#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pun s PRO 7 N 0.00 4.17 0.16 -0.78 0.04 -1.26 -4.95 135.00 132.39 2pun s PRO 7 Ca 0.00 2.49 0.23 0.00 0.04 0.00 0.00 61.00 63.76 2pun s PRO 7 Cb 0.00 -3.08 0.14 0.00 0.04 0.00 0.00 34.50 31.60 2pun s PRO 7 CO 0.00 -0.62 1.16 -0.07 0.04 0.00 0.00 177.00 177.51 2pun h LEU 8 N 5.85 0.00 -9.44 -3.56 3.38 -2.04 -3.47 115.31 106.02 2pun h LEU 8 Ca -0.45 -0.12 -0.53 0.00 0.09 0.00 0.00 57.88 56.88 2pun h LEU 8 Cb 1.21 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.99 2pun h LEU 8 CO 0.86 0.06 1.12 -0.47 0.09 0.00 0.00 178.44 180.10 2pun s TYR 9 N -3.27 1.97 -0.02 1.13 5.04 -1.26 -4.81 117.35 116.13 2pun s TYR 9 Ca 0.03 -0.05 0.01 0.00 -2.44 0.00 0.00 57.07 54.62 2pun s TYR 9 Cb 0.11 -4.13 0.01 0.00 0.35 0.00 0.00 41.96 38.30 2pun s TYR 9 CO 0.76 -4.77 -0.04 -1.21 -1.34 0.00 0.00 175.55 168.96 2pun s GLU 10 N 3.24 0.51 0.01 4.97 2.02 -1.26 -5.06 118.70 123.12 2pun s GLU 10 Ca 0.81 -0.09 -0.30 0.00 0.02 0.00 0.00 54.97 55.40 2pun s GLU 10 Cb -0.43 -0.55 -0.06 0.00 0.10 0.00 0.00 34.13 33.19 2pun s GLU 10 CO 0.36 -0.01 1.54 -0.08 0.02 0.00 0.00 175.26 177.09 2pun s THR 11 N 0.48 3.44 0.56 3.63 -1.32 -1.26 -5.00 115.64 116.18 2pun s THR 11 Ca -0.05 0.81 -0.17 0.00 -1.21 0.00 0.00 61.69 61.06 2pun s THR 11 Cb -0.09 -3.52 -0.05 0.00 -1.51 0.00 0.00 72.50 67.33 2pun s THR 11 CO -0.00 -0.02 1.04 -0.76 -2.21 0.00 0.00 174.62 172.67 2pun s LEU 12 N 2.80 3.60 0.00 9.08 1.43 -1.26 -5.07 118.68 129.26 2pun s LEU 12 Ca 0.69 1.81 0.00 0.00 -1.03 0.00 0.00 54.13 55.60 2pun s LEU 12 Cb -0.35 -4.54 -0.00 0.00 0.03 0.00 0.00 46.19 41.34 2pun s LEU 12 CO 0.29 -0.99 0.01 -0.46 0.23 0.00 0.00 176.35 175.43 2pun n ASN 13 N -1.71 2.18 -0.05 2.29 0.23 -1.26 -4.96 115.26 111.97 2pun n ASN 13 Ca 0.09 -1.70 -0.03 0.00 -0.53 0.00 0.00 54.58 52.41 2pun n ASN 13 Cb 0.53 0.15 0.21 0.00 -2.08 0.00 0.00 39.78 38.60 2pun n ASN 13 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2pun h GLU 14 N 0.00 0.64 0.07 -3.83 5.08 -1.99 0.12 114.58 114.67 2pun h GLU 14 Ca -0.13 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.06 2pun h GLU 14 Cb 0.40 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2pun h GLU 14 CO 0.21 0.69 -0.03 1.03 -1.00 0.00 0.00 179.01 179.91 2pun h SER 15 N 0.60 -0.07 -0.94 1.42 0.87 -1.96 -2.89 113.55 110.57 2pun h SER 15 Ca 0.12 -0.49 0.14 0.00 -1.23 0.00 0.00 61.79 60.33 2pun h SER 15 Cb 0.45 0.02 -0.08 0.00 -0.44 0.00 0.00 62.40 62.35 2pun h SER 15 CO 0.02 0.49 0.60 0.28 -0.53 0.00 0.00 176.83 177.68 2pun h SER 16 N -0.67 0.74 -0.19 6.23 0.02 -1.90 -0.64 113.55 117.15 2pun h SER 16 Ca -0.01 0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 60.95 2pun h SER 16 Cb 0.56 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 2pun h SER 16 CO 0.01 0.37 -0.05 0.00 -1.14 0.00 0.00 176.83 176.02 2pun h ALA 17 N 1.59 0.26 -0.40 3.77 0.00 -0.83 -0.88 119.26 122.77 2pun h ALA 17 Ca 0.48 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2pun h ALA 17 Cb 0.69 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2pun h ALA 17 CO -0.24 0.03 0.23 -0.24 0.00 0.00 0.00 179.25 179.03 2pun h VAL 18 N 0.08 1.12 -0.48 0.00 3.04 -1.23 -0.93 116.25 117.85 2pun h VAL 18 Ca 0.05 -0.30 -0.05 0.00 -1.01 0.00 0.00 66.70 65.38 2pun h VAL 18 Cb 0.49 0.57 -0.02 0.00 -2.01 0.00 0.00 31.29 30.33 2pun h VAL 18 CO 0.02 0.13 0.08 0.00 -1.01 0.00 0.00 177.57 176.79 2pun h ALA 19 N 1.70 0.63 0.29 3.17 0.00 -0.94 -1.78 119.26 122.32 2pun h ALA 19 Ca 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2pun h ALA 19 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2pun h ALA 19 CO -0.03 0.35 -0.14 -0.07 0.00 0.00 0.00 179.25 179.37 2pun h LEU 20 N 0.66 -0.33 -1.40 0.00 4.07 -0.90 -1.18 115.31 116.23 2pun h LEU 20 Ca 0.15 -0.13 0.20 0.00 0.08 0.00 0.00 57.88 58.18 2pun h LEU 20 Cb 0.38 0.08 -0.07 0.00 1.08 0.00 0.00 40.66 42.13 2pun h LEU 20 CO 0.01 -0.06 0.60 0.00 -1.08 0.00 0.00 178.44 177.92 2pun h ALA 21 N 0.04 2.09 0.86 1.53 0.00 -1.23 -0.57 119.26 121.98 2pun h ALA 21 Ca -0.04 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2pun h ALA 21 Cb 0.43 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.19 2pun h ALA 21 CO 0.06 -0.39 -0.41 -0.24 0.00 0.00 0.00 179.25 178.27 2pun h VAL 22 N 0.49 0.12 0.00 0.00 3.04 -1.07 -3.11 116.25 115.72 2pun h VAL 22 Ca 0.49 -0.06 -0.01 0.00 -1.01 0.00 0.00 66.70 66.12 2pun h VAL 22 Cb 1.10 0.13 -0.00 0.00 -2.01 0.00 0.00 31.29 30.51 2pun h VAL 22 CO -0.22 0.00 -0.03 0.07 -1.01 0.00 0.00 177.57 176.39 2pun h LYS 23 N -1.20 0.00 -4.77 4.17 5.09 -0.45 -2.94 116.57 116.46 2pun h LYS 23 Ca -0.12 0.00 -0.70 0.00 0.09 0.00 0.00 60.65 59.93 2pun h LYS 23 Cb 0.89 0.00 -0.19 0.00 0.10 0.00 0.00 32.23 33.03 2pun h LYS 23 CO 0.19 0.03 0.21 -0.48 -2.09 0.00 0.00 179.45 177.31 2pun s LEU 24 N -7.26 5.29 -0.41 7.07 0.05 -0.29 -5.10 118.68 118.02 2pun s LEU 24 Ca -0.04 -1.45 -0.37 0.00 0.05 0.00 0.00 54.13 52.32 2pun s LEU 24 Cb 0.14 -2.32 -0.13 0.00 -2.05 0.00 0.00 46.19 41.83 2pun s LEU 24 CO 0.53 -1.14 2.21 0.61 -0.55 0.00 0.00 176.35 178.01 2pun n GLY 25 N 5.26 0.30 0.00 -3.48 0.00 -1.11 -4.70 105.19 101.46 2pun n GLY 25 Ca -0.06 0.97 0.00 0.00 0.00 0.00 0.00 46.02 46.93 2pun n GLY 25 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2pun n LEU 33 N 9.57 0.00 -4.47 0.99 -0.00 -1.26 -5.09 117.00 116.74 2pun n LEU 33 Ca 0.45 0.00 -0.28 0.00 -0.00 0.00 0.00 56.01 56.18 2pun n LEU 33 Cb 0.17 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.48 2pun n LEU 33 CO 0.79 0.00 -0.50 0.42 -0.00 0.00 0.00 177.39 178.10 2pun s THR 34 N -2.04 2.69 -0.02 1.47 -4.23 -0.76 -4.97 115.64 107.78 2pun s THR 34 Ca 0.00 -1.67 0.01 0.00 -1.18 0.00 0.00 61.69 58.84 2pun s THR 34 Cb 0.00 -2.25 0.02 0.00 1.34 0.00 0.00 72.50 71.61 2pun s THR 34 CO 0.00 0.03 -0.01 0.00 -0.54 0.00 0.00 174.62 174.10 2pun s GLN 36 N 0.71 1.40 -0.08 0.00 -1.52 -0.35 -4.96 119.66 114.86 2pun s GLN 36 Ca -0.07 -0.36 -0.30 0.00 -1.95 0.00 0.00 55.36 52.68 2pun s GLN 36 Cb -0.11 -1.21 -0.04 0.00 -0.22 0.00 0.00 33.01 31.44 2pun s GLN 36 CO -0.01 0.06 1.34 -2.00 -0.25 0.00 0.00 175.29 174.42 2pun s GLU 37 N 0.51 4.27 -0.06 2.91 -6.30 -1.26 -1.06 118.70 117.71 2pun s GLU 37 Ca -0.10 1.82 0.09 0.00 -2.50 0.00 0.00 54.97 54.27 2pun s GLU 37 Cb -0.13 -3.69 0.13 0.00 0.00 0.00 0.00 34.13 30.44 2pun s GLU 37 CO 0.02 -0.62 1.03 0.44 0.02 0.00 0.00 175.26 176.14 2pun n ILE 38 N 5.00 0.95 -2.02 -3.70 -5.35 0.45 -4.98 119.36 109.71 2pun n ILE 38 Ca 0.13 -1.12 -0.36 0.00 -0.27 0.00 0.00 62.75 61.13 2pun n ILE 38 Cb 0.45 0.21 0.03 0.00 -1.74 0.00 0.00 39.64 38.59 2pun n ILE 38 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2pun s GLY 39 N -1.76 2.70 -0.17 3.28 0.00 -1.24 -4.92 107.32 105.21 2pun s GLY 39 Ca 0.14 0.97 -0.05 0.00 0.00 0.00 0.00 44.72 45.78 2pun s GLY 39 CO 0.01 1.36 0.16 1.34 0.00 0.00 0.00 173.10 175.96 2pun n ASP 40 N -1.61 2.06 -1.36 1.64 -0.08 -1.26 -4.97 116.55 110.97 2pun n ASP 40 Ca 0.13 0.12 0.00 0.00 -1.51 0.00 0.00 54.79 53.53 2pun n ASP 40 Cb 0.50 -0.73 0.00 0.00 2.34 0.00 0.00 41.12 43.23 2pun n ASP 40 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2pun n GLY 41 N 2.02 1.63 0.27 0.27 0.00 -1.26 -5.06 105.19 103.07 2pun n GLY 41 Ca -0.37 -2.05 0.03 0.00 0.00 0.00 0.00 46.02 43.63 2pun n GLY 41 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2pun n ASN 42 N -1.87 2.01 -0.00 1.61 6.94 -1.26 -4.62 115.26 118.07 2pun n ASN 42 Ca 0.00 -1.65 0.10 0.00 -0.02 0.00 0.00 54.58 53.01 2pun n ASN 42 Cb 0.00 -0.06 -0.11 0.00 -2.36 0.00 0.00 39.78 37.25 2pun n ASN 42 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2pun n LEU 43 N 0.14 0.96 -3.88 -4.53 4.77 -1.26 -4.44 117.00 108.76 2pun n LEU 43 Ca 0.05 -0.47 -0.11 0.00 -0.03 0.00 0.00 56.01 55.44 2pun n LEU 43 Cb 0.25 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.21 2pun n LEU 43 CO 0.04 0.24 -0.27 0.20 -1.33 0.00 0.00 177.39 176.27 2pun s ASN 44 N -3.04 0.00 0.16 -1.43 0.01 -1.26 -1.30 114.94 108.08 2pun s ASN 44 Ca 0.08 -0.05 -0.13 0.00 -0.71 0.00 0.00 52.86 52.05 2pun s ASN 44 Cb 0.16 0.17 -0.07 0.00 0.41 0.00 0.00 41.25 41.92 2pun s ASN 44 CO 0.87 -0.16 0.54 -0.31 -1.51 0.00 0.00 177.10 176.53 2pun s TYR 45 N -0.56 3.57 -0.21 2.20 4.12 0.75 -4.75 117.35 122.47 2pun s TYR 45 Ca -0.06 1.01 -0.01 0.00 0.02 0.00 0.00 57.07 58.03 2pun s TYR 45 Cb -0.04 -2.34 0.06 0.00 -1.52 0.00 0.00 41.96 38.12 2pun s TYR 45 CO 0.00 0.41 -0.01 0.08 0.02 0.00 0.00 175.55 176.05 2pun s VAL 46 N -1.52 1.02 -0.27 0.71 1.01 -1.26 -0.91 120.40 119.18 2pun s VAL 46 Ca 0.39 -0.88 -0.09 0.00 0.00 0.00 0.00 61.98 61.40 2pun s VAL 46 Cb -0.14 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2pun s VAL 46 CO 0.19 -0.15 0.13 -0.36 0.00 0.00 0.00 175.10 174.91 2pun s PHE 47 N 1.63 3.15 -0.25 5.22 0.08 0.11 -0.41 117.98 127.50 2pun s PHE 47 Ca -0.03 -0.19 -0.17 0.00 0.12 0.00 0.00 56.93 56.66 2pun s PHE 47 Cb -0.18 -2.31 -0.03 0.00 -0.57 0.00 0.00 43.02 39.93 2pun s PHE 47 CO -0.07 -0.28 0.45 -1.58 -0.10 0.00 0.00 175.22 173.65 2pun s HIS 48 N 1.68 3.28 -0.10 0.36 5.65 -0.22 -0.84 115.29 125.10 2pun s HIS 48 Ca 0.07 0.57 0.04 0.00 0.25 0.00 0.00 55.06 55.98 2pun s HIS 48 Cb -0.16 -2.64 0.00 0.00 -1.18 0.00 0.00 32.58 28.61 2pun s HIS 48 CO 0.07 -0.22 -0.22 0.42 -0.65 0.00 0.00 174.74 174.15 2pun s ILE 49 N 2.05 1.89 -0.01 0.89 1.01 0.03 -1.22 121.20 125.85 2pun s ILE 49 Ca 0.19 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 59.98 2pun s ILE 49 Cb -0.16 -1.65 -0.02 0.00 0.01 0.00 0.00 42.46 40.65 2pun s ILE 49 CO 0.09 0.52 -0.20 -0.47 0.00 0.00 0.00 174.94 174.89 2pun s TYR 50 N 0.43 1.76 0.05 3.97 6.14 -0.09 -0.28 117.35 129.33 2pun s TYR 50 Ca -0.17 -0.33 -0.01 0.00 0.64 0.00 0.00 57.07 57.20 2pun s TYR 50 Cb -0.17 -1.13 -0.00 0.00 0.42 0.00 0.00 41.96 41.08 2pun s TYR 50 CO 0.07 -0.03 -0.01 -3.47 0.64 0.00 0.00 175.55 172.75 2pun n ASP 51 N 2.57 0.74 -1.79 4.32 -0.08 -1.26 -1.83 116.55 119.22 2pun n ASP 51 Ca -0.15 0.10 0.00 0.00 -1.51 0.00 0.00 54.79 53.22 2pun n ASP 51 Cb 0.53 -0.24 0.00 0.00 2.34 0.00 0.00 41.12 43.75 2pun n ASP 51 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 2pun n ARG 56 N -3.17 -3.72 -4.04 -0.67 0.00 -1.26 -5.10 116.66 98.70 2pun n ARG 56 Ca -0.01 2.69 -0.09 0.00 -0.00 0.00 0.00 57.85 60.44 2pun n ARG 56 Cb 0.02 -3.12 -0.09 0.00 -0.00 0.00 0.00 32.46 29.27 2pun n ARG 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2pun s ALA 57 N -1.81 0.41 -0.03 2.89 0.00 -1.26 -5.07 121.76 116.89 2pun s ALA 57 Ca 0.00 -1.14 -0.19 0.00 0.00 0.00 0.00 51.96 50.63 2pun s ALA 57 Cb 0.00 0.72 0.03 0.00 0.00 0.00 0.00 23.12 23.87 2pun s ALA 57 CO 0.00 -0.52 0.40 -1.17 0.00 0.00 0.00 175.76 174.47 2pun s LEU 58 N -2.98 0.48 -0.12 0.00 2.96 0.61 -4.44 118.68 115.19 2pun s LEU 58 Ca 0.17 0.27 0.01 0.00 -0.22 0.00 0.00 54.13 54.36 2pun s LEU 58 Cb 0.06 1.57 -0.01 0.00 0.50 0.00 0.00 46.19 48.31 2pun s LEU 58 CO -0.02 -0.47 -0.15 -0.63 -1.32 0.00 0.00 176.35 173.76 2pun s ILE 59 N -1.21 2.90 -0.26 6.68 -1.09 -0.54 -0.79 121.20 126.89 2pun s ILE 59 Ca -0.12 -0.72 0.01 0.00 -2.23 0.00 0.00 60.65 57.59 2pun s ILE 59 Cb -0.04 -2.20 0.05 0.00 -1.58 0.00 0.00 42.46 38.70 2pun s ILE 59 CO 0.05 0.53 -0.09 -0.63 -1.23 0.00 0.00 174.94 173.58 2pun s ILE 60 N 0.27 2.40 -0.17 2.92 1.01 -0.02 -0.44 121.20 127.16 2pun s ILE 60 Ca -0.10 -1.50 -0.09 0.00 0.00 0.00 0.00 60.65 58.96 2pun s ILE 60 Cb -0.16 -2.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.90 2pun s ILE 60 CO 0.06 0.00 0.13 -0.75 0.00 0.00 0.00 174.94 174.38 2pun s LYS 61 N 1.16 3.87 -0.02 2.79 2.20 -0.35 0.04 119.74 129.43 2pun s LYS 61 Ca -0.07 -0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.36 2pun s LYS 61 Cb -0.19 -3.30 0.01 0.00 -1.51 0.00 0.00 37.83 32.83 2pun s LYS 61 CO -0.05 0.48 -0.05 -1.14 -0.36 0.00 0.00 175.35 174.24 2pun s GLN 62 N -0.18 0.66 0.34 4.03 0.74 -0.09 -0.97 119.66 124.19 2pun s GLN 62 Ca 0.10 -0.15 -0.27 0.00 0.05 0.00 0.00 55.36 55.09 2pun s GLN 62 Cb -0.11 -0.67 -0.09 0.00 1.10 0.00 0.00 33.01 33.24 2pun s GLN 62 CO 0.00 0.02 1.10 0.00 -0.55 0.00 0.00 175.29 175.87 2pun s ALA 63 N 0.43 3.26 -0.22 1.58 0.00 -0.80 -0.17 121.76 125.83 2pun s ALA 63 Ca -0.05 0.86 -0.08 0.00 0.00 0.00 0.00 51.96 52.69 2pun s ALA 63 Cb -0.09 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 2pun s ALA 63 CO -0.00 -0.26 0.07 0.08 0.00 0.00 0.00 175.76 175.66 2pun s VAL 64 N -1.36 4.59 0.65 0.00 1.01 -0.42 -4.85 120.40 120.02 2pun s VAL 64 Ca 0.51 -0.09 -0.15 0.00 0.00 0.00 0.00 61.98 62.25 2pun s VAL 64 Cb -0.29 -3.11 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 2pun s VAL 64 CO 0.37 0.38 1.11 -2.16 0.00 0.00 0.00 175.10 174.80 2pun s PRO 65 N 1.08 2.88 0.01 2.72 0.04 -1.26 -4.83 135.00 135.64 2pun s PRO 65 Ca 0.04 1.39 -0.02 0.00 0.04 0.00 0.00 61.00 62.45 2pun s PRO 65 Cb -0.14 -1.96 -0.00 0.00 0.04 0.00 0.00 34.50 32.43 2pun s PRO 65 CO 0.03 -1.18 0.15 0.98 0.04 0.00 0.00 177.00 177.02 2pun n TYR 66 N -2.31 -0.02 0.00 0.56 9.36 -1.26 -3.83 117.16 119.66 2pun n TYR 66 Ca 0.10 0.06 0.00 0.00 3.32 0.00 0.00 57.90 61.39 2pun n TYR 66 Cb 0.52 -0.25 0.00 0.00 -0.63 0.00 0.00 39.34 38.98 2pun n TYR 66 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2pun n ALA 67 N -2.86 0.00 -2.48 2.98 0.00 -1.26 -4.35 120.51 112.54 2pun n ALA 67 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 2pun n ALA 67 Cb 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.38 2pun n ALA 67 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2pun s LYS 68 N 0.00 1.91 0.00 0.00 -0.14 -1.25 -5.19 119.74 115.07 2pun s LYS 68 Ca 0.00 -2.16 0.00 0.00 -1.36 0.00 0.00 55.97 52.45 2pun s LYS 68 Cb 0.00 -0.46 0.00 0.00 -1.68 0.00 0.00 37.83 35.69 2pun s LYS 68 CO 0.00 -0.51 0.00 1.55 -0.76 0.00 0.00 175.35 175.63 2pun n VAL 69 N -0.87 -0.62 -3.56 3.17 3.14 -1.25 -4.68 118.33 113.66 2pun n VAL 69 Ca -0.04 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 60.96 2pun n VAL 69 Cb 0.65 -0.77 -0.10 0.00 -1.06 0.00 0.00 33.84 32.55 2pun n VAL 69 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 2pun s VAL 70 N 0.00 5.29 0.00 1.55 -7.23 -1.26 -4.92 120.40 113.83 2pun s VAL 70 Ca 0.00 0.28 0.00 0.00 -1.81 0.00 0.00 61.98 60.45 2pun s VAL 70 Cb 0.00 -3.56 0.00 0.00 0.56 0.00 0.00 36.38 33.38 2pun s VAL 70 CO 0.00 0.26 0.00 0.61 -0.31 0.00 0.00 175.10 175.66 2pun n GLY 71 N 4.72 0.06 3.67 2.32 0.00 -1.26 -4.87 105.19 109.83 2pun n GLY 71 Ca -0.13 -1.71 -0.44 0.00 0.00 0.00 0.00 46.02 43.75 2pun n GLY 71 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2pun n GLU 72 N 0.20 1.93 -3.79 1.61 0.00 -1.26 -5.01 120.64 114.32 2pun n GLU 72 Ca 0.00 0.68 -0.10 0.00 0.00 0.00 0.00 57.16 57.74 2pun n GLU 72 Cb 0.00 -2.24 -0.05 0.00 0.00 0.00 0.00 31.44 29.15 2pun n GLU 72 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 2pun s SER 73 N -0.19 -0.10 -0.12 4.31 1.04 -1.26 -5.06 113.70 112.31 2pun s SER 73 Ca 0.60 -0.57 -0.29 0.00 0.48 0.00 0.00 55.95 56.16 2pun s SER 73 Cb -0.62 0.47 -0.02 0.00 0.10 0.00 0.00 66.02 65.94 2pun s SER 73 CO 0.58 -0.89 1.29 0.86 0.98 0.00 0.00 173.24 176.06 2pun s TRP 74 N -3.88 2.85 -0.12 5.02 -0.11 -1.26 -4.98 118.94 116.45 2pun s TRP 74 Ca 0.09 0.97 -0.29 0.00 1.22 0.00 0.00 56.10 58.09 2pun s TRP 74 Cb 0.02 -3.53 -0.05 0.00 -1.50 0.00 0.00 33.47 28.41 2pun s TRP 74 CO -0.06 -1.85 1.83 -2.14 -4.62 0.00 0.00 176.95 170.11 2pun s PRO 75 N 3.19 3.83 -0.00 5.86 0.02 -1.26 -4.99 135.00 141.66 2pun s PRO 75 Ca 0.57 2.08 0.01 0.00 0.02 0.00 0.00 61.00 63.67 2pun s PRO 75 Cb -0.24 -4.12 -0.00 0.00 0.02 0.00 0.00 34.50 30.16 2pun s PRO 75 CO 0.18 -1.27 -0.02 -0.51 -0.33 0.00 0.00 177.00 175.05 2pun s LEU 76 N 5.37 2.01 1.27 -5.54 1.43 -1.26 -5.10 118.68 116.86 2pun s LEU 76 Ca 0.82 -0.05 -0.20 0.00 -1.03 0.00 0.00 54.13 53.67 2pun s LEU 76 Cb -0.33 -0.09 0.31 0.00 0.03 0.00 0.00 46.19 46.11 2pun s LEU 76 CO 0.34 0.01 1.06 0.42 0.23 0.00 0.00 176.35 178.41 2pun s THR 77 N -0.08 1.48 -2.17 5.49 -4.23 -1.26 -4.10 115.64 110.77 2pun s THR 77 Ca 0.00 0.00 0.22 0.00 -1.18 0.00 0.00 61.69 60.73 2pun s THR 77 Cb -0.01 -2.37 0.54 0.00 1.34 0.00 0.00 72.50 72.00 2pun s THR 77 CO -0.00 0.00 1.47 2.30 -0.54 0.00 0.00 174.62 177.85 2pun n ILE 78 N -5.03 0.74 -0.04 2.99 -5.35 -1.26 -4.34 119.36 107.08 2pun n ILE 78 Ca 0.13 -0.82 0.08 0.00 -0.27 0.00 0.00 62.75 61.86 2pun n ILE 78 Cb 0.60 0.62 0.46 0.00 -1.74 0.00 0.00 39.64 39.58 2pun n ILE 78 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 2pun h ASP 79 N 4.04 0.41 -1.38 7.28 3.58 -1.93 -2.30 116.42 126.12 2pun h ASP 79 Ca 0.00 -0.00 0.42 0.00 0.42 0.00 0.00 57.03 57.87 2pun h ASP 79 Cb 0.91 -0.09 -0.10 0.00 1.72 0.00 0.00 39.33 41.77 2pun h ASP 79 CO 0.00 0.28 0.93 0.08 -2.88 0.00 0.00 179.24 177.64 2pun h ARG 80 N 0.48 0.10 -0.61 0.28 0.11 -1.92 -1.05 114.38 111.76 2pun h ARG 80 Ca 0.21 -0.01 -0.07 0.00 0.10 0.00 0.00 59.98 60.21 2pun h ARG 80 Cb 0.23 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 31.26 2pun h ARG 80 CO -0.05 0.07 0.09 0.00 0.10 0.00 0.00 179.97 180.17 2pun h ALA 81 N 1.47 0.82 -0.60 0.08 0.00 -1.75 -0.68 119.26 118.59 2pun h ALA 81 Ca 0.77 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 55.45 2pun h ALA 81 Cb 2.58 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 20.10 2pun h ALA 81 CO -0.26 0.58 0.36 -0.09 0.00 0.00 0.00 179.25 179.84 2pun h ARG 82 N 0.93 0.68 0.22 0.00 2.43 -1.37 -1.39 114.38 115.88 2pun h ARG 82 Ca 0.19 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 2pun h ARG 82 Cb 0.44 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 2pun h ARG 82 CO 0.01 0.45 -0.11 0.82 -1.51 0.00 0.00 179.97 179.64 2pun h ILE 83 N 0.70 0.83 -0.15 1.20 1.08 -1.33 -2.38 117.51 117.45 2pun h ILE 83 Ca 0.25 -0.23 0.02 0.00 -0.39 0.00 0.00 64.86 64.50 2pun h ILE 83 Cb 0.05 0.97 -0.02 0.00 -3.07 0.00 0.00 36.82 34.75 2pun h ILE 83 CO -0.11 0.05 0.03 -0.08 -0.69 0.00 0.00 178.15 177.35 2pun h GLU 84 N -0.41 0.09 -0.02 2.37 4.81 -1.04 0.29 114.58 120.67 2pun h GLU 84 Ca -0.03 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.22 2pun h GLU 84 Cb 0.31 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 2pun h GLU 84 CO 0.05 0.06 -0.14 0.77 -0.73 0.00 0.00 179.01 179.01 2pun h SER 85 N 0.09 -0.42 -0.19 1.04 0.02 -1.32 -0.78 113.55 112.00 2pun h SER 85 Ca 0.07 0.07 -0.14 0.00 -0.84 0.00 0.00 61.79 60.94 2pun h SER 85 Cb 0.06 0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 2pun h SER 85 CO -0.09 -0.20 -0.39 0.77 -1.14 0.00 0.00 176.83 175.78 2pun h SER 86 N -0.23 0.77 -0.42 3.07 4.64 -1.24 -1.67 113.55 118.47 2pun h SER 86 Ca 0.06 -0.34 -0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2pun h SER 86 Cb 0.30 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 2pun h SER 86 CO -0.15 1.07 0.26 0.00 -0.87 0.00 0.00 176.83 177.13 2pun h ALA 87 N 0.97 0.53 -0.54 5.18 0.00 -0.34 -1.59 119.26 123.48 2pun h ALA 87 Ca 0.05 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2pun h ALA 87 Cb 0.93 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2pun h ALA 87 CO 0.08 0.01 0.15 -0.07 0.00 0.00 0.00 179.25 179.43 2pun h LEU 88 N 0.55 0.75 -0.17 0.00 3.38 -0.93 -1.52 115.31 117.36 2pun h LEU 88 Ca 0.15 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 2pun h LEU 88 Cb -0.02 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 2pun h LEU 88 CO -0.03 0.72 -0.15 0.40 0.09 0.00 0.00 178.44 179.47 2pun h ILE 89 N 0.78 1.33 -0.67 1.22 2.04 -1.12 -2.20 117.51 118.90 2pun h ILE 89 Ca 0.18 -1.29 0.04 0.00 1.00 0.00 0.00 64.86 64.79 2pun h ILE 89 Cb 0.25 1.79 -0.05 0.00 -0.74 0.00 0.00 36.82 38.08 2pun h ILE 89 CO -0.01 0.39 0.40 0.03 0.00 0.00 0.00 178.15 178.96 2pun h ARG 90 N 0.06 0.74 -0.83 2.37 3.08 -1.12 -2.81 114.38 115.87 2pun h ARG 90 Ca 0.03 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 2pun h ARG 90 Cb 0.68 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 30.52 2pun h ARG 90 CO 0.04 0.49 0.40 1.96 -1.07 0.00 0.00 179.97 181.79 2pun h GLN 91 N 0.76 1.20 0.00 0.04 4.20 -1.24 -2.55 115.11 117.53 2pun h GLN 91 Ca 0.28 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.81 2pun h GLN 91 Cb 0.08 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 27.64 2pun h GLN 91 CO -0.13 0.92 0.00 0.41 -0.67 0.00 0.00 178.83 179.35 2pun n GLY 92 N -1.03 -0.83 0.09 3.46 0.00 -0.83 -1.09 105.19 104.96 2pun n GLY 92 Ca 0.08 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.17 2pun n GLY 92 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2pun n GLU 93 N -1.34 0.26 0.00 1.61 1.02 -0.96 -3.45 120.64 117.78 2pun n GLU 93 Ca 0.06 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 2pun n GLU 93 Cb 0.13 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 29.78 2pun n GLU 93 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2pun n HIS 94 N -2.21 0.00 -2.92 -0.32 8.25 -0.87 -4.86 115.22 112.30 2pun n HIS 94 Ca 0.05 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.33 2pun n HIS 94 Cb 0.43 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.53 2pun n HIS 94 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2pun n VAL 95 N -2.10 1.01 0.33 1.59 0.24 -0.25 -4.95 118.33 114.21 2pun n VAL 95 Ca 0.00 -4.37 0.22 0.00 -2.04 0.00 0.00 64.34 58.15 2pun n VAL 95 Cb 0.44 -0.31 1.17 0.00 -1.47 0.00 0.00 33.84 33.67 2pun n VAL 95 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2pun h PRO 96 N 2.95 0.00 -0.01 7.34 0.13 -1.73 0.52 132.00 141.20 2pun h PRO 96 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2pun h PRO 96 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 2pun h PRO 96 CO 0.60 0.00 -0.16 -2.39 -0.23 0.00 0.00 178.00 175.81 2pun n HIS 97 N -3.17 0.00 -0.02 1.56 1.44 -1.26 -3.96 115.22 109.81 2pun n HIS 97 Ca -0.03 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.70 2pun n HIS 97 Cb 0.09 -0.14 0.04 0.00 0.12 0.00 0.00 29.99 30.10 2pun n HIS 97 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2pun n LEU 98 N -0.76 2.13 -3.93 2.39 4.77 0.17 -4.80 117.00 116.97 2pun n LEU 98 Ca 0.14 -1.86 -0.10 0.00 -0.03 0.00 0.00 56.01 54.17 2pun n LEU 98 Cb 0.31 -0.06 -0.10 0.00 -2.33 0.00 0.00 43.42 41.24 2pun n LEU 98 CO 0.24 0.53 -0.24 0.68 -1.33 0.00 0.00 177.39 177.26 2pun s VAL 99 N -0.89 0.12 0.35 4.08 -7.23 -1.21 -0.19 120.40 115.42 2pun s VAL 99 Ca 0.06 -0.97 -0.28 0.00 -1.81 0.00 0.00 61.98 58.98 2pun s VAL 99 Cb 0.03 -0.63 -0.10 0.00 0.56 0.00 0.00 36.38 36.24 2pun s VAL 99 CO 0.05 -0.53 1.35 -2.16 -0.31 0.00 0.00 175.10 173.49 2pun s PRO 100 N -2.03 4.28 0.34 4.82 0.04 -1.26 -4.89 135.00 136.29 2pun s PRO 100 Ca -0.10 2.29 -0.29 0.00 0.04 0.00 0.00 61.00 62.94 2pun s PRO 100 Cb -0.05 -3.03 -0.11 0.00 0.04 0.00 0.00 34.50 31.36 2pun s PRO 100 CO -0.02 -0.28 1.40 -0.98 0.04 0.00 0.00 177.00 177.16 2pun s ARG 101 N -1.88 4.24 -0.20 4.56 3.03 -1.26 -4.81 118.95 122.62 2pun s ARG 101 Ca 0.50 2.38 -0.06 0.00 2.03 0.00 0.00 55.73 60.58 2pun s ARG 101 Cb -0.41 -3.04 -0.03 0.00 -1.03 0.00 0.00 34.95 30.45 2pun s ARG 101 CO 0.55 -0.37 0.02 0.08 -1.13 0.00 0.00 175.30 174.45 2pun s VAL 102 N -0.93 4.14 -0.13 4.99 1.01 -1.26 0.08 120.40 128.29 2pun s VAL 102 Ca 0.52 -0.25 0.19 0.00 0.00 0.00 0.00 61.98 62.44 2pun s VAL 102 Cb -0.43 -2.87 -0.27 0.00 0.00 0.00 0.00 36.38 32.81 2pun s VAL 102 CO 0.55 0.43 0.28 0.49 0.00 0.00 0.00 175.10 176.85 2pun n PHE 103 N 4.15 0.10 -3.60 5.22 3.01 0.78 -4.98 117.46 122.14 2pun n PHE 103 Ca -0.17 0.03 -0.13 0.00 1.01 0.00 0.00 57.45 58.20 2pun n PHE 103 Cb 0.52 -0.84 -0.07 0.00 -0.01 0.00 0.00 39.48 39.08 2pun n PHE 103 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 2pun s TYR 104 N -2.88 -0.61 0.07 1.38 6.14 -1.17 -5.02 117.35 115.26 2pun s TYR 104 Ca -0.09 1.35 -0.06 0.00 0.64 0.00 0.00 57.07 58.91 2pun s TYR 104 Cb 0.09 0.35 -0.01 0.00 0.42 0.00 0.00 41.96 42.81 2pun s TYR 104 CO 0.86 -0.38 0.13 -1.54 0.64 0.00 0.00 175.55 175.25 2pun s SER 105 N -0.22 0.21 -0.24 4.32 1.04 -1.26 0.10 113.70 117.64 2pun s SER 105 Ca -0.02 -0.70 -0.08 0.00 0.48 0.00 0.00 55.95 55.63 2pun s SER 105 Cb -0.03 0.29 0.11 0.00 0.10 0.00 0.00 66.02 66.48 2pun s SER 105 CO 0.01 -0.66 0.52 -0.62 0.98 0.00 0.00 173.24 173.47 2pun s ASP 106 N -2.73 -0.65 0.09 7.02 3.68 -0.62 -5.00 116.67 118.45 2pun s ASP 106 Ca 0.04 1.25 -0.08 0.00 2.13 0.00 0.00 52.55 55.88 2pun s ASP 106 Cb 0.04 1.75 -0.23 0.00 -1.45 0.00 0.00 42.92 43.04 2pun s ASP 106 CO -0.09 -0.23 1.18 0.71 0.13 0.00 0.00 175.17 176.87 2pun h THR 107 N 6.07 1.39 -0.33 1.71 1.35 -1.95 -0.23 112.91 120.93 2pun h THR 107 Ca -0.17 -2.67 -0.04 0.00 -0.55 0.00 0.00 66.41 62.97 2pun h THR 107 Cb 1.11 2.71 -0.01 0.00 -1.73 0.00 0.00 68.15 70.23 2pun h THR 107 CO 0.11 0.80 0.05 -0.33 -0.25 0.00 0.00 175.52 175.90 2pun h GLU 108 N 0.18 0.54 0.00 4.72 3.07 -1.97 -2.16 114.58 118.96 2pun h GLU 108 Ca -0.14 -0.15 0.00 0.00 -0.50 0.00 0.00 59.36 58.57 2pun h GLU 108 Cb 1.84 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 29.69 2pun h GLU 108 CO 0.21 0.63 0.00 0.52 -1.40 0.00 0.00 179.01 178.97 2pun h MET 109 N 0.37 0.00 -5.59 2.33 2.86 -1.88 -3.37 114.93 109.66 2pun h MET 109 Ca 0.10 0.00 -0.32 0.00 -2.06 0.00 0.00 59.70 57.41 2pun h MET 109 Cb 0.36 0.00 0.17 0.00 0.06 0.00 0.00 31.60 32.18 2pun h MET 109 CO 0.01 0.00 -0.76 0.00 1.06 0.00 0.00 176.91 177.22 2pun n ALA 110 N -1.83 -1.98 -3.19 6.32 0.00 -0.39 -4.66 120.51 114.78 2pun n ALA 110 Ca 0.04 -0.06 -0.31 0.00 0.00 0.00 0.00 53.44 53.11 2pun n ALA 110 Cb 0.36 -2.41 -0.17 0.00 0.00 0.00 0.00 19.45 17.23 2pun n ALA 110 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2pun s VAL 111 N -3.35 1.95 -0.19 0.00 1.01 -0.24 -1.91 120.40 117.67 2pun s VAL 111 Ca 0.00 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.03 2pun s VAL 111 Cb -0.00 -1.69 0.03 0.00 0.00 0.00 0.00 36.38 34.72 2pun s VAL 111 CO 0.72 0.54 -0.18 -0.89 0.00 0.00 0.00 175.10 175.29 2pun s THR 112 N 0.32 1.98 -0.26 3.92 2.01 -0.15 -1.60 115.64 121.86 2pun s THR 112 Ca -0.17 -0.98 -0.12 0.00 0.31 0.00 0.00 61.69 60.73 2pun s THR 112 Cb -0.17 -1.85 -0.05 0.00 0.01 0.00 0.00 72.50 70.44 2pun s THR 112 CO 0.08 0.44 0.25 -0.69 -0.69 0.00 0.00 174.62 174.00 2pun s VAL 113 N 1.30 5.28 0.22 3.82 1.01 0.11 -1.21 120.40 130.93 2pun s VAL 113 Ca 0.03 0.32 -0.00 0.00 0.00 0.00 0.00 61.98 62.33 2pun s VAL 113 Cb -0.14 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 2pun s VAL 113 CO -0.11 0.25 0.13 0.00 0.00 0.00 0.00 175.10 175.36 2pun s MET 114 N 1.64 1.26 0.32 2.72 0.23 0.41 -0.16 119.30 125.72 2pun s MET 114 Ca 0.10 -1.67 -0.29 0.00 -1.03 0.00 0.00 55.69 52.80 2pun s MET 114 Cb -0.15 0.16 -0.12 0.00 -1.53 0.00 0.00 34.83 33.19 2pun s MET 114 CO 0.09 -0.38 1.53 -1.91 -2.03 0.00 0.00 175.02 172.32 2pun n GLU 115 N -0.32 2.61 -2.46 3.16 2.13 0.11 -1.47 120.64 124.40 2pun n GLU 115 Ca 0.02 0.92 -0.42 0.00 0.66 0.00 0.00 57.16 58.34 2pun n GLU 115 Cb 0.66 -2.67 -0.03 0.00 0.27 0.00 0.00 31.44 29.68 2pun n GLU 115 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2pun s ASP 116 N 0.24 7.05 -0.19 4.31 3.68 -1.26 -4.61 116.67 125.89 2pun s ASP 116 Ca 0.60 1.82 0.12 0.00 2.13 0.00 0.00 52.55 57.23 2pun s ASP 116 Cb -0.51 -2.56 0.42 0.00 -1.45 0.00 0.00 42.92 38.82 2pun s ASP 116 CO 0.54 -0.58 1.21 0.18 0.13 0.00 0.00 175.17 176.66 2pun n LEU 117 N 5.14 2.57 0.00 -1.34 4.77 -1.26 -4.82 117.00 122.05 2pun n LEU 117 Ca 0.11 -3.75 0.13 0.00 -0.03 0.00 0.00 56.01 52.47 2pun n LEU 117 Cb 0.46 -0.49 0.74 0.00 -2.33 0.00 0.00 43.42 41.81 2pun n LEU 117 CO 0.55 1.33 0.95 -1.54 -1.33 0.00 0.00 177.39 177.35 2pun n SER 118 N -1.00 0.00 -0.03 -1.43 3.41 -1.26 -1.53 113.62 111.78 2pun n SER 118 Ca 0.18 -0.62 0.14 0.00 -0.26 0.00 0.00 58.87 58.31 2pun n SER 118 Cb 0.72 -0.08 0.60 0.00 -0.26 0.00 0.00 64.21 65.20 2pun n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2pun n HIS 119 N -1.08 0.00 -3.23 7.33 1.44 -1.26 -4.86 115.22 113.56 2pun n HIS 119 Ca 0.18 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.70 2pun n HIS 119 Cb 0.12 -0.33 -0.00 0.00 0.12 0.00 0.00 29.99 29.90 2pun n HIS 119 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2pun s LEU 120 N -2.75 3.50 0.07 2.39 1.43 -0.58 -4.99 118.68 117.75 2pun s LEU 120 Ca 0.21 -0.59 0.08 0.00 -1.03 0.00 0.00 54.13 52.81 2pun s LEU 120 Cb 0.19 -2.33 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 2pun s LEU 120 CO 0.52 -0.78 -0.23 -0.75 0.23 0.00 0.00 176.35 175.35 2pun s LYS 121 N -4.29 1.38 0.19 1.70 2.20 -0.20 -4.87 119.74 115.84 2pun s LYS 121 Ca 0.53 -1.09 -0.32 0.00 -0.36 0.00 0.00 55.97 54.73 2pun s LYS 121 Cb -0.07 -1.60 -0.12 0.00 -1.51 0.00 0.00 37.83 34.53 2pun s LYS 121 CO 0.31 0.40 1.74 0.42 -0.36 0.00 0.00 175.35 177.86 2pun s ILE 122 N -0.94 2.13 0.22 5.43 -1.09 -1.26 0.16 121.20 125.85 2pun s ILE 122 Ca 0.09 0.03 -0.08 0.00 -2.23 0.00 0.00 60.65 58.46 2pun s ILE 122 Cb -0.09 -3.02 0.17 0.00 -1.58 0.00 0.00 42.46 37.94 2pun s ILE 122 CO 0.03 0.00 1.84 0.00 -1.23 0.00 0.00 174.94 175.58 2pun h ALA 123 N 7.14 1.03 -0.48 9.38 0.00 -0.51 -2.07 119.26 133.74 2pun h ALA 123 Ca -0.44 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.51 2pun h ALA 123 Cb 1.20 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 2pun h ALA 123 CO 0.96 0.21 0.22 -0.09 0.00 0.00 0.00 179.25 180.54 2pun h ARG 124 N 0.87 0.42 0.03 0.00 2.43 -1.26 0.30 114.38 117.18 2pun h ARG 124 Ca 0.33 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.47 2pun h ARG 124 Cb 0.12 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2pun h ARG 124 CO -0.15 0.28 -0.01 -0.22 -1.51 0.00 0.00 179.97 178.35 2pun h LYS 125 N 0.44 -0.04 -0.73 0.20 3.64 -1.69 -1.27 116.57 117.13 2pun h LYS 125 Ca 0.21 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.66 2pun h LYS 125 Cb 0.15 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.92 2pun h LYS 125 CO -0.17 0.12 0.42 0.78 -2.27 0.00 0.00 179.45 178.33 2pun h GLY 126 N -0.19 1.08 1.00 5.01 0.00 -1.18 -0.98 103.07 107.82 2pun h GLY 126 Ca -0.00 -0.29 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 2pun h GLY 126 CO 0.01 0.17 0.15 1.41 0.00 0.00 0.00 176.54 178.28 2pun h LEU 127 N 0.75 0.85 -1.10 3.11 3.38 -0.64 0.16 115.31 121.83 2pun h LEU 127 Ca 0.33 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2pun h LEU 127 Cb 0.21 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2pun h LEU 127 CO -0.19 0.86 0.32 0.40 0.09 0.00 0.00 178.44 179.91 2pun h ILE 128 N 0.81 1.22 0.00 1.22 2.04 -1.09 -1.99 117.51 119.71 2pun h ILE 128 Ca 0.18 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.43 2pun h ILE 128 Cb 0.33 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 2pun h ILE 128 CO -0.00 0.26 0.00 -0.62 0.00 0.00 0.00 178.15 177.79 2pun n GLU 129 N -4.34 0.05 -0.11 2.37 1.02 -0.39 -4.88 120.64 114.37 2pun n GLU 129 Ca 0.06 0.30 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 2pun n GLU 129 Cb 0.14 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 29.95 2pun n GLU 129 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pun n GLY 130 N -0.04 0.94 3.77 0.62 0.00 -0.59 -5.07 105.19 104.82 2pun n GLY 130 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 2pun n GLY 130 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2pun s GLU 131 N -0.89 3.95 -0.02 1.61 0.41 0.47 -4.98 118.70 119.26 2pun s GLU 131 Ca 0.00 1.98 0.14 0.00 -0.41 0.00 0.00 54.97 56.68 2pun s GLU 131 Cb 0.00 -2.67 -0.20 0.00 -1.78 0.00 0.00 34.13 29.47 2pun s GLU 131 CO 0.00 -0.45 0.37 0.09 -0.49 0.00 0.00 175.26 174.78 2pun n ASN 132 N 0.01 1.51 -3.53 -0.19 3.02 -1.26 -4.24 115.26 110.57 2pun n ASN 132 Ca 0.05 -0.19 -0.21 0.00 -0.03 0.00 0.00 54.58 54.20 2pun n ASN 132 Cb 0.45 1.50 0.01 0.00 -0.61 0.00 0.00 39.78 41.13 2pun n ASN 132 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2pun n TYR 133 N -1.84 -2.44 0.28 3.10 4.01 -1.26 -4.81 117.16 114.19 2pun n TYR 133 Ca -0.01 0.99 0.18 0.00 -0.16 0.00 0.00 57.90 58.90 2pun n TYR 133 Cb 0.33 -2.98 0.94 0.00 -0.31 0.00 0.00 39.34 37.32 2pun n TYR 133 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2pun h PRO 134 N 0.41 0.00 -0.16 -0.72 0.13 -1.89 -1.26 132.00 128.51 2pun h PRO 134 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2pun h PRO 134 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2pun h PRO 134 CO 0.32 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.81 2pun n HIS 135 N -3.35 0.19 -0.11 1.56 8.25 -1.26 -4.68 115.22 115.82 2pun n HIS 135 Ca -0.01 -0.15 -0.05 0.00 -0.26 0.00 0.00 57.72 57.25 2pun n HIS 135 Cb 0.27 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 31.39 2pun n HIS 135 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2pun h LEU 136 N 3.00 -0.04 -0.49 2.41 5.85 -1.56 -0.53 115.31 123.94 2pun h LEU 136 Ca 0.00 0.07 -0.17 0.00 0.84 0.00 0.00 57.88 58.62 2pun h LEU 136 Cb 0.70 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 2pun h LEU 136 CO 0.00 0.01 -0.62 0.77 -0.34 0.00 0.00 178.44 178.27 2pun h SER 137 N 0.16 0.54 -0.06 1.25 4.64 -1.83 -0.08 113.55 118.16 2pun h SER 137 Ca 0.18 -0.31 0.03 0.00 -0.47 0.00 0.00 61.79 61.21 2pun h SER 137 Cb 0.22 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 62.13 2pun h SER 137 CO -0.25 1.02 -0.10 1.56 -0.87 0.00 0.00 176.83 178.19 2pun h GLN 138 N 0.35 -0.14 -0.18 4.77 4.20 -1.71 -0.56 115.11 121.84 2pun h GLN 138 Ca -0.01 0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2pun h GLN 138 Cb 1.17 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.97 2pun h GLN 138 CO 0.11 -0.09 -0.00 0.45 -0.67 0.00 0.00 178.83 178.62 2pun h HIS 139 N -0.14 0.35 -0.39 2.96 3.86 -0.96 -2.19 115.15 118.64 2pun h HIS 139 Ca 0.06 -0.06 -0.05 0.00 -1.16 0.00 0.00 60.37 59.15 2pun h HIS 139 Cb 0.23 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 28.59 2pun h HIS 139 CO -0.19 0.53 0.02 0.82 0.86 0.00 0.00 177.93 179.97 2pun h ILE 140 N 0.07 1.21 -0.62 2.45 1.08 -1.01 -0.29 117.51 120.40 2pun h ILE 140 Ca 0.05 -0.81 -0.05 0.00 -0.39 0.00 0.00 64.86 63.66 2pun h ILE 140 Cb 0.40 0.89 -0.03 0.00 -3.07 0.00 0.00 36.82 35.01 2pun h ILE 140 CO 0.01 0.28 0.19 1.23 -0.69 0.00 0.00 178.15 179.18 2pun h GLY 141 N 0.87 1.03 0.77 5.37 0.00 -0.96 0.18 103.07 110.34 2pun h GLY 141 Ca 0.12 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 2pun h GLY 141 CO 0.01 0.57 -0.08 -2.09 0.00 0.00 0.00 176.54 174.95 2pun h GLU 142 N 0.88 -0.21 -0.64 4.80 4.81 -1.07 -0.70 114.58 122.45 2pun h GLU 142 Ca 0.20 0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.55 2pun h GLU 142 Cb 0.29 0.05 -0.12 0.00 0.63 0.00 0.00 28.75 29.60 2pun h GLU 142 CO -0.01 0.04 -0.33 0.35 -0.73 0.00 0.00 179.01 178.33 2pun h PHE 143 N -0.45 -0.92 -0.40 0.92 3.04 -0.92 -1.62 116.94 116.59 2pun h PHE 143 Ca -0.02 0.08 -0.04 0.00 3.98 0.00 0.00 57.97 61.96 2pun h PHE 143 Cb 0.35 0.50 -0.02 0.00 2.56 0.00 0.00 35.95 39.34 2pun h PHE 143 CO 0.00 -0.38 0.08 -0.07 -2.02 0.00 0.00 178.31 175.92 2pun h LEU 144 N -0.14 0.62 -0.58 0.59 3.38 -0.50 -1.31 115.31 117.38 2pun h LEU 144 Ca 0.25 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2pun h LEU 144 Cb 0.56 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 2pun h LEU 144 CO -0.72 0.71 0.12 1.23 0.09 0.00 0.00 178.44 179.87 2pun h GLY 145 N 0.50 1.01 0.18 0.83 0.00 -0.79 -1.72 103.07 103.07 2pun h GLY 145 Ca 0.12 -0.65 -0.05 0.00 0.00 0.00 0.00 47.33 46.76 2pun h GLY 145 CO 0.00 0.60 -0.20 0.50 0.00 0.00 0.00 176.54 177.45 2pun h LYS 146 N 0.84 0.08 -0.46 4.80 1.57 -1.29 -2.25 116.57 119.85 2pun h LYS 146 Ca 0.18 -0.13 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 2pun h LYS 146 Cb 0.38 0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.70 2pun h LYS 146 CO 0.01 1.05 0.25 1.79 -0.57 0.00 0.00 179.45 181.98 2pun h THR 147 N -0.83 1.00 -0.07 -0.16 1.35 -1.32 -1.25 112.91 111.62 2pun h THR 147 Ca -0.03 -0.17 -0.19 0.00 -0.55 0.00 0.00 66.41 65.47 2pun h THR 147 Cb 1.15 0.46 -0.00 0.00 -1.73 0.00 0.00 68.15 68.02 2pun h THR 147 CO 0.04 0.09 -0.76 -0.07 -0.25 0.00 0.00 175.52 174.57 2pun h LEU 148 N 0.50 0.50 0.19 3.87 3.38 -1.41 -3.23 115.31 119.10 2pun h LEU 148 Ca 0.20 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2pun h LEU 148 Cb 0.07 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2pun h LEU 148 CO -0.12 1.08 -0.09 0.15 0.09 0.00 0.00 178.44 179.55 2pun h PHE 149 N 0.27 -0.24 0.00 1.13 3.57 -1.33 -3.36 116.94 116.99 2pun h PHE 149 Ca -0.04 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.46 2pun h PHE 149 Cb 1.34 0.08 0.00 0.00 2.79 0.00 0.00 35.95 40.16 2pun h PHE 149 CO 0.05 0.10 0.00 0.66 -2.23 0.00 0.00 178.31 176.89 2pun n TYR 150 N -5.05 0.00 -0.44 0.41 4.01 -0.48 -1.71 117.16 113.89 2pun n TYR 150 Ca -0.09 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.71 2pun n TYR 150 Cb 0.23 -0.25 0.17 0.00 -0.31 0.00 0.00 39.34 39.19 2pun n TYR 150 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2pun n SER 151 N -1.25 3.12 -5.01 7.72 7.64 -1.22 -4.68 113.62 119.94 2pun n SER 151 Ca 0.11 -2.35 -0.19 0.00 1.01 0.00 0.00 58.87 57.45 2pun n SER 151 Cb 0.16 -0.32 0.03 0.00 -1.01 0.00 0.00 64.21 63.08 2pun n SER 151 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2pun s SER 152 N -1.35 5.28 0.62 6.43 1.04 -0.69 -4.00 113.70 121.01 2pun s SER 152 Ca 0.27 -0.71 0.38 0.00 0.48 0.00 0.00 55.95 56.37 2pun s SER 152 Cb 0.18 -0.09 2.03 0.00 0.10 0.00 0.00 66.02 68.24 2pun s SER 152 CO 0.12 -1.08 2.26 0.44 0.98 0.00 0.00 173.24 175.96 2pun h ASP 153 N 0.43 0.00 0.02 7.02 3.32 -1.79 -0.50 116.42 124.92 2pun h ASP 153 Ca -0.35 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.59 2pun h ASP 153 Cb 1.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.82 2pun h ASP 153 CO 0.44 0.02 -0.36 1.88 -1.72 0.00 0.00 179.24 179.50 2pun h TYR 154 N 0.00 0.53 0.00 4.55 0.05 -1.92 -3.32 116.97 116.86 2pun h TYR 154 Ca -0.00 -0.14 -0.31 0.00 0.05 0.00 0.00 58.73 58.33 2pun h TYR 154 Cb 0.11 -0.12 -0.06 0.00 1.01 0.00 0.00 36.73 37.67 2pun h TYR 154 CO 0.00 0.76 -2.24 0.00 -1.05 0.00 0.00 178.16 175.63 2pun n ALA 155 N -2.49 1.66 -2.56 3.88 0.00 -1.02 -0.25 120.51 119.73 2pun n ALA 155 Ca -0.01 -1.16 -0.32 0.00 0.00 0.00 0.00 53.44 51.95 2pun n ALA 155 Cb 0.48 -0.20 -0.11 0.00 0.00 0.00 0.00 19.45 19.62 2pun n ALA 155 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2pun s LEU 156 N -5.28 3.04 0.28 0.00 1.43 -0.23 -4.72 118.68 113.20 2pun s LEU 156 Ca -0.09 -0.16 -0.30 0.00 -1.03 0.00 0.00 54.13 52.55 2pun s LEU 156 Cb 0.06 -1.72 -0.12 0.00 0.03 0.00 0.00 46.19 44.44 2pun s LEU 156 CO 0.77 0.31 1.51 -0.62 0.23 0.00 0.00 176.35 178.55 2pun n GLU 157 N 1.81 2.43 0.25 1.70 1.02 -1.26 -4.50 120.64 122.08 2pun n GLU 157 Ca -0.16 0.86 0.08 0.00 -0.02 0.00 0.00 57.16 57.92 2pun n GLU 157 Cb 0.52 -2.59 0.61 0.00 -0.02 0.00 0.00 31.44 29.97 2pun n GLU 157 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2pun h PRO 158 N 4.47 0.00 -0.62 3.49 0.11 -1.95 -1.34 132.00 136.15 2pun h PRO 158 Ca -0.46 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.56 2pun h PRO 158 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 2pun h PRO 158 CO 0.77 0.07 0.04 0.87 -0.21 0.00 0.00 178.00 179.54 2pun h LYS 159 N 0.00 1.07 -0.35 1.05 1.57 -1.99 -0.63 116.57 117.29 2pun h LYS 159 Ca -0.00 -0.32 -0.06 0.00 -1.87 0.00 0.00 60.65 58.40 2pun h LYS 159 Cb 0.13 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 2pun h LYS 159 CO 0.01 1.02 -0.01 0.28 -0.57 0.00 0.00 179.45 180.18 2pun h VAL 160 N 0.99 1.26 -0.68 0.50 2.07 -1.65 -3.08 116.25 115.66 2pun h VAL 160 Ca 0.18 -0.99 -0.06 0.00 0.82 0.00 0.00 66.70 66.65 2pun h VAL 160 Cb 0.51 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 2pun h VAL 160 CO 0.02 0.33 0.18 0.50 0.02 0.00 0.00 177.57 178.63 2pun h LYS 161 N 0.43 1.08 -0.61 1.57 3.11 -1.15 -2.45 116.57 118.56 2pun h LYS 161 Ca 0.10 -0.25 0.03 0.00 -2.81 0.00 0.00 60.65 57.72 2pun h LYS 161 Cb 0.47 -0.15 -0.03 0.00 -1.00 0.00 0.00 32.23 31.52 2pun h LYS 161 CO 0.02 0.95 0.40 0.87 -2.81 0.00 0.00 179.45 178.88 2pun h LYS 162 N 1.02 0.70 -0.27 1.90 1.57 -1.13 -0.76 116.57 119.59 2pun h LYS 162 Ca 0.22 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.86 2pun h LYS 162 Cb 0.34 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2pun h LYS 162 CO -0.00 0.46 -0.21 1.96 -0.57 0.00 0.00 179.45 181.10 2pun h GLN 163 N 0.72 0.62 -0.23 3.15 1.08 -1.41 -3.13 115.11 115.91 2pun h GLN 163 Ca 0.24 -0.30 0.01 0.00 -1.45 0.00 0.00 58.65 57.15 2pun h GLN 163 Cb 0.07 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 2pun h GLN 163 CO -0.06 0.90 0.16 -0.07 -0.95 0.00 0.00 178.83 178.80 2pun h LEU 164 N 0.35 0.22 -0.60 1.46 3.38 -0.98 -1.61 115.31 117.53 2pun h LEU 164 Ca 0.05 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2pun h LEU 164 Cb 0.75 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.42 2pun h LEU 164 CO 0.05 0.16 0.35 0.58 0.09 0.00 0.00 178.44 179.67 2pun h VAL 165 N 0.26 1.18 0.08 1.22 2.07 -1.14 -1.67 116.25 118.25 2pun h VAL 165 Ca 0.09 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 2pun h VAL 165 Cb 0.05 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2pun h VAL 165 CO -0.02 0.19 -0.04 0.11 0.02 0.00 0.00 177.57 177.83 2pun h LYS 166 N 0.81 -0.10 -0.49 1.57 1.57 -1.36 -2.11 116.57 116.46 2pun h LYS 166 Ca 0.21 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2pun h LYS 166 Cb -0.00 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 2pun h LYS 166 CO -0.04 0.06 0.29 0.37 -0.57 0.00 0.00 179.45 179.56 2pun h GLN 167 N -0.25 0.65 -0.53 3.15 4.15 -1.26 -2.61 115.11 118.41 2pun h GLN 167 Ca -0.01 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.36 2pun h GLN 167 Cb 0.21 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.76 2pun h GLN 167 CO 0.02 0.46 0.00 1.19 -1.93 0.00 0.00 178.83 178.57 2pun n PHE 168 N -4.44 1.12 -1.69 3.99 3.72 -0.64 -4.96 117.46 114.57 2pun n PHE 168 Ca 0.04 -0.62 -0.45 0.00 -0.05 0.00 0.00 57.45 56.38 2pun n PHE 168 Cb 0.08 -0.18 -0.04 0.00 -0.94 0.00 0.00 39.48 38.40 2pun n PHE 168 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2pun n THR 169 N 0.78 0.02 -3.20 4.37 -1.04 -0.80 -4.20 114.28 110.21 2pun n THR 169 Ca 0.22 -0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.99 2pun n THR 169 Cb 0.76 -1.72 -0.06 0.00 -1.82 0.00 0.00 70.33 67.50 2pun n THR 169 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2pun n ASN 170 N 3.73 1.43 -0.02 8.00 2.85 -1.26 -5.02 115.26 124.96 2pun n ASN 170 Ca 0.17 -3.02 -0.10 0.00 -0.11 0.00 0.00 54.58 51.52 2pun n ASN 170 Cb 0.31 -0.63 -0.04 0.00 1.24 0.00 0.00 39.78 40.66 2pun n ASN 170 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2pun h PRO 171 N 3.60 0.13 -0.39 1.20 0.11 -1.97 -1.10 132.00 133.58 2pun h PRO 171 Ca 0.11 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.16 2pun h PRO 171 Cb 0.83 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.90 2pun h PRO 171 CO 0.57 0.09 0.07 0.93 -0.21 0.00 0.00 178.00 179.45 2pun h GLU 172 N 0.14 0.65 -0.02 1.05 5.08 -1.99 -0.17 114.58 119.32 2pun h GLU 172 Ca 0.06 -0.17 -0.23 0.00 -1.00 0.00 0.00 59.36 58.02 2pun h GLU 172 Cb 0.03 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.21 2pun h GLU 172 CO -0.06 0.70 -0.93 -0.07 -1.00 0.00 0.00 179.01 177.65 2pun h LEU 173 N 0.49 0.66 -1.01 1.33 -0.00 -1.92 -2.78 115.31 112.09 2pun h LEU 173 Ca 0.12 -0.51 -0.04 0.00 -0.00 0.00 0.00 57.88 57.44 2pun h LEU 173 Cb 0.36 -0.20 -0.03 0.00 -0.00 0.00 0.00 40.66 40.79 2pun h LEU 173 CO 0.01 1.30 0.20 0.00 -0.00 0.00 0.00 178.44 179.95 2pun h ASP 175 N 0.89 1.08 0.12 0.00 -0.00 -0.86 0.24 116.42 117.88 2pun h ASP 175 Ca 0.20 -0.00 -0.00 0.00 -0.00 0.00 0.00 57.03 57.22 2pun h ASP 175 Cb 0.24 -0.24 -0.00 0.00 -0.00 0.00 0.00 39.33 39.33 2pun h ASP 175 CO -0.01 0.72 -0.07 0.40 -0.00 0.00 0.00 179.24 180.28 2pun h ILE 176 N 1.24 0.85 -0.60 2.25 2.04 -1.20 -2.11 117.51 119.98 2pun h ILE 176 Ca 0.41 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 66.18 2pun h ILE 176 Cb 0.06 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2pun h ILE 176 CO -0.14 0.00 0.03 0.74 0.00 0.00 0.00 178.15 178.78 2pun h THR 177 N -0.18 1.26 -0.92 -0.27 2.02 -1.09 -0.59 112.91 113.14 2pun h THR 177 Ca -0.01 -1.11 0.00 0.00 0.77 0.00 0.00 66.41 66.06 2pun h THR 177 Cb 0.15 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 67.30 2pun h THR 177 CO 0.02 0.40 0.59 -0.33 0.37 0.00 0.00 175.52 176.57 2pun h GLU 178 N 0.94 1.23 0.00 6.66 5.08 -0.49 -1.33 114.58 126.68 2pun h GLU 178 Ca 0.17 -0.09 -0.07 0.00 -1.00 0.00 0.00 59.36 58.37 2pun h GLU 178 Cb 0.52 -0.27 0.01 0.00 0.50 0.00 0.00 28.75 29.51 2pun h GLU 178 CO 0.03 0.84 -0.29 0.00 -1.00 0.00 0.00 179.01 178.58 2pun h ARG 179 N 1.26 0.19 0.15 2.33 3.08 -1.23 -3.19 114.38 116.97 2pun h ARG 179 Ca 0.34 -0.21 -0.31 0.00 0.07 0.00 0.00 59.98 59.86 2pun h ARG 179 Cb -0.10 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.01 2pun h ARG 179 CO -0.07 0.95 -1.59 -0.07 -1.07 0.00 0.00 179.97 178.11 2pun h LEU 180 N -0.47 0.48 0.16 3.04 3.38 -1.00 0.21 115.31 121.12 2pun h LEU 180 Ca -0.04 -0.90 -0.31 0.00 0.09 0.00 0.00 57.88 56.73 2pun h LEU 180 Cb 1.05 -0.16 0.03 0.00 0.09 0.00 0.00 40.66 41.67 2pun h LEU 180 CO 0.06 1.71 -1.33 0.58 0.09 0.00 0.00 178.44 179.54 2pun h VAL 181 N -0.11 1.29 0.00 1.22 2.07 -1.44 -3.40 116.25 115.88 2pun h VAL 181 Ca -0.33 -2.57 0.00 0.00 0.82 0.00 0.00 66.70 64.62 2pun h VAL 181 Cb 1.92 2.82 0.00 0.00 -1.52 0.00 0.00 31.29 34.51 2pun h VAL 181 CO 0.11 0.78 -0.92 0.49 0.02 0.00 0.00 177.57 178.05 2pun n PHE 182 N -3.75 0.00 0.09 1.57 3.72 -1.20 -4.74 117.46 113.15 2pun n PHE 182 Ca -0.15 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 2pun n PHE 182 Cb 1.03 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 39.48 2pun n PHE 182 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2pun n THR 183 N -1.51 0.50 -0.24 4.37 -1.04 -1.09 -4.73 114.28 110.55 2pun n THR 183 Ca 0.01 0.17 -0.07 0.00 -2.04 0.00 0.00 64.05 62.11 2pun n THR 183 Cb 0.25 -0.93 0.04 0.00 -1.82 0.00 0.00 70.33 67.86 2pun n THR 183 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2pun h ASP 184 N 0.00 0.94 0.18 8.00 3.32 -0.82 -1.74 116.42 126.30 2pun h ASP 184 Ca 0.00 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.85 2pun h ASP 184 Cb 0.00 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.30 2pun h ASP 184 CO 0.00 0.89 0.00 -2.65 -1.72 0.00 0.00 179.24 175.76 2pun n PRO 185 N -4.36 0.06 -0.06 3.56 -0.02 -1.26 -2.64 135.00 130.28 2pun n PRO 185 Ca 0.04 0.48 0.12 0.00 -2.02 0.00 0.00 63.50 62.13 2pun n PRO 185 Cb 0.20 -1.66 0.16 0.00 -0.02 0.00 0.00 33.50 32.18 2pun n PRO 185 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2pun n PHE 186 N -1.78 0.16 -4.19 6.00 3.72 -0.65 -4.86 117.46 115.85 2pun n PHE 186 Ca 0.01 -0.08 -0.13 0.00 -0.05 0.00 0.00 57.45 57.20 2pun n PHE 186 Cb 0.07 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.52 2pun n PHE 186 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2pun s PHE 187 N -1.84 1.16 -1.36 1.38 0.40 -1.08 -4.57 117.98 112.06 2pun s PHE 187 Ca 0.32 -1.35 -0.15 0.00 -0.60 0.00 0.00 56.93 55.14 2pun s PHE 187 Cb 0.21 -0.50 0.07 0.00 0.51 0.00 0.00 43.02 43.31 2pun s PHE 187 CO 0.31 -0.72 1.95 -3.47 0.70 0.00 0.00 175.22 173.99 2pun n ASP 188 N -0.48 4.50 -4.81 1.36 4.64 -1.26 -4.92 116.55 115.57 2pun n ASP 188 Ca 0.02 -2.91 -0.28 0.00 -1.38 0.00 0.00 54.79 50.25 2pun n ASP 188 Cb 0.65 -1.67 -0.05 0.00 -1.04 0.00 0.00 41.12 39.00 2pun n ASP 188 CO 0.00 0.00 0.00 -1.00 -0.82 0.00 0.00 177.20 175.38 2pun s HIS 189 N 3.23 3.22 0.32 -0.67 3.76 -1.26 -5.03 115.29 118.87 2pun s HIS 189 Ca 0.49 0.04 0.32 0.00 -0.15 0.00 0.00 55.06 55.76 2pun s HIS 189 Cb 0.08 -1.58 1.53 0.00 1.11 0.00 0.00 32.58 33.73 2pun s HIS 189 CO -0.01 0.52 2.07 0.38 -0.85 0.00 0.00 174.74 176.85 2pun h ASP 190 N 2.70 0.00 1.10 1.40 -0.00 -1.92 -2.69 116.42 117.00 2pun h ASP 190 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.56 2pun h ASP 190 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.52 2pun h ASP 190 CO 0.65 0.08 -0.05 0.35 -0.00 0.00 0.00 179.24 180.27 2pun n THR 191 N -3.33 0.18 -1.75 1.15 -2.24 -1.26 -4.88 114.28 102.15 2pun n THR 191 Ca -0.01 -0.09 -0.33 0.00 -2.27 0.00 0.00 64.05 61.35 2pun n THR 191 Cb 0.26 -0.46 0.05 0.00 -2.10 0.00 0.00 70.33 68.07 2pun n THR 191 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2pun s ASN 192 N -3.46 5.00 -0.28 3.42 0.01 -1.02 -2.13 114.94 116.47 2pun s ASN 192 Ca 0.13 2.09 0.02 0.00 -0.71 0.00 0.00 52.86 54.39 2pun s ASN 192 Cb 0.17 -2.56 0.17 0.00 0.41 0.00 0.00 41.25 39.44 2pun s ASN 192 CO 0.57 -1.71 0.50 -0.62 -1.51 0.00 0.00 177.10 174.32 2pun s ASP 193 N -2.39 -0.60 0.05 -1.22 3.68 0.75 -4.79 116.67 112.15 2pun s ASP 193 Ca 0.69 0.10 -0.10 0.00 2.13 0.00 0.00 52.55 55.37 2pun s ASP 193 Cb -0.23 1.60 0.01 0.00 -1.45 0.00 0.00 42.92 42.85 2pun s ASP 193 CO 0.41 -0.31 0.21 0.72 0.13 0.00 0.00 175.17 176.32 2pun s PHE 194 N 2.69 0.05 0.45 -5.34 -0.71 -1.26 -4.29 117.98 109.57 2pun s PHE 194 Ca 0.12 -0.29 -0.24 0.00 -1.04 0.00 0.00 56.93 55.48 2pun s PHE 194 Cb -0.12 -0.02 -0.07 0.00 -1.21 0.00 0.00 43.02 41.60 2pun s PHE 194 CO -0.25 -0.46 1.23 -1.21 -1.34 0.00 0.00 175.22 173.19 2pun s GLU 195 N -2.80 3.76 0.32 1.99 8.01 -1.26 -4.92 118.70 123.80 2pun s GLU 195 Ca -0.03 1.95 0.04 0.00 0.01 0.00 0.00 54.97 56.94 2pun s GLU 195 Cb 0.00 -2.51 0.66 0.00 -4.31 0.00 0.00 34.13 27.97 2pun s GLU 195 CO -0.05 -0.60 1.89 1.49 0.01 0.00 0.00 175.26 177.99 2pun h GLU 196 N 2.20 0.85 -0.59 1.61 4.57 -2.02 -1.74 114.58 119.46 2pun h GLU 196 Ca -0.50 -0.05 0.13 0.00 -1.18 0.00 0.00 59.36 57.76 2pun h GLU 196 Cb 1.25 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 29.62 2pun h GLU 196 CO 0.61 0.56 0.40 0.93 -1.18 0.00 0.00 179.01 180.33 2pun h GLU 197 N 0.88 0.22 0.00 1.92 3.07 -2.03 -1.21 114.58 117.43 2pun h GLU 197 Ca 0.43 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.27 2pun h GLU 197 Cb 0.45 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 2pun h GLU 197 CO -0.19 0.15 0.00 1.28 -1.40 0.00 0.00 179.01 178.85 2pun n LEU 198 N -4.44 0.76 -0.24 1.33 4.77 -0.66 -4.37 117.00 114.16 2pun n LEU 198 Ca 0.10 0.62 0.04 0.00 -0.03 0.00 0.00 56.01 56.74 2pun n LEU 198 Cb 0.49 -0.43 0.16 0.00 -2.33 0.00 0.00 43.42 41.31 2pun n LEU 198 CO 0.35 -0.35 0.94 -0.09 -1.33 0.00 0.00 177.39 176.90 2pun h ARG 199 N 0.00 0.28 -0.75 3.23 2.43 -1.28 -1.41 114.38 116.88 2pun h ARG 199 Ca 0.00 -0.02 0.09 0.00 -0.81 0.00 0.00 59.98 59.24 2pun h ARG 199 Cb 0.57 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 30.01 2pun h ARG 199 CO 0.00 0.19 0.49 -1.35 -1.51 0.00 0.00 179.97 177.79 2pun h PRO 200 N 0.29 0.66 0.05 0.20 0.11 -1.81 0.19 132.00 131.68 2pun h PRO 200 Ca 0.39 -0.04 -0.24 0.00 0.11 0.00 0.00 66.00 66.21 2pun h PRO 200 Cb 0.63 -0.15 0.01 0.00 0.11 0.00 0.00 31.00 31.60 2pun h PRO 200 CO -0.47 0.43 -1.05 0.74 -0.21 0.00 0.00 178.00 177.45 2pun h PHE 201 N 0.68 0.61 -0.53 0.65 -1.00 -1.61 -2.16 116.94 113.58 2pun h PHE 201 Ca 0.34 -0.37 -0.10 0.00 2.81 0.00 0.00 57.97 60.65 2pun h PHE 201 Cb 0.43 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 39.91 2pun h PHE 201 CO -0.00 1.21 -0.06 0.28 -1.61 0.00 0.00 178.31 178.14 2pun h VAL 202 N 0.19 1.27 -0.09 -0.55 2.07 -0.39 -2.66 116.25 116.09 2pun h VAL 202 Ca -0.10 -1.19 -0.11 0.00 0.82 0.00 0.00 66.70 66.12 2pun h VAL 202 Cb 1.71 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.44 2pun h VAL 202 CO 0.18 0.42 -0.45 -0.33 0.02 0.00 0.00 177.57 177.40 2pun h GLU 203 N 0.84 0.21 -0.61 1.57 5.08 -0.69 -1.84 114.58 119.14 2pun h GLU 203 Ca 0.14 -0.11 0.11 0.00 -1.00 0.00 0.00 59.36 58.50 2pun h GLU 203 Cb 0.61 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.78 2pun h GLU 203 CO 0.04 0.63 0.15 -0.22 -1.00 0.00 0.00 179.01 178.61 2pun h LYS 204 N 0.18 0.28 -0.13 2.33 3.64 -1.12 -1.39 116.57 120.36 2pun h LYS 204 Ca 0.01 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2pun h LYS 204 Cb 0.88 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 2pun h LYS 204 CO 0.07 0.19 0.06 1.25 -2.27 0.00 0.00 179.45 178.74 2pun h LEU 205 N 0.29 0.18 -1.71 5.20 5.85 -1.08 -2.64 115.31 121.39 2pun h LEU 205 Ca 0.32 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.89 2pun h LEU 205 Cb 0.46 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2pun h LEU 205 CO -0.39 0.28 0.17 -0.50 -0.34 0.00 0.00 178.44 177.66 2pun h TRP 206 N 0.06 0.34 -0.02 1.25 6.55 -1.08 -1.80 115.95 121.26 2pun h TRP 206 Ca 0.04 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.89 2pun h TRP 206 Cb 0.16 -0.11 0.00 0.00 -0.86 0.00 0.00 29.16 28.34 2pun h TRP 206 CO -0.02 0.23 0.00 0.09 -1.05 0.00 0.00 178.44 177.69 2pun n ASN 207 N -4.49 1.58 -4.46 -3.49 3.02 -0.55 -4.76 115.26 102.12 2pun n ASN 207 Ca 0.01 -1.53 -0.43 0.00 -0.03 0.00 0.00 54.58 52.60 2pun n ASN 207 Cb 0.08 -0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.20 2pun n ASN 207 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2pun s ASN 208 N -2.00 6.22 0.17 6.41 3.84 -0.68 -4.91 114.94 124.00 2pun s ASN 208 Ca 0.37 -0.90 0.08 0.00 0.21 0.00 0.00 52.86 52.63 2pun s ASN 208 Cb 0.21 -2.38 -0.03 0.00 -0.55 0.00 0.00 41.25 38.50 2pun s ASN 208 CO 0.33 -1.25 1.39 0.44 -2.79 0.00 0.00 177.10 175.22 2pun h ASP 209 N 9.35 0.00 0.66 -4.21 3.32 -1.85 -3.06 116.42 120.62 2pun h ASP 209 Ca -0.28 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.59 2pun h ASP 209 Cb 1.08 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 2pun h ASP 209 CO 1.11 0.87 -0.83 0.77 -1.72 0.00 0.00 179.24 179.43 2pun h SER 210 N 0.00 0.16 0.52 6.45 4.64 -1.97 -1.58 113.55 121.77 2pun h SER 210 Ca -0.01 -0.13 -0.17 0.00 -0.47 0.00 0.00 61.79 61.02 2pun h SER 210 Cb 1.55 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.58 2pun h SER 210 CO 0.11 0.92 -0.75 -0.37 -0.87 0.00 0.00 176.83 175.87 2pun h VAL 211 N 0.07 1.46 -0.13 0.95 -1.51 -1.96 -3.08 116.25 112.05 2pun h VAL 211 Ca -0.03 -2.35 -0.04 0.00 -1.23 0.00 0.00 66.70 63.06 2pun h VAL 211 Cb 1.45 2.27 -0.00 0.00 -2.13 0.00 0.00 31.29 32.87 2pun h VAL 211 CO 0.12 0.69 -0.06 0.11 -1.23 0.00 0.00 177.57 177.20 2pun h LYS 212 N 0.12 0.27 -0.98 5.19 1.57 -1.39 -0.69 116.57 120.65 2pun h LYS 212 Ca -0.02 -0.11 0.23 0.00 -1.87 0.00 0.00 60.65 58.88 2pun h LYS 212 Cb 1.32 -0.01 -0.12 0.00 0.08 0.00 0.00 32.23 33.50 2pun h LYS 212 CO 0.11 0.59 0.56 0.82 -0.57 0.00 0.00 179.45 180.96 2pun h ILE 213 N -0.07 0.55 -0.05 1.86 1.08 -1.42 0.92 117.51 120.39 2pun h ILE 213 Ca 0.03 -0.20 -0.19 0.00 -0.39 0.00 0.00 64.86 64.12 2pun h ILE 213 Cb 0.51 -0.07 -0.01 0.00 -3.07 0.00 0.00 36.82 34.18 2pun h ILE 213 CO 0.02 0.10 -0.77 -0.33 -0.69 0.00 0.00 178.15 176.48 2pun h GLU 214 N 0.57 0.34 -0.54 2.37 4.39 -1.38 -2.23 114.58 118.09 2pun h GLU 214 Ca 0.62 -0.30 -0.03 0.00 0.34 0.00 0.00 59.36 59.99 2pun h GLU 214 Cb 1.15 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 2pun h GLU 214 CO -0.47 0.96 0.20 0.00 -1.16 0.00 0.00 179.01 178.54 2pun h ALA 215 N 0.95 0.71 -0.61 3.43 0.00 -0.37 -1.79 119.26 121.58 2pun h ALA 215 Ca -0.04 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.79 2pun h ALA 215 Cb 1.36 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.87 2pun h ALA 215 CO 0.13 0.33 0.25 0.00 0.00 0.00 0.00 179.25 179.96 2pun h ALA 216 N 1.06 0.79 -0.55 0.00 0.00 -0.75 -1.01 119.26 118.79 2pun h ALA 216 Ca 0.18 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 2pun h ALA 216 Cb 0.22 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2pun h ALA 216 CO -0.01 -0.15 0.20 0.87 0.00 0.00 0.00 179.25 180.16 2pun h LYS 217 N 0.46 0.84 -0.23 0.00 1.57 -1.21 -0.54 116.57 117.47 2pun h LYS 217 Ca 0.30 -0.16 -0.09 0.00 -1.87 0.00 0.00 60.65 58.82 2pun h LYS 217 Cb 0.33 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2pun h LYS 217 CO -0.27 0.75 -0.26 -0.07 -0.57 0.00 0.00 179.45 179.02 2pun h LEU 218 N 0.76 0.43 -0.22 2.94 3.38 -1.09 -1.86 115.31 119.66 2pun h LEU 218 Ca 0.18 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2pun h LEU 218 Cb 0.23 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2pun h LEU 218 CO -0.01 0.69 0.02 0.50 0.09 0.00 0.00 178.44 179.74 2pun h LYS 219 N 0.38 0.37 -0.91 1.13 3.64 -0.94 -1.49 116.57 118.74 2pun h LYS 219 Ca 0.06 -0.11 0.03 0.00 -1.27 0.00 0.00 60.65 59.36 2pun h LYS 219 Cb 0.66 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.39 2pun h LYS 219 CO 0.05 0.53 0.59 -0.22 -2.27 0.00 0.00 179.45 178.13 2pun h LYS 220 N 0.16 1.14 -0.39 1.90 3.64 -0.93 0.19 116.57 122.28 2pun h LYS 220 Ca 0.06 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2pun h LYS 220 Cb 0.35 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 2pun h LYS 220 CO 0.01 0.75 0.25 1.03 -2.27 0.00 0.00 179.45 179.22 2pun h SER 221 N 1.18 0.45 -0.83 4.20 0.87 -1.21 -1.32 113.55 116.89 2pun h SER 221 Ca 0.35 -0.03 0.05 0.00 -1.23 0.00 0.00 61.79 60.93 2pun h SER 221 Cb -0.05 -0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 61.75 2pun h SER 221 CO -0.10 0.35 0.54 0.15 -0.53 0.00 0.00 176.83 177.24 2pun h PHE 222 N 0.52 0.96 0.00 2.24 3.57 -0.04 0.25 116.94 124.43 2pun h PHE 222 Ca 0.14 0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.50 2pun h PHE 222 Cb -0.03 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.37 2pun h PHE 222 CO -0.04 0.52 -0.79 -0.07 -2.23 0.00 0.00 178.31 175.70 2pun h LEU 223 N 0.96 0.00 0.00 0.59 3.38 -0.32 -3.40 115.31 116.52 2pun h LEU 223 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2pun h LEU 223 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2pun h LEU 223 CO -0.12 0.79 -0.76 0.35 0.09 0.00 0.00 178.44 178.79 2pun n THR 224 N -3.45 0.00 -2.79 0.22 -2.24 -0.53 -4.94 114.28 100.55 2pun n THR 224 Ca 0.00 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 2pun n THR 224 Cb 0.80 0.16 -0.01 0.00 -2.10 0.00 0.00 70.33 69.18 2pun n THR 224 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2pun s SER 225 N -1.72 6.86 -1.35 3.42 0.01 0.87 -4.88 113.70 116.91 2pun s SER 225 Ca 0.00 -2.48 -0.14 0.00 1.31 0.00 0.00 55.95 54.64 2pun s SER 225 Cb 0.00 -2.47 -0.02 0.00 0.21 0.00 0.00 66.02 63.73 2pun s SER 225 CO 0.00 -1.02 2.31 0.00 0.41 0.00 0.00 173.24 174.95 2pun n ALA 226 N 6.99 5.52 0.09 1.44 0.00 -1.26 -2.08 120.51 131.20 2pun n ALA 226 Ca 0.38 -3.61 -0.23 0.00 0.00 0.00 0.00 53.44 49.97 2pun n ALA 226 Cb 0.46 -3.49 -0.15 0.00 0.00 0.00 0.00 19.45 16.26 2pun n ALA 226 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2pun h GLU 227 N 6.14 0.41 -3.40 0.00 5.08 -1.64 -3.44 114.58 117.73 2pun h GLU 227 Ca 0.60 -0.71 -0.03 0.00 -1.00 0.00 0.00 59.36 58.22 2pun h GLU 227 Cb 0.55 0.26 -0.07 0.00 0.50 0.00 0.00 28.75 30.00 2pun h GLU 227 CO 1.86 1.34 0.04 -0.08 -1.00 0.00 0.00 179.01 181.16 2pun s THR 228 N -2.56 0.00 -0.45 1.13 -1.32 -0.83 -4.11 115.64 107.50 2pun s THR 228 Ca -0.14 -1.24 -0.27 0.00 -1.21 0.00 0.00 61.69 58.83 2pun s THR 228 Cb 0.04 -2.25 0.03 0.00 -1.51 0.00 0.00 72.50 68.81 2pun s THR 228 CO 0.87 0.00 1.00 -0.22 -2.21 0.00 0.00 174.62 174.06 2pun s LEU 229 N -3.01 3.88 0.39 9.08 2.96 -1.26 -0.98 118.68 129.74 2pun s LEU 229 Ca 0.18 0.31 0.04 0.00 -0.22 0.00 0.00 54.13 54.45 2pun s LEU 229 Cb -0.03 -3.33 -0.01 0.00 0.50 0.00 0.00 46.19 43.32 2pun s LEU 229 CO 0.10 -1.09 0.57 0.27 -1.32 0.00 0.00 176.35 174.87 2pun s ILE 230 N 3.96 4.01 0.01 6.68 -4.36 -0.26 -4.71 121.20 126.52 2pun s ILE 230 Ca 0.41 -0.77 -0.20 0.00 -0.26 0.00 0.00 60.65 59.83 2pun s ILE 230 Cb -0.09 -3.43 -0.21 0.00 1.25 0.00 0.00 42.46 39.97 2pun s ILE 230 CO 0.27 -0.23 1.15 -0.74 0.24 0.00 0.00 174.94 175.63 2pun h HIS 231 N 0.66 0.59 0.00 1.37 -0.00 -1.89 -3.20 115.15 112.68 2pun h HIS 231 Ca -0.46 -0.29 0.00 0.00 -0.00 0.00 0.00 60.37 59.62 2pun h HIS 231 Cb 1.26 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 2pun h HIS 231 CO 0.43 1.09 0.00 0.41 -0.00 0.00 0.00 177.93 179.86 2pun n GLY 232 N 0.90 1.51 2.69 5.26 0.00 -1.26 -1.79 105.19 112.50 2pun n GLY 232 Ca -0.09 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.88 2pun n GLY 232 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2pun n ASP 233 N 0.00 -1.44 -4.28 1.61 4.64 -1.26 -4.85 116.55 110.98 2pun n ASP 233 Ca 0.00 -2.36 -0.43 0.00 -1.38 0.00 0.00 54.79 50.63 2pun n ASP 233 Cb 0.00 0.75 0.00 0.00 -1.04 0.00 0.00 41.12 40.83 2pun n ASP 233 CO 0.00 0.00 0.00 -0.11 -0.82 0.00 0.00 177.20 176.27 2pun n LEU 234 N -0.97 5.64 -4.98 -2.67 7.94 -1.26 -4.75 117.00 115.95 2pun n LEU 234 Ca -0.08 -4.08 -0.21 0.00 -1.11 0.00 0.00 56.01 50.53 2pun n LEU 234 Cb 0.86 -1.70 0.03 0.00 0.53 0.00 0.00 43.42 43.14 2pun n LEU 234 CO -0.09 0.56 0.21 -1.38 -1.11 0.00 0.00 177.39 175.58 2pun s HIS 235 N 3.46 1.81 -0.57 1.96 -3.43 -1.26 -2.84 115.29 114.42 2pun s HIS 235 Ca 0.50 -0.68 0.24 0.00 -0.80 0.00 0.00 55.06 54.33 2pun s HIS 235 Cb 0.07 -2.16 0.93 0.00 -1.43 0.00 0.00 32.58 29.99 2pun s HIS 235 CO 0.02 -0.77 1.73 0.25 -2.00 0.00 0.00 174.74 173.97 2pun n THR 236 N -1.99 0.75 1.08 -5.38 -2.24 -1.26 -1.86 114.28 103.37 2pun n THR 236 Ca 0.09 0.07 0.13 0.00 -2.27 0.00 0.00 64.05 62.07 2pun n THR 236 Cb 0.62 -0.98 0.45 0.00 -2.10 0.00 0.00 70.33 68.32 2pun n THR 236 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2pun n GLY 237 N 0.42 -1.27 1.88 3.38 0.00 -1.26 -0.86 105.19 107.48 2pun n GLY 237 Ca 0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 46.02 45.76 2pun n GLY 237 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2pun n SER 238 N -1.38 4.66 -3.87 1.61 7.64 -0.78 -4.90 113.62 116.61 2pun n SER 238 Ca 0.08 -3.24 -0.15 0.00 1.01 0.00 0.00 58.87 56.56 2pun n SER 238 Cb 0.33 -0.73 -0.15 0.00 -1.01 0.00 0.00 64.21 62.65 2pun n SER 238 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2pun s ILE 239 N -3.00 0.18 -0.07 0.44 1.01 -1.24 -1.19 121.20 117.34 2pun s ILE 239 Ca 0.54 -0.02 -0.11 0.00 0.00 0.00 0.00 60.65 61.06 2pun s ILE 239 Cb 0.43 -0.21 -0.05 0.00 0.01 0.00 0.00 42.46 42.65 2pun s ILE 239 CO 0.12 0.09 0.28 -0.36 0.00 0.00 0.00 174.94 175.07 2pun s PHE 240 N 0.40 3.65 0.04 3.97 0.08 0.87 -0.30 117.98 126.69 2pun s PHE 240 Ca -0.04 0.75 -0.03 0.00 0.12 0.00 0.00 56.93 57.73 2pun s PHE 240 Cb -0.06 -2.14 -0.02 0.00 -0.57 0.00 0.00 43.02 40.23 2pun s PHE 240 CO -0.01 0.65 0.05 0.00 -0.10 0.00 0.00 175.22 175.81 2pun s ALA 241 N -0.93 0.08 0.31 5.36 0.00 0.41 -0.98 121.76 126.02 2pun s ALA 241 Ca 0.19 -0.68 -0.07 0.00 0.00 0.00 0.00 51.96 51.40 2pun s ALA 241 Cb -0.14 0.23 0.03 0.00 0.00 0.00 0.00 23.12 23.24 2pun s ALA 241 CO 0.08 -0.29 0.53 -1.13 0.00 0.00 0.00 175.76 174.95 2pun n SER 242 N 0.82 -1.52 -0.22 0.00 3.41 -0.53 -1.03 113.62 114.54 2pun n SER 242 Ca -0.19 -2.46 0.14 0.00 -0.26 0.00 0.00 58.87 56.09 2pun n SER 242 Cb 0.58 2.65 0.44 0.00 -0.26 0.00 0.00 64.21 67.62 2pun n SER 242 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2pun h GLU 243 N 0.00 0.55 -0.00 4.33 4.81 -2.00 -3.14 114.58 119.13 2pun h GLU 243 Ca -0.25 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 2pun h GLU 243 Cb 1.01 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.27 2pun h GLU 243 CO 0.33 0.36 -0.20 0.72 -0.73 0.00 0.00 179.01 179.49 2pun n HIS 244 N -4.52 0.00 -4.31 0.92 8.25 -1.26 -4.37 115.22 109.92 2pun n HIS 244 Ca 0.16 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.42 2pun n HIS 244 Cb 0.50 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.48 2pun n HIS 244 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2pun s GLU 245 N -1.28 0.93 -0.05 -0.41 2.02 -1.19 -5.07 118.70 113.65 2pun s GLU 245 Ca 0.04 -0.84 -0.04 0.00 0.02 0.00 0.00 54.97 54.14 2pun s GLU 245 Cb 0.05 -0.96 0.02 0.00 0.10 0.00 0.00 34.13 33.33 2pun s GLU 245 CO 0.20 0.23 0.13 0.99 0.02 0.00 0.00 175.26 176.83 2pun s THR 246 N -0.98 -0.01 -0.07 3.63 2.01 -1.26 -1.46 115.64 117.50 2pun s THR 246 Ca 0.01 0.02 -0.03 0.00 0.31 0.00 0.00 61.69 62.00 2pun s THR 246 Cb -0.09 -0.20 0.04 0.00 0.01 0.00 0.00 72.50 72.27 2pun s THR 246 CO 0.02 0.01 0.14 -0.54 -0.69 0.00 0.00 174.62 173.56 2pun s LYS 247 N 0.21 0.03 -0.18 4.92 -0.14 -0.15 -4.47 119.74 119.96 2pun s LYS 247 Ca -0.01 0.49 -0.18 0.00 -1.36 0.00 0.00 55.97 54.92 2pun s LYS 247 Cb -0.02 -0.27 -0.04 0.00 -1.68 0.00 0.00 37.83 35.82 2pun s LYS 247 CO -0.01 -0.27 0.47 0.08 -0.76 0.00 0.00 175.35 174.86 2pun s VAL 248 N 1.99 5.15 0.44 3.17 1.01 0.73 -0.09 120.40 132.80 2pun s VAL 248 Ca 0.00 0.87 0.06 0.00 0.00 0.00 0.00 61.98 62.92 2pun s VAL 248 Cb -0.12 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 2pun s VAL 248 CO -0.05 0.23 0.12 0.27 0.00 0.00 0.00 175.10 175.67 2pun s ILE 249 N 1.30 2.00 -1.13 2.22 -4.36 -0.33 -4.38 121.20 116.52 2pun s ILE 249 Ca 0.23 -1.82 -0.13 0.00 -0.26 0.00 0.00 60.65 58.67 2pun s ILE 249 Cb -0.15 -2.82 -0.03 0.00 1.25 0.00 0.00 42.46 40.71 2pun s ILE 249 CO 0.09 0.00 0.82 -0.67 0.24 0.00 0.00 174.94 175.42 2pun n ASP 250 N -1.19 -5.15 -1.58 4.36 2.03 -1.26 -4.78 116.55 108.97 2pun n ASP 250 Ca -0.05 -0.89 -0.03 0.00 0.52 0.00 0.00 54.79 54.35 2pun n ASP 250 Cb 0.66 -4.09 -0.01 0.00 -0.72 0.00 0.00 41.12 36.95 2pun n ASP 250 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2pun n PRO 251 N -3.88 1.17 0.29 -0.67 -0.04 -1.26 -4.47 135.00 126.13 2pun n PRO 251 Ca -0.12 -0.25 0.16 0.00 -0.04 0.00 0.00 63.50 63.25 2pun n PRO 251 Cb 0.61 -1.14 0.90 0.00 -0.04 0.00 0.00 33.50 33.83 2pun n PRO 251 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2pun h GLU 252 N 1.21 0.00 -0.10 0.54 4.11 -1.86 -1.84 114.58 116.63 2pun h GLU 252 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.48 2pun h GLU 252 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2pun h GLU 252 CO 0.10 0.05 0.00 1.19 0.07 0.00 0.00 179.01 180.42 2pun n PHE 253 N -3.54 0.12 -1.68 2.06 3.01 -1.24 -4.63 117.46 111.57 2pun n PHE 253 Ca -0.02 -0.06 -0.45 0.00 1.01 0.00 0.00 57.45 57.93 2pun n PHE 253 Cb 0.16 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.60 2pun n PHE 253 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2pun n ALA 254 N -0.07 1.32 -3.82 4.37 0.00 -0.69 -4.38 120.51 117.25 2pun n ALA 254 Ca 0.16 0.41 -0.04 0.00 0.00 0.00 0.00 53.44 53.97 2pun n ALA 254 Cb 0.24 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.39 2pun n ALA 254 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2pun s PHE 255 N 0.14 -0.02 -0.60 0.00 -0.12 -1.21 -4.65 117.98 111.52 2pun s PHE 255 Ca 0.70 -0.39 -0.28 0.00 -0.05 0.00 0.00 56.93 56.91 2pun s PHE 255 Cb -0.64 0.70 0.03 0.00 -0.63 0.00 0.00 43.02 42.48 2pun s PHE 255 CO 0.47 -1.00 1.19 0.71 -0.05 0.00 0.00 175.22 176.55 2pun s TYR 256 N -2.75 2.56 0.06 3.49 2.02 -1.25 -1.10 117.35 120.37 2pun s TYR 256 Ca 0.16 0.32 0.01 0.00 -0.37 0.00 0.00 57.07 57.19 2pun s TYR 256 Cb -0.03 -4.51 -0.00 0.00 -0.40 0.00 0.00 41.96 37.01 2pun s TYR 256 CO 0.05 -1.66 0.05 0.41 -1.57 0.00 0.00 175.55 172.83 2pun n GLY 257 N 5.12 3.82 3.74 0.71 0.00 -0.15 -4.22 105.19 114.21 2pun n GLY 257 Ca 0.07 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 43.99 2pun n GLY 257 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2pun s PRO 258 N -2.23 4.41 0.34 1.61 0.04 -0.88 -1.97 135.00 136.31 2pun s PRO 258 Ca 0.07 2.01 0.08 0.00 0.04 0.00 0.00 61.00 63.20 2pun s PRO 258 Cb 0.00 -3.20 0.77 0.00 0.04 0.00 0.00 34.50 32.11 2pun s PRO 258 CO 0.05 -0.21 1.85 0.82 0.04 0.00 0.00 177.00 179.54 2pun h ILE 259 N 3.74 0.83 0.00 0.56 2.04 -1.91 -2.18 117.51 120.58 2pun h ILE 259 Ca -0.45 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.16 2pun h ILE 259 Cb 1.21 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 2pun h ILE 259 CO 0.76 0.14 0.00 1.23 0.00 0.00 0.00 178.15 180.28 2pun h GLY 260 N 0.75 0.00 0.93 5.37 0.00 -1.92 -3.36 103.07 104.82 2pun h GLY 260 Ca 0.48 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.77 2pun h GLY 260 CO -0.24 0.00 -0.32 -2.75 0.00 0.00 0.00 176.54 173.23 2pun h PHE 261 N 0.00 -0.84 -0.93 5.60 3.04 -1.71 -1.30 116.94 120.80 2pun h PHE 261 Ca 0.00 -0.02 0.07 0.00 3.98 0.00 0.00 57.97 62.00 2pun h PHE 261 Cb 0.28 0.28 -0.06 0.00 2.56 0.00 0.00 35.95 39.01 2pun h PHE 261 CO 0.00 -0.50 0.60 -0.44 -2.02 0.00 0.00 178.31 175.96 2pun h ASP 262 N -0.99 0.93 -0.28 0.41 3.32 -1.80 -1.71 116.42 116.31 2pun h ASP 262 Ca -0.09 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 2pun h ASP 262 Cb 0.72 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 2pun h ASP 262 CO 0.15 0.59 0.14 0.58 -1.72 0.00 0.00 179.24 178.97 2pun h VAL 263 N 1.05 1.15 -0.03 -1.35 2.07 -1.73 -1.88 116.25 115.53 2pun h VAL 263 Ca 0.40 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 2pun h VAL 263 Cb 0.22 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 2pun h VAL 263 CO -0.16 0.15 0.01 1.23 0.02 0.00 0.00 177.57 178.83 2pun h GLY 264 N 0.32 0.05 0.60 2.17 0.00 -0.83 -1.44 103.07 103.94 2pun h GLY 264 Ca 0.10 -0.03 0.05 0.00 0.00 0.00 0.00 47.33 47.45 2pun h GLY 264 CO -0.01 0.02 0.13 1.46 0.00 0.00 0.00 176.54 178.14 2pun h GLN 265 N -0.10 0.28 0.12 4.80 4.20 -1.34 0.21 115.11 123.28 2pun h GLN 265 Ca 0.01 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2pun h GLN 265 Cb 0.15 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.87 2pun h GLN 265 CO -0.00 0.19 -0.06 0.35 -0.67 0.00 0.00 178.83 178.64 2pun h PHE 266 N 0.29 -0.15 -0.85 2.96 3.04 -1.18 -2.18 116.94 118.87 2pun h PHE 266 Ca 0.19 -0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.19 2pun h PHE 266 Cb 0.19 0.05 -0.06 0.00 2.56 0.00 0.00 35.95 38.69 2pun h PHE 266 CO -0.16 -0.04 0.53 0.82 -2.02 0.00 0.00 178.31 177.44 2pun h ILE 267 N -0.23 1.06 -0.67 1.41 2.04 -1.03 -1.82 117.51 118.27 2pun h ILE 267 Ca -0.02 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 2pun h ILE 267 Cb 0.18 -0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.22 2pun h ILE 267 CO 0.03 0.18 0.41 0.00 0.00 0.00 0.00 178.15 178.76 2pun h ALA 268 N 1.39 1.45 0.00 1.87 0.00 -0.40 -2.02 119.26 121.55 2pun h ALA 268 Ca 0.36 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.10 2pun h ALA 268 Cb 0.13 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2pun h ALA 268 CO -0.16 0.48 -0.48 -0.91 0.00 0.00 0.00 179.25 178.18 2pun h ASN 269 N 0.92 0.00 -0.44 0.00 2.35 -0.70 0.12 115.58 117.84 2pun h ASN 269 Ca 0.24 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.94 2pun h ASN 269 Cb -0.04 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.31 2pun h ASN 269 CO -0.05 0.48 0.05 -0.07 -1.65 0.00 0.00 177.43 176.19 2pun h LEU 270 N 0.00 0.72 -0.74 1.61 3.38 -1.00 -2.64 115.31 116.64 2pun h LEU 270 Ca -0.00 -0.27 -0.11 0.00 0.09 0.00 0.00 57.88 57.58 2pun h LEU 270 Cb 1.06 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2pun h LEU 270 CO 0.06 0.81 -0.26 -0.26 0.09 0.00 0.00 178.44 178.88 2pun h PHE 271 N 0.60 0.76 -0.92 1.13 0.04 -1.15 -1.87 116.94 115.54 2pun h PHE 271 Ca 0.13 -0.18 -0.01 0.00 2.80 0.00 0.00 57.97 60.71 2pun h PHE 271 Cb 0.41 -0.18 -0.04 0.00 2.20 0.00 0.00 35.95 38.34 2pun h PHE 271 CO 0.03 0.86 0.54 -0.07 -0.60 0.00 0.00 178.31 179.07 2pun h LEU 272 N 0.58 1.12 -0.47 1.54 3.38 -0.76 -1.03 115.31 119.68 2pun h LEU 272 Ca 0.08 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2pun h LEU 272 Cb 0.75 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 2pun h LEU 272 CO 0.06 0.87 0.10 -1.13 0.09 0.00 0.00 178.44 178.43 2pun h ASN 273 N 1.27 0.73 -0.94 -0.43 -0.73 -1.36 -2.99 115.58 111.13 2pun h ASN 273 Ca 0.33 -0.25 0.09 0.00 1.87 0.00 0.00 56.30 58.34 2pun h ASN 273 Cb -0.03 -0.19 -0.07 0.00 0.27 0.00 0.00 38.32 38.30 2pun h ASN 273 CO -0.06 0.79 0.59 0.00 -0.37 0.00 0.00 177.43 178.37 2pun h ALA 274 N 0.97 1.35 0.00 1.57 0.00 -1.01 -1.90 119.26 120.23 2pun h ALA 274 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2pun h ALA 274 Cb 0.35 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2pun h ALA 274 CO 0.01 0.28 -0.10 -0.07 0.00 0.00 0.00 179.25 179.36 2pun h LEU 275 N 1.00 0.00 0.00 0.00 3.38 -1.05 -2.44 115.31 116.20 2pun h LEU 275 Ca 0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.40 2pun h LEU 275 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2pun h LEU 275 CO -0.22 0.10 -0.25 -1.54 0.09 0.00 0.00 178.44 176.62 2pun n SER 276 N -4.15 0.44 -4.99 -0.43 3.41 -0.74 -4.86 113.62 102.30 2pun n SER 276 Ca -0.03 0.25 -0.19 0.00 -0.26 0.00 0.00 58.87 58.65 2pun n SER 276 Cb 0.18 -0.24 0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2pun n SER 276 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2pun s ARG 277 N -3.06 2.58 0.03 4.33 0.52 -0.92 -4.98 118.95 117.46 2pun s ARG 277 Ca 0.11 -1.30 0.08 0.00 -0.52 0.00 0.00 55.73 54.10 2pun s ARG 277 Cb 0.16 -2.67 -0.02 0.00 0.52 0.00 0.00 34.95 32.93 2pun s ARG 277 CO 0.62 -0.56 -0.23 -0.51 0.02 0.00 0.00 175.30 174.65 2pun s ASP 278 N -4.47 2.72 1.51 0.23 -0.00 -1.26 -4.90 116.67 110.49 2pun s ASP 278 Ca 0.58 -0.52 0.00 0.00 -0.00 0.00 0.00 52.55 52.61 2pun s ASP 278 Cb -0.09 -0.25 0.00 0.00 -0.00 0.00 0.00 42.92 42.59 2pun s ASP 278 CO 0.36 0.22 0.00 0.61 -0.00 0.00 0.00 175.17 176.36 2pun n GLY 279 N 1.98 3.33 0.05 0.21 0.00 -1.26 -1.68 105.19 107.82 2pun n GLY 279 Ca -0.17 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 45.86 2pun n GLY 279 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pun n ALA 280 N 10.72 1.78 0.23 4.61 0.00 -1.26 -2.17 120.51 134.41 2pun n ALA 280 Ca 0.00 -0.01 0.07 0.00 0.00 0.00 0.00 53.44 53.50 2pun n ALA 280 Cb 0.00 -1.33 0.53 0.00 0.00 0.00 0.00 19.45 18.65 2pun n ALA 280 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2pun h ASP 281 N 0.00 0.00 0.88 0.00 3.45 -1.73 -3.07 116.42 115.94 2pun h ASP 281 Ca 0.00 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.44 2pun h ASP 281 Cb 0.35 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.12 2pun h ASP 281 CO 0.00 0.20 -0.08 0.03 -1.57 0.00 0.00 179.24 177.82 2pun h ARG 282 N 0.00 0.00 -0.72 3.56 3.08 -1.53 -3.35 114.38 115.42 2pun h ARG 282 Ca -0.00 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.07 2pun h ARG 282 Cb 0.39 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.40 2pun h ARG 282 CO 0.03 0.08 0.46 0.93 -1.07 0.00 0.00 179.97 180.40 2pun h GLU 283 N 0.00 0.88 -0.98 0.04 4.39 -1.73 -1.56 114.58 115.62 2pun h GLU 283 Ca -0.00 -0.05 0.19 0.00 0.34 0.00 0.00 59.36 59.84 2pun h GLU 283 Cb 0.54 -0.20 -0.09 0.00 -0.10 0.00 0.00 28.75 28.90 2pun h GLU 283 CO 0.01 0.58 0.61 -1.35 -1.16 0.00 0.00 179.01 177.71 2pun h PRO 284 N 0.91 0.66 -0.50 2.33 0.11 -1.82 -1.10 132.00 132.59 2pun h PRO 284 Ca 0.28 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.23 2pun h PRO 284 Cb -0.02 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 2pun h PRO 284 CO -0.09 0.44 -0.18 -0.07 -0.21 0.00 0.00 178.00 177.89 2pun h LEU 285 N 0.68 1.01 -0.55 2.35 -0.00 -1.54 -0.72 115.31 116.55 2pun h LEU 285 Ca 0.55 -0.38 -0.03 0.00 -0.00 0.00 0.00 57.88 58.01 2pun h LEU 285 Cb 0.96 -0.28 -0.02 0.00 -0.00 0.00 0.00 40.66 41.32 2pun h LEU 285 CO -0.32 1.17 0.21 1.88 -0.00 0.00 0.00 178.44 181.38 2pun h TYR 286 N 0.86 0.84 -0.88 1.13 0.99 -1.25 -1.57 116.97 117.09 2pun h TYR 286 Ca 0.12 -0.07 0.02 0.00 2.00 0.00 0.00 58.73 60.80 2pun h TYR 286 Cb 0.75 -0.25 -0.05 0.00 1.00 0.00 0.00 36.73 38.18 2pun h TYR 286 CO 0.05 0.69 0.58 0.93 -0.00 0.00 0.00 178.16 180.41 2pun h GLU 287 N 0.75 1.12 -0.44 4.88 4.39 -1.12 -2.00 114.58 122.15 2pun h GLU 287 Ca 0.18 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 2pun h GLU 287 Cb 0.22 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 2pun h GLU 287 CO -0.01 0.74 0.16 0.45 -1.16 0.00 0.00 179.01 179.19 2pun h HIS 288 N 1.15 0.64 -0.08 4.33 3.86 -0.82 0.70 115.15 124.92 2pun h HIS 288 Ca 0.34 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.48 2pun h HIS 288 Cb -0.07 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 28.20 2pun h HIS 288 CO -0.01 0.51 -0.07 0.28 0.86 0.00 0.00 177.93 179.50 2pun h VAL 289 N 0.63 1.36 -0.38 2.45 2.07 -1.11 -0.23 116.25 121.03 2pun h VAL 289 Ca 0.15 -1.19 0.02 0.00 0.82 0.00 0.00 66.70 66.49 2pun h VAL 289 Cb 0.15 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 2pun h VAL 289 CO -0.01 0.33 0.23 -1.13 0.02 0.00 0.00 177.57 177.01 2pun h ASN 290 N -0.21 0.37 -0.20 0.57 -1.24 -1.19 -2.46 115.58 111.20 2pun h ASN 290 Ca 0.01 0.00 -0.13 0.00 0.71 0.00 0.00 56.30 56.89 2pun h ASN 290 Cb 0.57 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.53 2pun h ASN 290 CO 0.02 0.26 -0.35 -0.61 -1.29 0.00 0.00 177.43 175.47 2pun h GLN 291 N 0.46 0.72 -0.21 6.67 5.75 -0.86 -1.56 115.11 126.08 2pun h GLN 291 Ca 0.15 -0.35 -0.16 0.00 -0.15 0.00 0.00 58.65 58.15 2pun h GLN 291 Cb 0.00 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 2pun h GLN 291 CO -0.07 0.96 -0.51 -0.24 -2.65 0.00 0.00 178.83 176.32 2pun h VAL 292 N 0.60 1.31 -0.13 2.39 3.04 -0.91 0.21 116.25 122.77 2pun h VAL 292 Ca 0.06 -1.74 -0.02 0.00 -1.01 0.00 0.00 66.70 64.00 2pun h VAL 292 Cb 0.88 1.71 -0.00 0.00 -2.01 0.00 0.00 31.29 31.86 2pun h VAL 292 CO 0.08 0.54 0.02 -0.25 -1.01 0.00 0.00 177.57 176.95 2pun h TRP 293 N 0.46 0.22 0.10 3.17 2.91 -1.44 -0.48 115.95 120.89 2pun h TRP 293 Ca 0.02 -0.03 0.02 0.00 1.13 0.00 0.00 58.89 60.03 2pun h TRP 293 Cb 1.05 -0.06 -0.04 0.00 -0.51 0.00 0.00 29.16 29.61 2pun h TRP 293 CO 0.05 0.40 -0.26 1.49 -1.03 0.00 0.00 178.44 179.08 2pun h GLU 294 N -0.02 -0.45 -0.64 2.65 4.81 -0.97 0.10 114.58 120.06 2pun h GLU 294 Ca 0.04 0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 2pun h GLU 294 Cb 0.30 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 2pun h GLU 294 CO 0.00 -0.30 0.21 1.15 -0.73 0.00 0.00 179.01 179.34 2pun h THR 295 N -0.46 1.25 -0.94 0.32 2.02 -0.66 -1.48 112.91 112.95 2pun h THR 295 Ca 0.03 -0.84 0.05 0.00 0.77 0.00 0.00 66.41 66.42 2pun h THR 295 Cb 0.50 0.58 -0.06 0.00 -1.74 0.00 0.00 68.15 67.43 2pun h THR 295 CO -0.16 0.32 0.61 0.15 0.37 0.00 0.00 175.52 176.81 2pun h PHE 296 N 0.93 1.14 -0.21 3.16 3.57 -0.72 -0.83 116.94 123.98 2pun h PHE 296 Ca 0.21 0.03 -0.21 0.00 3.53 0.00 0.00 57.97 61.53 2pun h PHE 296 Cb 0.29 -0.37 0.01 0.00 2.79 0.00 0.00 35.95 38.66 2pun h PHE 296 CO 0.02 0.62 -0.68 1.49 -2.23 0.00 0.00 178.31 177.53 2pun h GLU 297 N 1.15 0.80 -0.46 1.11 4.81 -0.09 -0.99 114.58 120.91 2pun h GLU 297 Ca 0.39 -0.59 -0.14 0.00 -0.13 0.00 0.00 59.36 58.89 2pun h GLU 297 Cb 0.08 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 2pun h GLU 297 CO -0.14 1.21 -0.25 0.93 -0.73 0.00 0.00 179.01 180.03 2pun h GLU 298 N 0.58 0.97 -0.10 1.92 5.08 -1.12 -1.73 114.58 120.17 2pun h GLU 298 Ca -0.02 -0.43 -0.02 0.00 -1.00 0.00 0.00 59.36 57.88 2pun h GLU 298 Cb 1.30 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.52 2pun h GLU 298 CO 0.14 1.10 -0.03 1.15 -1.00 0.00 0.00 179.01 180.37 2pun h THR 299 N 0.83 1.30 -0.65 1.13 2.02 -1.11 0.16 112.91 116.60 2pun h THR 299 Ca 0.10 -0.99 0.02 0.00 0.77 0.00 0.00 66.41 66.31 2pun h THR 299 Cb 0.82 1.75 -0.04 0.00 -1.74 0.00 0.00 68.15 68.94 2pun h THR 299 CO 0.07 0.28 0.41 0.15 0.37 0.00 0.00 175.52 176.80 2pun h PHE 300 N -0.13 0.77 -0.61 3.16 3.04 -1.22 -1.92 116.94 120.03 2pun h PHE 300 Ca 0.03 0.02 -0.09 0.00 3.98 0.00 0.00 57.97 61.91 2pun h PHE 300 Cb 0.45 -0.26 -0.02 0.00 2.56 0.00 0.00 35.95 38.69 2pun h PHE 300 CO 0.06 0.46 0.04 0.77 -2.02 0.00 0.00 178.31 177.62 2pun h SER 301 N 0.82 1.02 -0.67 0.41 0.02 -1.04 -1.34 113.55 112.77 2pun h SER 301 Ca 0.25 -0.29 -0.05 0.00 -0.84 0.00 0.00 61.79 60.87 2pun h SER 301 Cb -0.02 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.22 2pun h SER 301 CO -0.09 1.06 0.24 -0.33 -1.14 0.00 0.00 176.83 176.57 2pun h GLU 302 N 0.96 1.02 -0.35 3.45 3.07 -0.49 -1.31 114.58 120.93 2pun h GLU 302 Ca 0.18 -0.20 -0.06 0.00 -0.50 0.00 0.00 59.36 58.78 2pun h GLU 302 Cb 0.50 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 2pun h GLU 302 CO 0.02 0.87 -0.01 0.00 -1.40 0.00 0.00 179.01 178.49 2pun h ALA 303 N 1.10 0.47 -0.31 3.43 0.00 -1.24 -1.64 119.26 121.07 2pun h ALA 303 Ca 0.22 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.93 2pun h ALA 303 Cb 0.25 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 2pun h ALA 303 CO -0.01 0.25 0.01 2.35 0.00 0.00 0.00 179.25 181.84 2pun h TRP 304 N 0.43 0.00 0.63 0.00 2.91 -1.14 0.31 115.95 119.09 2pun h TRP 304 Ca 0.10 0.02 -0.03 0.00 1.13 0.00 0.00 58.89 60.11 2pun h TRP 304 Cb 0.48 0.05 0.01 0.00 -0.51 0.00 0.00 29.16 29.18 2pun h TRP 304 CO 0.04 -0.04 -0.30 1.96 -1.03 0.00 0.00 178.44 179.06 2pun h GLN 305 N 0.10 -0.82 -0.04 2.65 1.08 -1.08 -2.81 115.11 114.20 2pun h GLN 305 Ca 0.15 0.06 -0.16 0.00 -1.45 0.00 0.00 58.65 57.25 2pun h GLN 305 Cb 0.20 0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.80 2pun h GLN 305 CO -0.24 -0.52 -0.68 1.57 -0.95 0.00 0.00 178.83 178.00 2pun h LYS 306 N -0.92 0.17 0.00 1.46 -0.00 -1.27 -3.38 116.57 112.63 2pun h LYS 306 Ca -0.09 -0.14 0.00 0.00 -0.00 0.00 0.00 60.65 60.43 2pun h LYS 306 Cb 0.67 0.03 0.00 0.00 -0.00 0.00 0.00 32.23 32.93 2pun h LYS 306 CO 0.14 0.79 -0.09 -0.25 -0.00 0.00 0.00 179.45 180.04 2pun n ASP 307 N -3.79 1.12 -4.78 7.07 10.43 0.11 -5.07 116.55 121.64 2pun n ASP 307 Ca -0.02 -1.93 -0.37 0.00 2.57 0.00 0.00 54.79 55.04 2pun n ASP 307 Cb 0.67 -0.12 -0.04 0.00 1.84 0.00 0.00 41.12 43.46 2pun n ASP 307 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 2pun s SER 308 N -1.09 6.82 -0.02 -2.24 0.01 -1.06 -4.54 113.70 111.59 2pun s SER 308 Ca 0.07 2.07 0.22 0.00 1.31 0.00 0.00 55.95 59.62 2pun s SER 308 Cb 0.06 -2.59 -0.30 0.00 0.21 0.00 0.00 66.02 63.39 2pun s SER 308 CO 0.01 -0.45 0.58 0.18 0.41 0.00 0.00 173.24 173.96 2pun n LEU 309 N 0.10 0.19 -4.79 2.44 4.77 0.66 -4.98 117.00 115.39 2pun n LEU 309 Ca 0.04 -0.06 -0.38 0.00 -0.03 0.00 0.00 56.01 55.58 2pun n LEU 309 Cb 0.49 -0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 2pun n LEU 309 CO 0.46 0.03 0.47 -1.81 -1.33 0.00 0.00 177.39 175.21 2pun s ASP 310 N -4.31 7.24 0.56 -1.43 1.01 -1.26 -4.96 116.67 113.52 2pun s ASP 310 Ca -0.05 1.57 0.27 0.00 0.71 0.00 0.00 52.55 55.04 2pun s ASP 310 Cb 0.14 -2.47 1.49 0.00 1.01 0.00 0.00 42.92 43.09 2pun s ASP 310 CO 0.90 0.11 2.02 -0.37 0.21 0.00 0.00 175.17 178.04 2pun h VAL 311 N 3.03 0.59 0.00 -1.27 -1.51 -2.00 -2.56 116.25 112.53 2pun h VAL 311 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 2pun h VAL 311 Cb 1.20 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 31.12 2pun h VAL 311 CO 0.65 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.77 2pun n TYR 312 N -4.07 0.00 -0.09 5.19 4.02 -1.26 -4.38 117.16 116.57 2pun n TYR 312 Ca 0.06 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.96 2pun n TYR 312 Cb 0.50 -0.47 0.30 0.00 -0.02 0.00 0.00 39.34 39.65 2pun n TYR 312 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2pun h ALA 313 N 3.02 1.46 -0.66 -0.72 0.00 -1.87 -2.75 119.26 117.75 2pun h ALA 313 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2pun h ALA 313 Cb 0.45 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2pun h ALA 313 CO 0.00 0.43 0.00 0.27 0.00 0.00 0.00 179.25 179.95 2pun n ASN 314 N -4.38 4.71 -4.67 0.00 6.94 -1.26 -4.51 115.26 112.09 2pun n ASN 314 Ca 0.04 -2.41 -0.43 0.00 -0.02 0.00 0.00 54.58 51.76 2pun n ASN 314 Cb 0.13 -0.58 -0.02 0.00 -2.36 0.00 0.00 39.78 36.95 2pun n ASN 314 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2pun s ILE 315 N -1.80 4.67 -0.09 1.53 1.01 -1.04 -4.95 121.20 120.53 2pun s ILE 315 Ca 0.51 1.99 -0.35 0.00 0.00 0.00 0.00 60.65 62.80 2pun s ILE 315 Cb 0.32 -4.28 -0.13 0.00 0.01 0.00 0.00 42.46 38.38 2pun s ILE 315 CO 0.25 -0.13 1.81 -0.90 0.00 0.00 0.00 174.94 175.97 2pun n ASP 316 N 5.98 3.15 0.00 3.58 5.75 -1.26 -1.76 116.55 132.00 2pun n ASP 316 Ca 0.11 1.01 0.00 0.00 -0.01 0.00 0.00 54.79 55.90 2pun n ASP 316 Cb 0.47 -1.33 0.00 0.00 -1.03 0.00 0.00 41.12 39.23 2pun n ASP 316 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pun n GLY 317 N 4.20 2.99 0.06 6.12 0.00 -1.26 -4.97 105.19 112.33 2pun n GLY 317 Ca 0.23 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 2pun n GLY 317 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2pun h TYR 318 N 0.00 0.01 -0.68 1.61 3.20 -1.68 -0.96 116.97 118.47 2pun h TYR 318 Ca 0.00 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.92 2pun h TYR 318 Cb 0.00 -0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.22 2pun h TYR 318 CO 0.00 0.59 0.39 1.25 -1.64 0.00 0.00 178.16 178.75 2pun h LEU 319 N -0.57 0.59 -0.40 2.82 5.85 -1.79 -1.15 115.31 120.66 2pun h LEU 319 Ca 0.00 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.79 2pun h LEU 319 Cb 0.59 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 2pun h LEU 319 CO 0.00 0.39 0.13 0.74 -0.34 0.00 0.00 178.44 179.37 2pun h THR 320 N 0.73 0.87 -0.16 1.05 2.02 -1.93 0.29 112.91 115.79 2pun h THR 320 Ca 0.29 -0.10 -0.13 0.00 0.77 0.00 0.00 66.41 67.25 2pun h THR 320 Cb 0.15 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 2pun h THR 320 CO -0.16 0.05 -0.46 0.44 0.37 0.00 0.00 175.52 175.76 2pun h ASP 321 N 0.29 0.42 -0.13 4.18 3.32 -0.99 -1.93 116.42 121.58 2pun h ASP 321 Ca 0.18 -0.20 0.01 0.00 0.02 0.00 0.00 57.03 57.04 2pun h ASP 321 Cb 0.17 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2pun h ASP 321 CO -0.19 0.83 0.07 0.74 -1.72 0.00 0.00 179.24 178.97 2pun h THR 322 N 0.32 1.01 -0.48 0.35 2.02 -0.77 -2.07 112.91 113.29 2pun h THR 322 Ca 0.02 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 2pun h THR 322 Cb 0.94 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 68.17 2pun h THR 322 CO 0.08 0.03 0.23 -0.07 0.37 0.00 0.00 175.52 176.16 2pun h LEU 323 N 0.16 0.60 -0.48 2.58 3.38 -0.80 -1.78 115.31 118.97 2pun h LEU 323 Ca 0.05 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2pun h LEU 323 Cb -0.00 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2pun h LEU 323 CO -0.03 0.52 0.10 0.28 0.09 0.00 0.00 178.44 179.40 2pun h SER 324 N 0.67 0.74 -0.48 -0.43 0.02 -1.14 -0.30 113.55 112.63 2pun h SER 324 Ca 0.17 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 2pun h SER 324 Cb 0.08 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 2pun h SER 324 CO -0.02 0.79 0.22 -0.74 -1.14 0.00 0.00 176.83 175.93 2pun h HIS 325 N 0.65 0.70 -0.56 3.45 -0.00 -1.05 -2.02 115.15 116.31 2pun h HIS 325 Ca 0.15 -0.04 0.02 0.00 -0.00 0.00 0.00 60.37 60.50 2pun h HIS 325 Cb 0.35 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.51 2pun h HIS 325 CO 0.02 0.57 0.36 0.82 -0.00 0.00 0.00 177.93 179.69 2pun h ILE 326 N 0.63 1.10 -0.15 6.26 2.04 -1.20 -1.69 117.51 124.51 2pun h ILE 326 Ca 0.16 -0.24 0.01 0.00 1.00 0.00 0.00 64.86 65.79 2pun h ILE 326 Cb 0.14 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2pun h ILE 326 CO -0.02 0.13 0.07 0.15 0.00 0.00 0.00 178.15 178.48 2pun h PHE 327 N 0.71 0.12 0.22 1.37 3.57 -0.93 0.11 116.94 122.12 2pun h PHE 327 Ca 0.22 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.71 2pun h PHE 327 Cb -0.03 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.68 2pun h PHE 327 CO -0.05 0.07 -0.12 1.49 -2.23 0.00 0.00 178.31 177.48 2pun h GLU 328 N 0.15 -0.30 -0.39 1.11 4.81 -1.27 -1.15 114.58 117.54 2pun h GLU 328 Ca 0.06 0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.34 2pun h GLU 328 Cb 0.01 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 2pun h GLU 328 CO -0.04 -0.20 0.18 0.93 -0.73 0.00 0.00 179.01 179.14 2pun h GLU 329 N -0.31 0.36 -0.68 1.92 5.08 -1.23 -2.28 114.58 117.43 2pun h GLU 329 Ca -0.03 -0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.41 2pun h GLU 329 Cb 0.25 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.34 2pun h GLU 329 CO 0.04 0.24 0.31 0.00 -1.00 0.00 0.00 179.01 178.60 2pun h ALA 330 N 1.21 0.92 -0.42 3.43 0.00 -0.51 0.89 119.26 124.79 2pun h ALA 330 Ca 0.17 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 2pun h ALA 330 Cb 0.09 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2pun h ALA 330 CO -0.13 -0.11 0.08 0.82 0.00 0.00 0.00 179.25 179.91 2pun h ILE 331 N 0.52 1.24 -0.33 0.00 1.08 -1.04 -0.79 117.51 118.19 2pun h ILE 331 Ca 0.34 -0.86 0.02 0.00 -0.39 0.00 0.00 64.86 63.97 2pun h ILE 331 Cb 0.39 0.99 -0.02 0.00 -3.07 0.00 0.00 36.82 35.11 2pun h ILE 331 CO -0.29 0.30 0.19 1.23 -0.69 0.00 0.00 178.15 178.88 2pun h GLY 332 N 0.54 0.46 1.04 5.37 0.00 -0.96 -1.46 103.07 108.06 2pun h GLY 332 Ca 0.13 -0.14 -0.04 0.00 0.00 0.00 0.00 47.33 47.28 2pun h GLY 332 CO 0.01 0.12 0.31 0.74 0.00 0.00 0.00 176.54 177.71 2pun h PHE 333 N 0.38 1.15 -0.64 5.60 0.04 -0.79 -2.16 116.94 120.52 2pun h PHE 333 Ca 0.13 -0.08 0.12 0.00 2.80 0.00 0.00 57.97 60.94 2pun h PHE 333 Cb 0.02 -0.34 -0.09 0.00 2.20 0.00 0.00 35.95 37.74 2pun h PHE 333 CO -0.08 0.87 0.19 0.00 -0.60 0.00 0.00 178.31 178.69 2pun h ALA 334 N 1.16 0.81 -0.66 2.45 0.00 -0.83 -1.10 119.26 121.08 2pun h ALA 334 Ca 0.25 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 2pun h ALA 334 Cb 0.21 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2pun h ALA 334 CO -0.02 -0.26 0.33 0.78 0.00 0.00 0.00 179.25 180.07 2pun h GLY 335 N 0.33 1.01 0.63 0.00 0.00 -0.66 -0.68 103.07 103.70 2pun h GLY 335 Ca 0.34 -0.50 0.03 0.00 0.00 0.00 0.00 47.33 47.20 2pun h GLY 335 CO -0.38 0.47 -0.13 0.00 0.00 0.00 0.00 176.54 176.50 2pun h GLU 337 N -0.20 0.87 0.06 0.00 4.57 -0.94 -0.06 114.58 118.88 2pun h GLU 337 Ca 0.06 -0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 2pun h GLU 337 Cb 0.28 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 2pun h GLU 337 CO -0.15 0.57 -0.14 -0.07 -1.18 0.00 0.00 179.01 178.04 2pun h LEU 338 N 0.89 -0.40 -0.14 1.64 3.38 -1.00 -2.25 115.31 117.43 2pun h LEU 338 Ca 0.31 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.33 2pun h LEU 338 Cb 0.07 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2pun h LEU 338 CO -0.13 -0.21 0.06 0.40 0.09 0.00 0.00 178.44 178.65 2pun h ILE 339 N -0.27 1.15 -0.19 1.22 2.04 -1.27 -3.23 117.51 116.97 2pun h ILE 339 Ca 0.03 -0.46 -0.13 0.00 1.00 0.00 0.00 64.86 65.30 2pun h ILE 339 Cb 0.30 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 2pun h ILE 339 CO -0.10 0.14 -0.42 0.08 0.00 0.00 0.00 178.15 177.85 2pun h ARG 340 N 0.08 0.44 0.00 2.37 -0.00 -0.97 -2.11 114.38 114.20 2pun h ARG 340 Ca 0.05 -0.23 0.00 0.00 -0.00 0.00 0.00 59.98 59.80 2pun h ARG 340 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.15 2pun h ARG 340 CO -0.00 0.79 0.00 0.54 -0.00 0.00 0.00 179.97 181.29 2pun n ARG 341 N -4.02 0.20 -0.06 0.08 5.12 -0.85 -0.73 116.66 116.40 2pun n ARG 341 Ca -0.02 0.41 -0.20 0.00 -1.93 0.00 0.00 57.85 56.12 2pun n ARG 341 Cb 0.51 -1.87 -0.13 0.00 -1.16 0.00 0.00 32.46 29.81 2pun n ARG 341 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 2pun n THR 342 N -2.24 1.64 -0.16 0.55 -1.04 -0.83 -3.62 114.28 108.57 2pun n THR 342 Ca 0.02 -0.61 0.00 0.00 -2.04 0.00 0.00 64.05 61.42 2pun n THR 342 Cb 0.24 -1.58 0.00 0.00 -1.82 0.00 0.00 70.33 67.17 2pun n THR 342 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 2pun n ILE 343 N -3.39 0.00 -1.96 12.58 -5.35 -0.96 -4.81 119.36 115.47 2pun n ILE 343 Ca -0.39 -0.38 -0.06 0.00 -0.27 0.00 0.00 62.75 61.65 2pun n ILE 343 Cb 1.02 1.16 0.03 0.00 -1.74 0.00 0.00 39.64 40.11 2pun n ILE 343 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2pun n GLY 344 N 0.24 0.11 0.13 3.28 0.00 0.09 -0.18 105.19 108.87 2pun n GLY 344 Ca 0.00 -1.88 -0.09 0.00 0.00 0.00 0.00 46.02 44.05 2pun n GLY 344 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2pun h LEU 345 N 0.00 0.26 -8.32 0.99 5.85 -1.66 -3.27 115.31 109.16 2pun h LEU 345 Ca -0.08 0.00 -0.72 0.00 0.84 0.00 0.00 57.88 57.92 2pun h LEU 345 Cb 0.27 -0.05 -0.24 0.00 0.37 0.00 0.00 40.66 41.01 2pun h LEU 345 CO 0.08 0.19 -0.43 0.00 -0.34 0.00 0.00 178.44 177.93 2pun s ALA 346 N -6.17 3.40 0.74 1.25 0.00 -1.26 -4.92 121.76 114.80 2pun s ALA 346 Ca -0.13 -1.93 -0.03 0.00 0.00 0.00 0.00 51.96 49.87 2pun s ALA 346 Cb 0.09 -2.80 0.12 0.00 0.00 0.00 0.00 23.12 20.54 2pun s ALA 346 CO 0.70 -1.56 1.02 -1.01 0.00 0.00 0.00 175.76 174.92 2pun s HIS 347 N 1.58 1.78 0.03 0.00 3.76 -1.26 -4.33 115.29 116.84 2pun s HIS 347 Ca 0.03 -0.12 0.08 0.00 -0.15 0.00 0.00 55.06 54.90 2pun s HIS 347 Cb -0.21 -3.15 -0.03 0.00 1.11 0.00 0.00 32.58 30.30 2pun s HIS 347 CO 0.06 -1.75 -0.23 0.14 -0.85 0.00 0.00 174.74 172.11 2pun s VAL 348 N -3.23 2.38 0.50 -0.90 -7.23 -1.24 -5.03 120.40 105.65 2pun s VAL 348 Ca 0.66 -1.25 0.21 0.00 -1.81 0.00 0.00 61.98 59.79 2pun s VAL 348 Cb -0.06 -1.94 0.27 0.00 0.56 0.00 0.00 36.38 35.21 2pun s VAL 348 CO 0.45 0.40 2.12 0.00 -0.31 0.00 0.00 175.10 177.76 2pun h ALA 349 N 4.85 1.67 -0.45 1.32 0.00 -1.97 -2.42 119.26 122.26 2pun h ALA 349 Ca -0.46 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.46 2pun h ALA 349 Cb 1.14 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.85 2pun h ALA 349 CO 0.46 0.09 -0.01 -0.44 0.00 0.00 0.00 179.25 179.35 2pun h ASP 350 N 0.00 -0.20 0.12 0.00 5.19 -1.94 -2.03 116.42 117.55 2pun h ASP 350 Ca -0.00 0.11 -0.27 0.00 -0.62 0.00 0.00 57.03 56.25 2pun h ASP 350 Cb 0.15 0.19 0.00 0.00 0.18 0.00 0.00 39.33 39.86 2pun h ASP 350 CO 0.01 -0.07 -1.37 -0.07 -3.12 0.00 0.00 179.24 174.63 2pun h LEU 351 N 0.10 0.41 -2.30 1.55 3.38 -1.78 -3.35 115.31 113.32 2pun h LEU 351 Ca 0.22 -0.87 -0.00 0.00 0.09 0.00 0.00 57.88 57.32 2pun h LEU 351 Cb 0.33 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2pun h LEU 351 CO -0.38 1.61 -0.00 0.44 0.09 0.00 0.00 178.44 180.19 2pun h ASP 352 N -0.28 0.00 -0.01 -0.43 3.45 -1.40 -2.87 116.42 114.88 2pun h ASP 352 Ca -0.29 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.17 2pun h ASP 352 Cb 1.77 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.54 2pun h ASP 352 CO 0.08 0.00 -0.61 0.35 -1.57 0.00 0.00 179.24 177.50 2pun n THR 353 N -3.11 0.00 -1.62 0.35 -2.24 -0.77 -4.97 114.28 101.92 2pun n THR 353 Ca -0.01 -0.20 -0.48 0.00 -2.27 0.00 0.00 64.05 61.09 2pun n THR 353 Cb 0.18 1.19 -0.04 0.00 -2.10 0.00 0.00 70.33 69.55 2pun n THR 353 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2pun n ILE 354 N -0.42 0.51 -4.32 2.28 5.41 -1.09 -5.01 119.36 116.73 2pun n ILE 354 Ca 0.08 -0.13 -0.22 0.00 1.00 0.00 0.00 62.75 63.48 2pun n ILE 354 Cb 0.42 -1.13 -0.13 0.00 -0.71 0.00 0.00 39.64 38.10 2pun n ILE 354 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2pun s VAL 355 N 0.22 1.44 1.05 1.39 1.01 -1.26 -4.53 120.40 119.72 2pun s VAL 355 Ca 0.76 -1.34 -0.16 0.00 0.00 0.00 0.00 61.98 61.24 2pun s VAL 355 Cb -0.79 -1.32 0.22 0.00 0.00 0.00 0.00 36.38 34.49 2pun s VAL 355 CO 0.47 -0.06 1.20 -2.16 0.00 0.00 0.00 175.10 174.56 2pun s PRO 356 N -1.62 0.00 0.21 2.72 0.05 -1.26 -4.84 135.00 130.27 2pun s PRO 356 Ca 0.03 -0.12 -0.09 0.00 0.05 0.00 0.00 61.00 60.87 2pun s PRO 356 Cb -0.09 -1.74 0.32 0.00 0.05 0.00 0.00 34.50 33.03 2pun s PRO 356 CO 0.03 -2.89 1.70 0.35 0.05 0.00 0.00 177.00 176.24 2pun h PHE 357 N -1.99 0.20 -0.69 0.56 3.04 -2.00 -1.44 116.94 114.63 2pun h PHE 357 Ca -0.46 0.04 -0.03 0.00 3.98 0.00 0.00 57.97 61.50 2pun h PHE 357 Cb 1.28 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 39.76 2pun h PHE 357 CO -1.23 -0.04 0.31 -0.44 -2.02 0.00 0.00 178.31 174.89 2pun h ASP 358 N 0.26 0.89 -0.28 0.41 3.45 -1.97 -1.26 116.42 117.91 2pun h ASP 358 Ca 0.33 -0.10 -0.04 0.00 0.43 0.00 0.00 57.03 57.65 2pun h ASP 358 Cb 0.50 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 39.03 2pun h ASP 358 CO -0.42 0.77 0.04 0.50 -1.57 0.00 0.00 179.24 178.55 2pun h LYS 359 N 0.98 0.48 -0.45 3.56 3.64 -1.76 -2.18 116.57 120.83 2pun h LYS 359 Ca 0.24 -0.13 0.09 0.00 -1.27 0.00 0.00 60.65 59.57 2pun h LYS 359 Cb 0.13 -0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 31.81 2pun h LYS 359 CO -0.03 0.60 -0.05 -0.09 -2.27 0.00 0.00 179.45 177.61 2pun h ARG 360 N 0.29 0.06 -0.52 1.90 2.43 -0.94 -0.19 114.38 117.41 2pun h ARG 360 Ca 0.09 -0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.30 2pun h ARG 360 Cb 0.36 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.84 2pun h ARG 360 CO 0.01 0.04 0.25 0.82 -1.51 0.00 0.00 179.97 179.58 2pun h ILE 361 N 0.06 0.93 -0.70 1.20 1.08 -1.18 -1.16 117.51 117.74 2pun h ILE 361 Ca 0.22 -0.17 -0.03 0.00 -0.39 0.00 0.00 64.86 64.49 2pun h ILE 361 Cb 0.33 0.40 -0.03 0.00 -3.07 0.00 0.00 36.82 34.45 2pun h ILE 361 CO -0.41 0.09 0.30 1.23 -0.69 0.00 0.00 178.15 178.67 2pun h GLY 362 N 0.48 1.10 2.00 5.37 0.00 -0.71 0.54 103.07 111.85 2pun h GLY 362 Ca 0.24 -0.58 -0.07 0.00 0.00 0.00 0.00 47.33 46.91 2pun h GLY 362 CO -0.18 0.55 -0.35 3.21 0.00 0.00 0.00 176.54 179.77 2pun h ARG 363 N 0.98 0.00 -0.08 4.80 2.47 -0.95 -2.42 114.38 119.18 2pun h ARG 363 Ca 0.24 0.00 -0.19 0.00 -1.26 0.00 0.00 59.98 58.77 2pun h ARG 363 Cb 0.17 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.50 2pun h ARG 363 CO -0.02 0.35 -0.68 0.87 0.56 0.00 0.00 179.97 181.04 2pun h LYS 364 N 0.00 0.61 -0.66 0.04 1.57 -0.60 -2.46 116.57 115.07 2pun h LYS 364 Ca -0.00 -0.55 0.13 0.00 -1.87 0.00 0.00 60.65 58.36 2pun h LYS 364 Cb 1.04 0.13 -0.09 0.00 0.08 0.00 0.00 32.23 33.39 2pun h LYS 364 CO 0.05 1.16 0.16 -0.09 -0.57 0.00 0.00 179.45 180.16 2pun h ARG 365 N 0.25 0.27 -0.02 3.15 2.43 -0.85 -2.31 114.38 117.30 2pun h ARG 365 Ca -0.06 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.01 2pun h ARG 365 Cb 1.34 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.81 2pun h ARG 365 CO 0.14 0.18 -0.38 -0.07 -1.51 0.00 0.00 179.97 178.33 2pun h LEU 366 N 0.28 0.05 -0.19 3.80 3.38 -1.39 -1.53 115.31 119.71 2pun h LEU 366 Ca 0.36 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.29 2pun h LEU 366 Cb 0.56 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2pun h LEU 366 CO -0.44 0.43 0.04 0.00 0.09 0.00 0.00 178.44 178.56 2pun h ALA 367 N 1.58 0.26 -0.69 1.53 0.00 -0.97 -0.30 119.26 120.66 2pun h ALA 367 Ca 0.00 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.82 2pun h ALA 367 Cb 0.70 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 2pun h ALA 367 CO 0.05 -0.09 0.37 -0.07 0.00 0.00 0.00 179.25 179.52 2pun h LEU 368 N 0.12 0.54 -0.05 0.00 3.38 -1.20 0.01 115.31 118.12 2pun h LEU 368 Ca 0.06 0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 2pun h LEU 368 Cb 0.29 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 40.99 2pun h LEU 368 CO 0.00 0.33 -0.54 -0.33 0.09 0.00 0.00 178.44 178.00 2pun h GLU 369 N 0.67 0.45 -0.27 1.13 5.08 -1.17 -1.71 114.58 118.76 2pun h GLU 369 Ca 0.32 -0.42 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 2pun h GLU 369 Cb 0.25 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2pun h GLU 369 CO -0.21 1.06 -0.23 1.79 -1.00 0.00 0.00 179.01 180.42 2pun h THR 370 N -0.02 1.26 -0.12 1.13 1.35 -1.07 -2.28 112.91 113.17 2pun h THR 370 Ca -0.05 -1.24 0.00 0.00 -0.55 0.00 0.00 66.41 64.57 2pun h THR 370 Cb 1.21 1.31 -0.01 0.00 -1.73 0.00 0.00 68.15 68.94 2pun h THR 370 CO 0.11 0.40 0.08 1.23 -0.25 0.00 0.00 175.52 177.08 2pun h GLY 371 N 1.00 0.17 0.59 5.82 0.00 -0.99 -0.55 103.07 109.12 2pun h GLY 371 Ca 0.07 -0.07 0.05 0.00 0.00 0.00 0.00 47.33 47.38 2pun h GLY 371 CO 0.05 0.07 0.10 -0.84 0.00 0.00 0.00 176.54 175.91 2pun h THR 372 N 0.16 0.84 -0.52 4.70 2.02 -1.24 -1.69 112.91 117.18 2pun h THR 372 Ca 0.04 -0.08 -0.11 0.00 0.77 0.00 0.00 66.41 67.03 2pun h THR 372 Cb -0.00 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 2pun h THR 372 CO -0.01 0.04 -0.12 0.00 0.37 0.00 0.00 175.52 175.81 2pun h ALA 373 N 1.27 0.71 -0.27 6.16 0.00 -1.36 -1.23 119.26 124.55 2pun h ALA 373 Ca 0.18 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.79 2pun h ALA 373 Cb 0.19 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2pun h ALA 373 CO -0.21 0.63 -0.02 0.74 0.00 0.00 0.00 179.25 180.38 2pun h PHE 374 N 0.86 -0.06 0.56 0.00 -1.00 -0.82 0.21 116.94 116.69 2pun h PHE 374 Ca 0.13 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.91 2pun h PHE 374 Cb 0.68 0.07 0.00 0.00 3.61 0.00 0.00 35.95 40.31 2pun h PHE 374 CO 0.05 -0.07 -0.30 0.82 -1.61 0.00 0.00 178.31 177.20 2pun h ILE 375 N 0.05 0.38 -0.76 -0.55 2.04 -1.16 -1.78 117.51 115.73 2pun h ILE 375 Ca 0.13 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.04 2pun h ILE 375 Cb 0.18 0.38 -0.05 0.00 -0.74 0.00 0.00 36.82 36.59 2pun h ILE 375 CO -0.24 0.00 0.46 -0.33 0.00 0.00 0.00 178.15 178.04 2pun h GLU 376 N -0.80 0.83 -0.15 2.37 5.08 -1.14 -3.22 114.58 117.55 2pun h GLU 376 Ca -0.07 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2pun h GLU 376 Cb 0.63 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.69 2pun h GLU 376 CO 0.10 0.55 0.00 1.63 -1.00 0.00 0.00 179.01 180.29 2pun n LYS 377 N -4.68 2.37 -0.36 2.33 4.01 0.06 -4.72 118.16 117.16 2pun n LYS 377 Ca 0.10 -2.04 0.26 0.00 -0.51 0.00 0.00 58.31 56.12 2pun n LYS 377 Cb 0.15 -1.48 0.53 0.00 -0.51 0.00 0.00 35.03 33.72 2pun n LYS 377 CO 0.00 0.00 0.00 0.07 -1.11 0.00 0.00 177.40 176.36 2pun h ARG 378 N 4.60 0.30 -0.18 1.97 0.11 -1.33 0.47 114.38 120.32 2pun h ARG 378 Ca 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.06 2pun h ARG 378 Cb 0.99 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 32.00 2pun h ARG 378 CO 0.00 0.20 0.00 -1.13 0.10 0.00 0.00 179.97 179.14 2pun n SER 379 N -4.80 2.06 -0.04 0.08 3.41 -1.26 -3.92 113.62 109.14 2pun n SER 379 Ca 0.31 -1.75 0.02 0.00 -0.26 0.00 0.00 58.87 57.18 2pun n SER 379 Cb 1.05 -0.11 -0.15 0.00 -0.26 0.00 0.00 64.21 64.73 2pun n SER 379 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2pun n GLU 380 N 0.58 0.75 -2.17 4.33 1.02 0.15 -4.94 120.64 120.37 2pun n GLU 380 Ca 0.17 -0.11 -0.40 0.00 -0.02 0.00 0.00 57.16 56.79 2pun n GLU 380 Cb 0.40 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.32 2pun n GLU 380 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2pun s PHE 381 N -3.01 3.11 -0.15 -0.32 0.40 -1.21 -4.94 117.98 111.87 2pun s PHE 381 Ca -0.08 1.46 0.11 0.00 -0.60 0.00 0.00 56.93 57.82 2pun s PHE 381 Cb 0.10 -3.61 -0.17 0.00 0.51 0.00 0.00 43.02 39.85 2pun s PHE 381 CO 0.81 -1.66 0.02 0.36 0.70 0.00 0.00 175.22 175.44 2pun n LYS 382 N 0.77 1.47 -4.23 0.44 0.00 -1.26 -5.00 118.16 110.34 2pun n LYS 382 Ca 0.00 0.01 -0.13 0.00 -0.00 0.00 0.00 58.31 58.19 2pun n LYS 382 Cb 0.43 -1.37 -0.10 0.00 -0.00 0.00 0.00 35.03 33.98 2pun n LYS 382 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2pun s THR 383 N -2.35 0.65 0.32 0.58 -4.23 -1.26 -5.05 115.64 104.29 2pun s THR 383 Ca -0.10 -1.97 0.01 0.00 -1.18 0.00 0.00 61.69 58.45 2pun s THR 383 Cb 0.05 -2.10 0.19 0.00 1.34 0.00 0.00 72.50 71.98 2pun s THR 383 CO 0.57 -0.48 1.90 -0.29 -0.54 0.00 0.00 174.62 175.77 2pun h ILE 384 N 2.71 1.20 0.00 2.99 6.09 -1.96 -2.52 117.51 126.01 2pun h ILE 384 Ca -0.37 -0.62 -0.03 0.00 -1.37 0.00 0.00 64.86 62.48 2pun h ILE 384 Cb 1.20 0.58 -0.00 0.00 0.47 0.00 0.00 36.82 39.07 2pun h ILE 384 CO 0.62 0.24 -0.13 0.00 -3.07 0.00 0.00 178.15 175.82 2pun h THR 385 N 0.75 1.07 -0.86 2.19 1.03 -1.96 0.15 112.91 115.27 2pun h THR 385 Ca 0.18 -0.44 0.02 0.00 -0.01 0.00 0.00 66.41 66.16 2pun h THR 385 Cb 0.16 1.24 -0.05 0.00 -1.07 0.00 0.00 68.15 68.44 2pun h THR 385 CO -0.02 0.12 0.57 0.44 -0.01 0.00 0.00 175.52 176.63 2pun h ASP 386 N 0.00 0.97 -0.23 0.00 3.32 -1.86 -0.45 116.42 118.17 2pun h ASP 386 Ca -0.00 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 2pun h ASP 386 Cb 0.23 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2pun h ASP 386 CO 0.02 0.69 -0.01 0.58 -1.72 0.00 0.00 179.24 178.80 2pun h VAL 387 N 1.15 1.26 -0.08 -1.35 2.07 -0.97 -1.72 116.25 116.61 2pun h VAL 387 Ca 0.33 -0.92 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 2pun h VAL 387 Cb -0.09 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 2pun h VAL 387 CO -0.08 0.29 0.04 0.40 0.02 0.00 0.00 177.57 178.24 2pun h ILE 388 N 0.17 1.08 -0.80 4.57 2.04 -1.22 -1.71 117.51 121.64 2pun h ILE 388 Ca 0.06 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.67 2pun h ILE 388 Cb 0.43 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 2pun h ILE 388 CO 0.01 0.07 0.34 -0.33 0.00 0.00 0.00 178.15 178.24 2pun h GLU 389 N 0.04 1.17 -0.12 2.37 4.39 -1.09 0.38 114.58 121.73 2pun h GLU 389 Ca 0.03 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.53 2pun h GLU 389 Cb 0.07 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 2pun h GLU 389 CO -0.00 0.94 0.08 1.25 -1.16 0.00 0.00 179.01 180.11 2pun h LEU 390 N 1.15 0.14 0.12 1.33 5.85 -1.24 -2.57 115.31 120.08 2pun h LEU 390 Ca 0.27 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 59.00 2pun h LEU 390 Cb 0.19 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.14 2pun h LEU 390 CO -0.03 0.10 -0.41 0.15 -0.34 0.00 0.00 178.44 177.92 2pun h PHE 391 N 0.15 -1.16 -0.62 1.25 3.04 -0.85 -1.29 116.94 117.47 2pun h PHE 391 Ca 0.04 0.03 0.12 0.00 3.98 0.00 0.00 57.97 62.14 2pun h PHE 391 Cb -0.01 0.49 -0.09 0.00 2.56 0.00 0.00 35.95 38.90 2pun h PHE 391 CO -0.07 -0.51 0.11 0.87 -2.02 0.00 0.00 178.31 176.69 2pun h LYS 392 N -0.65 0.23 -0.42 1.11 1.57 -0.93 -1.00 116.57 116.47 2pun h LYS 392 Ca 0.02 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2pun h LYS 392 Cb 0.67 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 2pun h LYS 392 CO -0.24 0.15 0.24 -0.07 -0.57 0.00 0.00 179.45 178.96 2pun h LEU 393 N 0.23 0.52 -1.66 2.94 3.38 -1.18 -1.51 115.31 118.03 2pun h LEU 393 Ca 0.33 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.19 2pun h LEU 393 Cb 0.51 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2pun h LEU 393 CO -0.44 0.44 -0.19 -0.07 0.09 0.00 0.00 178.44 178.27 2pun h LEU 394 N 0.55 0.00 -2.33 1.67 3.38 -0.50 -2.81 115.31 115.28 2pun h LEU 394 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2pun h LEU 394 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2pun h LEU 394 CO -0.03 0.19 0.00 1.33 0.09 0.00 0.00 178.44 180.02 2pun n VAL 395 N -3.80 0.51 0.00 1.22 0.24 -0.45 -5.01 118.33 111.03 2pun n VAL 395 Ca -0.02 -0.75 0.00 0.00 -2.04 0.00 0.00 64.34 61.53 2pun n VAL 395 Cb 0.29 0.98 0.00 0.00 -1.47 0.00 0.00 33.84 33.65 2pun n VAL 395 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98