#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 -0.04 0.00 7.94 -1.26 -4.80 117.00 118.84 1pis n LEU 2 Ca 0.00 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.80 1pis n LEU 2 Cb 0.00 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 43.81 1pis n LEU 2 CO 0.00 0.00 -0.69 -2.67 -1.11 0.00 0.00 177.39 172.92 1pis n TRP 3 N -0.08 0.77 0.35 1.96 4.27 -1.26 -3.72 117.44 119.73 1pis n TRP 3 Ca 0.00 0.27 0.10 0.00 -3.89 0.00 0.00 57.50 53.98 1pis n TRP 3 Cb 0.00 -1.14 0.43 0.00 -1.36 0.00 0.00 31.31 29.24 1pis n TRP 3 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1pis n GLN 4 N -3.00 0.13 -0.35 -2.67 0.00 -1.26 -2.19 117.38 108.04 1pis n GLN 4 Ca -0.21 0.43 0.08 0.00 0.00 0.00 0.00 57.00 57.29 1pis n GLN 4 Cb 1.08 -1.78 0.26 0.00 0.00 0.00 0.00 30.24 29.79 1pis n GLN 4 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 1pis h PHE 5 N 0.00 1.11 0.61 2.61 3.57 -1.82 -1.00 116.94 122.03 1pis h PHE 5 Ca 0.00 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 1pis h PHE 5 Cb 0.25 -0.35 0.01 0.00 2.79 0.00 0.00 35.95 38.64 1pis h PHE 5 CO 0.00 0.43 -0.30 0.00 -2.23 0.00 0.00 178.31 176.22 1pis h ARG 6 N 0.96 -0.80 -0.70 1.11 -0.00 -1.66 -1.72 114.38 111.57 1pis h ARG 6 Ca 0.49 0.05 0.29 0.00 -0.50 0.00 0.00 59.98 60.32 1pis h ARG 6 Cb 0.52 0.18 -0.13 0.00 0.00 0.00 0.00 29.97 30.54 1pis h ARG 6 CO -0.26 -0.49 0.35 0.45 0.00 0.00 0.00 179.97 180.02 1pis n SER 7 N -5.40 0.22 0.17 7.04 2.88 -1.19 -2.41 113.62 114.93 1pis n SER 7 Ca -0.13 1.17 -0.07 0.00 -1.33 0.00 0.00 58.87 58.51 1pis n SER 7 Cb 0.35 -0.56 -0.04 0.00 -0.75 0.00 0.00 64.21 63.22 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 -0.47 0.00 -1.46 -1.53 -0.84 -3.25 114.93 107.39 1pis h MET 8 Ca 0.58 0.03 0.00 0.00 -3.44 0.00 0.00 59.70 56.88 1pis h MET 8 Cb 1.53 0.11 0.00 0.00 -0.55 0.00 0.00 31.60 32.69 1pis h MET 8 CO -0.55 -0.31 0.00 -0.89 0.14 0.00 0.00 176.91 175.30 1pis n ILE 9 N -4.30 0.00 -0.06 1.77 5.41 -0.68 -2.22 119.36 119.28 1pis n ILE 9 Ca -0.06 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.62 1pis n ILE 9 Cb 0.19 -0.54 -0.06 0.00 -0.71 0.00 0.00 39.64 38.53 1pis n ILE 9 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1pis h LYS 10 N 0.00 0.00 -0.65 0.38 6.56 -1.55 -3.22 116.57 118.09 1pis h LYS 10 Ca 0.00 0.00 0.07 0.00 -1.06 0.00 0.00 60.65 59.66 1pis h LYS 10 Cb 0.00 0.00 -0.08 0.00 -0.57 0.00 0.00 32.23 31.58 1pis h LYS 10 CO 0.00 0.42 -0.36 0.00 -2.06 0.00 0.00 179.45 177.45 1pis n ALA 12 N -3.54 2.53 -3.84 0.00 0.00 -1.08 -4.68 120.51 109.90 1pis n ALA 12 Ca 0.02 -0.52 -0.30 0.00 0.00 0.00 0.00 53.44 52.64 1pis n ALA 12 Cb 0.19 -1.10 -0.11 0.00 0.00 0.00 0.00 19.45 18.43 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 -1.85 3.26 -0.50 0.00 -1.09 -1.18 -4.51 121.20 115.34 1pis s ILE 13 Ca 0.34 -4.15 -0.26 0.00 -2.23 0.00 0.00 60.65 54.35 1pis s ILE 13 Cb 0.19 -3.11 -0.06 0.00 -1.58 0.00 0.00 42.46 37.91 1pis s ILE 13 CO 0.29 -1.02 2.26 -2.84 -1.23 0.00 0.00 174.94 172.40 1pis s PRO 14 N -1.40 2.31 0.00 2.79 0.02 -1.26 -4.16 135.00 133.30 1pis s PRO 14 Ca 0.25 1.27 0.00 0.00 0.02 0.00 0.00 61.00 62.54 1pis s PRO 14 Cb -0.06 -4.52 0.00 0.00 0.02 0.00 0.00 34.50 29.94 1pis s PRO 14 CO -0.15 -3.05 0.00 0.41 -0.33 0.00 0.00 177.00 173.88 1pis n GLY 15 N 5.90 2.24 3.68 0.52 0.00 -1.26 -5.07 105.19 111.20 1pis n GLY 15 Ca 0.32 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 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 1.77 0.95 -4.50 1.61 7.64 -1.26 -5.03 113.62 114.80 1pis n SER 16 Ca 0.00 0.61 -0.38 0.00 1.01 0.00 0.00 58.87 60.10 1pis n SER 16 Cb 0.00 -1.49 -0.11 0.00 -1.01 0.00 0.00 64.21 61.59 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 -2.04 3.18 0.13 1.43 3.76 -1.26 -4.84 115.29 115.65 1pis s HIS 17 Ca 0.74 -0.29 0.00 0.00 -0.15 0.00 0.00 55.06 55.36 1pis s HIS 17 Cb -0.30 -2.36 0.00 0.00 1.11 0.00 0.00 32.58 31.03 1pis s HIS 17 CO 0.50 -0.34 0.00 -2.30 -0.85 0.00 0.00 174.74 171.76 1pis n PRO 18 N 5.01 0.99 0.00 8.40 -0.02 -1.26 -3.84 135.00 144.28 1pis n PRO 18 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.34 1pis n PRO 18 Cb 0.50 -0.26 0.00 0.00 -0.02 0.00 0.00 33.50 33.73 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 0.19 2.45 7.99 -1.26 -0.97 117.00 125.40 1pis n LEU 19 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 56.01 55.85 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 0.72 0.24 -1.51 0.00 0.00 177.39 176.84 1pis h MET 20 N 0.00 -0.41 0.03 3.23 2.86 -2.01 -1.87 114.93 116.76 1pis h MET 20 Ca 0.00 0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.58 1pis h MET 20 Cb 0.00 0.09 0.01 0.00 0.06 0.00 0.00 31.60 31.76 1pis h MET 20 CO 0.00 -0.23 -0.35 -0.44 1.06 0.00 0.00 176.91 176.95 1pis h ASP 21 N -0.50 0.26 0.39 1.22 5.19 -1.55 -3.45 116.42 117.98 1pis h ASP 21 Ca -0.04 -0.86 -0.02 0.00 -0.62 0.00 0.00 57.03 55.49 1pis h ASP 21 Cb 0.38 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.81 1pis h ASP 21 CO 0.07 1.09 -0.19 -0.26 -3.12 0.00 0.00 179.24 176.83 1pis h PHE 22 N -0.53 -0.48 -0.68 4.55 0.04 -1.04 -3.37 116.94 115.42 1pis h PHE 22 Ca -0.05 -0.01 0.05 0.00 2.80 0.00 0.00 57.97 60.76 1pis h PHE 22 Cb 1.17 0.16 -0.04 0.00 2.20 0.00 0.00 35.95 39.44 1pis h PHE 22 CO 0.20 -0.16 0.45 -0.97 -0.60 0.00 0.00 178.31 177.23 1pis h ASN 23 N -0.96 0.64 -0.44 2.17 -1.24 -1.59 -2.73 115.58 111.44 1pis h ASN 23 Ca -0.05 -0.00 -0.04 0.00 0.71 0.00 0.00 56.30 56.91 1pis h ASN 23 Cb 0.54 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.43 1pis h ASN 23 CO 0.09 0.42 0.13 0.78 -1.29 0.00 0.00 177.43 177.56 1pis h ASN 24 N 0.73 0.70 -4.01 1.15 2.35 -1.74 -3.48 115.58 111.29 1pis h ASN 24 Ca 0.29 -0.11 -0.47 0.00 -0.55 0.00 0.00 56.30 55.45 1pis h ASN 24 Cb 0.21 -0.18 0.15 0.00 0.05 0.00 0.00 38.32 38.55 1pis h ASN 24 CO -0.09 0.68 0.23 -0.72 -1.65 0.00 0.00 177.43 175.88 1pis s TYR 25 N -5.21 2.23 0.44 1.19 -0.85 -1.03 -4.28 117.35 109.84 1pis s TYR 25 Ca -0.09 1.18 0.00 0.00 -0.52 0.00 0.00 57.07 57.64 1pis s TYR 25 Cb 0.16 -3.19 0.00 0.00 0.38 0.00 0.00 41.96 39.31 1pis s TYR 25 CO 0.79 -2.57 0.00 0.41 -1.52 0.00 0.00 175.55 172.66 1pis n GLY 26 N -1.07 -2.55 0.08 5.49 0.00 -0.21 -4.83 105.19 102.10 1pis n GLY 26 Ca 0.06 -1.14 -0.05 0.00 0.00 0.00 0.00 46.02 44.90 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 -3.16 0.10 0.02 0.00 4.11 -1.26 -4.95 117.16 112.02 1pis n TYR 28 Ca -0.07 -3.66 0.04 0.00 -0.00 0.00 0.00 57.90 54.21 1pis n TYR 28 Cb 0.94 -0.38 0.08 0.00 -0.00 0.00 0.00 39.34 39.98 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 0.27 0.86 3.27 0.00 0.00 -1.26 -4.98 105.19 103.35 1pis n GLY 30 Ca 0.07 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 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 2.64 0.00 0.99 1.43 -1.26 -4.79 118.68 117.69 1pis s LEU 31 Ca 0.00 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 1pis s LEU 31 Cb 0.00 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.58 1pis s LEU 31 CO 0.00 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.22 1pis n GLY 32 N 4.44 1.07 2.68 -3.19 0.00 -1.26 -5.01 105.19 103.93 1pis n GLY 32 Ca -0.19 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.09 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 1.54 3.55 -0.02 0.00 -1.26 -4.95 105.19 104.05 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 1.82 0.00 1.61 3.41 -1.26 -4.74 113.62 114.46 1pis n SER 34 Ca 0.00 -1.16 0.00 0.00 -0.26 0.00 0.00 58.87 57.45 1pis n SER 34 Cb 0.00 -1.59 0.00 0.00 -0.26 0.00 0.00 64.21 62.36 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 6.53 0.73 0.00 5.00 0.00 -1.26 -5.16 105.19 111.04 1pis n GLY 35 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 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 -0.09 2.61 5.66 -1.26 -5.14 114.28 116.06 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 0.93 0.00 1.09 -0.02 -1.26 -4.69 135.00 131.05 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 -0.16 0.00 -3.61 -1.45 0.24 -1.22 -4.38 118.33 107.74 1pis n VAL 38 Ca 0.00 0.01 -0.23 0.00 -2.04 0.00 0.00 64.34 62.07 1pis n VAL 38 Cb 0.00 -0.64 -0.02 0.00 -1.47 0.00 0.00 33.84 31.71 1pis n VAL 38 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1pis s ASP 39 N 0.25 6.32 0.00 -1.34 1.11 -1.26 -5.04 116.67 116.70 1pis s ASP 39 Ca 0.00 0.33 0.00 0.00 0.18 0.00 0.00 52.55 53.06 1pis s ASP 39 Cb 0.00 -1.98 0.00 0.00 1.07 0.00 0.00 42.92 42.01 1pis s ASP 39 CO 0.00 -0.19 0.25 -1.84 1.18 0.00 0.00 175.17 174.57 1pis n GLU 40 N -1.50 0.00 0.15 8.23 0.00 -1.26 -2.48 120.64 123.77 1pis n GLU 40 Ca -0.06 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.22 1pis n GLU 40 Cb 0.56 -1.26 0.22 0.00 0.00 0.00 0.00 31.44 30.97 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 -1.27 -1.84 5.85 -1.80 0.09 115.31 116.34 1pis h LEU 41 Ca 0.00 -0.02 -0.07 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 -0.35 -0.78 -0.34 0.00 0.00 178.44 176.98 1pis h ASP 42 N 0.00 0.00 0.62 1.25 1.82 -1.81 -3.28 116.42 115.02 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 0.89 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.90 1pis h ASP 42 CO 0.00 0.35 0.00 -0.09 -1.61 0.00 0.00 179.24 177.89 1pis h ARG 43 N 0.00 0.00 0.03 0.28 1.12 -1.31 0.23 114.38 114.73 1pis h ARG 43 Ca -0.00 0.00 -0.22 0.00 -1.11 0.00 0.00 59.98 58.65 1pis h ARG 43 Cb 0.68 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 30.62 1pis h ARG 43 CO 0.05 0.00 -1.03 0.00 -3.11 0.00 0.00 179.97 175.88 1pis h GLU 46 N 0.77 -0.14 -0.02 0.00 4.22 -1.01 -0.02 114.58 118.38 1pis h GLU 46 Ca 0.16 0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.60 1pis h GLU 46 Cb 0.36 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1pis h GLU 46 CO 0.01 -0.09 -0.03 1.15 -2.18 0.00 0.00 179.01 177.86 1pis h THR 47 N -0.14 1.43 -0.02 0.32 2.02 -1.64 -2.44 112.91 112.42 1pis h THR 47 Ca 0.23 -1.31 0.01 0.00 0.77 0.00 0.00 66.41 66.11 1pis h THR 47 Cb 0.56 2.26 -0.00 0.00 -1.74 0.00 0.00 68.15 69.23 1pis h THR 47 CO -0.76 0.35 0.02 -0.74 0.37 0.00 0.00 175.52 174.75 1pis h HIS 48 N -0.46 0.01 0.03 3.16 -0.00 -1.54 -0.45 115.15 115.89 1pis h HIS 48 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 60.37 60.13 1pis h HIS 48 Cb 0.58 -0.00 0.01 0.00 -0.00 0.00 0.00 27.41 28.00 1pis h HIS 48 CO 0.11 0.01 -1.02 0.38 -0.00 0.00 0.00 177.93 177.41 1pis h ASP 49 N 0.01 0.61 1.72 3.26 3.04 -0.99 -1.58 116.42 122.49 1pis h ASP 49 Ca 0.01 -0.51 -0.05 0.00 -3.24 0.00 0.00 57.03 53.24 1pis h ASP 49 Cb 0.03 -0.19 -0.01 0.00 -1.04 0.00 0.00 39.33 38.13 1pis h ASP 49 CO -0.00 1.32 -0.28 -1.13 -2.04 0.00 0.00 179.24 177.11 1pis h ASN 50 N 0.24 0.00 -0.26 4.15 -1.24 -1.41 -0.87 115.58 116.19 1pis h ASN 50 Ca -0.10 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 56.82 1pis h ASN 50 Cb 1.67 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.71 1pis h ASN 50 CO 0.18 0.22 -0.18 0.00 -1.29 0.00 0.00 177.43 176.36 1pis h TYR 52 N 0.30 0.00 0.36 0.00 -1.99 -1.32 -0.72 116.97 113.61 1pis h TYR 52 Ca 0.05 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.77 1pis h TYR 52 Cb 0.72 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.44 1pis h TYR 52 CO 0.07 0.00 -0.20 0.00 -0.00 0.00 0.00 178.16 178.03 1pis h ARG 53 N 0.00 -0.50 0.00 4.88 2.47 -1.17 -1.39 114.38 118.66 1pis h ARG 53 Ca 0.01 0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.73 1pis h ARG 53 Cb 0.03 0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 28.46 1pis h ARG 53 CO -0.00 -0.34 -0.16 -0.44 0.56 0.00 0.00 179.97 179.59 1pis h ASP 54 N -0.52 0.00 0.37 7.04 3.32 -1.39 -3.06 116.42 122.18 1pis h ASP 54 Ca -0.04 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.82 1pis h ASP 54 Cb 0.42 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1pis h ASP 54 CO 0.06 0.16 -0.77 0.00 -1.72 0.00 0.00 179.24 176.97 1pis h ALA 55 N 1.84 0.59 -0.49 3.45 0.00 -1.07 -3.26 119.26 120.32 1pis h ALA 55 Ca -0.00 -0.64 -0.07 0.00 0.00 0.00 0.00 54.91 54.20 1pis h ALA 55 Cb 0.45 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1pis h ALA 55 CO 0.02 0.80 0.04 1.57 0.00 0.00 0.00 179.25 181.68 1pis h LYS 56 N 0.21 0.80 0.00 0.00 2.10 -1.20 -3.26 116.57 115.21 1pis h LYS 56 Ca -0.04 -0.20 0.00 0.00 -2.00 0.00 0.00 60.65 58.42 1pis h LYS 56 Cb 1.35 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 1pis h LYS 56 CO 0.13 0.78 0.00 -1.71 -2.00 0.00 0.00 179.45 176.65 1pis n ASN 57 N -4.23 0.00 -4.60 7.07 2.85 -1.16 -4.75 115.26 110.44 1pis n ASN 57 Ca 0.03 -0.81 -0.42 0.00 -0.11 0.00 0.00 54.58 53.27 1pis n ASN 57 Cb 0.28 0.00 -0.06 0.00 1.24 0.00 0.00 39.78 41.24 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 -1.62 4.14 0.57 1.20 2.96 -1.23 -4.98 118.68 119.72 1pis s LEU 58 Ca 0.17 0.45 0.33 0.00 -0.22 0.00 0.00 54.13 54.86 1pis s LEU 58 Cb 0.08 -2.91 1.71 0.00 0.50 0.00 0.00 46.19 45.57 1pis s LEU 58 CO 0.13 -0.56 2.15 0.44 -1.32 0.00 0.00 176.35 177.20 1pis h ASP 59 N 8.23 0.00 0.70 3.68 3.32 -1.93 -3.20 116.42 127.22 1pis h ASP 59 Ca -0.26 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.76 1pis h ASP 59 Cb 1.11 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.66 1pis h ASP 59 CO 0.84 0.06 -0.34 0.28 -1.72 0.00 0.00 179.24 178.36 1pis h SER 60 N 0.00 -0.80 -3.33 6.45 0.02 -1.96 -3.38 113.55 110.55 1pis h SER 60 Ca -0.00 -0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 60.34 1pis h SER 60 Cb 0.25 0.21 -0.40 0.00 0.14 0.00 0.00 62.40 62.59 1pis h SER 60 CO 0.01 -0.48 -0.74 0.00 -1.14 0.00 0.00 176.83 174.48 1pis s LYS 62 N 1.37 3.55 0.00 0.00 2.47 -1.21 -4.81 119.74 121.12 1pis s LYS 62 Ca 0.10 -0.13 -0.01 0.00 -1.56 0.00 0.00 55.97 54.38 1pis s LYS 62 Cb -0.18 -2.63 -0.03 0.00 -1.46 0.00 0.00 37.83 33.53 1pis s LYS 62 CO -0.19 0.14 1.55 1.19 0.16 0.00 0.00 175.35 178.19 1pis n PHE 63 N -1.46 0.00 0.39 4.03 3.01 -1.26 -2.13 117.46 120.04 1pis n PHE 63 Ca -0.03 -0.72 0.10 0.00 1.01 0.00 0.00 57.45 57.81 1pis n PHE 63 Cb 0.55 -0.55 0.42 0.00 -0.01 0.00 0.00 39.48 39.88 1pis n PHE 63 CO 0.00 0.00 0.00 1.47 1.01 0.00 0.00 176.76 179.24 1pis n LEU 64 N 1.84 0.41 0.19 4.37 -0.00 -1.26 -4.16 117.00 118.39 1pis n LEU 64 Ca 0.05 0.61 0.03 0.00 -0.00 0.00 0.00 56.01 56.70 1pis n LEU 64 Cb 0.38 -0.57 0.38 0.00 -0.00 0.00 0.00 43.42 43.61 1pis n LEU 64 CO 0.03 -0.49 0.74 -0.37 -0.00 0.00 0.00 177.39 177.30 1pis h VAL 65 N 0.00 1.21 0.00 1.47 -1.51 -1.74 -3.49 116.25 112.19 1pis h VAL 65 Ca 0.00 -1.24 0.00 0.00 -1.23 0.00 0.00 66.70 64.23 1pis h VAL 65 Cb 0.28 1.68 0.00 0.00 -2.13 0.00 0.00 31.29 31.12 1pis h VAL 65 CO 0.00 0.35 0.00 -0.67 -1.23 0.00 0.00 177.57 176.02 1pis n ASP 66 N -4.04 0.00 -3.47 4.19 2.03 -1.26 -4.61 116.55 109.38 1pis n ASP 66 Ca -0.02 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.01 1pis n ASP 66 Cb 0.40 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.69 1pis n ASP 66 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1pis s ASN 67 N -4.00 2.38 -0.21 1.67 3.84 -1.26 -5.04 114.94 112.33 1pis s ASN 67 Ca 0.00 -2.74 0.01 0.00 0.21 0.00 0.00 52.86 50.34 1pis s ASN 67 Cb 0.00 -0.54 0.27 0.00 -0.55 0.00 0.00 41.25 40.44 1pis s ASN 67 CO 0.00 -0.23 1.48 -0.81 -2.79 0.00 0.00 177.10 174.75 1pis n PRO 68 N 3.31 1.56 -0.30 0.43 -0.04 -1.26 -4.48 135.00 134.21 1pis n PRO 68 Ca 0.21 -1.31 0.12 0.00 -0.04 0.00 0.00 63.50 62.48 1pis n PRO 68 Cb 0.42 -1.51 0.28 0.00 -0.04 0.00 0.00 33.50 32.65 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 -0.12 0.79 0.00 0.54 4.01 -1.26 -4.76 117.16 116.37 1pis n TYR 69 Ca 0.26 -0.40 0.00 0.00 -0.16 0.00 0.00 57.90 57.60 1pis n TYR 69 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.98 1pis n TYR 69 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 1pis n THR 70 N 1.61 0.00 -2.39 -0.72 5.66 -1.26 -4.23 114.28 112.95 1pis n THR 70 Ca 0.23 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.81 1pis n THR 70 Cb 0.62 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.41 1pis n THR 70 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1pis n GLU 71 N -2.17 4.49 0.02 1.09 1.02 -1.26 -4.32 120.64 119.51 1pis n GLU 71 Ca 0.00 -3.91 0.00 0.00 -0.02 0.00 0.00 57.16 53.23 1pis n GLU 71 Cb 0.00 -2.66 0.00 0.00 -0.02 0.00 0.00 31.44 28.76 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 1.88 -0.29 -4.75 1.62 7.64 -1.26 -5.00 113.62 113.45 1pis n SER 72 Ca 0.47 0.06 -0.28 0.00 1.01 0.00 0.00 58.87 60.13 1pis n SER 72 Cb 0.29 0.71 -0.07 0.00 -1.01 0.00 0.00 64.21 64.14 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 -1.07 2.21 0.27 1.43 -0.85 -1.26 -5.07 117.35 113.01 1pis s TYR 73 Ca 0.00 -0.75 -0.05 0.00 -0.52 0.00 0.00 57.07 55.75 1pis s TYR 73 Cb 0.00 -1.82 0.02 0.00 0.38 0.00 0.00 41.96 40.54 1pis s TYR 73 CO 0.00 0.13 0.44 0.45 -1.52 0.00 0.00 175.55 175.05 1pis n SER 74 N -1.29 -1.25 -3.50 -0.18 2.88 -1.26 -4.91 113.62 104.10 1pis n SER 74 Ca -0.07 -2.28 -0.17 0.00 -1.33 0.00 0.00 58.87 55.01 1pis n SER 74 Cb 0.66 2.21 -0.08 0.00 -0.75 0.00 0.00 64.21 66.25 1pis n SER 74 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 1pis s TYR 75 N -3.75 1.53 0.32 0.66 1.13 -1.26 -1.87 117.35 114.10 1pis s TYR 75 Ca 0.17 -1.54 0.10 0.00 -1.41 0.00 0.00 57.07 54.39 1pis s TYR 75 Cb -0.02 -0.58 -0.06 0.00 -1.10 0.00 0.00 41.96 40.21 1pis s TYR 75 CO 0.12 -0.87 -0.09 -1.12 -2.51 0.00 0.00 175.55 171.08 1pis s SER 76 N -3.31 3.89 0.19 -0.18 0.01 -1.22 -4.73 113.70 108.35 1pis s SER 76 Ca 0.39 -1.04 -0.07 0.00 1.31 0.00 0.00 55.95 56.54 1pis s SER 76 Cb 0.03 -0.43 -0.02 0.00 0.21 0.00 0.00 66.02 65.81 1pis s SER 76 CO 0.23 -0.12 0.27 0.00 0.41 0.00 0.00 173.24 174.03 1pis n SER 78 N -0.26 0.00 0.00 0.00 2.88 -1.18 -4.83 113.62 110.23 1pis n SER 78 Ca -0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 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 -3.20 -1.23 0.00 0.00 175.04 170.61 1pis n ASN 79 N 0.00 0.00 -0.06 -3.46 2.85 -1.26 -4.79 115.26 108.54 1pis n ASN 79 Ca 0.00 0.12 -0.22 0.00 -0.11 0.00 0.00 54.58 54.37 1pis n ASN 79 Cb 0.00 0.00 -0.12 0.00 1.24 0.00 0.00 39.78 40.90 1pis n ASN 79 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1pis n THR 80 N -0.20 1.64 -3.17 -0.44 -2.24 -1.26 -4.79 114.28 103.82 1pis n THR 80 Ca 0.00 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1pis n THR 80 Cb 0.00 -1.82 0.00 0.00 -2.10 0.00 0.00 70.33 66.41 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 -3.87 -0.75 -3.41 -0.78 4.07 -1.26 -4.23 120.64 110.41 1pis n GLU 81 Ca -0.36 -0.37 -0.38 0.00 -0.06 0.00 0.00 57.16 55.99 1pis n GLU 81 Cb 0.90 0.66 -0.06 0.00 -0.06 0.00 0.00 31.44 32.88 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 -3.95 5.13 0.00 6.31 1.01 -1.26 -3.08 121.20 125.37 1pis s ILE 82 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 60.65 61.52 1pis s ILE 82 Cb 0.00 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.71 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 2.96 0.00 -3.31 2.92 5.66 -1.20 -4.83 114.28 116.48 1pis n THR 83 Ca -0.10 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.90 1pis n THR 83 Cb 0.52 0.00 0.00 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 -0.67 5.96 0.24 0.00 3.84 -0.78 -3.38 114.94 120.15 1pis s ASN 85 Ca 0.00 0.47 0.22 0.00 0.21 0.00 0.00 52.86 53.76 1pis s ASN 85 Cb 0.00 -2.54 0.97 0.00 -0.55 0.00 0.00 41.25 39.13 1pis s ASN 85 CO 0.00 -1.81 1.68 -0.24 -2.79 0.00 0.00 177.10 173.94 1pis n SER 86 N 10.17 0.60 -1.14 -4.21 2.88 -1.26 -1.80 113.62 118.87 1pis n SER 86 Ca 0.15 0.66 0.00 0.00 -1.33 0.00 0.00 58.87 58.36 1pis n SER 86 Cb 0.49 -0.79 0.00 0.00 -0.75 0.00 0.00 64.21 63.17 1pis n SER 86 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1pis n LYS 87 N -2.18 0.07 -2.46 -1.46 2.85 -1.26 -5.00 118.16 108.72 1pis n LYS 87 Ca 0.02 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 56.87 1pis n LYS 87 Cb 0.20 -1.47 -0.04 0.00 -0.65 0.00 0.00 35.03 33.07 1pis n LYS 87 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1pis s ASN 88 N 1.14 7.22 0.00 -5.58 6.03 -0.74 -5.03 114.94 117.98 1pis s ASN 88 Ca 0.00 2.21 0.00 0.00 -1.03 0.00 0.00 52.86 54.04 1pis s ASN 88 Cb 0.00 -2.62 0.00 0.00 -3.03 0.00 0.00 41.25 35.60 1pis s ASN 88 CO 0.00 -0.22 0.00 -3.20 -2.03 0.00 0.00 177.10 171.65 1pis n ASN 89 N 1.84 0.00 0.00 3.54 2.85 -1.26 -4.85 115.26 117.38 1pis n ASN 89 Ca 0.01 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.48 1pis n ASN 89 Cb 0.45 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.47 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 -4.28 120.51 117.16 1pis n ALA 90 Ca 0.00 -0.02 -0.18 0.00 0.00 0.00 0.00 53.44 53.24 1pis n ALA 90 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 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 0.47 0.00 0.00 0.00 4.39 -1.94 -2.35 114.58 115.14 1pis h GLU 92 Ca -0.07 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.39 1pis h GLU 92 Cb 1.45 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 30.06 1pis h GLU 92 CO 0.17 0.00 -1.57 0.00 -1.16 0.00 0.00 179.01 176.45 1pis n ALA 93 N -2.31 1.69 0.25 3.43 0.00 -1.20 -4.10 120.51 118.27 1pis n ALA 93 Ca 0.04 -0.66 -0.12 0.00 0.00 0.00 0.00 53.44 52.70 1pis n ALA 93 Cb 0.47 -0.91 -0.06 0.00 0.00 0.00 0.00 19.45 18.95 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 0.00 -0.64 -1.00 0.00 3.04 -0.83 0.78 116.94 118.29 1pis h PHE 94 Ca -0.23 -0.02 0.08 0.00 3.98 0.00 0.00 57.97 61.78 1pis h PHE 94 Cb 1.82 0.21 -0.07 0.00 2.56 0.00 0.00 35.95 40.47 1pis h PHE 94 CO 0.00 -0.35 0.64 0.82 -2.02 0.00 0.00 178.31 177.41 1pis h ILE 95 N -1.12 1.05 -0.10 1.41 1.08 -1.79 -2.18 117.51 115.87 1pis h ILE 95 Ca -0.07 -0.39 -0.05 0.00 -0.39 0.00 0.00 64.86 63.96 1pis h ILE 95 Cb 0.58 -0.18 -0.01 0.00 -3.07 0.00 0.00 36.82 34.15 1pis h ILE 95 CO 0.12 0.21 -0.18 0.00 -0.69 0.00 0.00 178.15 177.61 1pis h ASN 97 N 0.15 0.63 0.35 0.00 2.35 -0.30 -0.99 115.58 117.75 1pis h ASN 97 Ca 0.03 -0.24 -0.02 0.00 -0.55 0.00 0.00 56.30 55.52 1pis h ASN 97 Cb 0.41 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.61 1pis h ASN 97 CO 0.03 0.89 -0.17 0.00 -1.65 0.00 0.00 177.43 176.53 1pis h ASP 99 N -0.92 0.00 0.42 0.00 1.82 -1.49 -2.07 116.42 114.18 1pis h ASP 99 Ca -0.05 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.57 1pis h ASP 99 Cb 0.53 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.54 1pis h ASP 99 CO 0.08 0.00 -0.20 0.08 -1.61 0.00 0.00 179.24 177.58 1pis h ARG 100 N 0.00 -0.55 -0.58 0.28 0.11 -1.11 -2.55 114.38 109.98 1pis h ARG 100 Ca 0.03 0.04 0.01 0.00 0.10 0.00 0.00 59.98 60.16 1pis h ARG 100 Cb 0.93 0.12 -0.03 0.00 1.11 0.00 0.00 29.97 32.10 1pis h ARG 100 CO -0.00 -0.37 0.37 -0.97 0.10 0.00 0.00 179.97 179.10 1pis h ASN 101 N -0.68 0.62 -0.20 0.08 -0.73 -1.35 0.11 115.58 113.43 1pis h ASN 101 Ca -0.06 -0.01 0.02 0.00 1.87 0.00 0.00 56.30 58.12 1pis h ASN 101 Cb 0.44 -0.14 -0.02 0.00 0.27 0.00 0.00 38.32 38.86 1pis h ASN 101 CO 0.10 0.44 -0.12 0.00 -0.37 0.00 0.00 177.43 177.48 1pis n ALA 102 N -2.27 -0.13 0.09 1.57 0.00 -0.82 -0.43 120.51 118.52 1pis n ALA 102 Ca 0.04 0.17 -0.13 0.00 0.00 0.00 0.00 53.44 53.52 1pis n ALA 102 Cb 0.05 0.09 -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 -0.14 -0.23 -0.24 0.00 0.00 -0.58 -2.98 119.26 115.09 1pis h ALA 103 Ca 0.03 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.83 1pis h ALA 103 Cb 0.08 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.89 1pis h ALA 103 CO -0.19 -0.47 -0.40 0.82 0.00 0.00 0.00 179.25 179.01 1pis h ILE 104 N -0.55 0.17 0.00 0.00 2.04 -1.26 -3.31 117.51 114.59 1pis h ILE 104 Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 1pis h ILE 104 Cb 0.42 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 1pis h ILE 104 CO 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 178.15 178.08 1pis h PHE 106 N 0.00 0.00 0.00 0.00 0.04 -1.61 0.33 116.94 115.71 1pis h PHE 106 Ca -0.00 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.52 1pis h PHE 106 Cb 0.58 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.68 1pis h PHE 106 CO 0.00 0.02 -1.64 0.45 -0.60 0.00 0.00 178.31 176.53 1pis n SER 107 N -3.24 0.81 -0.05 2.17 2.88 -0.53 -4.52 113.62 111.14 1pis n SER 107 Ca -0.02 0.38 -0.14 0.00 -1.33 0.00 0.00 58.87 57.75 1pis n SER 107 Cb 0.14 0.10 -0.08 0.00 -0.75 0.00 0.00 64.21 63.62 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 0.42 -6.73 -1.46 1.79 -0.80 -3.48 116.57 106.31 1pis h LYS 108 Ca -0.25 -0.27 -0.49 0.00 -2.18 0.00 0.00 60.65 57.46 1pis h LYS 108 Cb 1.86 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 32.52 1pis h LYS 108 CO 0.06 0.87 0.26 0.00 -1.08 0.00 0.00 179.45 179.56 1pis s ALA 109 N -4.00 3.31 -0.40 3.86 0.00 0.06 -5.05 121.76 119.53 1pis s ALA 109 Ca -0.14 0.41 -0.36 0.00 0.00 0.00 0.00 51.96 51.88 1pis s ALA 109 Cb 0.05 -3.05 -0.15 0.00 0.00 0.00 0.00 23.12 19.97 1pis s ALA 109 CO 0.78 0.24 1.73 -2.30 0.00 0.00 0.00 175.76 176.20 1pis n PRO 110 N 0.83 0.00 -2.64 0.00 -0.02 -1.26 -4.80 135.00 127.12 1pis n PRO 110 Ca -0.01 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.15 1pis n PRO 110 Cb 0.50 -1.21 -0.05 0.00 -0.02 0.00 0.00 33.50 32.71 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 4.83 3.31 -0.60 6.00 6.14 -1.26 -2.54 117.35 133.23 1pis s TYR 111 Ca 0.97 1.56 -0.21 0.00 0.64 0.00 0.00 57.07 60.03 1pis s TYR 111 Cb -1.21 -2.86 0.07 0.00 0.42 0.00 0.00 41.96 38.38 1pis s TYR 111 CO 0.53 -0.30 0.85 -0.80 0.64 0.00 0.00 175.55 176.47 1pis s ASN 112 N -2.44 6.21 -0.00 4.32 0.01 -1.26 -4.88 114.94 116.89 1pis s ASN 112 Ca 0.62 -0.96 0.13 0.00 -0.71 0.00 0.00 52.86 51.93 1pis s ASN 112 Cb -0.10 -2.37 0.37 0.00 0.41 0.00 0.00 41.25 39.56 1pis s ASN 112 CO 0.20 -1.24 1.31 2.29 -1.51 0.00 0.00 177.10 178.14 1pis n LYS 113 N 7.11 2.01 0.08 -0.60 -0.00 -1.26 -4.23 118.16 121.27 1pis n LYS 113 Ca -0.05 -1.52 0.00 0.00 -0.00 0.00 0.00 58.31 56.74 1pis n LYS 113 Cb 0.45 -1.34 0.00 0.00 -0.00 0.00 0.00 35.03 34.14 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 0.72 0.00 0.00 -1.58 0.28 -1.26 -4.49 120.64 114.31 1pis n GLU 114 Ca 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.14 1pis n GLU 114 Cb 0.37 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.24 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 -2.89 0.00 0.27 -1.84 8.25 -1.26 -4.63 115.22 113.11 1pis n HIS 115 Ca 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.61 1pis n HIS 115 Cb 0.00 -0.03 0.70 0.00 1.12 0.00 0.00 29.99 31.79 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 0.13 0.00 -2.60 -0.41 3.64 -1.79 -0.44 116.57 115.11 1pis h LYS 116 Ca 0.00 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.83 1pis h LYS 116 Cb 0.13 0.00 -0.39 0.00 -0.41 0.00 0.00 32.23 31.56 1pis h LYS 116 CO 0.00 0.10 -0.82 1.21 -2.27 0.00 0.00 179.45 177.67 1pis s ASN 117 N -5.90 3.00 0.77 4.20 2.47 -1.26 -3.02 114.94 115.19 1pis s ASN 117 Ca -0.01 -1.87 -0.11 0.00 0.42 0.00 0.00 52.86 51.29 1pis s ASN 117 Cb 0.11 -0.31 0.05 0.00 -1.45 0.00 0.00 41.25 39.65 1pis s ASN 117 CO 0.56 -0.35 1.09 -0.22 -3.72 0.00 0.00 177.10 174.47 1pis s LEU 118 N 1.41 2.73 -0.13 3.21 2.96 -0.99 -5.03 118.68 122.83 1pis s LEU 118 Ca 0.15 1.33 -0.24 0.00 -0.22 0.00 0.00 54.13 55.15 1pis s LEU 118 Cb -0.20 -4.01 -0.22 0.00 0.50 0.00 0.00 46.19 42.26 1pis s LEU 118 CO -0.11 -1.78 0.65 0.44 -1.32 0.00 0.00 176.35 174.23 1pis h ASP 119 N -0.96 -0.00 0.00 3.68 3.32 -1.88 -3.50 116.42 117.08 1pis h ASP 119 Ca -0.46 -0.82 0.00 0.00 0.02 0.00 0.00 57.03 55.76 1pis h ASP 119 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1pis h ASP 119 CO 0.60 0.91 0.00 1.07 -1.72 0.00 0.00 179.24 180.09 1pis n THR 120 N -4.64 0.00 -0.41 0.35 5.66 -1.26 -4.84 114.28 109.13 1pis n THR 120 Ca -0.08 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.76 1pis n THR 120 Cb 0.40 0.00 0.11 0.00 -1.55 0.00 0.00 70.33 69.29 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 0.00 1.79 0.02 1.09 0.00 -1.26 -4.72 118.16 115.08 1pis n LYS 121 Ca 0.00 -1.88 0.00 0.00 -0.00 0.00 0.00 58.31 56.43 1pis n LYS 121 Cb 0.00 -1.74 0.00 0.00 -0.00 0.00 0.00 35.03 33.29 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 -0.51 0.00 -0.47 -1.58 5.02 -1.26 -5.01 118.16 114.35 1pis n LYS 122 Ca 0.38 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.76 1pis n LYS 122 Cb 1.22 0.00 0.31 0.00 -0.02 0.00 0.00 35.03 36.53 1pis n LYS 122 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1pis n TYR 123 N -2.60 1.16 -0.95 2.13 4.01 -1.26 -5.12 117.16 114.52 1pis n TYR 123 Ca 0.00 -0.59 0.00 0.00 -0.16 0.00 0.00 57.90 57.15 1pis n TYR 123 Cb 0.00 -0.16 0.00 0.00 -0.31 0.00 0.00 39.34 38.87 1pis n TYR 123 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40