#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pbl n GLU 2 N 0.00 0.00 -0.59 1.61 0.00 -1.16 -1.99 120.64 118.51 2pbl n GLU 2 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.25 2pbl n GLU 2 Cb 0.00 0.00 0.35 0.00 0.00 0.00 0.00 31.44 31.79 2pbl n GLU 2 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2pbl n LEU 3 N 0.00 4.67 -0.03 4.31 4.77 -0.41 -4.54 117.00 125.78 2pbl n LEU 3 Ca 0.00 -2.47 -0.09 0.00 -0.03 0.00 0.00 56.01 53.42 2pbl n LEU 3 Cb 0.00 -0.56 -0.03 0.00 -2.33 0.00 0.00 43.42 40.49 2pbl n LEU 3 CO 0.00 0.80 0.87 0.44 -1.33 0.00 0.00 177.39 178.17 2pbl h ASP 4 N 3.87 -0.03 -0.66 -1.43 3.32 -1.95 -2.25 116.42 117.29 2pbl h ASP 4 Ca 0.00 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.01 2pbl h ASP 4 Cb 1.43 0.05 -0.03 0.00 0.22 0.00 0.00 39.33 41.01 2pbl h ASP 4 CO 0.23 0.01 0.12 -0.78 -1.72 0.00 0.00 179.24 177.09 2pbl h ASP 5 N 0.08 1.04 -0.99 6.45 3.58 -1.95 -2.52 116.42 122.11 2pbl h ASP 5 Ca 0.08 -0.26 0.07 0.00 0.42 0.00 0.00 57.03 57.34 2pbl h ASP 5 Cb 0.09 -0.28 -0.07 0.00 1.72 0.00 0.00 39.33 40.80 2pbl h ASP 5 CO -0.13 1.03 0.64 0.00 -2.88 0.00 0.00 179.24 177.90 2pbl h ALA 6 N 1.05 1.37 -0.23 -0.78 0.00 -1.81 -2.58 119.26 116.28 2pbl h ALA 6 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2pbl h ALA 6 Cb 0.43 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2pbl h ALA 6 CO 0.01 0.42 0.00 0.66 0.00 0.00 0.00 179.25 180.34 2pbl n TYR 7 N -4.52 0.30 -2.89 0.00 4.02 -0.87 -4.46 117.16 108.74 2pbl n TYR 7 Ca 0.15 -0.15 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 2pbl n TYR 7 Cb 0.18 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.46 2pbl n TYR 7 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2pbl s ALA 8 N -1.70 3.58 -0.15 -0.72 0.00 -0.96 -4.93 121.76 116.88 2pbl s ALA 8 Ca 0.33 -0.26 -0.10 0.00 0.00 0.00 0.00 51.96 51.92 2pbl s ALA 8 Cb 0.18 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.92 2pbl s ALA 8 CO 0.27 -1.11 -0.09 -0.91 0.00 0.00 0.00 175.76 173.92 2pbl h ASN 9 N 7.93 0.00 -0.91 0.00 2.35 -1.89 -3.42 115.58 119.64 2pbl h ASN 9 Ca -0.23 -0.09 0.25 0.00 -0.55 0.00 0.00 56.30 55.68 2pbl h ASN 9 Cb 1.09 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 39.32 2pbl h ASN 9 CO 0.89 0.84 0.31 1.23 -1.65 0.00 0.00 177.43 179.06 2pbl h GLY 10 N -1.00 1.51 1.68 2.83 0.00 -1.91 -1.03 103.07 105.15 2pbl h GLY 10 Ca -0.05 -0.08 0.02 0.00 0.00 0.00 0.00 47.33 47.21 2pbl h GLY 10 CO -0.03 -0.38 0.15 0.00 0.00 0.00 0.00 176.54 176.27 2pbl h ALA 11 N 1.79 1.37 -0.33 3.60 0.00 -1.99 -1.94 119.26 121.77 2pbl h ALA 11 Ca 0.59 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.50 2pbl h ALA 11 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2pbl h ALA 11 CO -0.63 -0.17 0.00 0.66 0.00 0.00 0.00 179.25 179.10 2pbl n TYR 12 N -3.31 0.45 -4.28 0.00 4.01 -0.40 -4.96 117.16 108.68 2pbl n TYR 12 Ca -0.01 -0.51 -0.33 0.00 -0.16 0.00 0.00 57.90 56.88 2pbl n TYR 12 Cb 0.23 -0.04 -0.16 0.00 -0.31 0.00 0.00 39.34 39.06 2pbl n TYR 12 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2pbl s ILE 13 N -1.05 2.40 0.15 -0.72 1.01 -0.73 -5.08 121.20 117.18 2pbl s ILE 13 Ca 0.22 -0.84 -0.31 0.00 0.00 0.00 0.00 60.65 59.73 2pbl s ILE 13 Cb 0.12 -2.02 -0.08 0.00 0.01 0.00 0.00 42.46 40.49 2pbl s ILE 13 CO 0.15 0.52 1.38 -1.83 0.00 0.00 0.00 174.94 175.15 2pbl s GLU 14 N 1.12 4.33 -0.28 2.79 -1.05 -1.26 -2.08 118.70 122.27 2pbl s GLU 14 Ca 0.01 2.09 0.00 0.00 -0.15 0.00 0.00 54.97 56.92 2pbl s GLU 14 Cb -0.14 -3.22 0.00 0.00 -0.44 0.00 0.00 34.13 30.33 2pbl s GLU 14 CO -0.07 -0.39 0.00 0.41 0.95 0.00 0.00 175.26 176.16 2pbl n GLY 15 N 3.14 0.59 0.31 -3.83 0.00 -1.26 -4.93 105.19 99.20 2pbl n GLY 15 Ca 0.10 -0.73 0.11 0.00 0.00 0.00 0.00 46.02 45.50 2pbl n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pbl h ALA 16 N 0.00 1.34 -0.01 4.61 0.00 -1.68 -0.48 119.26 123.04 2pbl h ALA 16 Ca -0.05 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2pbl h ALA 16 Cb 0.21 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2pbl h ALA 16 CO 0.08 -0.31 0.01 0.00 0.00 0.00 0.00 179.25 179.03 2pbl h ALA 17 N 1.67 1.69 0.00 0.00 0.00 -1.91 -2.34 119.26 118.38 2pbl h ALA 17 Ca 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.43 2pbl h ALA 17 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2pbl h ALA 17 CO -0.50 -0.02 -0.32 -0.44 0.00 0.00 0.00 179.25 177.97 2pbl h ASP 18 N 0.00 0.00 0.18 0.00 3.32 -1.48 -3.39 116.42 115.05 2pbl h ASP 18 Ca 0.01 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 2pbl h ASP 18 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 2pbl h ASP 18 CO -0.00 0.02 -0.09 1.88 -1.72 0.00 0.00 179.24 179.33 2pbl h TYR 19 N 0.00 -0.23 -0.30 4.55 -1.99 -1.46 -2.88 116.97 114.67 2pbl h TYR 19 Ca 0.00 -0.01 0.07 0.00 2.00 0.00 0.00 58.73 60.79 2pbl h TYR 19 Cb 0.89 0.07 -0.07 0.00 2.00 0.00 0.00 36.73 39.63 2pbl h TYR 19 CO 0.00 -0.09 -0.14 -1.35 -0.00 0.00 0.00 178.16 176.59 2pbl h PRO 20 N -0.31 -0.09 -0.58 4.88 0.11 -1.77 0.55 132.00 134.79 2pbl h PRO 20 Ca -0.02 0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.04 2pbl h PRO 20 Cb 0.24 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.35 2pbl h PRO 20 CO 0.04 -0.06 0.17 -1.00 -0.21 0.00 0.00 178.00 176.94 2pbl h PRO 21 N -0.09 0.87 -0.15 1.05 0.13 -1.80 -2.00 132.00 130.01 2pbl h PRO 21 Ca 0.15 -0.17 -0.16 0.00 -0.87 0.00 0.00 66.00 64.95 2pbl h PRO 21 Cb 0.32 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.31 2pbl h PRO 21 CO -0.36 0.76 -0.58 0.00 -0.23 0.00 0.00 178.00 177.60 2pbl h ARG 22 N 0.85 0.49 -0.25 0.86 3.08 -1.21 -1.25 114.38 116.95 2pbl h ARG 22 Ca 0.19 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 2pbl h ARG 22 Cb 0.26 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 2pbl h ARG 22 CO -0.01 0.93 0.10 -1.49 -1.07 0.00 0.00 179.97 178.44 2pbl h TRP 23 N 0.37 0.37 -0.46 3.04 6.55 -0.77 0.08 115.95 125.13 2pbl h TRP 23 Ca 0.00 -0.03 0.01 0.00 0.95 0.00 0.00 58.89 59.83 2pbl h TRP 23 Cb 1.12 -0.11 -0.03 0.00 -0.86 0.00 0.00 29.16 29.28 2pbl h TRP 23 CO 0.04 0.39 0.29 0.00 -1.05 0.00 0.00 178.44 178.10 2pbl h ALA 24 N 0.95 0.59 -0.21 1.49 0.00 -1.24 0.25 119.26 121.08 2pbl h ALA 24 Ca 0.08 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2pbl h ALA 24 Cb 0.17 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2pbl h ALA 24 CO -0.01 -0.01 0.02 0.00 0.00 0.00 0.00 179.25 179.25 2pbl h ALA 25 N 1.19 0.28 -0.76 0.00 0.00 -1.16 -1.74 119.26 117.06 2pbl h ALA 25 Ca 0.18 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2pbl h ALA 25 Cb -0.02 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 2pbl h ALA 25 CO -0.07 -0.03 0.50 0.77 0.00 0.00 0.00 179.25 180.43 2pbl h SER 26 N 0.14 0.86 -0.25 0.00 0.02 -0.69 -1.55 113.55 112.07 2pbl h SER 26 Ca 0.06 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.96 2pbl h SER 26 Cb 0.35 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 2pbl h SER 26 CO 0.01 0.62 0.04 0.00 -1.14 0.00 0.00 176.83 176.36 2pbl h ALA 27 N 1.28 0.33 -0.17 3.77 0.00 -0.47 -1.94 119.26 122.07 2pbl h ALA 27 Ca 0.28 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.03 2pbl h ALA 27 Cb -0.10 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2pbl h ALA 27 CO -0.07 0.01 0.02 1.49 0.00 0.00 0.00 179.25 180.71 2pbl h GLU 28 N 0.23 0.08 -0.74 0.00 4.81 -1.20 -0.42 114.58 117.34 2pbl h GLU 28 Ca 0.08 -0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.36 2pbl h GLU 28 Cb 0.33 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.63 2pbl h GLU 28 CO 0.00 0.05 0.44 -0.44 -0.73 0.00 0.00 179.01 178.34 2pbl h ASP 29 N 0.09 0.69 -0.24 1.04 5.19 -1.23 -1.48 116.42 120.48 2pbl h ASP 29 Ca 0.08 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.50 2pbl h ASP 29 Cb 0.08 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 39.46 2pbl h ASP 29 CO -0.11 0.45 0.13 0.15 -3.12 0.00 0.00 179.24 176.74 2pbl h PHE 30 N 0.82 0.32 -0.23 4.55 3.57 -0.93 -1.08 116.94 123.97 2pbl h PHE 30 Ca 0.32 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.83 2pbl h PHE 30 Cb 0.15 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 2pbl h PHE 30 CO -0.05 0.27 0.12 0.00 -2.23 0.00 0.00 178.31 176.42 2pbl h ARG 31 N 0.28 0.25 -0.56 1.11 3.08 -0.58 -2.04 114.38 115.92 2pbl h ARG 31 Ca 0.08 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.16 2pbl h ARG 31 Cb 0.06 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 2pbl h ARG 31 CO -0.01 0.17 0.37 -0.91 -1.07 0.00 0.00 179.97 178.52 2pbl h ASN 32 N 0.26 0.53 0.65 7.04 2.35 -1.17 -1.99 115.58 123.25 2pbl h ASN 32 Ca 0.09 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.79 2pbl h ASN 32 Cb 0.01 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2pbl h ASN 32 CO -0.06 0.36 -0.23 0.77 -1.65 0.00 0.00 177.43 176.62 2pbl h SER 33 N 0.61 0.00 1.05 5.81 4.64 -0.48 -3.21 113.55 121.97 2pbl h SER 33 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2pbl h SER 33 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2pbl h SER 33 CO -0.06 0.23 -0.58 0.25 -0.87 0.00 0.00 176.83 175.80 2pbl h LEU 34 N 0.00 0.00 0.00 5.97 5.85 -1.03 -3.49 115.31 122.61 2pbl h LEU 34 Ca -0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2pbl h LEU 34 Cb 0.61 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.64 2pbl h LEU 34 CO 0.03 0.07 0.00 0.00 -0.34 0.00 0.00 178.44 178.20 2pbl n GLN 35 N -2.31 0.00 0.00 1.25 1.13 -1.21 -2.12 117.38 114.11 2pbl n GLN 35 Ca 0.03 0.00 0.13 0.00 -1.94 0.00 0.00 57.00 55.22 2pbl n GLN 35 Cb 0.47 0.00 0.77 0.00 0.11 0.00 0.00 30.24 31.59 2pbl n GLN 35 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2pbl n ASP 36 N 3.10 0.00 0.00 1.08 10.43 -1.26 -2.08 116.55 127.82 2pbl n ASP 36 Ca 0.00 -0.66 0.13 0.00 2.57 0.00 0.00 54.79 56.83 2pbl n ASP 36 Cb 0.00 -0.07 0.63 0.00 1.84 0.00 0.00 41.12 43.52 2pbl n ASP 36 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2pbl n ARG 37 N -1.07 0.24 -3.33 -1.24 1.74 -0.90 -4.51 116.66 107.58 2pbl n ARG 37 Ca 0.18 0.04 -0.44 0.00 -0.77 0.00 0.00 57.85 56.87 2pbl n ARG 37 Cb 0.12 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 29.98 2pbl n ARG 37 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2pbl s ALA 38 N -2.73 3.48 -0.81 7.54 0.00 -0.88 -0.56 121.76 127.79 2pbl s ALA 38 Ca 0.21 -1.83 -0.16 0.00 0.00 0.00 0.00 51.96 50.17 2pbl s ALA 38 Cb 0.18 -3.10 0.17 0.00 0.00 0.00 0.00 23.12 20.36 2pbl s ALA 38 CO 0.44 -1.71 0.87 1.03 0.00 0.00 0.00 175.76 176.38 2pbl s ARG 39 N 1.98 3.48 0.38 0.00 0.52 0.12 -4.95 118.95 120.48 2pbl s ARG 39 Ca 0.08 -2.01 -0.11 0.00 -0.52 0.00 0.00 55.73 53.18 2pbl s ARG 39 Cb -0.21 -4.56 -0.07 0.00 0.52 0.00 0.00 34.95 30.64 2pbl s ARG 39 CO 0.10 -1.49 0.75 -0.51 0.02 0.00 0.00 175.30 174.17 2pbl s LEU 40 N 1.48 3.89 -1.50 2.53 1.43 -1.26 -1.13 118.68 124.11 2pbl s LEU 40 Ca 0.21 1.15 -0.11 0.00 -1.03 0.00 0.00 54.13 54.34 2pbl s LEU 40 Cb -0.12 -4.01 0.07 0.00 0.03 0.00 0.00 46.19 42.17 2pbl s LEU 40 CO -0.06 -0.35 0.89 0.59 0.23 0.00 0.00 176.35 177.65 2pbl n ASN 41 N -1.09 -3.83 -4.76 2.29 3.02 -1.12 -4.93 115.26 104.84 2pbl n ASN 41 Ca 0.02 -0.82 -0.39 0.00 -0.03 0.00 0.00 54.58 53.36 2pbl n ASN 41 Cb 0.54 -3.77 -0.04 0.00 -0.61 0.00 0.00 39.78 35.89 2pbl n ASN 41 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2pbl s LEU 42 N -7.17 4.46 0.11 3.41 1.43 0.71 -4.78 118.68 116.87 2pbl s LEU 42 Ca 0.52 2.23 -0.21 0.00 -1.03 0.00 0.00 54.13 55.64 2pbl s LEU 42 Cb -0.27 -3.75 -0.07 0.00 0.03 0.00 0.00 46.19 42.13 2pbl s LEU 42 CO 0.84 -0.22 0.65 -0.44 0.23 0.00 0.00 176.35 177.40 2pbl s SER 43 N -1.02 7.17 0.00 2.29 0.01 -1.26 -0.27 113.70 120.61 2pbl s SER 43 Ca 0.47 1.40 0.03 0.00 1.31 0.00 0.00 55.95 59.16 2pbl s SER 43 Cb -0.30 -2.41 -0.01 0.00 0.21 0.00 0.00 66.02 63.52 2pbl s SER 43 CO 0.38 0.24 0.34 0.00 0.41 0.00 0.00 173.24 174.61 2pbl n TYR 44 N 1.60 0.00 -3.81 2.43 0.18 0.59 -4.90 117.16 113.24 2pbl n TYR 44 Ca -0.08 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.61 2pbl n TYR 44 Cb 0.50 0.00 0.03 0.00 -0.38 0.00 0.00 39.34 39.49 2pbl n TYR 44 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 2pbl s GLY 45 N -0.83 0.39 0.22 -7.48 0.00 -1.09 -4.80 107.32 93.74 2pbl s GLY 45 Ca 0.02 -0.77 0.18 0.00 0.00 0.00 0.00 44.72 44.15 2pbl s GLY 45 CO 0.09 -0.23 1.22 0.83 0.00 0.00 0.00 173.10 175.00 2pbl h GLU 46 N 2.00 0.00 -7.23 2.90 4.39 -1.98 -3.44 114.58 111.21 2pbl h GLU 46 Ca -0.33 0.00 -0.52 0.00 0.34 0.00 0.00 59.36 58.86 2pbl h GLU 46 Cb 1.25 0.00 0.13 0.00 -0.10 0.00 0.00 28.75 30.03 2pbl h GLU 46 CO 0.42 0.30 0.35 0.20 -1.16 0.00 0.00 179.01 179.11 2pbl s GLY 47 N -4.51 2.02 0.42 -3.84 0.00 -1.26 -4.92 107.32 95.23 2pbl s GLY 47 Ca 0.02 0.53 0.12 0.00 0.00 0.00 0.00 44.72 45.39 2pbl s GLY 47 CO 0.76 0.90 1.98 -0.55 0.00 0.00 0.00 173.10 176.19 2pbl h ASP 48 N -0.50 0.43 -0.73 1.64 3.32 -2.04 -1.71 116.42 116.83 2pbl h ASP 48 Ca -0.46 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2pbl h ASP 48 Cb 1.25 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2pbl h ASP 48 CO 0.51 0.26 0.00 0.54 -1.72 0.00 0.00 179.24 178.84 2pbl n ARG 49 N -4.48 2.93 -1.90 3.56 1.74 -1.26 -4.58 116.66 112.68 2pbl n ARG 49 Ca 0.10 -2.71 -0.40 0.00 -0.77 0.00 0.00 57.85 54.06 2pbl n ARG 49 Cb 0.34 -1.64 -0.01 0.00 -1.02 0.00 0.00 32.46 30.13 2pbl n ARG 49 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2pbl n HIS 50 N 1.57 2.59 -4.20 -1.55 8.25 -0.65 -2.82 115.22 118.41 2pbl n HIS 50 Ca 0.25 -2.87 -0.15 0.00 -0.26 0.00 0.00 57.72 54.69 2pbl n HIS 50 Cb 0.68 -1.95 -0.11 0.00 1.12 0.00 0.00 29.99 29.74 2pbl n HIS 50 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2pbl s LYS 51 N -0.54 0.93 0.03 -0.41 -0.14 -1.26 -0.30 119.74 118.04 2pbl s LYS 51 Ca 0.56 -1.22 -0.02 0.00 -1.36 0.00 0.00 55.97 53.92 2pbl s LYS 51 Cb 0.18 -0.65 -0.02 0.00 -1.68 0.00 0.00 37.83 35.66 2pbl s LYS 51 CO -0.09 0.11 0.01 -0.59 -0.76 0.00 0.00 175.35 174.03 2pbl s PHE 52 N -2.49 0.28 -0.11 3.18 -0.71 0.62 -1.20 117.98 117.55 2pbl s PHE 52 Ca 0.08 -0.59 -0.06 0.00 -1.04 0.00 0.00 56.93 55.31 2pbl s PHE 52 Cb -0.03 -0.21 -0.04 0.00 -1.21 0.00 0.00 43.02 41.54 2pbl s PHE 52 CO 0.01 -0.27 0.14 -0.51 -1.34 0.00 0.00 175.22 173.24 2pbl s ASP 53 N -1.88 6.33 -0.19 1.98 1.01 -1.26 -0.20 116.67 122.46 2pbl s ASP 53 Ca -0.09 0.45 0.01 0.00 0.71 0.00 0.00 52.55 53.62 2pbl s ASP 53 Cb -0.04 -2.04 0.04 0.00 1.01 0.00 0.00 42.92 41.89 2pbl s ASP 53 CO -0.03 0.40 -0.10 -0.22 0.21 0.00 0.00 175.17 175.43 2pbl s LEU 54 N -1.08 2.19 -0.24 1.23 2.96 -0.29 -4.20 118.68 119.26 2pbl s LEU 54 Ca 0.16 -0.84 -0.08 0.00 -0.22 0.00 0.00 54.13 53.14 2pbl s LEU 54 Cb -0.12 -1.21 -0.04 0.00 0.50 0.00 0.00 46.19 45.32 2pbl s LEU 54 CO 0.05 -0.14 0.10 -0.36 -1.32 0.00 0.00 176.35 174.68 2pbl s PHE 55 N 1.42 3.18 -0.08 5.38 0.08 -0.19 0.16 117.98 127.94 2pbl s PHE 55 Ca -0.01 -0.10 -0.04 0.00 0.12 0.00 0.00 56.93 56.91 2pbl s PHE 55 Cb -0.16 -2.23 -0.04 0.00 -0.57 0.00 0.00 43.02 40.02 2pbl s PHE 55 CO -0.08 -0.13 0.11 -0.51 -0.10 0.00 0.00 175.22 174.51 2pbl s LEU 56 N 1.24 4.13 0.96 -0.37 1.43 0.27 -0.46 118.68 125.90 2pbl s LEU 56 Ca 0.06 0.33 -0.15 0.00 -1.03 0.00 0.00 54.13 53.33 2pbl s LEU 56 Cb -0.14 -2.13 0.18 0.00 0.03 0.00 0.00 46.19 44.12 2pbl s LEU 56 CO 0.05 0.36 1.25 -2.16 0.23 0.00 0.00 176.35 176.07 2pbl s PRO 57 N -1.26 0.68 0.07 1.29 0.04 -1.26 -4.84 135.00 129.72 2pbl s PRO 57 Ca 0.18 -0.18 -0.16 0.00 0.04 0.00 0.00 61.00 60.87 2pbl s PRO 57 Cb -0.12 -1.83 -0.12 0.00 0.04 0.00 0.00 34.50 32.47 2pbl s PRO 57 CO 0.08 -2.42 1.35 0.93 0.04 0.00 0.00 177.00 176.98 2pbl h GLU 58 N -1.65 0.60 0.00 4.56 5.08 -1.95 -3.46 114.58 117.76 2pbl h GLU 58 Ca -0.45 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 57.55 2pbl h GLU 58 Cb 1.27 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2pbl h GLU 58 CO 0.45 0.97 0.00 0.41 -1.00 0.00 0.00 179.01 179.84 2pbl n GLY 59 N 0.32 0.74 3.68 -3.84 0.00 -1.26 -5.01 105.19 99.82 2pbl n GLY 59 Ca -0.05 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 2pbl n GLY 59 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2pbl s THR 60 N 0.81 2.98 0.35 2.61 2.01 -1.26 -4.93 115.64 118.20 2pbl s THR 60 Ca 0.00 0.34 -0.29 0.00 0.31 0.00 0.00 61.69 62.05 2pbl s THR 60 Cb 0.00 -3.22 -0.11 0.00 0.01 0.00 0.00 72.50 69.18 2pbl s THR 60 CO 0.00 -0.01 1.54 -2.65 -0.69 0.00 0.00 174.62 172.81 2pbl n PRO 61 N 6.10 2.72 0.00 4.92 -0.02 -1.26 -4.87 135.00 142.59 2pbl n PRO 61 Ca 0.17 0.96 0.13 0.00 -2.02 0.00 0.00 63.50 62.74 2pbl n PRO 61 Cb 0.40 -2.71 0.61 0.00 -0.02 0.00 0.00 33.50 31.78 2pbl n PRO 61 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2pbl n VAL 62 N 1.06 0.11 -2.42 -1.45 0.24 0.84 -4.95 118.33 111.75 2pbl n VAL 62 Ca 0.04 0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.36 2pbl n VAL 62 Cb 0.38 -0.56 0.00 0.00 -1.47 0.00 0.00 33.84 32.19 2pbl n VAL 62 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2pbl n GLY 63 N 1.28 -1.97 3.29 7.63 0.00 -1.26 -4.35 105.19 109.80 2pbl n GLY 63 Ca 0.08 -1.25 -0.32 0.00 0.00 0.00 0.00 46.02 44.52 2pbl n GLY 63 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2pbl s LEU 64 N 0.00 2.33 -0.19 0.99 2.96 -0.09 -0.85 118.68 123.84 2pbl s LEU 64 Ca 0.00 -0.46 -0.00 0.00 -0.22 0.00 0.00 54.13 53.45 2pbl s LEU 64 Cb 0.00 -1.48 0.01 0.00 0.50 0.00 0.00 46.19 45.22 2pbl s LEU 64 CO 0.00 0.18 -0.16 0.12 -1.32 0.00 0.00 176.35 175.17 2pbl s PHE 65 N 0.24 2.82 -0.20 5.38 5.36 -0.07 -0.44 117.98 131.06 2pbl s PHE 65 Ca -0.13 -1.40 -0.07 0.00 -0.96 0.00 0.00 56.93 54.37 2pbl s PHE 65 Cb -0.17 -1.96 -0.04 0.00 -0.34 0.00 0.00 43.02 40.52 2pbl s PHE 65 CO 0.07 -0.70 0.06 0.08 -1.46 0.00 0.00 175.22 173.27 2pbl s VAL 66 N 1.27 4.60 -0.18 3.12 1.01 0.29 -0.40 120.40 130.11 2pbl s VAL 66 Ca 0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 61.98 61.89 2pbl s VAL 66 Cb -0.14 -3.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.13 2pbl s VAL 66 CO -0.09 0.42 -0.05 0.12 0.00 0.00 0.00 175.10 175.50 2pbl s PHE 67 N 0.75 2.96 -0.22 5.22 5.36 0.16 -1.12 117.98 131.09 2pbl s PHE 67 Ca 0.03 -0.57 -0.04 0.00 -0.96 0.00 0.00 56.93 55.39 2pbl s PHE 67 Cb -0.13 -2.00 -0.01 0.00 -0.34 0.00 0.00 43.02 40.54 2pbl s PHE 67 CO 0.02 -0.25 -0.04 0.08 -1.46 0.00 0.00 175.22 173.57 2pbl s VAL 68 N 0.78 3.42 0.68 3.12 1.01 -0.07 -3.93 120.40 125.41 2pbl s VAL 68 Ca -0.02 -0.48 -0.11 0.00 0.00 0.00 0.00 61.98 61.37 2pbl s VAL 68 Cb -0.15 -2.56 -0.00 0.00 0.00 0.00 0.00 36.38 33.67 2pbl s VAL 68 CO 0.02 0.42 1.05 -1.38 0.00 0.00 0.00 175.10 175.21 2pbl s HIS 69 N 1.46 3.25 0.00 5.22 -3.43 -1.26 -1.45 115.29 119.08 2pbl s HIS 69 Ca 0.06 1.37 0.00 0.00 -0.80 0.00 0.00 55.06 55.68 2pbl s HIS 69 Cb -0.14 -2.85 0.00 0.00 -1.43 0.00 0.00 32.58 28.16 2pbl s HIS 69 CO -0.03 -1.10 0.00 0.41 -2.00 0.00 0.00 174.74 172.02 2pbl n GLY 70 N -2.23 2.89 0.00 -1.38 0.00 -1.09 -3.23 105.19 100.15 2pbl n GLY 70 Ca 0.07 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 44.03 2pbl n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pbl n GLY 71 N 5.00 1.68 3.35 -0.02 0.00 -1.26 -4.66 105.19 109.27 2pbl n GLY 71 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2pbl n GLY 71 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2pbl n TYR 72 N 0.00 -2.14 -3.57 1.61 4.01 -1.26 -2.53 117.16 113.28 2pbl n TYR 72 Ca 0.00 0.66 -0.20 0.00 -0.16 0.00 0.00 57.90 58.20 2pbl n TYR 72 Cb 0.00 -4.14 0.06 0.00 -0.31 0.00 0.00 39.34 34.96 2pbl n TYR 72 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 2pbl n TRP 73 N -4.49 -2.14 -0.05 -0.72 8.01 -1.26 -4.92 117.44 111.87 2pbl n TRP 73 Ca -0.04 0.91 -0.02 0.00 -1.31 0.00 0.00 57.50 57.03 2pbl n TRP 73 Cb 0.58 -4.76 0.00 0.00 -2.01 0.00 0.00 31.31 25.11 2pbl n TRP 73 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2pbl n ALA 75 N -4.27 -1.41 -0.68 6.99 0.00 -1.05 -0.30 120.51 119.78 2pbl n ALA 75 Ca -0.26 -0.06 0.08 0.00 0.00 0.00 0.00 53.44 53.21 2pbl n ALA 75 Cb 0.66 -0.05 -0.04 0.00 0.00 0.00 0.00 19.45 20.02 2pbl n ALA 75 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2pbl n PHE 76 N -0.16 -1.82 -4.14 0.00 3.72 -1.26 -4.43 117.46 109.37 2pbl n PHE 76 Ca -0.00 0.99 -0.10 0.00 -0.05 0.00 0.00 57.45 58.28 2pbl n PHE 76 Cb 0.03 -1.65 -0.04 0.00 -0.94 0.00 0.00 39.48 36.88 2pbl n PHE 76 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2pbl n ASP 77 N -3.19 -0.39 0.30 4.37 5.68 -1.26 -4.95 116.55 117.11 2pbl n ASP 77 Ca -0.04 -2.16 0.17 0.00 -0.50 0.00 0.00 54.79 52.26 2pbl n ASP 77 Cb 0.32 0.90 0.94 0.00 -1.14 0.00 0.00 41.12 42.15 2pbl n ASP 77 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2pbl h LYS 78 N 0.00 0.00 0.00 0.11 2.10 -1.95 -3.20 116.57 113.63 2pbl h LYS 78 Ca -0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.53 2pbl h LYS 78 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 2pbl h LYS 78 CO 0.18 0.03 0.00 0.43 -2.00 0.00 0.00 179.45 178.10 2pbl n SER 79 N -3.47 0.26 -0.41 7.07 7.64 -1.26 -2.69 113.62 120.77 2pbl n SER 79 Ca -0.02 0.56 0.11 0.00 1.01 0.00 0.00 58.87 60.53 2pbl n SER 79 Cb 0.14 -0.62 0.47 0.00 -1.01 0.00 0.00 64.21 63.20 2pbl n SER 79 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2pbl n SER 80 N -1.79 1.25 0.00 6.43 7.64 -1.21 -4.50 113.62 121.44 2pbl n SER 80 Ca 0.03 -1.57 0.00 0.00 1.01 0.00 0.00 58.87 58.34 2pbl n SER 80 Cb 0.21 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 2pbl n SER 80 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 2pbl n TRP 81 N 0.03 0.00 -0.29 1.43 7.02 -1.09 -4.23 117.44 120.31 2pbl n TRP 81 Ca 0.17 -0.05 0.06 0.00 -1.02 0.00 0.00 57.50 56.65 2pbl n TRP 81 Cb 0.28 -0.01 0.20 0.00 -2.42 0.00 0.00 31.31 29.36 2pbl n TRP 81 CO 0.00 0.00 0.00 0.77 -2.02 0.00 0.00 177.69 176.44 2pbl h SER 82 N 0.00 0.53 0.00 -0.99 0.02 -1.79 -1.13 113.55 110.19 2pbl h SER 82 Ca 0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2pbl h SER 82 Cb 0.44 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.97 2pbl h SER 82 CO 0.00 0.25 0.05 1.12 -1.14 0.00 0.00 176.83 177.10 2pbl h HIS 83 N 0.64 0.00 0.00 3.45 2.07 -1.80 0.26 115.15 119.78 2pbl h HIS 83 Ca 0.44 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.96 2pbl h HIS 83 Cb 0.57 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.55 2pbl h HIS 83 CO -0.09 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 176.05 2pbl n LEU 84 N -2.79 0.00 0.11 6.12 4.77 -0.43 -2.96 117.00 121.83 2pbl n LEU 84 Ca -0.02 0.23 0.13 0.00 -0.03 0.00 0.00 56.01 56.31 2pbl n LEU 84 Cb 0.10 -0.23 0.43 0.00 -2.33 0.00 0.00 43.42 41.39 2pbl n LEU 84 CO 0.16 -0.06 0.88 0.00 -1.33 0.00 0.00 177.39 177.04 2pbl n ALA 85 N -1.23 2.13 -0.03 -1.18 0.00 0.08 -4.23 120.51 116.05 2pbl n ALA 85 Ca 0.12 0.01 -0.09 0.00 0.00 0.00 0.00 53.44 53.48 2pbl n ALA 85 Cb 0.16 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.13 2pbl n ALA 85 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2pbl h VAL 86 N 0.00 0.74 -0.29 0.00 2.07 -1.71 -1.11 116.25 115.95 2pbl h VAL 86 Ca 0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 2pbl h VAL 86 Cb 0.65 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 2pbl h VAL 86 CO 0.00 0.00 0.18 1.23 0.02 0.00 0.00 177.57 179.00 2pbl h GLY 87 N -0.05 0.41 1.11 2.17 0.00 -1.43 -1.18 103.07 104.09 2pbl h GLY 87 Ca 0.10 -0.17 -0.15 0.00 0.00 0.00 0.00 47.33 47.12 2pbl h GLY 87 CO -0.22 0.16 -0.31 0.00 0.00 0.00 0.00 176.54 176.17 2pbl h ALA 88 N 1.08 0.60 -0.79 3.60 0.00 -1.73 -2.92 119.26 119.10 2pbl h ALA 88 Ca 0.10 -0.42 0.09 0.00 0.00 0.00 0.00 54.91 54.68 2pbl h ALA 88 Cb -0.00 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.58 2pbl h ALA 88 CO -0.02 0.65 0.44 -0.07 0.00 0.00 0.00 179.25 180.25 2pbl h LEU 89 N 0.77 0.62 -1.94 0.00 3.38 -0.94 -1.56 115.31 115.64 2pbl h LEU 89 Ca 0.08 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 2pbl h LEU 89 Cb 0.90 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 2pbl h LEU 89 CO 0.08 0.35 -0.11 0.77 0.09 0.00 0.00 178.44 179.63 2pbl h SER 90 N 0.74 0.00 -0.05 -0.43 4.64 -1.03 -1.02 113.55 116.40 2pbl h SER 90 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 2pbl h SER 90 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2pbl h SER 90 CO -0.25 0.11 0.00 0.29 -0.87 0.00 0.00 176.83 176.11 2pbl n LYS 91 N -3.61 1.68 -0.21 4.77 5.02 -0.65 -4.94 118.16 120.22 2pbl n LYS 91 Ca -0.02 -0.99 0.00 0.00 -2.02 0.00 0.00 58.31 55.28 2pbl n LYS 91 Cb 0.23 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 2pbl n LYS 91 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2pbl n GLY 92 N 1.16 0.89 3.82 0.72 0.00 -0.38 -4.86 105.19 106.54 2pbl n GLY 92 Ca 0.18 -0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 2pbl n GLY 92 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2pbl s TRP 93 N -2.00 3.73 0.43 1.61 0.52 -0.83 -0.11 118.94 122.27 2pbl s TRP 93 Ca 0.00 1.20 -0.21 0.00 0.02 0.00 0.00 56.10 57.11 2pbl s TRP 93 Cb 0.00 -2.46 -0.11 0.00 -1.15 0.00 0.00 33.47 29.75 2pbl s TRP 93 CO 0.00 0.52 0.95 0.00 0.02 0.00 0.00 176.95 178.44 2pbl s ALA 94 N -1.26 3.04 -0.10 0.98 0.00 -0.03 -3.93 121.76 120.46 2pbl s ALA 94 Ca 0.33 0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.70 2pbl s ALA 94 Cb -0.18 -3.15 0.02 0.00 0.00 0.00 0.00 23.12 19.81 2pbl s ALA 94 CO 0.19 0.13 -0.10 0.08 0.00 0.00 0.00 175.76 176.06 2pbl s VAL 95 N -2.16 1.14 0.00 0.00 1.01 0.39 -0.90 120.40 119.90 2pbl s VAL 95 Ca 0.62 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.20 2pbl s VAL 95 Cb -0.09 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.17 2pbl s VAL 95 CO 0.13 0.38 0.00 0.00 0.00 0.00 0.00 175.10 175.61 2pbl n ALA 96 N 4.59 0.00 -2.76 5.51 0.00 0.46 -1.02 120.51 127.30 2pbl n ALA 96 Ca -0.16 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.18 2pbl n ALA 96 Cb 0.50 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.89 2pbl n ALA 96 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2pbl s PRO 98 N -1.89 0.88 0.55 0.00 0.04 -1.25 -0.67 135.00 132.66 2pbl s PRO 98 Ca 0.00 -0.80 0.08 0.00 0.04 0.00 0.00 61.00 60.32 2pbl s PRO 98 Cb 0.00 0.37 0.07 0.00 0.04 0.00 0.00 34.50 34.98 2pbl s PRO 98 CO 0.00 -0.30 0.75 -1.12 0.04 0.00 0.00 177.00 176.37 2pbl s SER 99 N -2.66 5.19 -0.03 6.66 0.01 -0.34 -4.40 113.70 118.12 2pbl s SER 99 Ca 0.02 -0.63 -0.29 0.00 1.31 0.00 0.00 55.95 56.36 2pbl s SER 99 Cb 0.03 -0.06 0.10 0.00 0.21 0.00 0.00 66.02 66.29 2pbl s SER 99 CO -0.10 -1.22 0.83 -0.72 0.41 0.00 0.00 173.24 172.44 2pbl s TYR 100 N -2.63 -0.45 0.74 2.43 -0.85 -1.13 -4.47 117.35 111.00 2pbl s TYR 100 Ca 0.60 0.53 -0.13 0.00 -0.52 0.00 0.00 57.07 57.55 2pbl s TYR 100 Cb -0.07 0.49 0.05 0.00 0.38 0.00 0.00 41.96 42.81 2pbl s TYR 100 CO 0.38 -0.55 1.13 -1.21 -1.52 0.00 0.00 175.55 173.78 2pbl s GLU 101 N -2.28 2.23 0.21 -3.49 2.02 -1.26 -4.96 118.70 111.17 2pbl s GLU 101 Ca -0.01 1.45 0.10 0.00 0.02 0.00 0.00 54.97 56.53 2pbl s GLU 101 Cb -0.01 -1.87 -0.04 0.00 0.10 0.00 0.00 34.13 32.30 2pbl s GLU 101 CO -0.03 -1.70 -0.15 -0.51 0.02 0.00 0.00 175.26 172.89 2pbl s LEU 102 N -5.47 2.74 0.44 1.80 1.43 -1.26 -4.84 118.68 113.53 2pbl s LEU 102 Ca 0.67 -0.76 -0.23 0.00 -1.03 0.00 0.00 54.13 52.78 2pbl s LEU 102 Cb -0.22 -1.40 -0.08 0.00 0.03 0.00 0.00 46.19 44.52 2pbl s LEU 102 CO 0.49 0.09 1.09 0.00 0.23 0.00 0.00 176.35 178.25 2pbl n PRO 104 N -0.44 1.87 -0.21 0.00 -0.04 -1.26 -4.85 135.00 130.07 2pbl n PRO 104 Ca 0.07 -1.32 -0.07 0.00 -0.04 0.00 0.00 63.50 62.14 2pbl n PRO 104 Cb 0.50 -1.39 0.03 0.00 -0.04 0.00 0.00 33.50 32.60 2pbl n PRO 104 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2pbl h GLU 105 N 2.51 0.86 -5.53 0.54 3.07 -1.66 -3.44 114.58 110.93 2pbl h GLU 105 Ca 0.00 -0.13 -0.64 0.00 -0.50 0.00 0.00 59.36 58.09 2pbl h GLU 105 Cb 0.56 -0.15 -0.13 0.00 -0.84 0.00 0.00 28.75 28.19 2pbl h GLU 105 CO 0.00 0.70 -0.56 0.14 -1.40 0.00 0.00 179.01 177.89 2pbl s VAL 106 N -5.68 1.75 0.24 3.13 -7.23 -0.88 -5.03 120.40 106.69 2pbl s VAL 106 Ca -0.13 -1.98 0.05 0.00 -1.81 0.00 0.00 61.98 58.12 2pbl s VAL 106 Cb 0.13 -2.72 -0.03 0.00 0.56 0.00 0.00 36.38 34.32 2pbl s VAL 106 CO 0.78 0.00 0.34 -0.13 -0.31 0.00 0.00 175.10 175.78 2pbl s ARG 107 N -3.78 3.38 0.24 4.82 0.52 -1.26 -4.02 118.95 118.85 2pbl s ARG 107 Ca 0.26 -0.79 -0.05 0.00 -0.52 0.00 0.00 55.73 54.63 2pbl s ARG 107 Cb 0.07 -2.85 0.38 0.00 0.52 0.00 0.00 34.95 33.06 2pbl s ARG 107 CO 0.14 0.43 1.82 0.82 0.02 0.00 0.00 175.30 178.52 2pbl h ILE 108 N 1.21 0.94 -0.50 1.52 2.04 -1.95 -1.13 117.51 119.64 2pbl h ILE 108 Ca -0.52 -0.28 0.05 0.00 1.00 0.00 0.00 64.86 65.11 2pbl h ILE 108 Cb 1.23 0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 2pbl h ILE 108 CO 0.61 0.15 0.33 0.77 0.00 0.00 0.00 178.15 180.01 2pbl h SER 109 N 0.82 0.43 0.06 1.72 4.64 -1.95 -0.24 113.55 119.04 2pbl h SER 109 Ca 0.39 -0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.55 2pbl h SER 109 Cb 0.32 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 2pbl h SER 109 CO -0.23 0.29 -0.54 -0.33 -0.87 0.00 0.00 176.83 175.14 2pbl h GLU 110 N 0.49 0.52 -0.56 4.77 5.08 -1.64 -2.82 114.58 120.41 2pbl h GLU 110 Ca 0.21 -0.32 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 2pbl h GLU 110 Cb 0.22 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 2pbl h GLU 110 CO -0.06 0.93 0.26 0.82 -1.00 0.00 0.00 179.01 179.96 2pbl h ILE 111 N 0.40 1.21 -0.75 3.13 2.04 -0.15 -1.34 117.51 122.05 2pbl h ILE 111 Ca 0.01 -0.62 0.13 0.00 1.00 0.00 0.00 64.86 65.37 2pbl h ILE 111 Cb 1.08 0.57 -0.09 0.00 -0.74 0.00 0.00 36.82 37.64 2pbl h ILE 111 CO 0.10 0.25 0.33 0.74 0.00 0.00 0.00 178.15 179.57 2pbl h THR 112 N 0.77 0.73 -0.61 -0.27 2.02 -1.07 -0.21 112.91 114.26 2pbl h THR 112 Ca 0.19 -0.18 -0.09 0.00 0.77 0.00 0.00 66.41 67.11 2pbl h THR 112 Cb 0.15 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.70 2pbl h THR 112 CO -0.02 0.09 0.04 1.56 0.37 0.00 0.00 175.52 177.56 2pbl h GLN 113 N 0.51 1.06 -0.71 6.66 1.08 -1.19 -1.48 115.11 121.04 2pbl h GLN 113 Ca 0.40 -0.32 -0.03 0.00 -1.45 0.00 0.00 58.65 57.26 2pbl h GLN 113 Cb 0.55 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.84 2pbl h GLN 113 CO -0.35 1.01 0.34 1.96 -0.95 0.00 0.00 178.83 180.84 2pbl h GLN 114 N 0.96 1.03 -0.85 1.46 4.20 -0.49 -1.48 115.11 119.95 2pbl h GLN 114 Ca 0.18 -0.15 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 2pbl h GLN 114 Cb 0.51 -0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.06 2pbl h GLN 114 CO 0.02 0.81 0.42 0.82 -0.67 0.00 0.00 178.83 180.23 2pbl h ILE 115 N 1.00 1.26 -0.38 2.54 1.08 -0.75 0.10 117.51 122.36 2pbl h ILE 115 Ca 0.24 -0.70 0.00 0.00 -0.39 0.00 0.00 64.86 64.02 2pbl h ILE 115 Cb 0.12 0.16 -0.02 0.00 -3.07 0.00 0.00 36.82 34.01 2pbl h ILE 115 CO -0.03 0.30 0.25 -1.28 -0.69 0.00 0.00 178.15 176.70 2pbl h SER 116 N 1.20 0.43 -0.88 1.72 0.87 -0.81 0.43 113.55 116.51 2pbl h SER 116 Ca 0.29 -0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.86 2pbl h SER 116 Cb 0.09 -0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 61.90 2pbl h SER 116 CO -0.04 0.32 0.57 1.56 -0.53 0.00 0.00 176.83 178.71 2pbl h GLN 117 N 0.51 1.11 -0.11 2.24 1.08 -0.68 -1.71 115.11 117.55 2pbl h GLN 117 Ca 0.14 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.25 2pbl h GLN 117 Cb -0.05 -0.25 -0.00 0.00 -0.05 0.00 0.00 27.48 27.12 2pbl h GLN 117 CO -0.03 0.73 -0.01 0.00 -0.95 0.00 0.00 178.83 178.58 2pbl h ALA 118 N 1.34 0.15 -0.46 3.87 0.00 -0.21 -1.45 119.26 122.50 2pbl h ALA 118 Ca 0.34 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2pbl h ALA 118 Cb -0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2pbl h ALA 118 CO -0.10 -0.15 0.30 0.28 0.00 0.00 0.00 179.25 179.58 2pbl h VAL 119 N -0.09 1.13 -0.33 0.00 2.07 -0.90 -0.23 116.25 117.90 2pbl h VAL 119 Ca 0.03 -0.25 0.04 0.00 0.82 0.00 0.00 66.70 67.35 2pbl h VAL 119 Cb 0.38 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 2pbl h VAL 119 CO 0.01 0.12 0.09 0.74 0.02 0.00 0.00 177.57 178.55 2pbl h THR 120 N 0.62 0.87 -0.30 2.57 2.02 -1.24 0.84 112.91 118.29 2pbl h THR 120 Ca 0.17 -0.08 -0.02 0.00 0.77 0.00 0.00 66.41 67.25 2pbl h THR 120 Cb -0.05 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 2pbl h THR 120 CO -0.03 0.04 0.11 0.00 0.37 0.00 0.00 175.52 176.00 2pbl h ALA 121 N 1.23 0.39 -0.71 6.16 0.00 -0.93 -2.79 119.26 122.60 2pbl h ALA 121 Ca 0.15 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2pbl h ALA 121 Cb 0.15 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2pbl h ALA 121 CO -0.18 0.01 0.45 0.00 0.00 0.00 0.00 179.25 179.53 2pbl h ALA 122 N 0.95 1.45 0.00 0.00 0.00 -0.71 -2.05 119.26 118.89 2pbl h ALA 122 Ca 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2pbl h ALA 122 Cb 0.21 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2pbl h ALA 122 CO -0.01 0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.74 2pbl h ALA 123 N 1.52 1.00 0.00 0.00 0.00 -0.60 -0.91 119.26 120.27 2pbl h ALA 123 Ca 0.26 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 2pbl h ALA 123 Cb -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2pbl h ALA 123 CO -0.05 0.00 -0.51 0.87 0.00 0.00 0.00 179.25 179.56 2pbl h LYS 124 N 0.00 0.00 0.12 0.00 1.57 -1.12 -3.36 116.57 113.79 2pbl h LYS 124 Ca 0.00 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.49 2pbl h LYS 124 Cb 0.34 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 2pbl h LYS 124 CO 0.00 0.51 -1.42 0.93 -0.57 0.00 0.00 179.45 178.90 2pbl h GLU 125 N 0.00 0.26 -5.42 3.15 4.39 -1.06 -3.45 114.58 112.45 2pbl h GLU 125 Ca -0.01 -0.45 -0.68 0.00 0.34 0.00 0.00 59.36 58.57 2pbl h GLU 125 Cb 1.37 0.17 -0.33 0.00 -0.10 0.00 0.00 28.75 29.86 2pbl h GLU 125 CO 0.07 1.15 -0.88 0.42 -1.16 0.00 0.00 179.01 178.61 2pbl s ILE 126 N -2.63 2.07 0.43 3.13 -1.09 -0.94 -5.12 121.20 117.04 2pbl s ILE 126 Ca -0.07 -1.02 -0.06 0.00 -2.23 0.00 0.00 60.65 57.27 2pbl s ILE 126 Cb 0.07 -1.78 -0.04 0.00 -1.58 0.00 0.00 42.46 39.13 2pbl s ILE 126 CO 0.87 0.56 0.73 -1.81 -1.23 0.00 0.00 174.94 174.06 2pbl s ASP 127 N 0.28 6.34 0.00 3.58 1.01 -1.26 -4.66 116.67 121.95 2pbl s ASP 127 Ca -0.17 0.90 0.00 0.00 0.71 0.00 0.00 52.55 53.99 2pbl s ASP 127 Cb -0.17 -2.23 0.00 0.00 1.01 0.00 0.00 42.92 41.52 2pbl s ASP 127 CO 0.08 -0.47 0.00 0.61 0.21 0.00 0.00 175.17 175.60 2pbl n GLY 128 N -1.88 -0.67 3.72 0.21 0.00 -1.26 -4.13 105.19 101.18 2pbl n GLY 128 Ca 0.00 -2.23 -0.32 0.00 0.00 0.00 0.00 46.02 43.47 2pbl n GLY 128 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2pbl s PRO 129 N -0.33 1.92 -0.08 1.61 0.04 -1.26 -4.69 135.00 132.21 2pbl s PRO 129 Ca 0.00 1.53 0.04 0.00 0.04 0.00 0.00 61.00 62.61 2pbl s PRO 129 Cb 0.00 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.70 2pbl s PRO 129 CO 0.00 -1.96 -0.21 0.42 0.04 0.00 0.00 177.00 175.29 2pbl s ILE 130 N -2.42 2.35 0.00 0.56 1.01 -0.59 -0.91 121.20 121.20 2pbl s ILE 130 Ca 0.68 -0.95 0.07 0.00 0.00 0.00 0.00 60.65 60.45 2pbl s ILE 130 Cb -0.24 -1.89 -0.02 0.00 0.01 0.00 0.00 42.46 40.32 2pbl s ILE 130 CO 0.51 0.56 -0.21 0.68 0.00 0.00 0.00 174.94 176.48 2pbl s VAL 131 N -0.04 1.69 -0.06 2.92 -7.23 0.41 -0.12 120.40 117.97 2pbl s VAL 131 Ca -0.06 -0.99 0.06 0.00 -1.81 0.00 0.00 61.98 59.17 2pbl s VAL 131 Cb -0.15 -1.42 -0.01 0.00 0.56 0.00 0.00 36.38 35.37 2pbl s VAL 131 CO 0.05 0.41 -0.23 -0.76 -0.31 0.00 0.00 175.10 174.25 2pbl s LEU 132 N -0.68 2.03 0.04 1.32 1.43 -0.59 -0.55 118.68 121.67 2pbl s LEU 132 Ca 0.08 -0.48 -0.01 0.00 -1.03 0.00 0.00 54.13 52.70 2pbl s LEU 132 Cb -0.08 -1.28 -0.03 0.00 0.03 0.00 0.00 46.19 44.83 2pbl s LEU 132 CO -0.00 0.22 -0.03 0.00 0.23 0.00 0.00 176.35 176.77 2pbl s ALA 133 N -0.09 0.34 -0.18 4.21 0.00 -0.27 -0.71 121.76 125.06 2pbl s ALA 133 Ca -0.04 -0.94 -0.28 0.00 0.00 0.00 0.00 51.96 50.69 2pbl s ALA 133 Cb -0.13 0.22 0.10 0.00 0.00 0.00 0.00 23.12 23.31 2pbl s ALA 133 CO 0.04 -0.28 0.87 0.20 0.00 0.00 0.00 175.76 176.59 2pbl s GLY 134 N -2.30 -0.37 -0.20 0.00 0.00 -1.15 -0.89 107.32 102.41 2pbl s GLY 134 Ca -0.03 1.98 -0.05 0.00 0.00 0.00 0.00 44.72 46.63 2pbl s GLY 134 CO -0.06 1.32 0.00 -1.58 0.00 0.00 0.00 173.10 172.77 2pbl s HIS 135 N -0.58 3.04 0.00 1.90 2.46 -0.53 0.16 115.29 121.74 2pbl s HIS 135 Ca -0.03 -0.47 0.00 0.00 0.47 0.00 0.00 55.06 55.03 2pbl s HIS 135 Cb -0.02 -2.09 0.00 0.00 -0.13 0.00 0.00 32.58 30.34 2pbl s HIS 135 CO 0.02 -0.25 0.00 0.45 -2.47 0.00 0.00 174.74 172.49 2pbl n SER 136 N 4.28 0.00 -0.22 9.88 2.88 -0.00 -0.57 113.62 129.87 2pbl n SER 136 Ca -0.17 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.53 2pbl n SER 136 Cb 0.52 0.00 0.48 0.00 -0.75 0.00 0.00 64.21 64.46 2pbl n SER 136 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2pbl h ALA 137 N -0.64 2.10 0.00 -1.46 0.00 -1.85 0.13 119.26 117.54 2pbl h ALA 137 Ca 0.00 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2pbl h ALA 137 Cb 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2pbl h ALA 137 CO 0.00 -0.35 -0.39 0.78 0.00 0.00 0.00 179.25 179.29 2pbl h GLY 138 N 0.46 0.00 1.14 0.00 0.00 -0.81 -0.30 103.07 103.56 2pbl h GLY 138 Ca 0.43 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.57 2pbl h GLY 138 CO -0.16 0.00 -0.55 -1.33 0.00 0.00 0.00 176.54 174.50 2pbl h GLY 139 N 1.43 0.95 0.81 4.60 0.00 -0.57 -0.49 103.07 109.80 2pbl h GLY 139 Ca -0.00 -1.12 0.02 0.00 0.00 0.00 0.00 47.33 46.23 2pbl h GLY 139 CO 0.05 1.01 0.09 0.84 0.00 0.00 0.00 176.54 178.53 2pbl h HIS 140 N 0.65 0.17 -0.52 5.60 -0.00 -0.85 -2.26 115.15 117.93 2pbl h HIS 140 Ca 0.01 0.01 -0.10 0.00 -0.00 0.00 0.00 60.37 60.30 2pbl h HIS 140 Cb 1.16 -0.04 -0.02 0.00 -0.00 0.00 0.00 27.41 28.52 2pbl h HIS 140 CO 0.08 0.08 -0.06 -0.07 -0.00 0.00 0.00 177.93 177.95 2pbl h LEU 141 N 0.21 0.91 -0.88 0.26 3.38 -0.80 -2.12 115.31 116.27 2pbl h LEU 141 Ca 0.11 -0.27 -0.12 0.00 0.09 0.00 0.00 57.88 57.69 2pbl h LEU 141 Cb 0.07 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2pbl h LEU 141 CO -0.11 1.00 -0.51 -0.37 0.09 0.00 0.00 178.44 178.55 2pbl h VAL 142 N 0.84 1.36 -0.74 1.22 -1.51 -1.05 -2.99 116.25 113.38 2pbl h VAL 142 Ca 0.14 -1.75 -0.05 0.00 -1.23 0.00 0.00 66.70 63.82 2pbl h VAL 142 Cb 0.58 1.89 -0.03 0.00 -2.13 0.00 0.00 31.29 31.60 2pbl h VAL 142 CO 0.04 0.51 0.28 0.00 -1.23 0.00 0.00 177.57 177.17 2pbl h ALA 143 N 1.38 1.10 0.00 5.19 0.00 -0.87 -3.35 119.26 122.71 2pbl h ALA 143 Ca 0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 2pbl h ALA 143 Cb 0.93 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2pbl h ALA 143 CO 0.07 0.64 0.46 0.54 0.00 0.00 0.00 179.25 180.96 2pbl n ARG 144 N -4.28 0.57 0.00 0.00 5.12 -0.85 -4.36 116.66 112.87 2pbl n ARG 144 Ca 0.06 -0.35 0.00 0.00 -1.93 0.00 0.00 57.85 55.64 2pbl n ARG 144 Cb 0.19 -1.70 0.00 0.00 -1.16 0.00 0.00 32.46 29.79 2pbl n ARG 144 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2pbl n LEU 146 N 3.10 0.00 -4.62 0.55 4.77 -1.26 -4.75 117.00 114.79 2pbl n LEU 146 Ca 0.12 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.67 2pbl n LEU 146 Cb 0.21 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.28 2pbl n LEU 146 CO 0.27 0.00 0.97 -0.62 -1.33 0.00 0.00 177.39 176.67 2pbl s ASP 147 N 0.00 6.80 0.50 -1.43 -1.08 -1.26 -0.34 116.67 119.85 2pbl s ASP 147 Ca 0.00 0.80 0.33 0.00 -0.52 0.00 0.00 52.55 53.16 2pbl s ASP 147 Cb 0.00 -2.54 1.77 0.00 -1.46 0.00 0.00 42.92 40.69 2pbl s ASP 147 CO 0.00 -1.01 2.02 -0.65 0.52 0.00 0.00 175.17 176.05 2pbl h PRO 148 N 8.53 0.00 0.00 4.34 0.11 -1.83 0.60 132.00 143.75 2pbl h PRO 148 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2pbl h PRO 148 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2pbl h PRO 148 CO 1.06 0.00 -0.06 1.49 -0.21 0.00 0.00 178.00 180.28 2pbl h GLU 149 N 0.00 0.00 0.00 1.05 4.81 -1.93 -3.38 114.58 115.12 2pbl h GLU 149 Ca 0.00 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.94 2pbl h GLU 149 Cb 0.05 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.39 2pbl h GLU 149 CO 0.00 0.00 -1.70 0.28 -0.73 0.00 0.00 179.01 176.86 2pbl n VAL 150 N -2.65 1.52 -4.25 0.32 0.31 0.15 -4.99 118.33 108.75 2pbl n VAL 150 Ca 0.05 -0.14 -0.35 0.00 -0.01 0.00 0.00 64.34 63.89 2pbl n VAL 150 Cb 0.48 -2.04 -0.09 0.00 -0.91 0.00 0.00 33.84 31.28 2pbl n VAL 150 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2pbl s LEU 151 N -7.76 3.72 0.46 7.52 2.96 -0.91 -4.89 118.68 119.78 2pbl s LEU 151 Ca -0.32 0.17 -0.24 0.00 -0.22 0.00 0.00 54.13 53.52 2pbl s LEU 151 Cb 0.09 -1.87 -0.09 0.00 0.50 0.00 0.00 46.19 44.82 2pbl s LEU 151 CO 0.50 0.35 1.29 -2.65 -1.32 0.00 0.00 176.35 174.51 2pbl n PRO 152 N 2.36 1.87 -0.25 0.98 -0.02 -1.26 -4.66 135.00 134.02 2pbl n PRO 152 Ca -0.19 0.67 0.06 0.00 -2.02 0.00 0.00 63.50 62.02 2pbl n PRO 152 Cb 0.54 -2.43 0.18 0.00 -0.02 0.00 0.00 33.50 31.76 2pbl n PRO 152 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2pbl h GLU 153 N 1.92 0.16 -0.26 -0.52 4.57 -1.98 -0.70 114.58 117.77 2pbl h GLU 153 Ca -0.49 -0.01 0.08 0.00 -1.18 0.00 0.00 59.36 57.76 2pbl h GLU 153 Cb 1.30 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.84 2pbl h GLU 153 CO 0.59 0.11 0.25 0.00 -1.18 0.00 0.00 179.01 178.78 2pbl h ALA 154 N 1.67 1.98 0.01 2.92 0.00 -2.00 0.21 119.26 124.05 2pbl h ALA 154 Ca 0.42 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 55.01 2pbl h ALA 154 Cb 0.75 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 2pbl h ALA 154 CO -0.60 -0.39 -1.73 0.28 0.00 0.00 0.00 179.25 176.81 2pbl n VAL 155 N -3.94 1.55 -0.31 0.00 0.31 -0.58 -4.31 118.33 111.04 2pbl n VAL 155 Ca 0.03 -0.19 0.07 0.00 -0.01 0.00 0.00 64.34 64.24 2pbl n VAL 155 Cb 0.40 -1.96 0.22 0.00 -0.91 0.00 0.00 33.84 31.60 2pbl n VAL 155 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2pbl h GLY 156 N -0.77 1.45 1.48 2.92 0.00 -0.85 -1.23 103.07 106.07 2pbl h GLY 156 Ca -0.47 -0.31 0.06 0.00 0.00 0.00 0.00 47.33 46.61 2pbl h GLY 156 CO -0.25 0.04 0.20 0.00 0.00 0.00 0.00 176.54 176.53 2pbl h ALA 157 N 1.54 1.86 -0.00 3.60 0.00 -0.77 0.67 119.26 126.16 2pbl h ALA 157 Ca 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2pbl h ALA 157 Cb 0.58 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2pbl h ALA 157 CO -0.32 -0.31 -0.45 0.54 0.00 0.00 0.00 179.25 178.71 2pbl n ARG 158 N -3.88 0.05 -2.32 0.00 1.74 -0.47 -4.88 116.66 106.89 2pbl n ARG 158 Ca 0.02 -0.03 -0.42 0.00 -0.77 0.00 0.00 57.85 56.65 2pbl n ARG 158 Cb 0.33 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.25 2pbl n ARG 158 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2pbl s ILE 159 N -2.97 3.96 -0.25 0.55 1.01 0.22 -1.54 121.20 122.18 2pbl s ILE 159 Ca 0.12 1.30 -0.10 0.00 0.00 0.00 0.00 60.65 61.97 2pbl s ILE 159 Cb 0.18 -3.83 -0.16 0.00 0.01 0.00 0.00 42.46 38.65 2pbl s ILE 159 CO 0.68 -0.02 -0.17 -1.14 0.00 0.00 0.00 174.94 174.29 2pbl n ARG 160 N 5.55 0.62 -4.06 2.79 0.63 0.83 -4.53 116.66 118.48 2pbl n ARG 160 Ca 0.13 0.28 -0.13 0.00 -0.92 0.00 0.00 57.85 57.20 2pbl n ARG 160 Cb 0.45 -1.56 -0.13 0.00 0.45 0.00 0.00 32.46 31.67 2pbl n ARG 160 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 2pbl s ASN 161 N -7.10 0.53 -0.09 6.15 0.01 -1.25 -1.80 114.94 111.39 2pbl s ASN 161 Ca -0.35 -0.26 0.00 0.00 -0.71 0.00 0.00 52.86 51.54 2pbl s ASN 161 Cb 0.11 -0.00 0.02 0.00 0.41 0.00 0.00 41.25 41.79 2pbl s ASN 161 CO 0.56 -0.07 -0.07 -0.69 -1.51 0.00 0.00 177.10 175.32 2pbl s VAL 162 N -0.64 0.88 -0.49 1.60 1.01 0.11 -1.54 120.40 121.33 2pbl s VAL 162 Ca -0.04 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 61.74 2pbl s VAL 162 Cb -0.05 -0.90 0.14 0.00 0.00 0.00 0.00 36.38 35.56 2pbl s VAL 162 CO -0.00 0.33 0.28 -0.69 0.00 0.00 0.00 175.10 175.02 2pbl s VAL 163 N 1.48 1.90 -0.20 2.92 1.01 0.11 -1.42 120.40 126.20 2pbl s VAL 163 Ca -0.00 -2.99 -0.29 0.00 0.00 0.00 0.00 61.98 58.70 2pbl s VAL 163 Cb -0.13 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 33.93 2pbl s VAL 163 CO -0.05 -0.89 1.09 -2.84 0.00 0.00 0.00 175.10 172.41 2pbl s PRO 164 N -0.06 4.27 -0.33 2.72 0.02 -1.22 -2.93 135.00 137.47 2pbl s PRO 164 Ca 0.19 1.44 -0.13 0.00 0.02 0.00 0.00 61.00 62.52 2pbl s PRO 164 Cb -0.22 -3.66 -0.02 0.00 0.02 0.00 0.00 34.50 30.63 2pbl s PRO 164 CO -0.02 -0.61 0.25 0.42 -0.33 0.00 0.00 177.00 176.70 2pbl s ILE 165 N 3.14 5.28 -1.24 2.83 1.01 0.12 -1.93 121.20 130.41 2pbl s ILE 165 Ca 0.47 -0.15 -0.07 0.00 0.00 0.00 0.00 60.65 60.90 2pbl s ILE 165 Cb -0.17 -3.71 -0.01 0.00 0.01 0.00 0.00 42.46 38.58 2pbl s ILE 165 CO 0.09 0.01 0.71 -1.20 0.00 0.00 0.00 174.94 174.55 2pbl n SER 166 N 5.13 -2.94 -4.82 3.58 7.64 0.13 -0.82 113.62 121.51 2pbl n SER 166 Ca -0.12 -0.90 -0.32 0.00 1.01 0.00 0.00 58.87 58.54 2pbl n SER 166 Cb 0.50 -3.82 0.01 0.00 -1.01 0.00 0.00 64.21 59.89 2pbl n SER 166 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2pbl s PRO 167 N -5.89 3.37 -0.37 1.43 0.04 -1.26 -2.58 135.00 129.74 2pbl s PRO 167 Ca 0.20 1.05 -0.19 0.00 0.04 0.00 0.00 61.00 62.09 2pbl s PRO 167 Cb -0.06 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.44 2pbl s PRO 167 CO 0.83 -0.76 0.58 -0.51 0.04 0.00 0.00 177.00 177.18 2pbl s LEU 168 N -4.76 4.37 -0.02 -3.56 1.43 -1.21 -4.40 118.68 110.53 2pbl s LEU 168 Ca 0.60 -0.06 0.15 0.00 -1.03 0.00 0.00 54.13 53.79 2pbl s LEU 168 Cb -0.14 -2.68 -0.23 0.00 0.03 0.00 0.00 46.19 43.18 2pbl s LEU 168 CO 0.42 -0.58 0.31 -1.54 0.23 0.00 0.00 176.35 175.19 2pbl n SER 169 N 5.95 1.64 -3.78 2.29 3.41 -1.26 -4.24 113.62 117.62 2pbl n SER 169 Ca -0.03 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.31 2pbl n SER 169 Cb 0.48 1.65 -0.17 0.00 -0.26 0.00 0.00 64.21 65.92 2pbl n SER 169 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2pbl s ASP 170 N -3.73 2.80 0.00 4.04 -1.08 -1.26 -1.63 116.67 115.81 2pbl s ASP 170 Ca -0.05 -0.73 0.28 0.00 -0.52 0.00 0.00 52.55 51.52 2pbl s ASP 170 Cb 0.09 -0.67 1.02 0.00 -1.46 0.00 0.00 42.92 41.90 2pbl s ASP 170 CO 0.61 -0.27 1.75 0.18 0.52 0.00 0.00 175.17 177.97 2pbl n LEU 171 N 5.01 0.31 -0.25 -1.34 4.77 -1.26 -4.34 117.00 119.90 2pbl n LEU 171 Ca -0.09 0.18 0.02 0.00 -0.03 0.00 0.00 56.01 56.09 2pbl n LEU 171 Cb 0.47 -0.32 0.14 0.00 -2.33 0.00 0.00 43.42 41.39 2pbl n LEU 171 CO 0.14 0.07 1.06 0.03 -1.33 0.00 0.00 177.39 177.36 2pbl h ARG 172 N 0.20 0.57 0.00 3.23 3.08 -1.94 -1.06 114.38 118.47 2pbl h ARG 172 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2pbl h ARG 172 Cb 0.45 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2pbl h ARG 172 CO 0.00 0.38 0.00 -1.35 -1.07 0.00 0.00 179.97 177.93 2pbl h PRO 173 N 0.59 0.00 0.00 0.04 0.11 -2.01 -1.72 132.00 129.01 2pbl h PRO 173 Ca 0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.47 2pbl h PRO 173 Cb 0.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 2pbl h PRO 173 CO -0.28 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 177.44 2pbl h LEU 174 N 0.00 0.00 -1.98 2.35 3.38 -1.47 -1.92 115.31 115.67 2pbl h LEU 174 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2pbl h LEU 174 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2pbl h LEU 174 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.46 2pbl h LEU 175 N 0.00 0.00 -3.87 1.67 3.38 -1.41 -1.82 115.31 113.25 2pbl h LEU 175 Ca 0.00 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.55 2pbl h LEU 175 Cb 0.39 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 40.89 2pbl h LEU 175 CO 0.00 0.00 0.50 0.54 0.09 0.00 0.00 178.44 179.57 2pbl n ARG 176 N -3.08 2.55 -4.20 1.13 1.74 -0.72 -2.92 116.66 111.16 2pbl n ARG 176 Ca -0.01 -3.05 -0.19 0.00 -0.77 0.00 0.00 57.85 53.84 2pbl n ARG 176 Cb 0.22 -2.15 -0.12 0.00 -1.02 0.00 0.00 32.46 29.39 2pbl n ARG 176 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2pbl s THR 177 N -3.22 1.25 -0.06 0.55 -4.23 -0.68 -1.28 115.64 107.96 2pbl s THR 177 Ca 0.55 -1.43 -0.01 0.00 -1.18 0.00 0.00 61.69 59.62 2pbl s THR 177 Cb 0.46 -1.25 -0.01 0.00 1.34 0.00 0.00 72.50 73.04 2pbl s THR 177 CO 0.10 -0.24 0.94 -1.20 -0.54 0.00 0.00 174.62 173.69 2pbl n SER 178 N 1.08 0.50 0.00 3.99 7.64 -0.84 -4.40 113.62 121.59 2pbl n SER 178 Ca -0.20 -1.82 0.00 0.00 1.01 0.00 0.00 58.87 57.86 2pbl n SER 178 Cb 0.55 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 2pbl n SER 178 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2pbl n ASN 180 N 4.01 0.00 0.22 6.43 5.15 -1.26 -4.27 115.26 125.54 2pbl n ASN 180 Ca 0.04 0.00 0.07 0.00 -0.60 0.00 0.00 54.58 54.10 2pbl n ASN 180 Cb 0.04 0.00 0.53 0.00 -0.53 0.00 0.00 39.78 39.82 2pbl n ASN 180 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 2pbl h GLU 181 N 0.00 0.00 0.08 1.20 5.08 -1.94 0.74 114.58 119.74 2pbl h GLU 181 Ca 0.00 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 57.99 2pbl h GLU 181 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2pbl h GLU 181 CO 0.00 0.23 -2.13 1.63 -1.00 0.00 0.00 179.01 177.75 2pbl n LYS 182 N -3.89 0.72 -0.06 2.33 5.02 -1.26 -4.48 118.16 116.55 2pbl n LYS 182 Ca -0.02 0.23 -0.12 0.00 -2.02 0.00 0.00 58.31 56.38 2pbl n LYS 182 Cb 0.32 -1.66 0.01 0.00 -0.02 0.00 0.00 35.03 33.68 2pbl n LYS 182 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 2pbl h PHE 183 N 0.05 0.95 -5.10 2.13 0.04 -1.90 -3.37 116.94 109.73 2pbl h PHE 183 Ca -0.46 -0.32 0.01 0.00 2.80 0.00 0.00 57.97 60.00 2pbl h PHE 183 Cb 2.00 -0.19 -0.12 0.00 2.20 0.00 0.00 35.95 39.84 2pbl h PHE 183 CO 0.06 1.10 -1.47 1.63 -0.60 0.00 0.00 178.31 179.03 2pbl n LYS 184 N -4.01 -4.38 -4.12 1.51 5.02 0.24 -4.68 118.16 107.74 2pbl n LYS 184 Ca -0.03 3.31 -0.15 0.00 -2.02 0.00 0.00 58.31 59.42 2pbl n LYS 184 Cb 0.59 -4.72 -0.05 0.00 -0.02 0.00 0.00 35.03 30.83 2pbl n LYS 184 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 2pbl s ASP 186 N -0.61 0.90 0.16 4.39 1.47 -1.26 -5.11 116.67 116.62 2pbl s ASP 186 Ca -0.26 -1.48 -0.15 0.00 1.18 0.00 0.00 52.55 51.83 2pbl s ASP 186 Cb 0.02 0.62 0.10 0.00 -0.34 0.00 0.00 42.92 43.32 2pbl s ASP 186 CO 0.71 -1.21 1.73 0.00 0.68 0.00 0.00 175.17 177.08 2pbl h ALA 187 N 2.17 0.43 -0.51 2.11 0.00 -2.00 -1.51 119.26 119.95 2pbl h ALA 187 Ca -0.28 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2pbl h ALA 187 Cb 1.24 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 2pbl h ALA 187 CO 0.39 -0.32 0.20 -0.44 0.00 0.00 0.00 179.25 179.08 2pbl h ASP 188 N 0.21 0.66 -0.55 0.00 3.32 -2.04 -1.08 116.42 116.94 2pbl h ASP 188 Ca 0.19 -0.08 -0.10 0.00 0.02 0.00 0.00 57.03 57.05 2pbl h ASP 188 Cb 0.22 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 2pbl h ASP 188 CO -0.24 0.60 -0.06 0.00 -1.72 0.00 0.00 179.24 177.81 2pbl h ALA 189 N 1.50 0.75 -0.44 3.45 0.00 -1.84 0.73 119.26 123.41 2pbl h ALA 189 Ca 0.17 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2pbl h ALA 189 Cb 0.15 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2pbl h ALA 189 CO -0.02 0.63 0.14 0.00 0.00 0.00 0.00 179.25 180.01 2pbl h ALA 190 N 0.94 0.57 0.24 0.00 0.00 -0.88 -2.32 119.26 117.81 2pbl h ALA 190 Ca 0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2pbl h ALA 190 Cb 0.63 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2pbl h ALA 190 CO 0.04 0.22 -0.12 0.82 0.00 0.00 0.00 179.25 180.22 2pbl h ILE 191 N 0.57 0.79 -0.97 0.00 2.04 -1.15 -1.92 117.51 116.86 2pbl h ILE 191 Ca 0.14 -0.14 0.20 0.00 1.00 0.00 0.00 64.86 66.06 2pbl h ILE 191 Cb 0.26 0.87 -0.09 0.00 -0.74 0.00 0.00 36.82 37.12 2pbl h ILE 191 CO -0.00 0.03 0.62 0.00 0.00 0.00 0.00 178.15 178.79 2pbl h ALA 192 N 0.35 1.92 -0.51 1.87 0.00 -0.74 -1.59 119.26 120.56 2pbl h ALA 192 Ca -0.03 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2pbl h ALA 192 Cb 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2pbl h ALA 192 CO 0.05 -0.26 0.00 0.39 0.00 0.00 0.00 179.25 179.43 2pbl n GLU 193 N -4.65 2.31 -3.22 0.00 -0.58 -0.88 -4.90 120.64 108.72 2pbl n GLU 193 Ca 0.22 -2.03 -0.40 0.00 -0.42 0.00 0.00 57.16 54.53 2pbl n GLU 193 Cb 0.64 -1.46 -0.07 0.00 -0.57 0.00 0.00 31.44 29.98 2pbl n GLU 193 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2pbl s SER 194 N -1.14 6.42 0.44 1.62 0.01 -0.60 -4.85 113.70 115.60 2pbl s SER 194 Ca 0.38 0.40 0.20 0.00 1.31 0.00 0.00 55.95 58.24 2pbl s SER 194 Cb 0.20 -2.28 1.16 0.00 0.21 0.00 0.00 66.02 65.31 2pbl s SER 194 CO 0.27 -0.35 1.86 -0.65 0.41 0.00 0.00 173.24 174.78 2pbl h PRO 195 N 8.13 0.31 0.00 12.44 0.11 -1.75 -0.68 132.00 150.56 2pbl h PRO 195 Ca -0.28 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.80 2pbl h PRO 195 Cb 1.13 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2pbl h PRO 195 CO 0.74 0.21 -0.02 -0.39 -0.21 0.00 0.00 178.00 178.33 2pbl h VAL 196 N 0.32 0.23 -1.22 3.15 -1.51 -1.68 -3.46 116.25 112.08 2pbl h VAL 196 Ca 0.46 -0.14 -0.70 0.00 -1.23 0.00 0.00 66.70 65.09 2pbl h VAL 196 Cb 1.28 1.11 -0.11 0.00 -2.13 0.00 0.00 31.29 31.43 2pbl h VAL 196 CO -0.15 0.02 2.01 -0.62 -1.23 0.00 0.00 177.57 177.60 2pbl n GLU 197 N -3.37 3.24 0.00 5.19 -0.58 -0.27 -4.94 120.64 119.92 2pbl n GLU 197 Ca -0.02 -3.42 0.00 0.00 -0.42 0.00 0.00 57.16 53.30 2pbl n GLU 197 Cb 0.12 -3.32 0.00 0.00 -0.57 0.00 0.00 31.44 27.67 2pbl n GLU 197 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2pbl n GLN 199 N 7.18 0.00 -4.02 3.49 1.13 -1.26 -5.09 117.38 118.81 2pbl n GLN 199 Ca 0.45 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 55.16 2pbl n GLN 199 Cb 0.44 0.00 -0.13 0.00 0.11 0.00 0.00 30.24 30.66 2pbl n GLN 199 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2pbl s ASN 200 N -0.33 4.76 -0.00 1.08 0.02 -1.26 -5.08 114.94 114.13 2pbl s ASN 200 Ca 0.00 -0.24 0.01 0.00 -1.02 0.00 0.00 52.86 51.62 2pbl s ASN 200 Cb 0.00 -1.82 -0.00 0.00 0.02 0.00 0.00 41.25 39.45 2pbl s ASN 200 CO 0.00 0.04 -0.03 -0.13 0.02 0.00 0.00 177.10 177.00 2pbl s ARG 201 N 1.14 0.29 0.58 -0.60 0.52 -1.26 -4.40 118.95 115.22 2pbl s ARG 201 Ca 0.03 -0.12 -0.19 0.00 -0.52 0.00 0.00 55.73 54.92 2pbl s ARG 201 Cb -0.14 -0.28 -0.05 0.00 0.52 0.00 0.00 34.95 35.00 2pbl s ARG 201 CO 0.01 0.07 1.03 0.66 0.02 0.00 0.00 175.30 177.10 2pbl n TYR 202 N 3.01 1.09 -2.33 -0.53 4.01 0.53 -4.91 117.16 118.03 2pbl n TYR 202 Ca -0.13 0.44 -0.42 0.00 -0.16 0.00 0.00 57.90 57.63 2pbl n TYR 202 Cb 0.59 -2.18 -0.03 0.00 -0.31 0.00 0.00 39.34 37.41 2pbl n TYR 202 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2pbl s ASP 203 N -1.18 6.93 -0.18 7.72 1.11 -1.26 -4.96 116.67 124.85 2pbl s ASP 203 Ca 0.75 1.94 -0.30 0.00 0.18 0.00 0.00 52.55 55.12 2pbl s ASP 203 Cb -0.42 -2.55 0.14 0.00 1.07 0.00 0.00 42.92 41.15 2pbl s ASP 203 CO 0.48 -0.69 1.06 0.00 1.18 0.00 0.00 175.17 177.20 2pbl s ALA 204 N 2.60 -1.97 -0.24 5.23 0.00 -1.26 -4.75 121.76 121.37 2pbl s ALA 204 Ca 0.60 1.63 -0.24 0.00 0.00 0.00 0.00 51.96 53.94 2pbl s ALA 204 Cb -0.27 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.03 2pbl s ALA 204 CO 0.23 -0.32 0.80 0.21 0.00 0.00 0.00 175.76 176.69 2pbl s LYS 205 N -1.19 4.18 -0.16 0.00 2.20 -0.75 -4.89 119.74 119.13 2pbl s LYS 205 Ca 0.01 0.90 -0.05 0.00 -0.36 0.00 0.00 55.97 56.47 2pbl s LYS 205 Cb -0.01 -3.64 -0.03 0.00 -1.51 0.00 0.00 37.83 32.64 2pbl s LYS 205 CO -0.01 -0.50 -0.01 0.08 -0.36 0.00 0.00 175.35 174.55 2pbl s VAL 206 N 2.79 4.13 -0.15 4.02 1.01 -1.26 -0.71 120.40 130.25 2pbl s VAL 206 Ca 0.34 -0.27 -0.01 0.00 0.00 0.00 0.00 61.98 62.04 2pbl s VAL 206 Cb -0.15 -2.82 0.04 0.00 0.00 0.00 0.00 36.38 33.44 2pbl s VAL 206 CO 0.07 0.49 -0.04 -0.89 0.00 0.00 0.00 175.10 174.73 2pbl s THR 207 N 0.34 0.94 -0.22 3.92 2.01 -0.51 -1.26 115.64 120.86 2pbl s THR 207 Ca -0.02 -0.45 -0.23 0.00 0.31 0.00 0.00 61.69 61.30 2pbl s THR 207 Cb -0.14 -1.12 -0.02 0.00 0.01 0.00 0.00 72.50 71.24 2pbl s THR 207 CO 0.02 0.16 0.72 -0.69 -0.69 0.00 0.00 174.62 174.15 2pbl s VAL 208 N 1.71 4.94 -0.18 3.82 1.01 -0.45 -3.45 120.40 127.79 2pbl s VAL 208 Ca 0.02 1.36 -0.01 0.00 0.00 0.00 0.00 61.98 63.35 2pbl s VAL 208 Cb -0.14 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.21 2pbl s VAL 208 CO -0.08 0.03 -0.13 0.86 0.00 0.00 0.00 175.10 175.78 2pbl s TRP 209 N 2.35 2.84 0.01 5.22 -0.11 -0.81 -0.50 118.94 127.95 2pbl s TRP 209 Ca 0.32 -1.15 -0.01 0.00 1.22 0.00 0.00 56.10 56.47 2pbl s TRP 209 Cb -0.16 -1.97 -0.01 0.00 -1.50 0.00 0.00 33.47 29.83 2pbl s TRP 209 CO 0.09 -0.57 0.01 0.54 -4.62 0.00 0.00 176.95 172.40 2pbl s VAL 210 N 1.14 0.09 0.12 5.86 0.11 -0.09 0.18 120.40 127.80 2pbl s VAL 210 Ca 0.01 -0.76 -0.30 0.00 -2.93 0.00 0.00 61.98 58.00 2pbl s VAL 210 Cb -0.14 -0.26 -0.06 0.00 -1.53 0.00 0.00 36.38 34.38 2pbl s VAL 210 CO -0.04 -0.42 1.01 -0.83 -3.33 0.00 0.00 175.10 171.49 2pbl s GLY 211 N -1.26 2.93 0.48 6.54 0.00 -1.26 -0.78 107.32 113.98 2pbl s GLY 211 Ca -0.14 0.65 0.15 0.00 0.00 0.00 0.00 44.72 45.39 2pbl s GLY 211 CO -0.00 1.55 2.07 -1.33 0.00 0.00 0.00 173.10 175.39 2pbl h GLY 212 N 5.57 0.23 -2.90 0.20 0.00 -0.79 -2.00 103.07 103.38 2pbl h GLY 212 Ca -0.43 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.82 2pbl h GLY 212 CO 0.73 0.06 0.00 0.00 0.00 0.00 0.00 176.54 177.33 2pbl n ALA 213 N -2.54 3.39 -1.89 3.60 0.00 0.06 -4.83 120.51 118.30 2pbl n ALA 213 Ca 0.03 -1.45 -0.29 0.00 0.00 0.00 0.00 53.44 51.73 2pbl n ALA 213 Cb 0.23 -1.07 0.07 0.00 0.00 0.00 0.00 19.45 18.68 2pbl n ALA 213 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2pbl s GLU 214 N -2.19 2.29 0.31 0.00 2.02 -0.76 -4.69 118.70 115.68 2pbl s GLU 214 Ca 0.43 0.25 -0.29 0.00 0.02 0.00 0.00 54.97 55.38 2pbl s GLU 214 Cb 0.31 -1.98 -0.13 0.00 0.10 0.00 0.00 34.13 32.44 2pbl s GLU 214 CO 0.16 -1.40 1.26 0.54 0.02 0.00 0.00 175.26 175.84 2pbl n ARG 215 N -3.21 1.94 -0.33 1.61 5.12 -1.26 -4.79 116.66 115.75 2pbl n ARG 215 Ca 0.08 0.68 0.20 0.00 -1.93 0.00 0.00 57.85 56.88 2pbl n ARG 215 Cb 0.60 -2.24 0.41 0.00 -1.16 0.00 0.00 32.46 30.07 2pbl n ARG 215 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 2pbl h PRO 216 N 2.80 0.35 -0.77 5.56 0.11 -1.94 -0.82 132.00 137.28 2pbl h PRO 216 Ca -0.45 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.73 2pbl h PRO 216 Cb 1.29 -0.08 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 2pbl h PRO 216 CO 0.65 0.23 0.42 0.00 -0.21 0.00 0.00 178.00 179.09 2pbl h ALA 217 N 1.81 1.08 -0.13 -0.75 0.00 -1.90 -0.04 119.26 119.33 2pbl h ALA 217 Ca 0.67 0.04 -0.17 0.00 0.00 0.00 0.00 54.91 55.45 2pbl h ALA 217 Cb 1.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2pbl h ALA 217 CO -0.59 0.04 -0.63 0.74 0.00 0.00 0.00 179.25 178.82 2pbl h PHE 218 N 0.72 0.61 -0.69 0.00 -1.00 -1.48 0.39 116.94 115.49 2pbl h PHE 218 Ca 0.37 -0.24 -0.04 0.00 2.81 0.00 0.00 57.97 60.87 2pbl h PHE 218 Cb 0.34 -0.11 -0.03 0.00 3.61 0.00 0.00 35.95 39.77 2pbl h PHE 218 CO -0.08 0.98 0.25 -0.07 -1.61 0.00 0.00 178.31 177.78 2pbl h LEU 219 N 0.35 0.95 -0.02 1.54 3.38 -0.99 -1.85 115.31 118.67 2pbl h LEU 219 Ca -0.01 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 2pbl h LEU 219 Cb 1.18 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 2pbl h LEU 219 CO 0.11 0.86 -0.00 0.44 0.09 0.00 0.00 178.44 179.95 2pbl h ASP 220 N 1.00 0.03 -0.92 -0.43 3.32 -0.79 -2.42 116.42 116.22 2pbl h ASP 220 Ca 0.23 -0.33 0.17 0.00 0.02 0.00 0.00 57.03 57.11 2pbl h ASP 220 Cb 0.23 -0.01 -0.08 0.00 0.22 0.00 0.00 39.33 39.69 2pbl h ASP 220 CO -0.02 0.36 0.59 1.56 -1.72 0.00 0.00 179.24 180.01 2pbl h GLN 221 N -0.30 0.62 0.20 3.56 1.08 -0.84 0.06 115.11 119.49 2pbl h GLN 221 Ca 0.00 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 2pbl h GLN 221 Cb 0.34 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 2pbl h GLN 221 CO 0.00 0.41 -0.10 0.00 -0.95 0.00 0.00 178.83 178.20 2pbl h ALA 222 N 1.61 -0.27 -0.17 3.87 0.00 -1.17 -2.97 119.26 120.15 2pbl h ALA 222 Ca 0.48 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 2pbl h ALA 222 Cb 0.86 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2pbl h ALA 222 CO -0.23 -0.43 -0.10 0.97 0.00 0.00 0.00 179.25 179.46 2pbl h ILE 223 N -0.72 1.17 -0.81 0.00 6.09 -1.08 -1.24 117.51 120.92 2pbl h ILE 223 Ca -0.03 -0.74 0.04 0.00 -1.37 0.00 0.00 64.86 62.77 2pbl h ILE 223 Cb 0.50 1.15 -0.05 0.00 0.47 0.00 0.00 36.82 38.89 2pbl h ILE 223 CO 0.05 0.23 0.51 -0.50 -3.07 0.00 0.00 178.15 175.37 2pbl h TRP 224 N 0.26 0.95 -0.25 2.19 6.55 -1.00 0.19 115.95 124.84 2pbl h TRP 224 Ca 0.05 0.03 -0.07 0.00 0.95 0.00 0.00 58.89 59.85 2pbl h TRP 224 Cb 0.34 -0.31 -0.01 0.00 -0.86 0.00 0.00 29.16 28.33 2pbl h TRP 224 CO 0.01 0.52 -0.11 1.25 -1.05 0.00 0.00 178.44 179.05 2pbl h LEU 225 N 0.97 0.54 -0.37 -4.49 5.85 -1.17 -1.20 115.31 115.43 2pbl h LEU 225 Ca 0.34 -0.40 0.05 0.00 0.84 0.00 0.00 57.88 58.71 2pbl h LEU 225 Cb 0.08 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 2pbl h LEU 225 CO -0.14 0.82 0.09 0.58 -0.34 0.00 0.00 178.44 179.45 2pbl h VAL 226 N 0.25 0.83 -0.06 1.05 2.07 -1.02 -1.73 116.25 117.64 2pbl h VAL 226 Ca 0.06 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 2pbl h VAL 226 Cb 0.62 0.59 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2pbl h VAL 226 CO 0.04 0.04 0.03 -0.33 0.02 0.00 0.00 177.57 177.37 2pbl h GLU 227 N 0.22 0.09 -0.88 1.57 5.08 -0.50 0.58 114.58 120.75 2pbl h GLU 227 Ca 0.18 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2pbl h GLU 227 Cb 0.20 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 2pbl h GLU 227 CO -0.22 0.18 0.54 0.00 -1.00 0.00 0.00 179.01 178.50 2pbl h ALA 228 N 0.91 1.30 -0.14 3.43 0.00 -1.03 -3.22 119.26 120.50 2pbl h ALA 228 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2pbl h ALA 228 Cb 0.12 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2pbl h ALA 228 CO -0.00 0.61 0.00 0.91 0.00 0.00 0.00 179.25 180.77 2pbl n TRP 229 N -4.37 0.17 -3.97 0.00 7.02 -0.67 -4.98 117.44 110.65 2pbl n TRP 229 Ca 0.10 -0.15 -0.27 0.00 -1.02 0.00 0.00 57.50 56.16 2pbl n TRP 229 Cb 0.06 -0.01 -0.01 0.00 -2.42 0.00 0.00 31.31 28.93 2pbl n TRP 229 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 2pbl n ASP 230 N 0.77 -1.51 -4.91 -0.99 2.03 0.14 -4.95 116.55 107.14 2pbl n ASP 230 Ca 0.10 -0.96 -0.27 0.00 0.52 0.00 0.00 54.79 54.18 2pbl n ASP 230 Cb 0.38 -3.23 0.02 0.00 -0.72 0.00 0.00 41.12 37.57 2pbl n ASP 230 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2pbl s ALA 231 N -3.72 3.30 0.86 -1.67 0.00 -0.86 -5.03 121.76 114.65 2pbl s ALA 231 Ca 0.22 -0.58 -0.11 0.00 0.00 0.00 0.00 51.96 51.49 2pbl s ALA 231 Cb -0.12 -2.65 0.11 0.00 0.00 0.00 0.00 23.12 20.47 2pbl s ALA 231 CO 0.88 -0.67 1.10 -0.51 0.00 0.00 0.00 175.76 176.55 2pbl s ASP 232 N -4.24 3.63 -0.10 0.00 1.11 -0.39 -4.85 116.67 111.83 2pbl s ASP 232 Ca 0.52 1.79 -0.04 0.00 0.18 0.00 0.00 52.55 55.00 2pbl s ASP 232 Cb -0.11 -2.42 0.05 0.00 1.07 0.00 0.00 42.92 41.52 2pbl s ASP 232 CO 0.46 -2.59 0.20 -2.28 1.18 0.00 0.00 175.17 172.14 2pbl s HIS 233 N -2.83 -0.28 -0.12 4.23 2.46 -1.26 -1.34 115.29 116.15 2pbl s HIS 233 Ca 0.63 0.74 0.03 0.00 0.47 0.00 0.00 55.06 56.93 2pbl s HIS 233 Cb -0.19 -0.12 0.01 0.00 -0.13 0.00 0.00 32.58 32.14 2pbl s HIS 233 CO 0.57 -0.28 -0.23 0.08 -2.47 0.00 0.00 174.74 172.41 2pbl s VAL 234 N 2.05 2.06 -0.37 0.89 1.01 0.35 -4.96 120.40 121.43 2pbl s VAL 234 Ca -0.01 -1.00 -0.11 0.00 0.00 0.00 0.00 61.98 60.87 2pbl s VAL 234 Cb -0.12 -1.80 0.03 0.00 0.00 0.00 0.00 36.38 34.49 2pbl s VAL 234 CO -0.07 0.55 0.20 -0.63 0.00 0.00 0.00 175.10 175.15 2pbl s ILE 235 N 0.60 4.49 -0.25 2.22 1.01 -1.26 -0.92 121.20 127.10 2pbl s ILE 235 Ca -0.12 -0.91 -0.29 0.00 0.00 0.00 0.00 60.65 59.33 2pbl s ILE 235 Cb -0.17 -3.52 -0.00 0.00 0.01 0.00 0.00 42.46 38.77 2pbl s ILE 235 CO 0.03 -0.25 1.30 0.00 0.00 0.00 0.00 174.94 176.02 2pbl s ALA 236 N 1.54 3.46 -0.35 9.38 0.00 0.04 -4.74 121.76 131.09 2pbl s ALA 236 Ca 0.02 0.24 -0.41 0.00 0.00 0.00 0.00 51.96 51.80 2pbl s ALA 236 Cb -0.19 -3.73 -0.16 0.00 0.00 0.00 0.00 23.12 19.04 2pbl s ALA 236 CO 0.06 -1.57 1.82 0.34 0.00 0.00 0.00 175.76 176.41 2pbl n PHE 237 N 7.31 1.86 -1.29 0.00 7.35 -1.26 -0.78 117.46 130.66 2pbl n PHE 237 Ca 0.15 0.63 -0.12 0.00 -0.76 0.00 0.00 57.45 57.35 2pbl n PHE 237 Cb 0.46 -2.42 -0.05 0.00 0.35 0.00 0.00 39.48 37.82 2pbl n PHE 237 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2pbl n GLU 238 N 5.76 -1.61 -2.76 -4.13 -0.58 -1.26 -4.82 120.64 111.24 2pbl n GLU 238 Ca 0.32 0.84 -0.36 0.00 -0.42 0.00 0.00 57.16 57.54 2pbl n GLU 238 Cb 0.09 -5.13 -0.06 0.00 -0.57 0.00 0.00 31.44 25.77 2pbl n GLU 238 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2pbl s LYS 239 N -2.88 4.48 0.51 3.49 -0.14 -0.86 -4.45 119.74 119.88 2pbl s LYS 239 Ca 0.00 1.31 0.05 0.00 -1.36 0.00 0.00 55.97 55.97 2pbl s LYS 239 Cb 0.00 -2.66 0.05 0.00 -1.68 0.00 0.00 37.83 33.53 2pbl s LYS 239 CO 0.00 0.18 0.38 -2.39 -0.76 0.00 0.00 175.35 172.76 2pbl n HIS 240 N 0.28 -0.62 0.27 3.18 1.44 -1.26 -0.76 115.22 117.75 2pbl n HIS 240 Ca 0.03 -2.17 0.12 0.00 -2.01 0.00 0.00 57.72 53.70 2pbl n HIS 240 Cb 0.51 -0.42 0.77 0.00 0.12 0.00 0.00 29.99 30.97 2pbl n HIS 240 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 2pbl h HIS 241 N 0.66 0.00 0.00 -1.40 2.76 -1.93 -2.53 115.15 112.71 2pbl h HIS 241 Ca -0.32 0.00 -0.28 0.00 -2.20 0.00 0.00 60.37 57.56 2pbl h HIS 241 Cb 1.18 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.09 2pbl h HIS 241 CO 0.00 0.07 -2.07 1.19 -1.30 0.00 0.00 177.93 175.82 2pbl n PHE 242 N -3.87 0.33 0.96 5.26 3.72 -1.26 -4.41 117.46 118.20 2pbl n PHE 242 Ca -0.02 0.12 0.11 0.00 -0.05 0.00 0.00 57.45 57.60 2pbl n PHE 242 Cb 0.16 -0.99 0.03 0.00 -0.94 0.00 0.00 39.48 37.74 2pbl n PHE 242 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 2pbl n ASN 243 N -2.77 2.27 -0.08 4.37 6.94 -1.20 -4.40 115.26 120.39 2pbl n ASN 243 Ca -0.23 -1.63 0.10 0.00 -0.02 0.00 0.00 54.58 52.79 2pbl n ASN 243 Cb 1.02 0.33 0.47 0.00 -2.36 0.00 0.00 39.78 39.24 2pbl n ASN 243 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 2pbl h VAL 244 N 3.01 0.95 0.00 3.53 3.04 -1.66 -1.11 116.25 124.01 2pbl h VAL 244 Ca 0.00 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.53 2pbl h VAL 244 Cb 0.80 0.43 0.00 0.00 -2.01 0.00 0.00 31.29 30.51 2pbl h VAL 244 CO 0.00 0.09 -0.04 2.30 -1.01 0.00 0.00 177.57 178.91 2pbl n ILE 245 N -4.47 0.44 -0.33 3.17 -5.35 -1.26 -4.26 119.36 107.30 2pbl n ILE 245 Ca 0.09 -0.22 0.04 0.00 -0.27 0.00 0.00 62.75 62.39 2pbl n ILE 245 Cb 0.30 -0.53 0.19 0.00 -1.74 0.00 0.00 39.64 37.86 2pbl n ILE 245 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2pbl h GLU 246 N 0.00 0.88 0.00 6.28 5.08 -1.45 -1.82 114.58 123.55 2pbl h GLU 246 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2pbl h GLU 246 Cb 0.68 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2pbl h GLU 246 CO 0.00 0.58 0.08 -2.30 -1.00 0.00 0.00 179.01 176.38 2pbl n PRO 247 N -4.67 0.09 0.26 2.33 -0.02 -1.26 -1.75 135.00 129.98 2pbl n PRO 247 Ca 0.16 0.57 0.12 0.00 -2.02 0.00 0.00 63.50 62.33 2pbl n PRO 247 Cb 0.29 -1.89 0.76 0.00 -0.02 0.00 0.00 33.50 32.64 2pbl n PRO 247 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2pbl h LEU 248 N 0.00 0.00 -0.12 2.45 3.38 -1.63 -1.41 115.31 117.98 2pbl h LEU 248 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2pbl h LEU 248 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2pbl h LEU 248 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 2pbl n ALA 249 N -2.45 2.00 -2.91 1.53 0.00 -0.72 -1.69 120.51 116.27 2pbl n ALA 249 Ca -0.02 -0.04 -0.39 0.00 0.00 0.00 0.00 53.44 52.98 2pbl n ALA 249 Cb 0.12 -1.38 -0.12 0.00 0.00 0.00 0.00 19.45 18.07 2pbl n ALA 249 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2pbl s ASP 250 N -3.48 5.58 0.46 0.00 -1.08 -0.53 -3.85 116.67 113.76 2pbl s ASP 250 Ca 0.10 -0.86 0.29 0.00 -0.52 0.00 0.00 52.55 51.56 2pbl s ASP 250 Cb 0.13 -1.99 1.37 0.00 -1.46 0.00 0.00 42.92 40.98 2pbl s ASP 250 CO 0.44 -0.31 1.71 -0.65 0.52 0.00 0.00 175.17 176.87 2pbl h PRO 251 N 8.37 0.16 -0.57 4.34 0.11 -1.84 -1.95 132.00 140.62 2pbl h PRO 251 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2pbl h PRO 251 Cb 1.11 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2pbl h PRO 251 CO 0.64 0.11 0.00 0.39 -0.21 0.00 0.00 178.00 178.93 2pbl n GLU 252 N -4.50 2.56 -1.98 1.05 -0.58 -1.26 -4.81 120.64 111.12 2pbl n GLU 252 Ca 0.31 -2.40 -0.34 0.00 -0.42 0.00 0.00 57.16 54.31 2pbl n GLU 252 Cb 1.26 -1.53 0.03 0.00 -0.57 0.00 0.00 31.44 30.62 2pbl n GLU 252 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2pbl s SER 253 N -1.21 5.32 0.33 1.62 1.04 -0.73 -4.89 113.70 115.18 2pbl s SER 253 Ca 0.44 2.14 0.05 0.00 0.48 0.00 0.00 55.95 59.05 2pbl s SER 253 Cb 0.24 -2.57 0.59 0.00 0.10 0.00 0.00 66.02 64.37 2pbl s SER 253 CO 0.32 -1.49 1.85 0.44 0.98 0.00 0.00 173.24 175.34 2pbl h ASP 254 N 0.60 0.46 -0.07 7.02 3.32 -1.91 -1.28 116.42 124.57 2pbl h ASP 254 Ca -0.49 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 56.46 2pbl h ASP 254 Cb 1.26 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.69 2pbl h ASP 254 CO 0.55 0.57 0.03 0.25 -1.72 0.00 0.00 179.24 178.93 2pbl h LEU 255 N 0.46 0.09 -1.25 1.55 5.85 -1.91 -1.52 115.31 118.58 2pbl h LEU 255 Ca 0.09 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.75 2pbl h LEU 255 Cb 0.39 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 2pbl h LEU 255 CO 0.02 0.18 0.53 0.58 -0.34 0.00 0.00 178.44 179.41 2pbl h VAL 256 N -0.01 1.08 -0.34 1.05 2.07 -1.74 -2.39 116.25 115.96 2pbl h VAL 256 Ca 0.02 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 2pbl h VAL 256 Cb 0.11 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 2pbl h VAL 256 CO -0.00 0.17 0.12 0.00 0.02 0.00 0.00 177.57 177.88 2pbl h ALA 257 N 1.55 0.44 0.05 1.67 0.00 -0.75 -1.43 119.26 120.79 2pbl h ALA 257 Ca 0.34 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2pbl h ALA 257 Cb 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2pbl h ALA 257 CO -0.11 0.06 -0.02 0.28 0.00 0.00 0.00 179.25 179.45 2pbl h VAL 258 N 0.40 1.04 -0.75 0.00 2.07 -1.00 -0.77 116.25 117.24 2pbl h VAL 258 Ca 0.11 -0.30 0.11 0.00 0.82 0.00 0.00 66.70 67.44 2pbl h VAL 258 Cb 0.21 1.24 -0.08 0.00 -1.52 0.00 0.00 31.29 31.15 2pbl h VAL 258 CO -0.01 0.08 0.38 0.40 0.02 0.00 0.00 177.57 178.43 2pbl h ILE 259 N -0.20 0.81 -0.32 4.57 2.04 -1.38 -1.93 117.51 121.12 2pbl h ILE 259 Ca -0.01 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.64 2pbl h ILE 259 Cb 0.17 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.40 2pbl h ILE 259 CO 0.01 0.11 0.00 0.35 0.00 0.00 0.00 178.15 178.62 2pbl n THR 260 N -4.87 0.41 0.73 -0.27 -2.24 -0.55 -4.80 114.28 102.71 2pbl n THR 260 Ca 0.13 -0.54 0.06 0.00 -2.27 0.00 0.00 64.05 61.42 2pbl n THR 260 Cb 0.32 0.53 0.35 0.00 -2.10 0.00 0.00 70.33 69.42 2pbl n THR 260 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50