#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c4p n GLY 2 N 0.00 -1.54 3.10 0.00 0.00 -1.26 -4.96 105.19 100.53 3c4p n GLY 2 Ca 0.00 -1.49 -0.23 0.00 0.00 0.00 0.00 46.02 44.30 3c4p n GLY 2 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3c4p n VAL 3 N -1.73 0.00 -1.80 1.61 0.24 -1.26 -4.91 118.33 110.48 3c4p n VAL 3 Ca -0.00 -0.87 -0.41 0.00 -2.04 0.00 0.00 64.34 61.02 3c4p n VAL 3 Cb 0.06 -1.49 0.00 0.00 -1.47 0.00 0.00 33.84 30.94 3c4p n VAL 3 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 3c4p s MET 4 N -5.19 4.03 0.14 7.34 0.00 -0.48 -4.94 119.30 120.20 3c4p s MET 4 Ca 0.59 2.55 -0.01 0.00 0.00 0.00 0.00 55.69 58.83 3c4p s MET 4 Cb -0.02 -2.91 -0.04 0.00 0.00 0.00 0.00 34.83 31.86 3c4p s MET 4 CO 0.41 -0.59 0.07 0.95 0.00 0.00 0.00 175.02 175.86 3c4p s THR 5 N -1.13 0.11 0.29 10.11 -4.23 -1.26 -4.20 115.64 115.32 3c4p s THR 5 Ca 0.54 -1.93 -0.01 0.00 -1.18 0.00 0.00 61.69 59.11 3c4p s THR 5 Cb -0.46 -2.13 0.27 0.00 1.34 0.00 0.00 72.50 71.52 3c4p s THR 5 CO 0.62 -0.38 1.92 1.23 -0.54 0.00 0.00 174.62 177.47 3c4p h GLY 6 N 2.81 1.34 0.99 3.99 0.00 -1.93 -0.87 103.07 109.40 3c4p h GLY 6 Ca -0.35 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 46.49 3c4p h GLY 6 CO 0.58 0.35 0.16 0.00 0.00 0.00 0.00 176.54 177.63 3c4p h ALA 7 N 1.48 0.71 -0.49 3.60 0.00 -1.97 -1.01 119.26 121.58 3c4p h ALA 7 Ca 0.38 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 3c4p h ALA 7 Cb 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3c4p h ALA 7 CO -0.13 0.37 -0.18 0.87 0.00 0.00 0.00 179.25 180.18 3c4p h LYS 8 N 0.75 0.98 -0.73 0.00 1.57 -1.86 -2.03 116.57 115.25 3c4p h LYS 8 Ca 0.17 -0.39 0.01 0.00 -1.87 0.00 0.00 60.65 58.57 3c4p h LYS 8 Cb 0.29 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 3c4p h LYS 8 CO -0.00 1.07 0.48 0.35 -0.57 0.00 0.00 179.45 180.77 3c4p h PHE 9 N 0.85 0.90 -0.27 -1.35 3.57 -0.82 -1.62 116.94 118.21 3c4p h PHE 9 Ca 0.12 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.50 3c4p h PHE 9 Cb 0.74 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 3c4p h PHE 9 CO 0.05 0.56 -0.41 1.15 -2.23 0.00 0.00 178.31 177.43 3c4p h THR 10 N 0.97 1.29 0.00 4.41 2.02 -1.05 -2.92 112.91 117.64 3c4p h THR 10 Ca 0.27 -1.59 -0.09 0.00 0.77 0.00 0.00 66.41 65.77 3c4p h THR 10 Cb -0.09 1.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 3c4p h THR 10 CO -0.07 0.51 -0.44 -0.61 0.37 0.00 0.00 175.52 175.28 3c4p h GLN 11 N 0.54 0.00 -6.73 6.66 4.15 -1.12 -3.42 115.11 115.18 3c4p h GLN 11 Ca 0.04 0.00 -0.51 0.00 0.77 0.00 0.00 58.65 58.95 3c4p h GLN 11 Cb 0.94 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.64 3c4p h GLN 11 CO 0.08 0.44 0.49 0.42 -1.93 0.00 0.00 178.83 178.34 3c4p s ILE 12 N -3.92 3.63 0.09 2.39 1.01 -0.63 -5.03 121.20 118.74 3c4p s ILE 12 Ca -0.02 1.50 0.06 0.00 0.00 0.00 0.00 60.65 62.19 3c4p s ILE 12 Cb 0.13 -3.96 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 3c4p s ILE 12 CO 0.72 0.30 -0.16 -1.10 0.00 0.00 0.00 174.94 174.71 3c4p s GLN 13 N -0.84 0.95 0.34 2.79 -0.21 -1.26 -4.94 119.66 116.49 3c4p s GLN 13 Ca 0.48 -1.08 -0.27 0.00 0.02 0.00 0.00 55.36 54.50 3c4p s GLN 13 Cb -0.31 -1.00 -0.13 0.00 1.00 0.00 0.00 33.01 32.58 3c4p s GLN 13 CO 0.38 0.22 1.13 1.19 -2.12 0.00 0.00 175.29 176.08 3c4p n PHE 14 N 1.04 1.67 -0.06 0.91 3.01 -1.26 -2.07 117.46 120.70 3c4p n PHE 14 Ca -0.19 0.61 0.00 0.00 1.01 0.00 0.00 57.45 58.88 3c4p n PHE 14 Cb 0.55 -2.31 0.00 0.00 -0.01 0.00 0.00 39.48 37.70 3c4p n PHE 14 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3c4p n GLY 15 N 1.02 0.76 3.83 1.37 0.00 -0.14 -4.89 105.19 107.15 3c4p n GLY 15 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 3c4p n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3c4p s MET 16 N -0.74 3.70 0.64 1.61 -1.94 -0.88 -4.52 119.30 117.18 3c4p s MET 16 Ca 0.00 0.99 -0.07 0.00 -1.71 0.00 0.00 55.69 54.90 3c4p s MET 16 Cb 0.00 -2.10 0.02 0.00 2.01 0.00 0.00 34.83 34.77 3c4p s MET 16 CO 0.00 -0.48 0.97 0.95 -0.01 0.00 0.00 175.02 176.45 3c4p s THR 17 N -2.67 3.26 0.19 2.05 -4.23 -1.26 -0.31 115.64 112.66 3c4p s THR 17 Ca 0.59 0.03 -0.13 0.00 -1.18 0.00 0.00 61.69 61.00 3c4p s THR 17 Cb -0.12 -3.34 0.11 0.00 1.34 0.00 0.00 72.50 70.49 3c4p s THR 17 CO 0.37 -0.37 1.73 0.03 -0.54 0.00 0.00 174.62 175.83 3c4p h ARG 18 N -0.39 0.27 -0.71 3.99 3.08 -1.79 -1.54 114.38 117.29 3c4p h ARG 18 Ca -0.45 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 59.56 3c4p h ARG 18 Cb 1.27 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.23 3c4p h ARG 18 CO 0.61 0.18 0.37 0.37 -1.07 0.00 0.00 179.97 180.43 3c4p h GLN 19 N 0.27 1.00 -0.66 0.04 5.75 -1.94 -0.73 115.11 118.84 3c4p h GLN 19 Ca 0.25 -0.12 -0.02 0.00 -0.15 0.00 0.00 58.65 58.61 3c4p h GLN 19 Cb 0.32 -0.19 -0.03 0.00 1.07 0.00 0.00 27.48 28.64 3c4p h GLN 19 CO -0.30 0.75 0.34 1.96 -2.65 0.00 0.00 178.83 178.92 3c4p h GLN 20 N 1.00 0.94 -0.05 1.69 4.20 -1.82 -1.03 115.11 120.05 3c4p h GLN 20 Ca 0.25 -0.13 -0.00 0.00 0.06 0.00 0.00 58.65 58.83 3c4p h GLN 20 Cb 0.05 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 3c4p h GLN 20 CO -0.04 0.73 0.02 0.28 -0.67 0.00 0.00 178.83 179.15 3c4p h VAL 21 N 0.91 1.12 -0.79 -0.54 2.07 -0.76 -2.80 116.25 115.46 3c4p h VAL 21 Ca 0.23 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.40 3c4p h VAL 21 Cb 0.08 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 3c4p h VAL 21 CO -0.03 0.10 0.51 -0.07 0.02 0.00 0.00 177.57 178.10 3c4p h LEU 22 N -0.06 0.92 -0.88 2.57 3.38 -1.00 -0.60 115.31 119.64 3c4p h LEU 22 Ca 0.02 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 3c4p h LEU 22 Cb 0.14 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3c4p h LEU 22 CO -0.00 0.68 -0.01 0.44 0.09 0.00 0.00 178.44 179.64 3c4p h ASP 23 N 1.08 0.79 0.03 -0.43 3.32 -1.04 -0.32 116.42 119.85 3c4p h ASP 23 Ca 0.29 -0.20 -0.12 0.00 0.02 0.00 0.00 57.03 57.02 3c4p h ASP 23 Cb -0.10 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.25 3c4p h ASP 23 CO -0.06 0.86 -0.50 0.40 -1.72 0.00 0.00 179.24 178.22 3c4p h ILE 24 N 0.76 1.51 -0.43 0.35 2.04 -1.20 -3.36 117.51 117.18 3c4p h ILE 24 Ca 0.15 -2.17 -0.11 0.00 1.00 0.00 0.00 64.86 63.73 3c4p h ILE 24 Cb 0.48 2.85 -0.02 0.00 -0.74 0.00 0.00 36.82 39.39 3c4p h ILE 24 CO 0.02 0.61 -0.16 0.00 0.00 0.00 0.00 178.15 178.62 3c4p h ALA 25 N 0.22 0.90 -0.34 1.87 0.00 -1.03 -3.48 119.26 117.40 3c4p h ALA 25 Ca -0.07 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3c4p h ALA 25 Cb 1.27 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3c4p h ALA 25 CO 0.10 0.63 0.00 0.41 0.00 0.00 0.00 179.25 180.38 3c4p n GLY 26 N -0.32 0.14 0.29 0.00 0.00 -0.14 -4.52 105.19 100.65 3c4p n GLY 26 Ca 0.01 -0.92 0.12 0.00 0.00 0.00 0.00 46.02 45.23 3c4p n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c4p h ALA 27 N 0.00 1.91 0.00 4.61 0.00 -1.89 0.13 119.26 124.02 3c4p h ALA 27 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3c4p h ALA 27 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3c4p h ALA 27 CO 0.00 -0.09 0.00 -0.85 0.00 0.00 0.00 179.25 178.31 3c4p n GLU 28 N -4.29 0.19 0.00 0.00 0.00 -1.26 -1.82 120.64 113.45 3c4p n GLU 28 Ca -0.01 0.39 0.12 0.00 0.00 0.00 0.00 57.16 57.65 3c4p n GLU 28 Cb 0.16 -1.84 0.25 0.00 0.00 0.00 0.00 31.44 30.01 3c4p n GLU 28 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3c4p n ASN 29 N -2.19 0.69 -4.55 -1.84 3.02 0.03 -4.98 115.26 105.44 3c4p n ASN 29 Ca 0.03 -0.48 -0.25 0.00 -0.03 0.00 0.00 54.58 53.85 3c4p n ASN 29 Cb 0.25 0.27 -0.09 0.00 -0.61 0.00 0.00 39.78 39.60 3c4p n ASN 29 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3c4p s GLU 31 N -3.21 0.81 0.27 0.00 -1.05 -0.09 -4.97 118.70 110.46 3c4p s GLU 31 Ca 0.27 -1.04 -0.07 0.00 -0.15 0.00 0.00 54.97 53.99 3c4p s GLU 31 Cb -0.07 0.31 -0.01 0.00 -0.44 0.00 0.00 34.13 33.92 3c4p s GLU 31 CO 0.16 -0.24 0.40 -0.08 0.95 0.00 0.00 175.26 176.45 3c4p s THR 32 N -3.89 0.00 0.00 1.83 -1.32 -1.26 -1.00 115.64 110.01 3c4p s THR 32 Ca 0.07 -1.61 0.00 0.00 -1.21 0.00 0.00 61.69 58.94 3c4p s THR 32 Cb 0.06 -2.42 0.00 0.00 -1.51 0.00 0.00 72.50 68.63 3c4p s THR 32 CO -0.10 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 172.92 3c4p n GLY 33 N -0.42 -1.05 7.00 6.08 0.00 0.21 -4.87 105.19 112.14 3c4p n GLY 33 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.88 3c4p n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3c4p n GLY 34 N 0.00 3.41 0.26 -0.02 0.00 -1.26 -0.83 105.19 106.74 3c4p n GLY 34 Ca 0.00 -0.02 0.17 0.00 0.00 0.00 0.00 46.02 46.18 3c4p n GLY 34 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3c4p h SER 35 N 0.00 0.00 -0.28 1.61 0.02 -2.02 -3.05 113.55 109.84 3c4p h SER 35 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3c4p h SER 35 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3c4p h SER 35 CO 0.00 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.18 3c4p n PHE 36 N -2.81 0.36 -3.89 3.45 3.01 -0.01 -5.06 117.46 112.51 3c4p n PHE 36 Ca -0.01 -0.25 0.00 0.00 1.01 0.00 0.00 57.45 58.20 3c4p n PHE 36 Cb 0.16 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 3c4p n PHE 36 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3c4p n GLY 37 N 1.00 3.10 1.76 1.37 0.00 -1.15 -1.94 105.19 109.33 3c4p n GLY 37 Ca 0.14 -0.31 0.08 0.00 0.00 0.00 0.00 46.02 45.93 3c4p n GLY 37 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3c4p n ASP 38 N 1.93 5.29 -4.89 1.61 5.68 -1.26 0.64 116.55 125.55 3c4p n ASP 38 Ca 0.00 -2.70 -0.30 0.00 -0.50 0.00 0.00 54.79 51.29 3c4p n ASP 38 Cb 0.00 -0.64 0.05 0.00 -1.14 0.00 0.00 41.12 39.39 3c4p n ASP 38 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 3c4p s SER 39 N -0.83 5.41 -0.17 -1.12 0.01 -0.82 -4.69 113.70 111.50 3c4p s SER 39 Ca 0.53 1.05 -0.03 0.00 1.31 0.00 0.00 55.95 58.81 3c4p s SER 39 Cb 0.38 -1.86 -0.02 0.00 0.21 0.00 0.00 66.02 64.73 3c4p s SER 39 CO 0.20 -1.33 -0.05 -0.63 0.41 0.00 0.00 173.24 171.83 3c4p s ILE 40 N -3.32 3.57 -0.15 1.44 1.01 -0.32 -4.24 121.20 119.19 3c4p s ILE 40 Ca 0.58 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.78 3c4p s ILE 40 Cb -0.11 -2.58 0.01 0.00 0.01 0.00 0.00 42.46 39.79 3c4p s ILE 40 CO 0.51 0.47 -0.18 -2.28 0.00 0.00 0.00 174.94 173.46 3c4p s HIS 41 N 0.75 2.74 -0.12 3.97 5.65 -0.17 -0.51 115.29 127.60 3c4p s HIS 41 Ca -0.02 -1.22 0.03 0.00 0.25 0.00 0.00 55.06 54.09 3c4p s HIS 41 Cb -0.15 -1.87 0.01 0.00 -1.18 0.00 0.00 32.58 29.39 3c4p s HIS 41 CO 0.02 -0.57 -0.21 0.00 -0.65 0.00 0.00 174.74 173.33 3c4p s ARG 43 N 0.70 4.49 0.00 0.00 0.52 0.06 -1.36 118.95 123.36 3c4p s ARG 43 Ca -0.11 1.05 0.00 0.00 -0.52 0.00 0.00 55.73 56.15 3c4p s ARG 43 Cb -0.16 -3.36 0.00 0.00 0.52 0.00 0.00 34.95 31.95 3c4p s ARG 43 CO 0.01 0.28 0.00 0.41 0.02 0.00 0.00 175.30 176.03 3c4p n GLY 44 N 2.40 1.61 3.74 -3.53 0.00 0.15 -1.38 105.19 108.17 3c4p n GLY 44 Ca -0.03 -1.78 -0.33 0.00 0.00 0.00 0.00 46.02 43.88 3c4p n GLY 44 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3c4p s HIS 45 N 2.10 2.29 0.34 1.61 0.00 -1.26 -4.60 115.29 115.77 3c4p s HIS 45 Ca 0.00 1.59 -0.29 0.00 -3.00 0.00 0.00 55.06 53.36 3c4p s HIS 45 Cb 0.00 -3.31 -0.11 0.00 -4.00 0.00 0.00 32.58 25.16 3c4p s HIS 45 CO 0.00 -2.18 1.49 0.00 -1.00 0.00 0.00 174.74 173.06 3c4p n ALA 46 N -2.75 2.25 -3.72 -1.38 0.00 -1.26 -0.86 120.51 112.79 3c4p n ALA 46 Ca 0.12 0.36 -0.12 0.00 0.00 0.00 0.00 53.44 53.79 3c4p n ALA 46 Cb 0.51 -2.41 -0.13 0.00 0.00 0.00 0.00 19.45 17.43 3c4p n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3c4p s ALA 47 N -0.73 -0.63 0.00 0.00 0.00 -0.84 -4.70 121.76 114.86 3c4p s ALA 47 Ca 0.57 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.60 3c4p s ALA 47 Cb -0.50 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 21.91 3c4p s ALA 47 CO 0.58 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 176.51 3c4p n GLY 48 N 4.33 3.03 1.52 0.00 0.00 -0.51 -0.66 105.19 112.90 3c4p n GLY 48 Ca -0.23 -0.17 0.07 0.00 0.00 0.00 0.00 46.02 45.69 3c4p n GLY 48 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3c4p n ASP 49 N 2.54 4.50 0.00 1.61 2.03 -1.26 -4.90 116.55 121.07 3c4p n ASP 49 Ca 0.00 -2.57 0.00 0.00 0.52 0.00 0.00 54.79 52.74 3c4p n ASP 49 Cb 0.00 -0.59 0.00 0.00 -0.72 0.00 0.00 41.12 39.81 3c4p n ASP 49 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3c4p n TYR 50 N 0.72 0.00 -3.84 -0.67 9.36 0.17 -5.18 117.16 117.71 3c4p n TYR 50 Ca 0.22 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.33 3c4p n TYR 50 Cb 0.90 0.00 -0.09 0.00 -0.63 0.00 0.00 39.34 39.52 3c4p n TYR 50 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 3c4p s TYR 51 N 3.00 -0.02 0.66 2.98 1.51 -1.23 -1.98 117.35 122.27 3c4p s TYR 51 Ca 0.00 -0.02 -0.17 0.00 -1.01 0.00 0.00 57.07 55.86 3c4p s TYR 51 Cb 0.00 -0.01 -0.02 0.00 -0.11 0.00 0.00 41.96 41.83 3c4p s TYR 51 CO 0.00 -0.32 1.10 0.00 -1.11 0.00 0.00 175.55 175.22 3c4p n ALA 52 N 1.39 0.44 -3.37 3.71 0.00 -0.04 -4.74 120.51 117.90 3c4p n ALA 52 Ca -0.22 -0.06 -0.10 0.00 0.00 0.00 0.00 53.44 53.06 3c4p n ALA 52 Cb 0.56 -2.20 -0.03 0.00 0.00 0.00 0.00 19.45 17.78 3c4p n ALA 52 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 3c4p s TYR 53 N -1.56 -0.24 0.12 0.00 -0.85 -0.72 0.29 117.35 114.39 3c4p s TYR 53 Ca 0.78 -0.08 0.09 0.00 -0.52 0.00 0.00 57.07 57.34 3c4p s TYR 53 Cb -0.38 0.46 -0.04 0.00 0.38 0.00 0.00 41.96 42.38 3c4p s TYR 53 CO 0.45 -0.92 -0.23 0.00 -1.52 0.00 0.00 175.55 173.34 3c4p s ALA 54 N -3.84 1.99 -0.06 9.51 0.00 -0.46 -1.48 121.76 127.42 3c4p s ALA 54 Ca 0.07 -1.33 0.01 0.00 0.00 0.00 0.00 51.96 50.71 3c4p s ALA 54 Cb -0.01 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.84 3c4p s ALA 54 CO -0.05 0.41 -0.08 0.99 0.00 0.00 0.00 175.76 177.03 3c4p s THR 55 N -1.19 0.79 -0.17 0.00 2.01 -0.15 -0.57 115.64 116.36 3c4p s THR 55 Ca 0.09 -0.26 -0.02 0.00 0.31 0.00 0.00 61.69 61.81 3c4p s THR 55 Cb -0.10 -0.77 -0.01 0.00 0.01 0.00 0.00 72.50 71.63 3c4p s THR 55 CO 0.05 0.28 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.81 3c4p s PHE 56 N 0.89 2.89 0.13 4.92 0.08 0.33 -1.03 117.98 126.19 3c4p s PHE 56 Ca -0.11 -0.76 0.03 0.00 0.12 0.00 0.00 56.93 56.21 3c4p s PHE 56 Cb -0.15 -1.95 -0.04 0.00 -0.57 0.00 0.00 43.02 40.31 3c4p s PHE 56 CO 0.01 -0.34 0.19 0.20 -0.10 0.00 0.00 175.22 175.18 3c4p s GLY 57 N 0.79 1.84 0.19 4.36 0.00 -0.18 -1.17 107.32 113.15 3c4p s GLY 57 Ca -0.03 -1.06 0.08 0.00 0.00 0.00 0.00 44.72 43.70 3c4p s GLY 57 CO 0.01 -1.06 -0.16 -1.36 0.00 0.00 0.00 173.10 170.54 3c4p s PHE 58 N -1.65 1.72 0.38 1.90 0.40 -1.26 -1.06 117.98 118.41 3c4p s PHE 58 Ca 0.32 -0.53 0.24 0.00 -0.60 0.00 0.00 56.93 56.36 3c4p s PHE 58 Cb -0.11 -0.83 1.26 0.00 0.51 0.00 0.00 43.02 43.85 3c4p s PHE 58 CO 0.26 0.33 2.01 1.79 0.70 0.00 0.00 175.22 180.31 3c4p h THR 59 N 2.86 0.70 -2.42 0.64 1.35 -1.52 -3.45 112.91 111.07 3c4p h THR 59 Ca -0.40 -0.70 0.02 0.00 -0.55 0.00 0.00 66.41 64.79 3c4p h THR 59 Cb 1.21 1.43 -0.00 0.00 -1.73 0.00 0.00 68.15 69.06 3c4p h THR 59 CO 0.57 0.16 0.23 -1.54 -0.25 0.00 0.00 175.52 174.70 3c4p n SER 60 N -3.73 -1.23 -0.06 5.36 3.41 -1.26 -5.01 113.62 111.09 3c4p n SER 60 Ca -0.02 -1.79 0.14 0.00 -0.26 0.00 0.00 58.87 56.95 3c4p n SER 60 Cb 0.28 2.04 0.67 0.00 -0.26 0.00 0.00 64.21 66.94 3c4p n SER 60 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3c4p n ALA 61 N -1.61 2.66 -1.73 7.33 0.00 -1.26 -4.73 120.51 121.17 3c4p n ALA 61 Ca -0.09 -0.21 -0.36 0.00 0.00 0.00 0.00 53.44 52.78 3c4p n ALA 61 Cb 0.35 -1.40 0.04 0.00 0.00 0.00 0.00 19.45 18.44 3c4p n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3c4p s ALA 62 N -2.52 2.51 0.52 0.00 0.00 -1.26 -4.91 121.76 116.10 3c4p s ALA 62 Ca 0.29 1.00 0.17 0.00 0.00 0.00 0.00 51.96 53.41 3c4p s ALA 62 Cb 0.20 -3.45 1.27 0.00 0.00 0.00 0.00 23.12 21.14 3c4p s ALA 62 CO 0.47 -1.22 2.14 0.00 0.00 0.00 0.00 175.76 177.15 3c4p h ALA 63 N 0.79 2.03 -0.53 0.00 0.00 -2.05 -1.28 119.26 118.21 3c4p h ALA 63 Ca -0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3c4p h ALA 63 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3c4p h ALA 63 CO 0.55 -0.04 0.00 -0.40 0.00 0.00 0.00 179.25 179.35 3c4p n ASP 64 N -4.53 3.02 -4.73 0.00 5.75 -1.26 -4.51 116.55 110.30 3c4p n ASP 64 Ca -0.02 -1.98 -0.35 0.00 -0.01 0.00 0.00 54.79 52.42 3c4p n ASP 64 Cb 0.13 -0.35 0.08 0.00 -1.03 0.00 0.00 41.12 39.94 3c4p n ASP 64 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3c4p s ALA 65 N -1.29 2.26 0.16 2.12 0.00 -0.49 -4.93 121.76 119.59 3c4p s ALA 65 Ca 0.38 1.03 0.07 0.00 0.00 0.00 0.00 51.96 53.44 3c4p s ALA 65 Cb 0.20 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 3c4p s ALA 65 CO 0.27 -1.71 0.01 0.15 0.00 0.00 0.00 175.76 174.48 3c4p s LYS 66 N -3.63 2.45 0.04 0.00 -0.14 -1.26 -4.16 119.74 113.04 3c4p s LYS 66 Ca 0.78 -1.04 -0.30 0.00 -1.36 0.00 0.00 55.97 54.05 3c4p s LYS 66 Cb -0.33 -2.41 -0.08 0.00 -1.68 0.00 0.00 37.83 33.33 3c4p s LYS 66 CO 0.42 0.47 1.84 0.08 -0.76 0.00 0.00 175.35 177.40 3c4p s VAL 67 N -1.64 3.04 -0.07 3.17 1.01 0.58 -1.30 120.40 125.19 3c4p s VAL 67 Ca 0.27 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.48 3c4p s VAL 67 Cb -0.10 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.14 3c4p s VAL 67 CO 0.19 -0.01 0.54 -0.90 0.00 0.00 0.00 175.10 174.91 3c4p n ASP 68 N 6.85 1.08 -3.72 3.32 5.68 -0.23 -0.97 116.55 128.57 3c4p n ASP 68 Ca 0.18 -1.06 -0.12 0.00 -0.50 0.00 0.00 54.79 53.30 3c4p n ASP 68 Cb 0.41 -0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 40.27 3c4p n ASP 68 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 3c4p s SER 69 N -0.08 -0.37 -0.07 -1.12 0.15 -1.13 -0.67 113.70 110.40 3c4p s SER 69 Ca 0.01 0.68 0.03 0.00 0.70 0.00 0.00 55.95 57.37 3c4p s SER 69 Cb 0.00 0.57 0.01 0.00 -1.71 0.00 0.00 66.02 64.90 3c4p s SER 69 CO 0.01 -0.17 -0.15 -0.54 1.20 0.00 0.00 173.24 173.58 3c4p s LYS 70 N 1.25 2.02 0.04 5.44 1.02 -0.38 -1.01 119.74 128.13 3c4p s LYS 70 Ca -0.09 -0.52 0.03 0.00 0.02 0.00 0.00 55.97 55.41 3c4p s LYS 70 Cb -0.09 -1.62 -0.02 0.00 -0.52 0.00 0.00 37.83 35.58 3c4p s LYS 70 CO -0.10 0.06 -0.10 -1.12 -0.92 0.00 0.00 175.35 173.17 3c4p s SER 71 N 0.59 1.19 -0.02 2.83 0.01 -0.19 -1.04 113.70 117.07 3c4p s SER 71 Ca -0.16 -0.50 -0.17 0.00 1.31 0.00 0.00 55.95 56.43 3c4p s SER 71 Cb -0.16 -0.02 0.03 0.00 0.21 0.00 0.00 66.02 66.07 3c4p s SER 71 CO 0.05 -0.10 0.36 0.00 0.41 0.00 0.00 173.24 173.96 3c4p s GLN 72 N -1.39 0.71 -0.10 12.44 1.03 -0.35 -0.98 119.66 131.03 3c4p s GLN 72 Ca -0.05 -0.10 0.02 0.00 0.04 0.00 0.00 55.36 55.27 3c4p s GLN 72 Cb -0.09 0.32 0.02 0.00 0.03 0.00 0.00 33.01 33.29 3c4p s GLN 72 CO 0.01 -0.20 -0.13 1.41 -2.54 0.00 0.00 175.29 173.84 3c4p s MET 73 N -1.24 1.96 -1.60 9.60 1.75 -0.55 -4.58 119.30 124.64 3c4p s MET 73 Ca -0.13 -0.47 0.00 0.00 -1.25 0.00 0.00 55.69 53.84 3c4p s MET 73 Cb -0.04 -1.70 0.00 0.00 2.84 0.00 0.00 34.83 35.93 3c4p s MET 73 CO 0.05 -0.07 0.00 1.63 -0.65 0.00 0.00 175.02 175.98 3c4p n LYS 74 N 4.21 -1.25 0.04 4.11 5.02 -1.26 -1.76 118.16 127.26 3c4p n LYS 74 Ca -0.19 0.95 0.11 0.00 -2.02 0.00 0.00 58.31 57.16 3c4p n LYS 74 Cb 0.51 -5.27 -0.10 0.00 -0.02 0.00 0.00 35.03 30.15 3c4p n LYS 74 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3c4p n LEU 75 N -2.16 0.36 -3.95 -0.35 4.77 -1.26 -4.85 117.00 109.56 3c4p n LEU 75 Ca -0.18 0.14 -0.16 0.00 -0.03 0.00 0.00 56.01 55.78 3c4p n LEU 75 Cb 0.60 -0.03 -0.14 0.00 -2.33 0.00 0.00 43.42 41.52 3c4p n LEU 75 CO 0.24 -0.08 -0.40 -0.76 -1.33 0.00 0.00 177.39 175.06 3c4p s LEU 76 N -4.87 1.98 0.09 2.23 1.43 -1.26 -3.26 118.68 115.01 3c4p s LEU 76 Ca -0.05 -0.09 -0.00 0.00 -1.03 0.00 0.00 54.13 52.96 3c4p s LEU 76 Cb 0.12 -0.26 -0.04 0.00 0.03 0.00 0.00 46.19 46.04 3c4p s LEU 76 CO 0.86 0.06 0.25 0.00 0.23 0.00 0.00 176.35 177.74 3c4p s ALA 77 N -0.08 3.97 0.49 4.21 0.00 -1.26 -4.97 121.76 124.13 3c4p s ALA 77 Ca 0.01 -0.83 -0.21 0.00 0.00 0.00 0.00 51.96 50.93 3c4p s ALA 77 Cb -0.02 -1.87 -0.07 0.00 0.00 0.00 0.00 23.12 21.16 3c4p s ALA 77 CO -0.00 0.76 1.15 -1.25 0.00 0.00 0.00 175.76 176.41 3c4p s PRO 78 N -2.65 3.60 0.05 0.00 0.04 -1.26 -4.93 135.00 129.85 3c4p s PRO 78 Ca 0.36 1.70 -0.21 0.00 0.04 0.00 0.00 61.00 62.89 3c4p s PRO 78 Cb -0.13 -2.24 -0.13 0.00 0.04 0.00 0.00 34.50 32.04 3c4p s PRO 78 CO 0.28 -0.67 1.46 0.77 0.04 0.00 0.00 177.00 178.88 3c4p h SER 79 N 1.70 0.26 -1.34 6.66 0.02 -1.49 -3.41 113.55 115.95 3c4p h SER 79 Ca -0.50 -0.34 -0.26 0.00 -0.84 0.00 0.00 61.79 59.86 3c4p h SER 79 Cb 1.25 -0.07 -0.22 0.00 0.14 0.00 0.00 62.40 63.51 3c4p h SER 79 CO 0.59 0.53 -0.61 0.00 -1.14 0.00 0.00 176.83 176.20 3c4p s ALA 80 N -4.87 -1.24 -0.31 3.77 0.00 0.10 -5.01 121.76 114.20 3c4p s ALA 80 Ca -0.14 -0.91 -0.28 0.00 0.00 0.00 0.00 51.96 50.63 3c4p s ALA 80 Cb 0.05 -2.44 -0.04 0.00 0.00 0.00 0.00 23.12 20.70 3c4p s ALA 80 CO 0.72 -2.17 2.04 -2.14 0.00 0.00 0.00 175.76 174.20 3c4p s PRO 81 N 0.69 3.10 -0.01 0.00 0.02 -1.15 -3.57 135.00 134.08 3c4p s PRO 81 Ca 0.30 1.65 0.02 0.00 0.02 0.00 0.00 61.00 62.99 3c4p s PRO 81 Cb 0.01 -4.32 0.03 0.00 0.02 0.00 0.00 34.50 30.24 3c4p s PRO 81 CO -0.09 -2.14 0.94 0.25 -0.33 0.00 0.00 177.00 175.63 3c4p n THR 82 N 7.61 0.91 -1.73 0.99 -2.24 -1.24 -2.56 114.28 116.02 3c4p n THR 82 Ca 0.27 -0.95 -0.39 0.00 -2.27 0.00 0.00 64.05 60.71 3c4p n THR 82 Cb 0.47 0.51 0.04 0.00 -2.10 0.00 0.00 70.33 69.24 3c4p n THR 82 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3c4p n LEU 83 N -0.50 5.13 -4.01 3.22 7.94 -1.18 -4.87 117.00 122.72 3c4p n LEU 83 Ca 0.02 0.99 -0.09 0.00 -1.11 0.00 0.00 56.01 55.82 3c4p n LEU 83 Cb 0.34 -1.55 -0.08 0.00 0.53 0.00 0.00 43.42 42.65 3c4p n LEU 83 CO 0.00 -0.67 -0.16 0.42 -1.11 0.00 0.00 177.39 175.87 3c4p s THR 84 N -1.29 0.11 0.39 1.96 -4.23 -1.26 -4.20 115.64 107.13 3c4p s THR 84 Ca 0.70 -1.55 0.09 0.00 -1.18 0.00 0.00 61.69 59.75 3c4p s THR 84 Cb -0.43 -1.76 0.31 0.00 1.34 0.00 0.00 72.50 71.96 3c4p s THR 84 CO 0.51 -0.51 1.96 0.25 -0.54 0.00 0.00 174.62 176.29 3c4p h LEU 85 N 2.76 0.54 0.28 4.79 5.85 -1.95 -0.29 115.31 127.28 3c4p h LEU 85 Ca -0.33 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 3c4p h LEU 85 Cb 1.20 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.13 3c4p h LEU 85 CO 0.55 0.33 -0.13 0.00 -0.34 0.00 0.00 178.44 178.85 3c4p h ALA 86 N 1.65 -0.37 -0.44 1.25 0.00 -1.95 -0.72 119.26 118.67 3c4p h ALA 86 Ca 0.31 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3c4p h ALA 86 Cb 0.41 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3c4p h ALA 86 CO -0.10 -0.65 0.16 0.87 0.00 0.00 0.00 179.25 179.53 3c4p h LYS 87 N -0.49 0.63 -0.53 0.00 1.57 -1.76 -1.76 116.57 114.23 3c4p h LYS 87 Ca -0.04 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.60 3c4p h LYS 87 Cb 0.37 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 3c4p h LYS 87 CO 0.06 0.54 0.14 0.35 -0.57 0.00 0.00 179.45 179.97 3c4p h PHE 88 N 0.63 0.83 0.00 -1.35 3.57 -0.78 -2.50 116.94 117.33 3c4p h PHE 88 Ca 0.15 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.58 3c4p h PHE 88 Cb 0.15 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.64 3c4p h PHE 88 CO 0.01 0.69 0.00 -0.91 -2.23 0.00 0.00 178.31 175.87 3c4p h ASN 89 N 0.78 0.00 1.49 0.41 2.35 -0.26 -2.66 115.58 117.70 3c4p h ASN 89 Ca 0.17 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 3c4p h ASN 89 Cb 0.27 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 3c4p h ASN 89 CO -0.00 0.00 -0.25 1.56 -1.65 0.00 0.00 177.43 177.09 3c4p h GLN 90 N 0.00 0.00 -6.61 0.81 4.20 -1.01 -3.45 115.11 109.04 3c4p h GLN 90 Ca 0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 3c4p h GLN 90 Cb 0.70 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.51 3c4p h GLN 90 CO 0.00 0.25 0.70 0.08 -0.67 0.00 0.00 178.83 179.19 3c4p s VAL 91 N -3.24 3.23 0.02 -0.54 1.01 -1.00 -5.03 120.40 114.85 3c4p s VAL 91 Ca 0.04 0.94 0.05 0.00 0.00 0.00 0.00 61.98 63.01 3c4p s VAL 91 Cb 0.07 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 3c4p s VAL 91 CO 0.68 0.10 -0.15 0.42 0.00 0.00 0.00 175.10 176.16 3c4p s THR 92 N 0.63 1.15 0.25 3.92 -4.23 -1.26 -5.04 115.64 111.06 3c4p s THR 92 Ca 0.61 -0.89 -0.31 0.00 -1.18 0.00 0.00 61.69 59.92 3c4p s THR 92 Cb -0.37 -1.01 -0.13 0.00 1.34 0.00 0.00 72.50 72.33 3c4p s THR 92 CO 0.34 0.11 1.48 0.52 -0.54 0.00 0.00 174.62 176.53 3c4p n VAL 93 N 2.15 0.88 0.00 2.29 0.31 -1.26 -1.16 118.33 121.54 3c4p n VAL 93 Ca -0.17 -0.22 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 3c4p n VAL 93 Cb 0.55 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.85 3c4p n VAL 93 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3c4p n GLY 94 N 2.30 1.96 3.74 2.92 0.00 -0.43 -5.01 105.19 110.68 3c4p n GLY 94 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 3c4p n GLY 94 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3c4p s MET 95 N -0.85 2.72 0.68 1.61 1.00 -0.30 -4.59 119.30 119.56 3c4p s MET 95 Ca 0.00 1.90 -0.11 0.00 0.00 0.00 0.00 55.69 57.47 3c4p s MET 95 Cb 0.00 -1.89 -0.00 0.00 0.00 0.00 0.00 34.83 32.94 3c4p s MET 95 CO 0.00 -1.42 1.05 0.99 0.00 0.00 0.00 175.02 175.65 3c4p s THR 96 N -1.58 4.12 0.24 2.05 2.01 -1.26 0.30 115.64 121.52 3c4p s THR 96 Ca 0.79 0.71 -0.05 0.00 0.31 0.00 0.00 61.69 63.45 3c4p s THR 96 Cb -0.33 -3.47 0.22 0.00 0.01 0.00 0.00 72.50 68.93 3c4p s THR 96 CO 0.37 -0.88 1.85 -0.09 -0.69 0.00 0.00 174.62 175.18 3c4p h ARG 97 N -0.57 0.94 -0.15 4.92 2.43 -1.84 -0.10 114.38 120.02 3c4p h ARG 97 Ca -0.44 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 3c4p h ARG 97 Cb 1.21 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.54 3c4p h ARG 97 CO 0.58 0.62 0.09 0.00 -1.51 0.00 0.00 179.97 179.75 3c4p h ALA 98 N 1.41 0.19 -0.75 2.80 0.00 -1.93 -1.13 119.26 119.84 3c4p h ALA 98 Ca 0.38 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.32 3c4p h ALA 98 Cb 0.19 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 3c4p h ALA 98 CO -0.18 -0.32 0.46 1.96 0.00 0.00 0.00 179.25 181.17 3c4p h GLN 99 N 0.19 0.85 -0.26 0.00 4.20 -1.79 -0.42 115.11 117.88 3c4p h GLN 99 Ca 0.05 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 3c4p h GLN 99 Cb -0.00 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 3c4p h GLN 99 CO -0.01 0.56 0.07 0.28 -0.67 0.00 0.00 178.83 179.06 3c4p h VAL 100 N 0.87 1.21 -0.50 -0.54 2.07 -0.68 -2.26 116.25 116.41 3c4p h VAL 100 Ca 0.32 -0.67 -0.08 0.00 0.82 0.00 0.00 66.70 67.08 3c4p h VAL 100 Cb 0.10 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 3c4p h VAL 100 CO -0.14 0.22 0.01 -0.07 0.02 0.00 0.00 177.57 177.61 3c4p h LEU 101 N 0.25 0.86 -1.88 2.57 3.38 -0.97 -0.20 115.31 119.32 3c4p h LEU 101 Ca 0.08 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.79 3c4p h LEU 101 Cb 0.27 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3c4p h LEU 101 CO -0.00 0.95 0.17 0.00 0.09 0.00 0.00 178.44 179.65 3c4p h ALA 102 N 0.94 2.04 0.09 1.53 0.00 -0.98 0.14 119.26 123.02 3c4p h ALA 102 Ca 0.14 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3c4p h ALA 102 Cb 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3c4p h ALA 102 CO 0.02 -0.09 -0.04 1.15 0.00 0.00 0.00 179.25 180.29 3c4p h THR 103 N 0.15 0.78 0.00 0.00 2.02 -0.64 -3.37 112.91 111.86 3c4p h THR 103 Ca 0.11 -1.37 0.00 0.00 0.77 0.00 0.00 66.41 65.91 3c4p h THR 103 Cb 0.24 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 3c4p h THR 103 CO -0.02 0.24 0.00 -0.37 0.37 0.00 0.00 175.52 175.74 3c4p h VAL 104 N -0.96 0.00 0.00 3.16 -1.51 -0.92 -3.45 116.25 112.57 3c4p h VAL 104 Ca -0.01 -0.91 0.00 0.00 -1.23 0.00 0.00 66.70 64.55 3c4p h VAL 104 Cb 0.48 1.91 0.00 0.00 -2.13 0.00 0.00 31.29 31.55 3c4p h VAL 104 CO 0.02 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.97 3c4p n GLY 105 N 1.02 3.57 0.15 5.19 0.00 0.47 -3.12 105.19 112.46 3c4p n GLY 105 Ca 0.04 -1.32 0.12 0.00 0.00 0.00 0.00 46.02 44.86 3c4p n GLY 105 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3c4p h GLN 106 N 0.00 0.00 -0.04 1.61 1.08 -1.87 -1.93 115.11 113.97 3c4p h GLN 106 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3c4p h GLN 106 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3c4p h GLN 106 CO 0.00 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.29 3c4p n GLY 107 N -0.35 4.42 0.03 3.46 0.00 -1.26 -4.69 105.19 106.80 3c4p n GLY 107 Ca 0.01 -0.91 0.13 0.00 0.00 0.00 0.00 46.02 45.24 3c4p n GLY 107 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3c4p n SER 108 N -1.13 0.44 -4.32 1.61 7.64 -0.72 0.03 113.62 117.17 3c4p n SER 108 Ca 0.14 -0.17 -0.25 0.00 1.01 0.00 0.00 58.87 59.60 3c4p n SER 108 Cb 0.60 0.07 -0.12 0.00 -1.01 0.00 0.00 64.21 63.74 3c4p n SER 108 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3c4p s THR 110 N -1.25 1.53 -0.39 0.00 -4.23 0.17 -4.66 115.64 106.80 3c4p s THR 110 Ca 0.10 -2.13 -0.23 0.00 -1.18 0.00 0.00 61.69 58.25 3c4p s THR 110 Cb -0.09 -2.27 0.01 0.00 1.34 0.00 0.00 72.50 71.49 3c4p s THR 110 CO 0.05 -0.42 0.77 -0.89 -0.54 0.00 0.00 174.62 173.59 3c4p s THR 111 N -3.10 4.71 -0.11 3.99 2.01 -1.26 -0.65 115.64 121.23 3c4p s THR 111 Ca 0.26 0.70 -0.28 0.00 0.31 0.00 0.00 61.69 62.68 3c4p s THR 111 Cb 0.03 -4.24 -0.25 0.00 0.01 0.00 0.00 72.50 68.04 3c4p s THR 111 CO 0.09 -0.53 0.86 -0.25 -0.69 0.00 0.00 174.62 174.10 3c4p h TRP 112 N 8.66 0.05 -2.78 4.92 7.01 -1.25 -3.39 115.95 129.17 3c4p h TRP 112 Ca -0.25 -0.03 -0.12 0.00 2.11 0.00 0.00 58.89 60.61 3c4p h TRP 112 Cb 1.09 -0.00 -0.23 0.00 -2.10 0.00 0.00 29.16 27.92 3c4p h TRP 112 CO 0.79 0.94 -0.22 -1.54 -2.79 0.00 0.00 178.44 175.63 3c4p s SER 113 N -6.20 -0.38 -0.10 2.65 1.04 -0.94 -1.21 113.70 108.58 3c4p s SER 113 Ca -0.18 0.61 -0.04 0.00 0.48 0.00 0.00 55.95 56.81 3c4p s SER 113 Cb -0.02 0.67 0.05 0.00 0.10 0.00 0.00 66.02 66.82 3c4p s SER 113 CO 0.70 -0.26 0.21 -0.70 0.98 0.00 0.00 173.24 174.17 3c4p s GLU 114 N -0.33 0.12 -0.03 4.02 2.12 -0.20 -0.58 118.70 123.83 3c4p s GLU 114 Ca -0.05 0.58 0.01 0.00 0.36 0.00 0.00 54.97 55.87 3c4p s GLU 114 Cb -0.03 -0.14 0.02 0.00 0.26 0.00 0.00 34.13 34.24 3c4p s GLU 114 CO 0.02 -0.24 -0.02 -0.47 -0.54 0.00 0.00 175.26 174.01 3c4p s TYR 115 N 1.87 0.49 -0.69 5.30 6.04 -0.29 -1.25 117.35 128.81 3c4p s TYR 115 Ca -0.03 -0.08 -0.07 0.00 0.04 0.00 0.00 57.07 56.93 3c4p s TYR 115 Cb -0.11 -0.50 0.18 0.00 -1.04 0.00 0.00 41.96 40.49 3c4p s TYR 115 CO -0.07 -0.15 0.55 0.71 -1.54 0.00 0.00 175.55 175.05 3c4p s TYR 116 N 0.92 3.53 -0.39 4.97 1.51 0.16 -1.23 117.35 126.81 3c4p s TYR 116 Ca -0.10 -2.47 0.24 0.00 -1.01 0.00 0.00 57.07 53.73 3c4p s TYR 116 Cb -0.14 -3.41 1.05 0.00 -0.11 0.00 0.00 41.96 39.36 3c4p s TYR 116 CO -0.01 -0.89 1.74 -1.00 -1.11 0.00 0.00 175.55 174.28 3c4p h PRO 117 N 7.28 0.00 -0.18 -1.71 0.13 -1.81 -2.08 132.00 133.63 3c4p h PRO 117 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 3c4p h PRO 117 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 3c4p h PRO 117 CO 0.73 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.50 3c4p n ALA 118 N -1.80 2.73 -1.51 -0.56 0.00 -1.26 -5.06 120.51 113.05 3c4p n ALA 118 Ca 0.01 -2.34 -0.56 0.00 0.00 0.00 0.00 53.44 50.55 3c4p n ALA 118 Cb 0.21 -0.59 -0.07 0.00 0.00 0.00 0.00 19.45 19.00 3c4p n ALA 118 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3c4p n TYR 119 N -0.76 0.67 1.71 0.00 4.19 -0.79 -1.05 117.16 121.15 3c4p n TYR 119 Ca 0.19 0.96 0.13 0.00 3.31 0.00 0.00 57.90 62.49 3c4p n TYR 119 Cb 0.79 -2.12 0.64 0.00 0.49 0.00 0.00 39.34 39.14 3c4p n TYR 119 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 3c4p n PRO 120 N 1.60 1.33 -2.11 2.98 -0.04 -1.26 -5.09 135.00 132.41 3c4p n PRO 120 Ca 0.19 -0.48 -0.34 0.00 -0.04 0.00 0.00 63.50 62.83 3c4p n PRO 120 Cb 0.13 -1.43 0.02 0.00 -0.04 0.00 0.00 33.50 32.17 3c4p n PRO 120 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3c4p s SER 121 N -1.83 5.53 0.00 3.54 0.15 -0.21 -4.96 113.70 115.92 3c4p s SER 121 Ca 0.38 2.13 0.27 0.00 0.70 0.00 0.00 55.95 59.43 3c4p s SER 121 Cb 0.19 -2.57 0.80 0.00 -1.71 0.00 0.00 66.02 62.73 3c4p s SER 121 CO 0.31 -1.35 1.59 0.35 1.20 0.00 0.00 173.24 175.35 3c4p n THR 122 N -1.63 0.00 -1.71 6.45 -2.24 -1.26 -4.39 114.28 109.50 3c4p n THR 122 Ca 0.11 -0.22 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 3c4p n THR 122 Cb 0.51 0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 69.28 3c4p n THR 122 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3c4p n ALA 123 N -0.11 2.68 -0.90 6.98 0.00 -1.26 -1.61 120.51 126.29 3c4p n ALA 123 Ca 0.15 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.96 3c4p n ALA 123 Cb 0.38 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 17.27 3c4p n ALA 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3c4p n GLY 124 N 4.07 0.62 3.63 0.00 0.00 -1.26 -4.06 105.19 108.20 3c4p n GLY 124 Ca 0.17 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.69 3c4p n GLY 124 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3c4p n VAL 125 N -2.73 0.02 -4.74 1.61 3.14 -0.64 -4.60 118.33 110.40 3c4p n VAL 125 Ca 0.00 -0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 61.04 3c4p n VAL 125 Cb 0.00 -1.19 -0.13 0.00 -1.06 0.00 0.00 33.84 31.46 3c4p n VAL 125 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 3c4p s THR 126 N 0.85 3.30 -0.04 1.55 -4.23 -0.36 -0.82 115.64 115.88 3c4p s THR 126 Ca 0.82 -0.61 0.02 0.00 -1.18 0.00 0.00 61.69 60.74 3c4p s THR 126 Cb -0.82 -2.35 0.02 0.00 1.34 0.00 0.00 72.50 70.68 3c4p s THR 126 CO 0.43 0.56 -0.07 -0.22 -0.54 0.00 0.00 174.62 174.78 3c4p s LEU 127 N -0.26 1.48 -0.17 4.79 2.96 -0.66 -1.14 118.68 125.68 3c4p s LEU 127 Ca 0.02 -0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 53.76 3c4p s LEU 127 Cb -0.13 -0.53 -0.00 0.00 0.50 0.00 0.00 46.19 46.03 3c4p s LEU 127 CO 0.03 -0.02 -0.13 -0.44 -1.32 0.00 0.00 176.35 174.47 3c4p s SER 128 N 0.72 3.78 -0.12 3.68 0.01 0.26 -0.25 113.70 121.78 3c4p s SER 128 Ca -0.11 -0.45 -0.06 0.00 1.31 0.00 0.00 55.95 56.64 3c4p s SER 128 Cb -0.14 -1.60 -0.04 0.00 0.21 0.00 0.00 66.02 64.46 3c4p s SER 128 CO 0.01 0.07 0.09 -0.76 0.41 0.00 0.00 173.24 173.05 3c4p s LEU 129 N 0.94 4.05 -0.32 2.44 1.43 0.72 -0.87 118.68 127.07 3c4p s LEU 129 Ca -0.03 0.31 -0.11 0.00 -1.03 0.00 0.00 54.13 53.27 3c4p s LEU 129 Cb -0.15 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.08 3c4p s LEU 129 CO -0.01 0.36 0.18 -0.94 0.23 0.00 0.00 176.35 176.17 3c4p s SER 130 N -0.75 5.74 0.13 2.29 1.04 0.17 -1.41 113.70 120.91 3c4p s SER 130 Ca 0.13 -0.48 0.11 0.00 0.48 0.00 0.00 55.95 56.18 3c4p s SER 130 Cb -0.12 -2.05 -0.04 0.00 0.10 0.00 0.00 66.02 63.91 3c4p s SER 130 CO 0.03 -0.21 -0.26 0.00 0.98 0.00 0.00 173.24 173.78 3c4p s PHE 132 N -1.09 0.57 0.94 0.00 0.40 0.19 0.30 117.98 119.28 3c4p s PHE 132 Ca 0.15 -0.32 -0.16 0.00 -0.60 0.00 0.00 56.93 56.00 3c4p s PHE 132 Cb -0.10 -0.35 0.22 0.00 0.51 0.00 0.00 43.02 43.30 3c4p s PHE 132 CO 0.06 -0.05 1.17 -0.40 0.70 0.00 0.00 175.22 176.71 3c4p n ASP 133 N 2.13 -0.31 -0.32 1.36 3.85 -0.71 -3.20 116.55 119.34 3c4p n ASP 133 Ca -0.18 -1.38 0.08 0.00 -0.71 0.00 0.00 54.79 52.60 3c4p n ASP 133 Cb 0.56 -0.93 0.24 0.00 -1.35 0.00 0.00 41.12 39.65 3c4p n ASP 133 CO 0.00 0.00 0.00 1.62 -1.01 0.00 0.00 177.20 177.81 3c4p h VAL 134 N -1.88 0.77 -0.10 2.12 3.04 -1.68 -1.51 116.25 116.99 3c4p h VAL 134 Ca -0.39 -0.25 -0.02 0.00 -1.01 0.00 0.00 66.70 65.03 3c4p h VAL 134 Cb 1.10 -0.02 -0.01 0.00 -2.01 0.00 0.00 31.29 30.34 3c4p h VAL 134 CO 0.27 0.13 -0.11 0.47 -1.01 0.00 0.00 177.57 177.33 3c4p n ASP 135 N -4.80 2.57 0.06 3.17 8.00 -1.26 -4.79 116.55 119.50 3c4p n ASP 135 Ca 0.18 -3.32 -0.10 0.00 0.71 0.00 0.00 54.79 52.27 3c4p n ASP 135 Cb 0.44 -0.50 -0.13 0.00 -0.02 0.00 0.00 41.12 40.91 3c4p n ASP 135 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3c4p h GLY 136 N 0.70 0.09 -2.93 0.44 0.00 -1.44 -3.42 103.07 96.51 3c4p h GLY 136 Ca 0.03 -0.22 -0.48 0.00 0.00 0.00 0.00 47.33 46.66 3c4p h GLY 136 CO 0.10 0.20 0.40 -0.47 0.00 0.00 0.00 176.54 176.76 3c4p s TYR 137 N -2.68 3.43 -0.04 5.60 5.04 -1.26 -0.84 117.35 126.61 3c4p s TYR 137 Ca -0.02 1.69 -0.02 0.00 -2.44 0.00 0.00 57.07 56.29 3c4p s TYR 137 Cb 0.09 -3.07 0.02 0.00 0.35 0.00 0.00 41.96 39.35 3c4p s TYR 137 CO 0.84 -0.34 0.08 0.45 -1.34 0.00 0.00 175.55 175.24 3c4p s SER 138 N -1.53 -0.04 0.00 4.32 0.15 -1.26 -4.88 113.70 110.46 3c4p s SER 138 Ca 0.54 0.16 0.25 0.00 0.70 0.00 0.00 55.95 57.60 3c4p s SER 138 Cb -0.22 0.10 0.54 0.00 -1.71 0.00 0.00 66.02 64.72 3c4p s SER 138 CO 0.27 -0.09 1.43 -1.54 1.20 0.00 0.00 173.24 174.51 3c4p n SER 139 N 3.72 0.71 0.00 5.45 3.41 -1.26 -4.41 113.62 121.23 3c4p n SER 139 Ca -0.21 -0.51 0.00 0.00 -0.26 0.00 0.00 58.87 57.90 3c4p n SER 139 Cb 0.54 0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.75 3c4p n SER 139 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3c4p n THR 140 N -1.22 0.00 0.00 6.66 -2.24 -1.26 -4.79 114.28 111.44 3c4p n THR 140 Ca 0.08 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 3c4p n THR 140 Cb 0.34 0.89 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 3c4p n THR 140 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3c4p n GLY 141 N 0.73 3.60 3.22 3.38 0.00 -1.26 -1.43 105.19 113.43 3c4p n GLY 141 Ca 0.00 -0.39 -0.25 0.00 0.00 0.00 0.00 46.02 45.38 3c4p n GLY 141 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3c4p s PHE 142 N 3.30 1.72 0.55 1.61 0.40 -1.26 -4.47 117.98 119.83 3c4p s PHE 142 Ca 0.00 -0.36 -0.20 0.00 -0.60 0.00 0.00 56.93 55.77 3c4p s PHE 142 Cb 0.00 -1.04 -0.05 0.00 0.51 0.00 0.00 43.02 42.44 3c4p s PHE 142 CO 0.00 0.06 1.15 0.71 0.70 0.00 0.00 175.22 177.84 3c4p s TYR 143 N -0.73 2.62 -0.37 0.36 2.02 -1.26 -4.58 117.35 115.40 3c4p s TYR 143 Ca 0.07 1.53 0.12 0.00 -0.37 0.00 0.00 57.07 58.42 3c4p s TYR 143 Cb -0.08 -3.35 0.44 0.00 -0.40 0.00 0.00 41.96 38.57 3c4p s TYR 143 CO 0.01 -1.74 1.04 0.54 -1.57 0.00 0.00 175.55 173.83 3c4p n ARG 144 N -1.29 2.26 0.00 -0.62 1.74 -0.02 -4.95 116.66 113.78 3c4p n ARG 144 Ca 0.12 -3.85 0.00 0.00 -0.77 0.00 0.00 57.85 53.35 3c4p n ARG 144 Cb 0.50 -1.74 0.00 0.00 -1.02 0.00 0.00 32.46 30.21 3c4p n ARG 144 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3c4p n GLY 145 N -0.29 1.38 3.39 -0.13 0.00 -1.21 -4.28 105.19 104.05 3c4p n GLY 145 Ca 0.23 -0.25 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 3c4p n GLY 145 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3c4p s SER 146 N 0.00 -0.08 0.02 1.61 1.04 -0.49 -1.73 113.70 114.07 3c4p s SER 146 Ca 0.00 -0.67 -0.05 0.00 0.48 0.00 0.00 55.95 55.71 3c4p s SER 146 Cb 0.00 0.48 -0.01 0.00 0.10 0.00 0.00 66.02 66.59 3c4p s SER 146 CO 0.00 -0.93 0.08 0.00 0.98 0.00 0.00 173.24 173.37 3c4p s ALA 147 N -3.91 -0.12 -0.25 5.32 0.00 0.15 -0.42 121.76 122.53 3c4p s ALA 147 Ca 0.12 -0.41 -0.06 0.00 0.00 0.00 0.00 51.96 51.61 3c4p s ALA 147 Cb 0.02 0.18 -0.02 0.00 0.00 0.00 0.00 23.12 23.30 3c4p s ALA 147 CO -0.03 -0.24 0.04 -1.58 0.00 0.00 0.00 175.76 173.94 3c4p s HIS 148 N -1.92 3.06 -0.17 0.00 2.46 0.91 -1.12 115.29 118.50 3c4p s HIS 148 Ca -0.11 -0.69 0.01 0.00 0.47 0.00 0.00 55.06 54.74 3c4p s HIS 148 Cb -0.05 -2.20 0.01 0.00 -0.13 0.00 0.00 32.58 30.21 3c4p s HIS 148 CO -0.02 -0.46 -0.18 -0.51 -2.47 0.00 0.00 174.74 171.11 3c4p s LEU 149 N 1.55 2.25 0.07 8.88 1.43 -0.50 -1.20 118.68 131.17 3c4p s LEU 149 Ca 0.05 -0.59 0.09 0.00 -1.03 0.00 0.00 54.13 52.66 3c4p s LEU 149 Cb -0.15 -1.51 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 3c4p s LEU 149 CO 0.01 0.03 -0.25 -1.66 0.23 0.00 0.00 176.35 174.71 3c4p s TRP 150 N 1.15 2.17 0.08 0.29 -2.14 -0.93 -0.20 118.94 119.36 3c4p s TRP 150 Ca 0.01 -0.40 0.04 0.00 2.66 0.00 0.00 56.10 58.41 3c4p s TRP 150 Cb -0.14 -1.26 -0.03 0.00 -3.10 0.00 0.00 33.47 28.94 3c4p s TRP 150 CO -0.08 0.17 -0.10 -0.06 -2.66 0.00 0.00 176.95 174.22 3c4p s PHE 151 N -0.89 0.99 -0.04 1.66 0.40 0.65 -0.09 117.98 120.66 3c4p s PHE 151 Ca 0.11 -0.58 0.02 0.00 -0.60 0.00 0.00 56.93 55.88 3c4p s PHE 151 Cb -0.10 -0.56 0.01 0.00 0.51 0.00 0.00 43.02 42.88 3c4p s PHE 151 CO 0.03 -0.01 -0.10 0.99 0.70 0.00 0.00 175.22 176.83 3c4p s THR 152 N -1.97 0.88 -1.31 0.64 2.01 -0.72 -1.66 115.64 113.51 3c4p s THR 152 Ca 0.00 -0.37 -0.06 0.00 0.31 0.00 0.00 61.69 61.57 3c4p s THR 152 Cb -0.06 -0.80 0.04 0.00 0.01 0.00 0.00 72.50 71.69 3c4p s THR 152 CO 0.00 0.28 0.42 0.47 -0.69 0.00 0.00 174.62 175.11 3c4p n ASP 153 N 3.56 -4.33 -0.12 3.53 8.00 -0.00 -1.55 116.55 125.64 3c4p n ASP 153 Ca -0.21 -0.25 -0.02 0.00 0.71 0.00 0.00 54.79 55.02 3c4p n ASP 153 Cb 0.53 -3.57 -0.01 0.00 -0.02 0.00 0.00 41.12 38.05 3c4p n ASP 153 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3c4p n GLY 154 N -1.18 0.50 3.28 0.44 0.00 -1.26 -5.02 105.19 101.95 3c4p n GLY 154 Ca -0.07 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 3c4p n GLY 154 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c4p s VAL 155 N -1.90 2.29 0.16 1.61 1.01 -0.60 -2.24 120.40 120.74 3c4p s VAL 155 Ca 0.00 -0.96 -0.31 0.00 0.00 0.00 0.00 61.98 60.71 3c4p s VAL 155 Cb 0.00 -1.88 -0.11 0.00 0.00 0.00 0.00 36.38 34.39 3c4p s VAL 155 CO 0.00 0.56 1.72 -0.22 0.00 0.00 0.00 175.10 177.16 3c4p s LEU 156 N 0.11 4.38 -0.04 3.92 2.96 0.15 -1.76 118.68 128.40 3c4p s LEU 156 Ca -0.11 2.75 0.16 0.00 -0.22 0.00 0.00 54.13 56.71 3c4p s LEU 156 Cb -0.16 -3.58 -0.24 0.00 0.50 0.00 0.00 46.19 42.71 3c4p s LEU 156 CO 0.06 -0.95 0.30 0.00 -1.32 0.00 0.00 176.35 174.45 3c4p n GLN 157 N 4.65 0.65 -3.63 1.98 1.13 0.87 -1.31 117.38 121.72 3c4p n GLN 157 Ca 0.16 -0.12 -0.02 0.00 -1.94 0.00 0.00 57.00 55.08 3c4p n GLN 157 Cb 0.37 -1.38 -0.01 0.00 0.11 0.00 0.00 30.24 29.33 3c4p n GLN 157 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 3c4p s GLY 158 N -3.99 -0.35 0.06 1.08 0.00 -1.16 -4.93 107.32 98.03 3c4p s GLY 158 Ca -0.06 0.79 -0.14 0.00 0.00 0.00 0.00 44.72 45.30 3c4p s GLY 158 CO 0.66 0.20 0.32 -1.59 0.00 0.00 0.00 173.10 172.69 3c4p s LYS 159 N -2.68 0.88 -0.23 2.90 -2.85 -1.26 -2.19 119.74 114.30 3c4p s LYS 159 Ca 0.12 -0.58 -0.25 0.00 -1.00 0.00 0.00 55.97 54.26 3c4p s LYS 159 Cb 0.02 0.38 0.07 0.00 -2.06 0.00 0.00 37.83 36.24 3c4p s LYS 159 CO -0.03 -0.30 0.69 0.50 0.10 0.00 0.00 175.35 176.31 3c4p s ARG 160 N -2.94 0.83 0.13 1.78 3.52 -0.34 -4.99 118.95 116.94 3c4p s ARG 160 Ca -0.02 0.87 0.04 0.00 -0.13 0.00 0.00 55.73 56.49 3c4p s ARG 160 Cb 0.00 0.40 -0.04 0.00 -1.56 0.00 0.00 34.95 33.76 3c4p s ARG 160 CO -0.06 -0.12 -0.09 1.14 -0.81 0.00 0.00 175.30 175.36 3c4p s GLN 161 N 0.18 0.98 -0.04 5.12 1.03 -1.26 -0.07 119.66 125.60 3c4p s GLN 161 Ca -0.01 -1.38 0.00 0.00 0.04 0.00 0.00 55.36 54.00 3c4p s GLN 161 Cb -0.04 -0.51 0.03 0.00 0.03 0.00 0.00 33.01 32.52 3c4p s GLN 161 CO 0.02 0.05 -0.01 -1.58 -2.54 0.00 0.00 175.29 171.23 3c4p s TRP 162 N -3.29 0.52 -0.65 9.60 0.51 0.44 -4.91 118.94 121.15 3c4p s TRP 162 Ca 0.14 -0.09 0.00 0.00 -2.12 0.00 0.00 56.10 54.03 3c4p s TRP 162 Cb 0.03 -0.58 0.00 0.00 -0.81 0.00 0.00 33.47 32.10 3c4p s TRP 162 CO -0.01 -0.20 0.00 -0.25 -0.51 0.00 0.00 176.95 175.98 3c4p n ASP 163 N 4.40 -4.20 -4.79 2.95 8.00 -1.26 -1.39 116.55 120.26 3c4p n ASP 163 Ca -0.20 0.15 -0.35 0.00 0.71 0.00 0.00 54.79 55.10 3c4p n ASP 163 Cb 0.50 -2.25 -0.03 0.00 -0.02 0.00 0.00 41.12 39.33 3c4p n ASP 163 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3c4p s LEU 164 N -1.40 3.91 0.00 0.64 1.43 -1.26 -4.28 118.68 117.71 3c4p s LEU 164 Ca 0.00 2.05 0.00 0.00 -1.03 0.00 0.00 54.13 55.15 3c4p s LEU 164 Cb 0.00 -4.45 0.00 0.00 0.03 0.00 0.00 46.19 41.77 3c4p s LEU 164 CO 0.00 -0.82 0.00 1.33 0.23 0.00 0.00 176.35 177.09