.02 -1.54 -3.21 112.91 111.11 1pis h THR 47 Ca -0.13 -1.71 0.00 0.00 0.77 0.00 0.00 66.41 65.34 1pis h THR 47 Cb 1.51 2.08 0.00 0.00 -1.74 0.00 0.00 68.15 70.00 1pis h THR 47 CO 0.10 0.36 0.00 1.57 0.37 0.00 0.00 175.52 177.92 1pis n HIS 48 N -4.73 0.00 -0.12 3.16 -0.00 -0.88 -0.95 115.22 111.70 1pis n HIS 48 Ca -0.07 0.00 -0.16 0.00 -0.00 0.00 0.00 57.72 57.49 1pis n HIS 48 Cb 0.30 0.00 -0.13 0.00 -0.00 0.00 0.00 29.99 30.17 1pis n HIS 48 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 1pis n ASP 49 N -0.63 1.55 0.01 0.26 5.75 -1.25 -4.25 116.55 117.98 1pis n ASP 49 Ca 0.03 -0.11 -0.08 0.00 -0.01 0.00 0.00 54.79 54.62 1pis n ASP 49 Cb 0.01 -0.10 -0.13 0.00 -1.03 0.00 0.00 41.12 39.87 1pis n ASP 49 CO 0.00 0.00 0.00 -1.13 -0.11 0.00 0.00 177.20 175.96 1pis h ASN 50 N 0.00 0.00 -0.37 -1.12 -1.24 -1.46 0.22 115.58 111.60 1pis h ASN 50 Ca -0.57 0.00 0.01 0.00 0.71 0.00 0.00 56.30 56.44 1pis h ASN 50 Cb 1.98 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 41.01 1pis h ASN 50 CO -0.06 0.99 0.24 0.00 -1.29 0.00 0.00 177.43 177.31 1pis h TYR 52 N 0.49 0.00 -0.03 0.00 -1.99 -1.74 -1.80 116.97 111.91 1pis h TYR 52 Ca 0.14 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.87 1pis h TYR 52 Cb -0.04 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.69 1pis h TYR 52 CO -0.06 0.00 0.01 0.00 -0.00 0.00 0.00 178.16 178.11 1pis h ARG 53 N 0.00 0.04 0.00 4.88 2.47 -0.77 -1.93 114.38 119.07 1pis h ARG 53 Ca 0.01 -0.01 -0.02 0.00 -1.26 0.00 0.00 59.98 58.70 1pis h ARG 53 Cb 0.06 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.37 1pis h ARG 53 CO -0.00 0.24 -0.11 -0.44 0.56 0.00 0.00 179.97 180.22 1pis h ASP 54 N -0.17 0.00 -0.24 7.04 3.32 -1.34 -3.06 116.42 121.98 1pis h ASP 54 Ca 0.01 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.94 1pis h ASP 54 Cb 0.22 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 1pis h ASP 54 CO -0.00 0.11 -0.31 0.00 -1.72 0.00 0.00 179.24 177.31 1pis h ALA 55 N 1.89 0.36 -0.33 3.45 0.00 -1.24 -3.24 119.26 120.15 1pis h ALA 55 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1pis h ALA 55 Cb 0.31 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1pis h ALA 55 CO 0.01 0.39 0.21 1.57 0.00 0.00 0.00 179.25 181.44 1pis h LYS 56 N 0.34 0.44 0.00 0.00 5.09 -1.25 -2.82 116.57 118.37 1pis h LYS 56 Ca 0.03 -0.03 0.00 0.00 0.09 0.00 0.00 60.65 60.74 1pis h LYS 56 Cb 0.89 -0.10 0.00 0.00 0.10 0.00 0.00 32.23 33.12 1pis h LYS 56 CO 0.07 0.30 0.00 -1.71 -2.09 0.00 0.00 179.45 176.02 1pis n ASN 57 N -4.48 0.00 -4.65 7.07 5.15 -1.17 -4.53 115.26 112.65 1pis n ASN 57 Ca 0.02 0.09 -0.43 0.00 -0.60 0.00 0.00 54.58 53.66 1pis n ASN 57 Cb 0.07 -0.31 -0.02 0.00 -0.53 0.00 0.00 39.78 38.99 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 -2.62 4.04 0.30 1.20 2.96 -1.07 -4.98 118.68 118.51 1pis s LEU 58 Ca 0.15 1.30 0.01 0.00 -0.22 0.00 0.00 54.13 55.37 1pis s LEU 58 Cb 0.11 -3.54 0.72 0.00 0.50 0.00 0.00 46.19 43.98 1pis s LEU 58 CO 0.27 -0.76 1.60 -2.24 -1.32 0.00 0.00 176.35 173.89 1pis h ASP 59 N 7.81 -0.34 -0.60 3.68 2.03 -1.92 -3.02 116.42 124.06 1pis h ASP 59 Ca -0.20 0.25 -0.02 0.00 -0.73 0.00 0.00 57.03 56.32 1pis h ASP 59 Cb 1.07 0.42 -0.03 0.00 -0.83 0.00 0.00 39.33 39.95 1pis h ASP 59 CO 1.00 -0.29 0.28 0.28 -1.03 0.00 0.00 179.24 179.47 1pis h SER 60 N 0.06 0.79 -3.05 4.15 0.02 -1.96 -3.40 113.55 110.16 1pis h SER 60 Ca 0.57 -0.14 -0.46 0.00 -0.84 0.00 0.00 61.79 60.92 1pis h SER 60 Cb 1.17 -0.20 -0.41 0.00 0.14 0.00 0.00 62.40 63.10 1pis h SER 60 CO -0.83 0.71 -0.75 0.00 -1.14 0.00 0.00 176.83 174.82 1pis s LYS 62 N 2.13 3.81 -0.03 0.00 -0.14 -1.22 -4.60 119.74 119.68 1pis s LYS 62 Ca 0.02 0.25 -0.00 0.00 -1.36 0.00 0.00 55.97 54.88 1pis s LYS 62 Cb -0.16 -3.06 0.01 0.00 -1.68 0.00 0.00 37.83 32.94 1pis s LYS 62 CO -0.10 0.60 2.09 1.19 -0.76 0.00 0.00 175.35 178.37 1pis n PHE 63 N 1.17 0.14 0.21 3.18 3.01 -1.26 -1.13 117.46 122.77 1pis n PHE 63 Ca -0.10 -1.12 0.06 0.00 1.01 0.00 0.00 57.45 57.30 1pis n PHE 63 Cb 0.52 -0.60 0.45 0.00 -0.01 0.00 0.00 39.48 39.85 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 3.06 0.00 -8.48 4.37 4.07 -1.97 -3.41 115.31 112.95 1pis h LEU 64 Ca 0.04 0.00 -0.47 0.00 0.08 0.00 0.00 57.88 57.52 1pis h LEU 64 Cb 1.02 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.73 1pis h LEU 64 CO 0.08 0.30 1.33 0.68 -1.08 0.00 0.00 178.44 179.75 1pis s VAL 65 N -4.15 3.31 0.13 1.22 -7.23 -0.29 -4.93 120.40 108.46 1pis s VAL 65 Ca -0.02 0.13 -0.14 0.00 -1.81 0.00 0.00 61.98 60.14 1pis s VAL 65 Cb 0.14 -3.82 -0.01 0.00 0.56 0.00 0.00 36.38 33.25 1pis s VAL 65 CO 0.68 -0.80 1.58 -2.24 -0.31 0.00 0.00 175.10 174.02 1pis h ASP 66 N 15.23 0.75 -1.59 4.85 2.03 -1.89 -3.41 116.42 132.37 1pis h ASP 66 Ca -0.23 -0.31 -0.33 0.00 -0.73 0.00 0.00 57.03 55.43 1pis h ASP 66 Cb 1.16 -0.20 -0.26 0.00 -0.83 0.00 0.00 39.33 39.20 1pis h ASP 66 CO 1.21 0.87 -0.69 0.54 -1.03 0.00 0.00 179.24 180.14 1pis s ASN 67 N -6.26 -0.15 0.57 4.15 2.20 -1.26 -5.05 114.94 109.14 1pis s ASN 67 Ca -0.13 -2.18 0.34 0.00 -0.94 0.00 0.00 52.86 49.95 1pis s ASN 67 Cb 0.11 0.91 1.69 0.00 -2.00 0.00 0.00 41.25 41.96 1pis s ASN 67 CO 0.80 -0.12 2.13 -0.65 -2.94 0.00 0.00 177.10 176.32 1pis h PRO 68 N 5.52 0.00 -1.66 3.55 0.11 -1.97 -3.22 132.00 134.32 1pis h PRO 68 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1pis h PRO 68 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1pis h PRO 68 CO 0.16 0.06 0.00 2.48 -0.21 0.00 0.00 178.00 180.49 1pis n TYR 69 N -3.35 0.00 0.03 0.65 0.18 -1.26 -4.35 117.16 109.06 1pis n TYR 69 Ca -0.01 -0.47 0.00 0.00 1.88 0.00 0.00 57.90 59.30 1pis n TYR 69 Cb 0.21 -0.30 0.00 0.00 -0.38 0.00 0.00 39.34 38.88 1pis n TYR 69 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1pis n THR 70 N 1.15 0.00 -3.11 -3.48 -2.24 -1.22 -4.42 114.28 100.96 1pis n THR 70 Ca 0.00 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.54 1pis n THR 70 Cb 0.32 -0.07 -0.05 0.00 -2.10 0.00 0.00 70.33 68.44 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 -2.66 2.13 0.00 -0.78 1.02 -1.26 -4.32 120.64 114.77 1pis n GLU 71 Ca 0.00 -4.18 0.00 0.00 -0.02 0.00 0.00 57.16 52.96 1pis n GLU 71 Cb 0.00 -1.96 0.00 0.00 -0.02 0.00 0.00 31.44 29.46 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 0.24 0.00 -4.89 1.62 3.41 -1.26 -5.06 113.62 107.69 1pis n SER 72 Ca 0.28 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.59 1pis n SER 72 Cb 0.50 0.46 0.01 0.00 -0.26 0.00 0.00 64.21 64.92 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 -0.99 3.53 0.00 7.33 -0.85 -1.26 -5.12 117.35 119.98 1pis s TYR 73 Ca 0.00 1.07 0.00 0.00 -0.52 0.00 0.00 57.07 57.62 1pis s TYR 73 Cb 0.00 -2.67 0.00 0.00 0.38 0.00 0.00 41.96 39.67 1pis s TYR 73 CO 0.00 -0.67 0.00 -1.13 -1.52 0.00 0.00 175.55 172.23 1pis n SER 74 N -2.65 0.72 -3.45 -0.18 3.41 -1.26 -4.97 113.62 105.24 1pis n SER 74 Ca 0.05 -0.55 -0.13 0.00 -0.26 0.00 0.00 58.87 57.97 1pis n SER 74 Cb 0.55 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.45 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 -1.03 0.94 0.47 7.33 1.13 -1.26 -1.68 117.35 123.26 1pis s TYR 75 Ca 0.00 -1.20 0.06 0.00 -1.41 0.00 0.00 57.07 54.52 1pis s TYR 75 Cb 0.00 -0.07 -0.01 0.00 -1.10 0.00 0.00 41.96 40.78 1pis s TYR 75 CO 0.00 -1.07 0.25 0.45 -2.51 0.00 0.00 175.55 172.67 1pis s SER 76 N -3.19 4.52 -0.13 -0.18 0.15 -1.24 -4.67 113.70 108.96 1pis s SER 76 Ca 0.30 -1.17 -0.26 0.00 0.70 0.00 0.00 55.95 55.51 1pis s SER 76 Cb 0.00 -0.06 0.06 0.00 -1.71 0.00 0.00 66.02 64.31 1pis s SER 76 CO 0.18 -0.78 0.64 0.00 1.20 0.00 0.00 173.24 174.47 1pis n SER 78 N 1.73 0.00 0.19 0.00 2.88 -1.08 -4.73 113.62 112.61 1pis n SER 78 Ca -0.17 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.22 1pis n SER 78 Cb 0.56 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.95 1pis n SER 78 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 1pis h ASN 79 N 0.00 -0.90 -0.55 -3.46 -0.73 -1.98 -3.34 115.58 104.62 1pis h ASN 79 Ca 0.00 0.09 -0.29 0.00 1.87 0.00 0.00 56.30 57.96 1pis h ASN 79 Cb 0.00 0.31 -0.40 0.00 0.27 0.00 0.00 38.32 38.50 1pis h ASN 79 CO 0.00 -0.45 -1.09 0.35 -0.37 0.00 0.00 177.43 175.87 1pis n THR 80 N -5.44 1.39 -2.39 -3.57 -2.24 -1.26 -4.77 114.28 96.00 1pis n THR 80 Ca -0.09 -3.11 -0.37 0.00 -2.27 0.00 0.00 64.05 58.21 1pis n THR 80 Cb 0.34 0.92 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 1pis n THR 80 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1pis s GLU 81 N -3.70 3.41 -0.16 -0.78 -6.30 -1.25 -4.57 118.70 105.34 1pis s GLU 81 Ca 0.30 -1.54 -0.09 0.00 -2.50 0.00 0.00 54.97 51.14 1pis s GLU 81 Cb 0.35 -5.40 -0.05 0.00 0.00 0.00 0.00 34.13 29.03 1pis s GLU 81 CO -0.02 -2.84 0.14 0.42 0.02 0.00 0.00 175.26 172.98 1pis s ILE 82 N 6.72 5.45 0.00 -3.70 1.01 -1.26 -2.44 121.20 126.97 1pis s ILE 82 Ca 0.58 0.21 0.00 0.00 0.00 0.00 0.00 60.65 61.45 1pis s ILE 82 Cb 0.01 -3.45 0.00 0.00 0.01 0.00 0.00 42.46 39.04 1pis s ILE 82 CO 0.07 0.52 0.00 1.07 0.00 0.00 0.00 174.94 176.60 1pis n THR 83 N 2.85 0.00 -4.00 2.92 5.66 -1.26 -4.87 114.28 115.58 1pis n THR 83 Ca -0.18 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.70 1pis n THR 83 Cb 0.53 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.29 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 -3.18 6.37 0.48 0.00 3.84 -0.67 -3.59 114.94 118.19 1pis s ASN 85 Ca 0.26 1.61 0.27 0.00 0.21 0.00 0.00 52.86 55.20 1pis s ASN 85 Cb -0.02 -2.53 1.15 0.00 -0.55 0.00 0.00 41.25 39.30 1pis s ASN 85 CO 0.17 -1.27 1.92 -1.28 -2.79 0.00 0.00 177.10 173.86 1pis h SER 86 N 10.75 0.00 0.00 -4.21 0.87 -1.94 0.26 113.55 119.28 1pis h SER 86 Ca -0.34 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 1pis h SER 86 Cb 1.15 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1pis h SER 86 CO 1.00 0.16 0.63 0.07 -0.53 0.00 0.00 176.83 178.16 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 0.60 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 1pis h LYS 87 CO 0.02 0.00 0.00 -1.71 -2.00 0.00 0.00 179.45 175.76 1pis n ASN 88 N -2.49 0.00 0.00 7.07 5.15 0.92 -5.04 115.26 120.88 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 0.65 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 0.00 0.00 0.00 1.20 2.85 -1.26 -4.89 115.26 113.16 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 -0.01 5.20 0.00 -1.26 -4.37 120.51 117.07 1pis n ALA 90 Ca 0.00 -0.02 -0.17 0.00 0.00 0.00 0.00 53.44 53.25 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 0.19 0.14 -0.43 0.00 3.07 -1.92 -2.53 114.58 113.11 1pis h GLU 92 Ca -0.06 -0.01 -0.08 0.00 -0.50 0.00 0.00 59.36 58.72 1pis h GLU 92 Cb 1.31 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 29.17 1pis h GLU 92 CO 0.13 0.09 -0.05 0.00 -1.40 0.00 0.00 179.01 177.79 1pis h ALA 93 N 1.70 1.12 0.73 3.43 0.00 -1.75 -2.19 119.26 122.30 1pis h ALA 93 Ca 0.43 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1pis h ALA 93 Cb 0.77 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1pis h ALA 93 CO -0.64 0.56 -0.40 0.35 0.00 0.00 0.00 179.25 179.12 1pis h PHE 94 N 0.67 -1.06 -0.53 0.00 3.04 -1.04 -2.01 116.94 116.01 1pis h PHE 94 Ca 0.13 -0.02 -0.06 0.00 3.98 0.00 0.00 57.97 62.00 1pis h PHE 94 Cb 0.48 0.37 -0.02 0.00 2.56 0.00 0.00 35.95 39.33 1pis h PHE 94 CO 0.02 -0.62 0.10 -0.84 -2.02 0.00 0.00 178.31 174.96 1pis h ILE 95 N -1.04 1.23 -0.24 1.41 -2.65 -1.60 -2.38 117.51 112.23 1pis h ILE 95 Ca -0.10 -0.86 0.07 0.00 1.03 0.00 0.00 64.86 65.00 1pis h ILE 95 Cb 0.82 0.71 -0.01 0.00 -2.05 0.00 0.00 36.82 36.29 1pis h ILE 95 CO 0.13 0.32 0.19 0.00 0.03 0.00 0.00 178.15 178.82 1pis h ASN 97 N 0.00 0.42 0.02 0.00 -0.73 -0.82 0.68 115.58 115.15 1pis h ASN 97 Ca 0.11 -0.31 -0.00 0.00 1.87 0.00 0.00 56.30 57.97 1pis h ASN 97 Cb 0.50 -0.13 0.00 0.00 0.27 0.00 0.00 38.32 38.97 1pis h ASN 97 CO -0.00 1.08 -0.01 0.00 -0.37 0.00 0.00 177.43 178.13 1pis h ASP 99 N -0.43 0.00 0.58 0.00 3.58 -1.29 -1.14 116.42 117.72 1pis h ASP 99 Ca -0.00 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.42 1pis h ASP 99 Cb 0.41 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.47 1pis h ASP 99 CO 0.00 0.05 -0.28 0.08 -2.88 0.00 0.00 179.24 176.22 1pis h ARG 100 N 0.00 -0.74 -1.06 0.28 0.11 -0.91 -3.04 114.38 109.02 1pis h ARG 100 Ca -0.00 0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.13 1pis h ARG 100 Cb 0.22 0.17 0.00 0.00 1.11 0.00 0.00 29.97 31.47 1pis h ARG 100 CO 0.01 -0.49 0.00 -1.71 0.10 0.00 0.00 179.97 177.88 1pis n ASN 101 N -5.29 1.97 -0.07 0.08 2.85 -1.06 -0.91 115.26 112.83 1pis n ASN 101 Ca -0.10 -1.67 -0.06 0.00 -0.11 0.00 0.00 54.58 52.64 1pis n ASN 101 Cb 0.31 -0.42 -0.02 0.00 1.24 0.00 0.00 39.78 40.89 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 0.42 0.62 -0.03 5.20 0.00 -0.44 -4.37 120.51 121.91 1pis n ALA 102 Ca 0.00 -0.59 -0.12 0.00 0.00 0.00 0.00 53.44 52.73 1pis n ALA 102 Cb 0.35 0.02 -0.07 0.00 0.00 0.00 0.00 19.45 19.75 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 -1.07 0.13 -0.16 0.00 0.00 -0.90 -1.74 119.26 115.53 1pis h ALA 103 Ca 0.00 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.78 1pis h ALA 103 Cb 0.70 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1pis h ALA 103 CO 0.00 -0.19 -0.10 0.82 0.00 0.00 0.00 179.25 179.78 1pis h ILE 104 N -0.09 0.70 0.00 0.00 2.04 -1.36 -3.30 117.51 115.49 1pis h ILE 104 Ca 0.03 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.88 1pis h ILE 104 Cb 0.34 0.70 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1pis h ILE 104 CO 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 178.15 178.11 1pis h PHE 106 N 0.00 0.00 0.00 0.00 0.04 -1.40 -1.61 116.94 113.98 1pis h PHE 106 Ca -0.00 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.64 1pis h PHE 106 Cb 0.14 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.27 1pis h PHE 106 CO 0.00 0.35 -0.80 1.03 -0.60 0.00 0.00 178.31 178.29 1pis h SER 107 N 0.00 0.00 -0.01 2.17 0.87 -1.47 -3.38 113.55 111.73 1pis h SER 107 Ca -0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1pis h SER 107 Cb 0.84 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.80 1pis h SER 107 CO 0.05 0.53 -0.01 0.11 -0.53 0.00 0.00 176.83 176.97 1pis h LYS 108 N 0.00 0.02 -6.79 2.24 1.57 -0.93 -3.47 116.57 109.21 1pis h LYS 108 Ca -0.05 -0.01 -0.50 0.00 -1.87 0.00 0.00 60.65 58.22 1pis h LYS 108 Cb 1.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.76 1pis h LYS 108 CO 0.06 0.56 0.43 0.00 -0.57 0.00 0.00 179.45 179.93 1pis s ALA 109 N -4.04 3.37 0.04 3.86 0.00 -0.61 -5.06 121.76 119.32 1pis s ALA 109 Ca -0.16 0.79 -0.38 0.00 0.00 0.00 0.00 51.96 52.21 1pis s ALA 109 Cb 0.01 -3.28 -0.19 0.00 0.00 0.00 0.00 23.12 19.66 1pis s ALA 109 CO 0.68 -0.03 1.02 -2.30 0.00 0.00 0.00 175.76 175.13 1pis n PRO 110 N 1.25 0.11 -4.47 0.00 -0.02 -1.26 -4.81 135.00 125.79 1pis n PRO 110 Ca -0.01 0.04 -0.31 0.00 -2.02 0.00 0.00 63.50 61.19 1pis n PRO 110 Cb 0.46 -1.48 -0.11 0.00 -0.02 0.00 0.00 33.50 32.34 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 -0.10 2.76 -0.20 6.00 5.04 -1.26 -2.20 117.35 127.39 1pis s TYR 111 Ca 0.87 -0.13 0.01 0.00 -2.44 0.00 0.00 57.07 55.38 1pis s TYR 111 Cb -1.19 -1.53 0.03 0.00 0.35 0.00 0.00 41.96 39.62 1pis s TYR 111 CO 0.56 0.35 -0.17 -0.80 -1.34 0.00 0.00 175.55 174.15 1pis s ASN 112 N -1.59 3.38 0.00 4.32 -0.87 -1.26 -5.03 114.94 113.89 1pis s ASN 112 Ca 0.17 -0.81 -0.01 0.00 -1.57 0.00 0.00 52.86 50.65 1pis s ASN 112 Cb -0.11 -1.46 -0.05 0.00 -0.02 0.00 0.00 41.25 39.61 1pis s ASN 112 CO 0.08 -0.05 1.86 2.29 -2.57 0.00 0.00 177.10 178.71 1pis n LYS 113 N 4.60 0.95 0.12 -0.60 2.85 -1.26 -4.03 118.16 120.79 1pis n LYS 113 Ca -0.19 -0.19 0.00 0.00 -1.05 0.00 0.00 58.31 56.88 1pis n LYS 113 Cb 0.48 -1.31 0.00 0.00 -0.65 0.00 0.00 35.03 33.55 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 1.87 0.00 0.00 -1.58 -0.58 -1.26 -4.49 120.64 114.59 1pis n GLU 114 Ca 0.08 0.00 0.05 0.00 -0.42 0.00 0.00 57.16 56.87 1pis n GLU 114 Cb 0.46 0.00 0.29 0.00 -0.57 0.00 0.00 31.44 31.61 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 -3.22 0.00 0.30 -0.32 8.25 -1.26 -4.56 115.22 114.41 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 0.00 0.89 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 0.00 0.00 -2.19 -0.41 3.64 -1.79 0.37 116.57 116.19 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 0.00 0.00 -0.34 0.00 -0.41 0.00 0.00 32.23 31.48 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 -5.56 1.83 0.78 4.20 2.47 -1.26 -3.46 114.94 113.94 1pis s ASN 117 Ca -0.02 -1.24 -0.12 0.00 0.42 0.00 0.00 52.86 51.91 1pis s ASN 117 Cb 0.11 0.34 0.06 0.00 -1.45 0.00 0.00 41.25 40.32 1pis s ASN 117 CO 0.50 -0.34 1.15 -0.22 -3.72 0.00 0.00 177.10 174.47 1pis s LEU 118 N 1.89 2.61 0.24 3.21 2.96 -1.06 -5.04 118.68 123.49 1pis s LEU 118 Ca 0.13 0.90 0.21 0.00 -0.22 0.00 0.00 54.13 55.15 1pis s LEU 118 Cb -0.16 -3.48 0.05 0.00 0.50 0.00 0.00 46.19 43.11 1pis s LEU 118 CO -0.20 -1.76 1.17 0.44 -1.32 0.00 0.00 176.35 174.68 1pis h ASP 119 N -0.95 0.00 -3.12 3.68 3.32 -1.87 -3.51 116.42 113.97 1pis h ASP 119 Ca -0.46 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.01 1pis h ASP 119 Cb 1.31 0.00 0.15 0.00 0.22 0.00 0.00 39.33 41.01 1pis h ASP 119 CO 0.65 0.17 -0.07 1.07 -1.72 0.00 0.00 179.24 179.34 1pis n THR 120 N -2.88 2.71 0.00 0.35 5.66 -1.26 -4.29 114.28 114.58 1pis n THR 120 Ca -0.01 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.49 1pis n THR 120 Cb 0.63 -0.95 0.00 0.00 -1.55 0.00 0.00 70.33 68.45 1pis n THR 120 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1pis n LYS 121 N -0.23 0.00 0.13 1.09 0.00 -1.26 -4.92 118.16 112.97 1pis n LYS 121 Ca 0.12 0.00 -0.05 0.00 0.00 0.00 0.00 58.31 58.37 1pis n LYS 121 Cb 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.45 1pis n LYS 121 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 1pis h LYS 122 N 0.00 -0.33 -0.64 1.64 6.56 -2.03 -3.42 116.57 118.35 1pis h LYS 122 Ca 0.00 0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1pis h LYS 122 Cb 0.00 0.08 0.00 0.00 -0.57 0.00 0.00 32.23 31.74 1pis h LYS 122 CO 0.00 -0.22 0.00 0.66 -2.06 0.00 0.00 179.45 177.83 1pis n TYR 123 N -3.36 0.93 -0.97 -1.35 4.01 -1.26 -5.14 117.16 110.02 1pis n TYR 123 Ca -0.04 -0.44 0.00 0.00 -0.16 0.00 0.00 57.90 57.26 1pis n TYR 123 Cb 0.14 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 1pis n TYR 123 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40