#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1phd s LEU 11 N 0.00 4.18 0.28 1.20 1.02 -1.26 -4.37 118.68 119.73 1phd s LEU 11 Ca 0.00 0.24 -0.11 0.00 0.02 0.00 0.00 54.13 54.28 1phd s LEU 11 Cb 0.00 -2.07 -0.08 0.00 0.02 0.00 0.00 46.19 44.06 1phd s LEU 11 CO 0.00 0.21 0.63 0.00 0.02 0.00 0.00 176.35 177.21 1phd s ALA 12 N 0.18 3.47 0.40 4.21 0.00 0.77 -5.00 121.76 125.78 1phd s ALA 12 Ca 0.08 -0.18 -0.27 0.00 0.00 0.00 0.00 51.96 51.59 1phd s ALA 12 Cb -0.11 -2.56 -0.09 0.00 0.00 0.00 0.00 23.12 20.35 1phd s ALA 12 CO -0.01 0.38 1.41 -1.25 0.00 0.00 0.00 175.76 176.29 1phd s PRO 13 N -3.03 3.96 0.02 0.00 0.04 -1.26 -4.79 135.00 129.94 1phd s PRO 13 Ca 0.50 2.40 -0.30 0.00 0.04 0.00 0.00 61.00 63.63 1phd s PRO 13 Cb -0.11 -2.83 -0.05 0.00 0.04 0.00 0.00 34.50 31.55 1phd s PRO 13 CO 0.22 -0.59 1.31 -1.17 0.04 0.00 0.00 177.00 176.80 1phd s LEU 14 N -2.35 4.33 0.88 -3.56 2.96 -1.26 -5.00 118.68 114.68 1phd s LEU 14 Ca 0.56 2.06 -0.11 0.00 -0.22 0.00 0.00 54.13 56.43 1phd s LEU 14 Cb -0.43 -3.57 0.12 0.00 0.50 0.00 0.00 46.19 42.81 1phd s LEU 14 CO 0.57 -0.62 1.11 -2.16 -1.32 0.00 0.00 176.35 173.93 1phd s PRO 15 N 1.83 1.33 0.39 0.98 0.04 -1.26 -4.94 135.00 133.37 1phd s PRO 15 Ca 0.61 1.25 0.09 0.00 0.04 0.00 0.00 61.00 63.00 1phd s PRO 15 Cb -0.30 -1.78 0.80 0.00 0.04 0.00 0.00 34.50 33.25 1phd s PRO 15 CO 0.27 -2.32 1.94 -1.35 0.04 0.00 0.00 177.00 175.57 1phd h PRO 16 N -1.63 0.28 0.00 0.56 0.11 -2.05 -2.28 132.00 126.99 1phd h PRO 16 Ca -0.46 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1phd h PRO 16 Cb 1.26 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1phd h PRO 16 CO 0.48 0.37 0.00 -2.39 -0.21 0.00 0.00 178.00 176.25 1phd n HIS 17 N -4.31 0.00 -3.24 0.65 1.44 -1.26 -4.77 115.22 103.73 1phd n HIS 17 Ca -0.00 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.31 1phd n HIS 17 Cb 0.24 -0.25 -0.08 0.00 0.12 0.00 0.00 29.99 30.02 1phd n HIS 17 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1phd s VAL 18 N -2.50 5.06 0.21 0.61 1.01 -0.86 -4.84 120.40 119.09 1phd s VAL 18 Ca 0.29 0.75 -0.30 0.00 0.00 0.00 0.00 61.98 62.71 1phd s VAL 18 Cb 0.19 -3.85 -0.09 0.00 0.00 0.00 0.00 36.38 32.62 1phd s VAL 18 CO 0.41 0.02 1.36 -2.84 0.00 0.00 0.00 175.10 174.05 1phd s PRO 19 N 2.33 4.34 0.34 2.72 0.02 -1.26 -4.88 135.00 138.61 1phd s PRO 19 Ca 0.20 2.14 0.24 0.00 0.02 0.00 0.00 61.00 63.60 1phd s PRO 19 Cb -0.16 -3.17 1.21 0.00 0.02 0.00 0.00 34.50 32.41 1phd s PRO 19 CO 0.10 -0.32 1.73 1.05 -0.33 0.00 0.00 177.00 179.23 1phd h GLU 20 N 5.38 0.00 0.00 5.54 4.11 -1.97 0.23 114.58 127.87 1phd h GLU 20 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 1phd h GLU 20 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1phd h GLU 20 CO 0.78 0.00 0.00 1.12 0.07 0.00 0.00 179.01 180.98 1phd h HIS 21 N 0.00 0.00 -0.02 2.06 2.07 -2.03 -2.91 115.15 114.33 1phd h HIS 21 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1phd h HIS 21 Cb 0.11 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.09 1phd h HIS 21 CO 0.00 0.00 -0.16 1.28 -3.07 0.00 0.00 177.93 175.98 1phd n LEU 22 N -2.61 1.99 -4.72 6.12 4.77 0.07 -4.89 117.00 117.72 1phd n LEU 22 Ca 0.04 -0.67 -0.42 0.00 -0.03 0.00 0.00 56.01 54.94 1phd n LEU 22 Cb 0.43 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 1phd n LEU 22 CO 0.30 0.34 0.90 -0.69 -1.33 0.00 0.00 177.39 176.91 1phd s VAL 23 N -2.21 3.75 -0.28 4.08 1.01 -1.10 -0.02 120.40 125.63 1phd s VAL 23 Ca 0.28 1.35 0.01 0.00 0.00 0.00 0.00 61.98 63.62 1phd s VAL 23 Cb 0.20 -3.86 0.16 0.00 0.00 0.00 0.00 36.38 32.87 1phd s VAL 23 CO 0.42 0.16 0.42 0.12 0.00 0.00 0.00 175.10 176.22 1phd s PHE 24 N 0.54 -1.05 -1.16 5.22 5.36 -0.34 -4.87 117.98 121.67 1phd s PHE 24 Ca 0.56 0.58 -0.21 0.00 -0.96 0.00 0.00 56.93 56.91 1phd s PHE 24 Cb -0.32 -0.04 0.05 0.00 -0.34 0.00 0.00 43.02 42.38 1phd s PHE 24 CO 0.33 -0.92 1.62 -0.51 -1.46 0.00 0.00 175.22 174.28 1phd s ASP 25 N 2.58 6.59 -0.09 6.13 1.01 -1.26 -3.84 116.67 127.79 1phd s ASP 25 Ca 0.11 -1.93 -0.16 0.00 0.71 0.00 0.00 52.55 51.29 1phd s ASP 25 Cb -0.13 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.18 1phd s ASP 25 CO -0.26 -1.42 0.39 0.12 0.21 0.00 0.00 175.17 174.22 1phd s PHE 26 N 4.90 3.57 -0.40 4.23 5.36 -1.26 -4.96 117.98 129.42 1phd s PHE 26 Ca 0.51 0.83 -0.05 0.00 -0.96 0.00 0.00 56.93 57.27 1phd s PHE 26 Cb 0.02 -2.39 0.09 0.00 -0.34 0.00 0.00 43.02 40.40 1phd s PHE 26 CO -0.00 0.36 0.20 0.34 -1.46 0.00 0.00 175.22 174.65 1phd s ASP 27 N -0.01 5.32 0.52 6.13 2.15 -1.26 -4.42 116.67 125.11 1phd s ASP 27 Ca 0.22 -1.78 0.35 0.00 0.43 0.00 0.00 52.55 51.77 1phd s ASP 27 Cb -0.15 -1.86 1.91 0.00 -0.30 0.00 0.00 42.92 42.52 1phd s ASP 27 CO 0.09 -0.51 2.08 0.00 -0.17 0.00 0.00 175.17 176.66 1phd h MET 28 N 8.15 0.00 0.00 4.34 -0.00 -1.97 -0.63 114.93 124.83 1phd h MET 28 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.53 1phd h MET 28 Cb 1.06 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.66 1phd h MET 28 CO 0.70 0.00 -0.94 0.66 -0.00 0.00 0.00 176.91 177.33 1phd n TYR 29 N -2.74 0.03 -2.73 -0.10 4.01 -1.26 -3.39 117.16 110.97 1phd n TYR 29 Ca -0.02 0.01 -0.07 0.00 -0.16 0.00 0.00 57.90 57.66 1phd n TYR 29 Cb 0.06 -0.13 0.05 0.00 -0.31 0.00 0.00 39.34 39.02 1phd n TYR 29 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1phd n ASN 30 N -1.59 -2.54 -4.64 7.72 2.85 -0.38 -4.58 115.26 112.11 1phd n ASN 30 Ca 0.04 -2.85 -0.30 0.00 -0.11 0.00 0.00 54.58 51.36 1phd n ASN 30 Cb 0.35 1.54 0.18 0.00 1.24 0.00 0.00 39.78 43.09 1phd n ASN 30 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1phd s PRO 31 N 0.59 0.59 -0.03 1.20 0.04 -0.41 -4.58 135.00 132.39 1phd s PRO 31 Ca 0.30 1.17 -0.26 0.00 0.04 0.00 0.00 61.00 62.25 1phd s PRO 31 Cb 0.20 -1.70 -0.21 0.00 0.04 0.00 0.00 34.50 32.83 1phd s PRO 31 CO -0.19 -2.80 1.21 0.77 0.04 0.00 0.00 177.00 176.03 1phd h SER 32 N -1.98 0.01 -0.19 6.66 0.02 -1.87 -3.28 113.55 112.93 1phd h SER 32 Ca -0.50 -0.55 -0.07 0.00 -0.84 0.00 0.00 61.79 59.84 1phd h SER 32 Cb 1.29 -0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.78 1phd h SER 32 CO 0.47 0.56 0.09 0.59 -1.14 0.00 0.00 176.83 177.40 1phd n ASN 33 N -4.82 2.71 -0.30 3.07 3.02 -1.26 -4.62 115.26 113.07 1phd n ASN 33 Ca -0.09 -2.31 0.12 0.00 -0.03 0.00 0.00 54.58 52.28 1phd n ASN 33 Cb 0.28 -0.56 0.27 0.00 -0.61 0.00 0.00 39.78 39.16 1phd n ASN 33 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1phd h LEU 34 N 0.98 -0.10 -1.16 3.41 5.85 -1.79 0.24 115.31 122.73 1phd h LEU 34 Ca 0.08 0.21 0.25 0.00 0.84 0.00 0.00 57.88 59.26 1phd h LEU 34 Cb 1.18 0.30 -0.11 0.00 0.37 0.00 0.00 40.66 42.40 1phd h LEU 34 CO 0.20 -0.18 0.63 0.28 -0.34 0.00 0.00 178.44 179.02 1phd h SER 35 N 0.17 0.58 0.62 1.25 0.02 -1.91 0.33 113.55 114.61 1phd h SER 35 Ca 0.54 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.60 1phd h SER 35 Cb 1.07 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1phd h SER 35 CO -0.68 0.10 0.00 0.00 -1.14 0.00 0.00 176.83 175.11 1phd h ALA 36 N 1.68 1.00 0.00 3.77 0.00 -0.90 -3.48 119.26 121.33 1phd h ALA 36 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 1phd h ALA 36 Cb 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1phd h ALA 36 CO -0.40 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.26 1phd n GLY 37 N -0.32 3.37 0.27 0.00 0.00 0.11 -4.73 105.19 103.88 1phd n GLY 37 Ca 0.00 -1.77 -0.11 0.00 0.00 0.00 0.00 46.02 44.14 1phd n GLY 37 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1phd h VAL 38 N 0.00 1.27 -0.24 1.61 3.04 -1.88 -1.19 116.25 118.85 1phd h VAL 38 Ca 0.00 -1.49 -0.19 0.00 -1.01 0.00 0.00 66.70 64.01 1phd h VAL 38 Cb 0.00 1.31 0.00 0.00 -2.01 0.00 0.00 31.29 30.59 1phd h VAL 38 CO 0.00 0.50 -0.60 1.56 -1.01 0.00 0.00 177.57 178.02 1phd h GLN 39 N 0.75 0.82 -0.37 4.17 7.50 -1.92 -2.57 115.11 123.48 1phd h GLN 39 Ca 0.08 -0.55 -0.05 0.00 0.50 0.00 0.00 58.65 58.62 1phd h GLN 39 Cb 0.90 0.08 -0.02 0.00 0.05 0.00 0.00 27.48 28.48 1phd h GLN 39 CO 0.08 1.18 0.02 0.93 -1.50 0.00 0.00 178.83 179.54 1phd h GLU 40 N 0.61 0.58 -0.41 1.46 3.07 -1.82 -2.46 114.58 115.61 1phd h GLU 40 Ca -0.00 -0.12 -0.07 0.00 -0.50 0.00 0.00 59.36 58.66 1phd h GLU 40 Cb 1.21 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 29.02 1phd h GLU 40 CO 0.13 0.59 -0.04 0.00 -1.40 0.00 0.00 179.01 178.29 1phd h ALA 41 N 1.47 0.56 -0.32 3.43 0.00 -0.84 -3.14 119.26 120.42 1phd h ALA 41 Ca 0.12 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 1phd h ALA 41 Cb 0.33 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1phd h ALA 41 CO 0.01 0.37 -0.35 -1.49 0.00 0.00 0.00 179.25 177.79 1phd h TRP 42 N 0.57 0.85 0.00 0.00 4.06 -1.47 -3.17 115.95 116.80 1phd h TRP 42 Ca 0.11 -0.24 0.00 0.00 2.06 0.00 0.00 58.89 60.83 1phd h TRP 42 Cb 0.54 -0.19 0.00 0.00 -1.00 0.00 0.00 29.16 28.51 1phd h TRP 42 CO 0.04 0.97 0.00 0.00 -3.56 0.00 0.00 178.44 175.89 1phd n ALA 43 N -2.51 1.12 0.18 1.49 0.00 -0.93 -1.90 120.51 117.96 1phd n ALA 43 Ca -0.01 -0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.46 1phd n ALA 43 Cb 0.50 -1.04 0.43 0.00 0.00 0.00 0.00 19.45 19.35 1phd n ALA 43 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1phd h VAL 44 N 0.00 1.17 0.00 0.00 -1.51 -1.63 -1.27 116.25 113.01 1phd h VAL 44 Ca 0.00 -0.81 0.00 0.00 -1.23 0.00 0.00 66.70 64.66 1phd h VAL 44 Cb 0.04 1.37 0.00 0.00 -2.13 0.00 0.00 31.29 30.57 1phd h VAL 44 CO 0.00 0.24 0.02 -0.07 -1.23 0.00 0.00 177.57 176.53 1phd h LEU 45 N 0.07 0.00 -2.38 4.19 3.38 -1.63 -2.51 115.31 116.42 1phd h LEU 45 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1phd h LEU 45 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1phd h LEU 45 CO 0.03 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.56 1phd n GLN 46 N -2.51 2.19 -1.77 1.13 6.02 -0.48 -4.75 117.38 117.19 1phd n GLN 46 Ca -0.02 -1.92 -0.35 0.00 -0.01 0.00 0.00 57.00 54.70 1phd n GLN 46 Cb 0.06 -1.33 0.06 0.00 1.02 0.00 0.00 30.24 30.05 1phd n GLN 46 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1phd s GLU 47 N -1.08 2.66 0.38 -1.09 0.41 -0.95 -4.92 118.70 114.10 1phd s GLU 47 Ca 0.26 1.75 0.14 0.00 -0.41 0.00 0.00 54.97 56.70 1phd s GLU 47 Cb 0.15 -1.90 0.97 0.00 -1.78 0.00 0.00 34.13 31.57 1phd s GLU 47 CO 0.20 -1.43 1.81 0.66 -0.49 0.00 0.00 175.26 176.01 1phd h SER 48 N 0.36 0.55 0.47 -0.19 4.64 -1.94 0.26 113.55 117.69 1phd h SER 48 Ca -0.49 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1phd h SER 48 Cb 1.29 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1phd h SER 48 CO 0.53 0.19 0.00 -0.55 -0.87 0.00 0.00 176.83 176.13 1phd h ASN 49 N 0.53 0.00 -3.34 4.97 -0.00 -1.94 -3.43 115.58 112.36 1phd h ASN 49 Ca 0.53 0.00 -0.59 0.00 -0.00 0.00 0.00 56.30 56.24 1phd h ASN 49 Cb 1.14 0.00 -0.10 0.00 -0.00 0.00 0.00 38.32 39.36 1phd h ASN 49 CO -0.26 0.00 -0.26 -0.69 -0.00 0.00 0.00 177.43 176.22 1phd s VAL 50 N -3.64 5.26 0.66 6.14 1.01 0.90 -5.07 120.40 125.66 1phd s VAL 50 Ca -0.00 0.68 -0.16 0.00 0.00 0.00 0.00 61.98 62.50 1phd s VAL 50 Cb 0.09 -3.70 -0.00 0.00 0.00 0.00 0.00 36.38 32.78 1phd s VAL 50 CO 0.38 0.34 1.14 -2.84 0.00 0.00 0.00 175.10 174.13 1phd s PRO 51 N 0.69 2.72 0.37 2.72 0.02 -1.26 -4.85 135.00 135.41 1phd s PRO 51 Ca 0.19 1.54 0.07 0.00 0.02 0.00 0.00 61.00 62.82 1phd s PRO 51 Cb -0.14 -1.93 0.78 0.00 0.02 0.00 0.00 34.50 33.23 1phd s PRO 51 CO 0.06 -1.34 1.96 -0.44 -0.33 0.00 0.00 177.00 176.91 1phd h ASP 52 N 0.17 0.63 -3.19 2.53 5.19 -1.94 -3.40 116.42 116.41 1phd h ASP 52 Ca -0.48 0.01 -0.56 0.00 -0.62 0.00 0.00 57.03 55.38 1phd h ASP 52 Cb 1.26 -0.13 -0.36 0.00 0.18 0.00 0.00 39.33 40.29 1phd h ASP 52 CO 0.53 0.40 -0.82 -0.22 -3.12 0.00 0.00 179.24 176.02 1phd s LEU 53 N -9.67 1.46 0.37 1.55 2.96 -1.26 -1.04 118.68 113.05 1phd s LEU 53 Ca -0.09 -0.38 0.06 0.00 -0.22 0.00 0.00 54.13 53.50 1phd s LEU 53 Cb 0.19 -0.98 -0.07 0.00 0.50 0.00 0.00 46.19 45.83 1phd s LEU 53 CO 0.77 -0.07 0.02 0.68 -1.32 0.00 0.00 176.35 176.43 1phd s VAL 54 N 1.45 1.73 -0.05 1.68 -7.23 -0.83 -4.93 120.40 112.22 1phd s VAL 54 Ca 0.02 -2.02 0.06 0.00 -1.81 0.00 0.00 61.98 58.23 1phd s VAL 54 Cb -0.13 -2.89 -0.01 0.00 0.56 0.00 0.00 36.38 33.90 1phd s VAL 54 CO -0.07 -0.02 -0.24 0.86 -0.31 0.00 0.00 175.10 175.32 1phd s TRP 55 N -2.91 2.30 0.15 2.82 -0.11 0.96 -1.01 118.94 121.15 1phd s TRP 55 Ca 0.35 -0.67 0.08 0.00 1.22 0.00 0.00 56.10 57.08 1phd s TRP 55 Cb 0.09 -1.51 -0.04 0.00 -1.50 0.00 0.00 33.47 30.51 1phd s TRP 55 CO 0.17 -0.20 -0.10 -0.08 -4.62 0.00 0.00 176.95 172.12 1phd s THR 56 N -0.14 3.24 -2.91 5.86 -1.32 0.63 -1.20 115.64 119.79 1phd s THR 56 Ca -0.03 -1.53 0.24 0.00 -1.21 0.00 0.00 61.69 59.16 1phd s THR 56 Cb -0.13 -2.57 0.24 0.00 -1.51 0.00 0.00 72.50 68.52 1phd s THR 56 CO 0.03 -0.03 1.30 0.54 -2.21 0.00 0.00 174.62 174.25 1phd n ARG 57 N 0.27 2.31 -2.31 7.08 1.74 -1.26 -1.97 116.66 122.52 1phd n ARG 57 Ca -0.12 -1.91 -0.28 0.00 -0.77 0.00 0.00 57.85 54.77 1phd n ARG 57 Cb 0.54 -1.47 0.02 0.00 -1.02 0.00 0.00 32.46 30.54 1phd n ARG 57 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1phd n ASN 59 N -2.57 -4.38 0.00 0.00 4.13 -1.26 -1.89 115.26 109.29 1phd n ASN 59 Ca 0.04 -0.29 0.00 0.00 1.68 0.00 0.00 54.58 56.01 1phd n ASN 59 Cb 0.56 -3.61 0.00 0.00 -1.54 0.00 0.00 39.78 35.19 1phd n ASN 59 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1phd n GLY 60 N -1.22 0.80 0.05 7.41 0.00 -1.26 -4.61 105.19 106.36 1phd n GLY 60 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1phd n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1phd n GLY 61 N -2.09 -3.35 3.60 -0.02 0.00 -0.79 -4.93 105.19 97.61 1phd n GLY 61 Ca 0.00 -0.96 -0.06 0.00 0.00 0.00 0.00 46.02 44.99 1phd n GLY 61 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1phd s HIS 62 N -1.07 -0.26 0.48 1.61 -3.43 -0.83 -4.81 115.29 106.98 1phd s HIS 62 Ca 0.00 0.06 -0.05 0.00 -0.80 0.00 0.00 55.06 54.27 1phd s HIS 62 Cb 0.00 0.58 -0.03 0.00 -1.43 0.00 0.00 32.58 31.70 1phd s HIS 62 CO 0.00 -0.67 0.78 -1.58 -2.00 0.00 0.00 174.74 171.27 1phd s TRP 63 N -3.21 3.52 -0.05 0.38 0.52 -0.52 -0.27 118.94 119.31 1phd s TRP 63 Ca 0.08 0.76 -0.01 0.00 0.02 0.00 0.00 56.10 56.95 1phd s TRP 63 Cb -0.01 -2.32 0.03 0.00 -1.15 0.00 0.00 33.47 30.02 1phd s TRP 63 CO -0.05 -0.31 0.01 0.42 0.02 0.00 0.00 176.95 177.04 1phd s ILE 64 N -2.74 0.27 -0.01 2.03 1.01 -0.18 0.50 121.20 122.10 1phd s ILE 64 Ca 0.48 0.13 -0.23 0.00 0.00 0.00 0.00 60.65 61.03 1phd s ILE 64 Cb -0.10 -0.42 -0.05 0.00 0.01 0.00 0.00 42.46 41.90 1phd s ILE 64 CO 0.44 0.22 0.67 0.00 0.00 0.00 0.00 174.94 176.27 1phd s ALA 65 N 1.66 3.41 -1.27 9.38 0.00 -0.89 -1.96 121.76 132.10 1phd s ALA 65 Ca -0.00 0.13 0.11 0.00 0.00 0.00 0.00 51.96 52.19 1phd s ALA 65 Cb -0.13 -2.87 0.07 0.00 0.00 0.00 0.00 23.12 20.19 1phd s ALA 65 CO -0.03 0.06 0.80 0.25 0.00 0.00 0.00 175.76 176.84 1phd n THR 66 N 3.05 0.00 -4.69 0.00 -2.24 -0.21 -4.48 114.28 105.71 1phd n THR 66 Ca -0.04 -0.48 -0.24 0.00 -2.27 0.00 0.00 64.05 61.02 1phd n THR 66 Cb 0.51 1.20 -0.16 0.00 -2.10 0.00 0.00 70.33 69.79 1phd n THR 66 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1phd s ARG 67 N -1.00 1.40 0.38 -0.78 1.81 -1.26 -4.77 118.95 114.73 1phd s ARG 67 Ca 0.12 -0.52 0.21 0.00 -1.72 0.00 0.00 55.73 53.81 1phd s ARG 67 Cb 0.09 -1.28 1.21 0.00 -0.45 0.00 0.00 34.95 34.52 1phd s ARG 67 CO 0.16 0.24 1.67 0.78 -0.68 0.00 0.00 175.30 177.47 1phd h GLY 68 N 6.11 1.67 0.79 -3.53 0.00 -1.83 -0.30 103.07 105.99 1phd h GLY 68 Ca -0.34 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 46.77 1phd h GLY 68 CO 0.48 -0.41 -0.02 -1.61 0.00 0.00 0.00 176.54 174.98 1phd h GLN 69 N 0.25 0.32 -0.20 4.80 4.15 -1.96 -2.37 115.11 120.10 1phd h GLN 69 Ca 0.74 -0.11 -0.04 0.00 0.77 0.00 0.00 58.65 60.01 1phd h GLN 69 Cb 1.96 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 29.62 1phd h GLN 69 CO -0.49 0.56 -0.04 -0.07 -1.93 0.00 0.00 178.83 176.86 1phd h LEU 70 N 0.04 0.37 -0.36 -2.39 4.07 -1.53 -2.66 115.31 112.87 1phd h LEU 70 Ca 0.05 -0.35 0.05 0.00 0.08 0.00 0.00 57.88 57.71 1phd h LEU 70 Cb 0.43 -0.10 -0.05 0.00 1.08 0.00 0.00 40.66 42.02 1phd h LEU 70 CO 0.01 0.64 0.06 0.40 -1.08 0.00 0.00 178.44 178.47 1phd h ILE 71 N 0.10 0.81 -0.50 1.22 2.04 -1.20 0.19 117.51 120.17 1phd h ILE 71 Ca 0.05 -0.06 0.03 0.00 1.00 0.00 0.00 64.86 65.88 1phd h ILE 71 Cb 0.47 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 1phd h ILE 71 CO 0.02 0.03 0.29 0.03 0.00 0.00 0.00 178.15 178.52 1phd h ARG 72 N 0.18 0.55 -0.23 2.37 3.08 -1.49 0.52 114.38 119.36 1phd h ARG 72 Ca 0.17 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 1phd h ARG 72 Cb 0.20 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1phd h ARG 72 CO -0.23 0.36 0.09 0.93 -1.07 0.00 0.00 179.97 180.05 1phd h GLU 73 N 0.57 0.34 -0.49 0.04 5.08 -1.04 -1.31 114.58 117.78 1phd h GLU 73 Ca 0.21 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.45 1phd h GLU 73 Cb 0.05 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1phd h GLU 73 CO -0.11 0.40 0.10 0.00 -1.00 0.00 0.00 179.01 178.40 1phd h ALA 74 N 0.92 1.27 0.00 3.43 0.00 -0.39 -2.48 119.26 122.01 1phd h ALA 74 Ca 0.07 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1phd h ALA 74 Cb 0.19 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1phd h ALA 74 CO -0.01 0.51 -0.23 1.88 0.00 0.00 0.00 179.25 181.40 1phd h TYR 75 N 0.72 0.00 0.22 0.00 0.05 -0.48 -3.17 116.97 114.31 1phd h TYR 75 Ca 0.16 0.00 -0.34 0.00 0.05 0.00 0.00 58.73 58.60 1phd h TYR 75 Cb 0.29 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.06 1phd h TYR 75 CO 0.02 0.23 -1.53 0.93 -1.05 0.00 0.00 178.16 176.75 1phd h GLU 76 N 0.00 0.47 -2.62 4.88 5.08 -0.96 -3.38 114.58 118.05 1phd h GLU 76 Ca -0.00 -0.81 -0.29 0.00 -1.00 0.00 0.00 59.36 57.26 1phd h GLU 76 Cb 0.45 0.30 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 1phd h GLU 76 CO 0.03 1.38 1.16 -3.47 -1.00 0.00 0.00 179.01 177.11 1phd n ASP 77 N -3.66 5.16 0.32 1.42 2.03 -0.96 -4.76 116.55 116.10 1phd n ASP 77 Ca -0.18 -2.33 0.22 0.00 0.52 0.00 0.00 54.79 53.01 1phd n ASP 77 Cb 1.09 -1.19 1.16 0.00 -0.72 0.00 0.00 41.12 41.46 1phd n ASP 77 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 1phd h TYR 78 N 4.46 0.00 -0.73 -0.67 -0.00 -1.77 0.52 116.97 118.77 1phd h TYR 78 Ca 0.36 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 59.06 1phd h TYR 78 Cb 0.80 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.50 1phd h TYR 78 CO 1.74 0.00 0.36 -0.09 -0.00 0.00 0.00 178.16 180.17 1phd h ARG 79 N 0.00 1.05 0.02 0.10 9.65 -1.95 -3.33 114.38 119.92 1phd h ARG 79 Ca 0.00 -0.15 -0.31 0.00 -1.10 0.00 0.00 59.98 58.42 1phd h ARG 79 Cb 0.01 -0.19 -0.04 0.00 -1.39 0.00 0.00 29.97 28.36 1phd h ARG 79 CO 0.00 0.81 -1.69 0.72 2.80 0.00 0.00 179.97 182.61 1phd n HIS 80 N -4.42 0.82 -3.24 2.20 8.25 -0.95 -4.72 115.22 113.16 1phd n HIS 80 Ca 0.06 0.31 -0.46 0.00 -0.26 0.00 0.00 57.72 57.37 1phd n HIS 80 Cb 0.12 -1.09 -0.04 0.00 1.12 0.00 0.00 29.99 30.10 1phd n HIS 80 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1phd s PHE 81 N -2.43 3.24 0.04 4.41 0.08 0.13 -1.50 117.98 121.95 1phd s PHE 81 Ca -0.30 -1.30 -0.11 0.00 0.12 0.00 0.00 56.93 55.34 1phd s PHE 81 Cb 0.08 -3.89 -0.06 0.00 -0.57 0.00 0.00 43.02 38.59 1phd s PHE 81 CO 0.60 -1.12 0.38 0.45 -0.10 0.00 0.00 175.22 175.44 1phd s SER 82 N 3.40 6.68 0.00 1.36 0.15 0.13 -4.01 113.70 121.41 1phd s SER 82 Ca 0.09 0.82 0.31 0.00 0.70 0.00 0.00 55.95 57.87 1phd s SER 82 Cb -0.24 -2.19 1.73 0.00 -1.71 0.00 0.00 66.02 63.60 1phd s SER 82 CO 0.02 0.24 2.13 -1.20 1.20 0.00 0.00 173.24 175.63 1phd n SER 83 N 1.27 0.23 -0.30 5.45 7.64 -1.26 -0.60 113.62 126.05 1phd n SER 83 Ca -0.11 -0.99 0.12 0.00 1.01 0.00 0.00 58.87 58.90 1phd n SER 83 Cb 0.52 -0.02 0.29 0.00 -1.01 0.00 0.00 64.21 63.99 1phd n SER 83 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1phd h GLU 84 N 0.36 0.43 -2.62 1.43 4.81 -1.86 -3.29 114.58 113.84 1phd h GLU 84 Ca 0.00 -0.03 -0.60 0.00 -0.13 0.00 0.00 59.36 58.60 1phd h GLU 84 Cb 0.11 -0.10 -0.39 0.00 0.63 0.00 0.00 28.75 29.00 1phd h GLU 84 CO 0.00 0.29 -0.83 0.00 -0.73 0.00 0.00 179.01 177.73 1phd n PRO 86 N 2.52 1.38 -4.89 0.00 -0.04 -1.24 -3.78 135.00 128.95 1phd n PRO 86 Ca 0.26 -0.97 -0.28 0.00 -0.04 0.00 0.00 63.50 62.47 1phd n PRO 86 Cb 0.43 -1.48 -0.15 0.00 -0.04 0.00 0.00 33.50 32.26 1phd n PRO 86 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1phd s PHE 87 N -2.29 2.10 -0.14 0.54 0.40 -1.26 -1.19 117.98 116.15 1phd s PHE 87 Ca 0.27 -0.40 -0.06 0.00 -0.60 0.00 0.00 56.93 56.14 1phd s PHE 87 Cb 0.20 -1.28 -0.04 0.00 0.51 0.00 0.00 43.02 42.40 1phd s PHE 87 CO 0.45 0.07 0.08 0.42 0.70 0.00 0.00 175.22 176.94 1phd s ILE 88 N -0.74 4.97 0.92 0.64 1.01 -1.26 -2.20 121.20 124.55 1phd s ILE 88 Ca 0.10 0.02 -0.12 0.00 0.00 0.00 0.00 60.65 60.64 1phd s ILE 88 Cb -0.09 -3.18 0.14 0.00 0.01 0.00 0.00 42.46 39.33 1phd s ILE 88 CO 0.01 0.55 1.13 -2.16 0.00 0.00 0.00 174.94 174.47 1phd s PRO 89 N -0.41 1.08 0.12 2.79 0.04 -1.26 -4.86 135.00 132.50 1phd s PRO 89 Ca 0.10 0.30 -0.22 0.00 0.04 0.00 0.00 61.00 61.22 1phd s PRO 89 Cb -0.12 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.53 1phd s PRO 89 CO 0.02 -2.24 1.69 -0.09 0.04 0.00 0.00 177.00 176.42 1phd h ARG 90 N -1.53 -0.10 -1.03 4.56 2.43 -1.82 0.32 114.38 117.21 1phd h ARG 90 Ca -0.51 0.01 0.26 0.00 -0.81 0.00 0.00 59.98 58.93 1phd h ARG 90 Cb 1.33 0.02 -0.11 0.00 -0.42 0.00 0.00 29.97 30.79 1phd h ARG 90 CO 0.62 -0.07 0.63 0.93 -1.51 0.00 0.00 179.97 180.57 1phd h GLU 91 N -0.11 0.48 -0.04 0.20 3.07 -1.98 0.81 114.58 117.01 1phd h GLU 91 Ca 0.07 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 58.89 1phd h GLU 91 Cb 0.20 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1phd h GLU 91 CO -0.16 0.31 -0.01 0.00 -1.40 0.00 0.00 179.01 177.75 1phd h ALA 92 N 1.69 0.05 -0.01 3.43 0.00 -1.52 -0.28 119.26 122.62 1phd h ALA 92 Ca 0.64 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 55.26 1phd h ALA 92 Cb 1.39 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1phd h ALA 92 CO -0.42 -0.24 -0.38 0.78 0.00 0.00 0.00 179.25 178.99 1phd h GLY 93 N -0.29 0.02 0.73 0.00 0.00 0.11 -2.27 103.07 101.35 1phd h GLY 93 Ca 0.01 -0.02 -0.05 0.00 0.00 0.00 0.00 47.33 47.27 1phd h GLY 93 CO 0.00 0.01 -0.10 0.83 0.00 0.00 0.00 176.54 177.28 1phd h GLU 94 N 0.01 0.31 0.00 4.80 5.08 0.60 -3.27 114.58 122.10 1phd h GLU 94 Ca -0.00 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.18 1phd h GLU 94 Cb 0.68 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 1phd h GLU 94 CO 0.05 0.68 -0.13 0.00 -1.00 0.00 0.00 179.01 178.61 1phd h ALA 95 N 0.62 0.93 -2.76 3.43 0.00 -0.92 -3.44 119.26 117.13 1phd h ALA 95 Ca 0.03 -0.12 -0.50 0.00 0.00 0.00 0.00 54.91 54.31 1phd h ALA 95 Cb 0.61 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.40 1phd h ALA 95 CO 0.03 0.16 0.49 -0.47 0.00 0.00 0.00 179.25 179.46 1phd s TYR 96 N -3.25 3.40 -0.16 0.00 6.14 -0.87 -4.92 117.35 117.69 1phd s TYR 96 Ca 0.05 1.64 0.17 0.00 0.64 0.00 0.00 57.07 59.57 1phd s TYR 96 Cb 0.07 -3.32 0.37 0.00 0.42 0.00 0.00 41.96 39.50 1phd s TYR 96 CO 0.67 -0.81 1.21 -0.40 0.64 0.00 0.00 175.55 176.86 1phd n ASP 97 N 0.80 0.24 -4.77 4.32 5.68 -1.26 -4.94 116.55 116.62 1phd n ASP 97 Ca 0.01 -2.06 -0.37 0.00 -0.50 0.00 0.00 54.79 51.87 1phd n ASP 97 Cb 0.45 -0.02 -0.01 0.00 -1.14 0.00 0.00 41.12 40.41 1phd n ASP 97 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 1phd s PHE 98 N -1.22 2.84 -0.02 2.11 0.08 -1.26 -4.85 117.98 115.67 1phd s PHE 98 Ca 0.20 1.53 0.04 0.00 0.12 0.00 0.00 56.93 58.82 1phd s PHE 98 Cb 0.31 -3.40 -0.03 0.00 -0.57 0.00 0.00 43.02 39.33 1phd s PHE 98 CO -0.09 -1.58 -0.13 0.42 -0.10 0.00 0.00 175.22 173.74 1phd s ILE 99 N -1.54 3.16 -1.95 0.64 1.01 -0.89 -0.47 121.20 121.16 1phd s ILE 99 Ca 0.64 -0.84 0.14 0.00 0.00 0.00 0.00 60.65 60.59 1phd s ILE 99 Cb -0.29 -2.30 0.40 0.00 0.01 0.00 0.00 42.46 40.29 1phd s ILE 99 CO 0.35 0.48 1.33 -0.81 0.00 0.00 0.00 174.94 176.30 1phd n PRO 100 N 1.94 2.10 0.06 2.79 -0.05 -1.26 -4.05 135.00 136.53 1phd n PRO 100 Ca -0.17 -1.64 0.01 0.00 -0.05 0.00 0.00 63.50 61.66 1phd n PRO 100 Cb 0.52 -1.37 0.35 0.00 -0.05 0.00 0.00 33.50 32.95 1phd n PRO 100 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 175.50 177.24 1phd h THR 101 N 2.64 1.18 -0.53 0.52 1.35 -1.94 -2.34 112.91 113.78 1phd h THR 101 Ca 0.00 -0.74 -0.11 0.00 -0.55 0.00 0.00 66.41 65.01 1phd h THR 101 Cb 0.63 1.05 -0.07 0.00 -1.73 0.00 0.00 68.15 68.04 1phd h THR 101 CO 0.01 0.24 0.14 -1.54 -0.25 0.00 0.00 175.52 174.13 1phd n SER 102 N -4.29 4.34 -4.28 5.36 3.41 0.38 -4.76 113.62 113.78 1phd n SER 102 Ca 0.00 -2.86 -0.18 0.00 -0.26 0.00 0.00 58.87 55.57 1phd n SER 102 Cb 0.24 -0.68 -0.11 0.00 -0.26 0.00 0.00 64.21 63.41 1phd n SER 102 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1phd s MET 103 N -2.40 1.15 0.31 4.33 -1.94 -0.88 -3.94 119.30 115.92 1phd s MET 103 Ca 0.42 -1.39 0.08 0.00 -1.71 0.00 0.00 55.69 53.09 1phd s MET 103 Cb 0.33 -0.98 -0.03 0.00 2.01 0.00 0.00 34.83 36.16 1phd s MET 103 CO 0.11 0.18 0.19 -0.51 -0.01 0.00 0.00 175.02 174.98 1phd s ASP 104 N -2.82 5.10 0.48 3.03 1.01 -1.26 -4.69 116.67 117.53 1phd s ASP 104 Ca 0.15 -0.52 -0.23 0.00 0.71 0.00 0.00 52.55 52.66 1phd s ASP 104 Cb -0.03 -1.00 -0.07 0.00 1.01 0.00 0.00 42.92 42.83 1phd s ASP 104 CO 0.04 -0.22 1.23 -2.84 0.21 0.00 0.00 175.17 173.60 1phd s PRO 105 N -3.88 3.58 0.00 8.23 0.02 -1.26 -1.83 135.00 139.86 1phd s PRO 105 Ca 0.37 1.94 0.26 0.00 0.02 0.00 0.00 61.00 63.59 1phd s PRO 105 Cb -0.06 -2.38 0.73 0.00 0.02 0.00 0.00 34.50 32.81 1phd s PRO 105 CO 0.24 -0.75 1.56 -0.35 -0.33 0.00 0.00 177.00 177.38 1phd n PRO 106 N -0.62 0.30 -0.22 5.54 -0.04 -1.26 -4.84 135.00 133.87 1phd n PRO 106 Ca 0.08 -0.16 -0.06 0.00 -0.04 0.00 0.00 63.50 63.32 1phd n PRO 106 Cb 0.47 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.47 1phd n PRO 106 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1phd h GLU 107 N 0.38 0.84 -0.70 0.54 4.81 -1.90 -2.64 114.58 115.92 1phd h GLU 107 Ca 0.00 -0.07 0.14 0.00 -0.13 0.00 0.00 59.36 59.30 1phd h GLU 107 Cb 0.48 -0.18 -0.13 0.00 0.63 0.00 0.00 28.75 29.55 1phd h GLU 107 CO 0.00 0.59 -0.17 0.37 -0.73 0.00 0.00 179.01 179.06 1phd h GLN 108 N 0.85 -0.00 -0.75 1.92 -0.00 -1.64 -3.19 115.11 112.30 1phd h GLN 108 Ca 0.23 0.00 0.16 0.00 -0.00 0.00 0.00 58.65 59.03 1phd h GLN 108 Cb -0.05 0.00 -0.14 0.00 0.00 0.00 0.00 27.48 27.29 1phd h GLN 108 CO -0.04 -0.00 -0.14 -0.09 0.00 0.00 0.00 178.83 178.55 1phd h ARG 109 N -0.00 0.02 0.30 1.69 2.43 -1.76 0.06 114.38 117.12 1phd h ARG 109 Ca 0.33 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.49 1phd h ARG 109 Cb 0.51 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1phd h ARG 109 CO -0.72 0.01 -0.15 1.96 -1.51 0.00 0.00 179.97 179.57 1phd h GLN 110 N 0.02 -0.39 -0.31 0.20 1.08 -1.73 -1.85 115.11 112.12 1phd h GLN 110 Ca 0.37 0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.59 1phd h GLN 110 Cb 0.59 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.10 1phd h GLN 110 CO -0.75 -0.21 0.15 0.74 -0.95 0.00 0.00 178.83 177.82 1phd h PHE 111 N -0.48 0.42 0.21 2.96 0.04 -1.59 -2.59 116.94 115.90 1phd h PHE 111 Ca -0.04 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 1phd h PHE 111 Cb 0.36 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.38 1phd h PHE 111 CO -0.04 0.31 -0.10 -0.09 -0.60 0.00 0.00 178.31 177.80 1phd h ARG 112 N 0.44 -0.27 -0.97 1.51 2.43 -0.88 -2.29 114.38 114.35 1phd h ARG 112 Ca 0.11 0.02 0.17 0.00 -0.81 0.00 0.00 59.98 59.47 1phd h ARG 112 Cb 0.05 0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 29.56 1phd h ARG 112 CO -0.02 -0.11 0.57 0.00 -1.51 0.00 0.00 179.97 178.90 1phd h ALA 113 N 0.41 1.55 -0.26 2.80 0.00 -0.95 -1.46 119.26 121.35 1phd h ALA 113 Ca -0.03 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1phd h ALA 113 Cb 0.28 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1phd h ALA 113 CO 0.05 -0.02 -0.25 1.25 0.00 0.00 0.00 179.25 180.28 1phd h LEU 114 N 0.76 0.66 -1.26 0.00 5.85 -1.31 -2.94 115.31 117.07 1phd h LEU 114 Ca 0.54 -0.47 0.04 0.00 0.84 0.00 0.00 57.88 58.83 1phd h LEU 114 Cb 0.78 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 1phd h LEU 114 CO -0.36 1.00 0.52 0.00 -0.34 0.00 0.00 178.44 179.25 1phd h ALA 115 N 0.68 1.55 -0.65 1.25 0.00 -0.73 0.57 119.26 121.93 1phd h ALA 115 Ca 0.04 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1phd h ALA 115 Cb 0.81 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1phd h ALA 115 CO 0.06 0.36 0.22 -0.97 0.00 0.00 0.00 179.25 178.92 1phd h ASN 116 N 0.94 0.90 -0.80 0.00 -1.24 -1.31 -2.20 115.58 111.87 1phd h ASN 116 Ca 0.32 -0.15 0.07 0.00 0.71 0.00 0.00 56.30 57.25 1phd h ASN 116 Cb 0.09 -0.23 -0.06 0.00 0.73 0.00 0.00 38.32 38.84 1phd h ASN 116 CO -0.10 0.84 0.47 1.56 -1.29 0.00 0.00 177.43 178.91 1phd h GLN 117 N 0.95 0.82 -0.18 6.67 4.20 -0.70 0.18 115.11 127.05 1phd h GLN 117 Ca 0.21 -0.05 -0.18 0.00 0.06 0.00 0.00 58.65 58.70 1phd h GLN 117 Cb 0.25 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1phd h GLN 117 CO -0.01 0.54 -0.61 -0.39 -0.67 0.00 0.00 178.83 177.69 1phd h VAL 118 N 0.85 1.32 0.00 -0.54 -1.51 -1.12 -3.41 116.25 111.84 1phd h VAL 118 Ca 0.36 -1.87 0.00 0.00 -1.23 0.00 0.00 66.70 63.96 1phd h VAL 118 Cb 0.23 1.83 0.00 0.00 -2.13 0.00 0.00 31.29 31.22 1phd h VAL 118 CO -0.20 0.58 -0.51 1.33 -1.23 0.00 0.00 177.57 177.55 1phd n VAL 119 N -3.94 0.00 -0.17 7.19 0.24 -0.89 -4.94 118.33 115.83 1phd n VAL 119 Ca -0.04 -0.29 -0.08 0.00 -2.04 0.00 0.00 64.34 61.89 1phd n VAL 119 Cb 0.64 0.78 0.08 0.00 -1.47 0.00 0.00 33.84 33.87 1phd n VAL 119 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1phd n GLY 120 N 1.59 -2.52 0.47 7.63 0.00 0.62 -4.58 105.19 108.40 1phd n GLY 120 Ca 0.00 -0.82 -0.15 0.00 0.00 0.00 0.00 46.02 45.05 1phd n GLY 120 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1phd h MET 121 N 0.00 -0.56 -1.01 1.61 2.86 -1.88 -2.66 114.93 113.29 1phd h MET 121 Ca -0.11 0.04 0.24 0.00 -2.06 0.00 0.00 59.70 57.81 1phd h MET 121 Cb 0.37 0.13 -0.11 0.00 0.06 0.00 0.00 31.60 32.04 1phd h MET 121 CO 0.07 -0.37 0.62 -1.35 1.06 0.00 0.00 176.91 176.93 1phd h PRO 122 N -0.58 0.56 -0.24 -0.22 0.11 -1.92 0.12 132.00 129.82 1phd h PRO 122 Ca 0.03 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.07 1phd h PRO 122 Cb 0.68 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1phd h PRO 122 CO -0.44 0.37 0.01 0.28 -0.21 0.00 0.00 178.00 178.01 1phd h VAL 123 N 0.58 1.25 -0.34 3.15 2.07 -1.79 -2.69 116.25 118.47 1phd h VAL 123 Ca 0.62 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1phd h VAL 123 Cb 1.21 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.30 1phd h VAL 123 CO -0.41 0.27 0.17 0.58 0.02 0.00 0.00 177.57 178.20 1phd h VAL 124 N 0.21 1.16 -0.95 2.57 2.07 -1.02 -1.02 116.25 119.27 1phd h VAL 124 Ca 0.07 -0.44 0.20 0.00 0.82 0.00 0.00 66.70 67.35 1phd h VAL 124 Cb 0.38 0.82 -0.08 0.00 -1.52 0.00 0.00 31.29 30.90 1phd h VAL 124 CO 0.01 0.17 0.61 0.44 0.02 0.00 0.00 177.57 178.82 1phd h ASP 125 N 0.42 0.53 0.93 0.57 3.32 -0.81 -1.13 116.42 120.27 1phd h ASP 125 Ca 0.12 0.06 -0.20 0.00 0.02 0.00 0.00 57.03 57.03 1phd h ASP 125 Cb 0.11 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 1phd h ASP 125 CO -0.02 0.20 -0.95 0.50 -1.72 0.00 0.00 179.24 177.26 1phd h LYS 126 N 0.53 0.01 -0.02 3.56 3.64 -1.03 -3.29 116.57 119.97 1phd h LYS 126 Ca 0.51 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.88 1phd h LYS 126 Cb 1.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1phd h LYS 126 CO -0.24 0.95 -0.17 1.28 -2.27 0.00 0.00 179.45 178.99 1phd n LEU 127 N -3.42 2.26 -0.22 5.20 4.77 -0.45 -4.61 117.00 120.53 1phd n LEU 127 Ca -0.00 -0.77 0.02 0.00 -0.03 0.00 0.00 56.01 55.23 1phd n LEU 127 Cb 0.89 -0.01 0.13 0.00 -2.33 0.00 0.00 43.42 42.10 1phd n LEU 127 CO 0.46 0.39 0.94 -0.08 -1.33 0.00 0.00 177.39 177.77 1phd h GLU 128 N 3.27 0.29 -0.25 3.23 4.81 -1.32 0.70 114.58 125.31 1phd h GLU 128 Ca 0.00 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.12 1phd h GLU 128 Cb 0.79 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 1phd h GLU 128 CO 0.00 0.19 -0.22 -0.91 -0.73 0.00 0.00 179.01 177.34 1phd h ASN 129 N 0.30 0.47 0.12 1.04 -0.26 -1.85 0.42 115.58 115.82 1phd h ASN 129 Ca 0.35 -0.15 -0.17 0.00 -0.56 0.00 0.00 56.30 55.77 1phd h ASN 129 Cb 0.53 -0.13 -0.01 0.00 -1.06 0.00 0.00 38.32 37.65 1phd h ASN 129 CO -0.42 0.70 -0.62 0.03 -1.06 0.00 0.00 177.43 176.06 1phd h ARG 130 N 0.42 0.49 -0.13 0.81 2.47 -1.28 -1.22 114.38 115.94 1phd h ARG 130 Ca 0.07 -0.34 0.03 0.00 -1.26 0.00 0.00 59.98 58.47 1phd h ARG 130 Cb 0.62 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.97 1phd h ARG 130 CO 0.04 0.95 -0.02 0.82 0.56 0.00 0.00 179.97 182.32 1phd h ILE 131 N 0.36 0.88 -0.63 2.04 2.04 0.52 0.39 117.51 123.12 1phd h ILE 131 Ca -0.01 -0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.76 1phd h ILE 131 Cb 1.17 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 1phd h ILE 131 CO 0.11 0.00 0.05 -0.61 0.00 0.00 0.00 178.15 177.71 1phd h GLN 132 N 0.01 1.07 0.15 2.37 5.75 -1.00 -0.90 115.11 122.55 1phd h GLN 132 Ca 0.06 -0.31 -0.01 0.00 -0.15 0.00 0.00 58.65 58.25 1phd h GLN 132 Cb 0.09 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 28.53 1phd h GLN 132 CO -0.13 1.01 -0.07 1.49 -2.65 0.00 0.00 178.83 178.48 1phd h GLU 133 N 0.99 -0.19 -0.67 1.69 4.81 -0.98 -1.62 114.58 118.61 1phd h GLU 133 Ca 0.19 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.37 1phd h GLU 133 Cb 0.49 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.89 1phd h GLU 133 CO 0.02 -0.00 0.18 1.25 -0.73 0.00 0.00 179.01 179.72 1phd h LEU 134 N -0.34 1.01 0.19 1.64 5.85 -0.03 -2.31 115.31 121.30 1phd h LEU 134 Ca -0.02 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 1phd h LEU 134 Cb 0.27 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1phd h LEU 134 CO 0.03 0.97 -0.09 0.00 -0.34 0.00 0.00 178.44 179.02 1phd h ALA 135 N 1.07 -0.25 -0.55 1.25 0.00 -1.07 -1.64 119.26 118.08 1phd h ALA 135 Ca 0.21 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1phd h ALA 135 Cb 0.35 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 1phd h ALA 135 CO 0.00 -0.62 0.25 0.00 0.00 0.00 0.00 179.25 178.89 1phd h SER 137 N 0.48 0.25 -0.62 0.00 0.87 -1.37 0.15 113.55 113.31 1phd h SER 137 Ca 0.25 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.79 1phd h SER 137 Cb 0.21 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.09 1phd h SER 137 CO -0.20 0.19 0.31 0.25 -0.53 0.00 0.00 176.83 176.84 1phd h LEU 138 N 0.32 0.81 -0.09 2.23 5.85 -1.12 -1.59 115.31 121.71 1phd h LEU 138 Ca 0.10 -0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 1phd h LEU 138 Cb -0.01 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.81 1phd h LEU 138 CO -0.04 0.70 -0.13 0.40 -0.34 0.00 0.00 178.44 179.03 1phd h ILE 139 N 0.85 1.38 -0.61 4.05 2.04 -1.20 -2.11 117.51 121.90 1phd h ILE 139 Ca 0.21 -1.35 -0.01 0.00 1.00 0.00 0.00 64.86 64.72 1phd h ILE 139 Cb 0.10 2.05 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 1phd h ILE 139 CO -0.03 0.38 0.36 -0.08 0.00 0.00 0.00 178.15 178.78 1phd h GLU 140 N -0.18 0.83 -0.09 2.37 4.57 -0.90 0.41 114.58 121.60 1phd h GLU 140 Ca 0.01 -0.07 -0.09 0.00 -1.18 0.00 0.00 59.36 58.03 1phd h GLU 140 Cb 0.68 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.08 1phd h GLU 140 CO 0.03 0.59 -0.33 1.03 -1.18 0.00 0.00 179.01 179.15 1phd h SER 141 N 0.84 0.17 0.17 1.04 0.87 -1.19 -3.16 113.55 112.29 1phd h SER 141 Ca 0.22 -0.06 -0.25 0.00 -1.23 0.00 0.00 61.79 60.46 1phd h SER 141 Cb -0.01 -0.05 0.02 0.00 -0.44 0.00 0.00 62.40 61.92 1phd h SER 141 CO -0.04 0.50 -1.18 -0.07 -0.53 0.00 0.00 176.83 175.52 1phd h LEU 142 N 0.15 0.55 -0.59 2.23 3.38 -0.21 -3.43 115.31 117.40 1phd h LEU 142 Ca 0.02 -0.92 0.06 0.00 0.09 0.00 0.00 57.88 57.13 1phd h LEU 142 Cb 0.67 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 41.16 1phd h LEU 142 CO 0.05 1.55 -0.31 -1.14 0.09 0.00 0.00 178.44 178.68 1phd n ARG 143 N -3.94 -0.23 0.14 1.13 0.63 0.12 -1.56 116.66 112.95 1phd n ARG 143 Ca -0.18 0.89 0.12 0.00 -0.92 0.00 0.00 57.85 57.76 1phd n ARG 143 Cb 0.93 -1.31 0.51 0.00 0.45 0.00 0.00 32.46 33.04 1phd n ARG 143 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1phd n PRO 144 N -4.77 0.20 0.19 -0.14 -0.04 -1.26 -3.35 135.00 125.83 1phd n PRO 144 Ca 0.02 0.45 0.07 0.00 -0.04 0.00 0.00 63.50 64.01 1phd n PRO 144 Cb 0.18 -1.90 0.28 0.00 -0.04 0.00 0.00 33.50 32.02 1phd n PRO 144 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1phd h GLN 145 N 0.00 0.00 -0.16 0.54 4.20 -1.58 -3.45 115.11 114.66 1phd h GLN 145 Ca 0.00 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 1phd h GLN 145 Cb 0.33 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 1phd h GLN 145 CO 0.00 0.31 -0.06 0.41 -0.67 0.00 0.00 178.83 178.82 1phd n GLY 146 N 0.60 0.45 3.61 3.46 0.00 -1.21 -4.95 105.19 107.14 1phd n GLY 146 Ca 0.01 -0.07 -0.02 0.00 0.00 0.00 0.00 46.02 45.95 1phd n GLY 146 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1phd s GLN 147 N -1.85 0.35 0.00 1.61 -2.07 -1.26 -1.81 119.66 114.62 1phd s GLN 147 Ca 0.00 0.64 0.00 0.00 -1.82 0.00 0.00 55.36 54.18 1phd s GLN 147 Cb 0.00 0.12 0.00 0.00 -1.09 0.00 0.00 33.01 32.04 1phd s GLN 147 CO 0.00 -0.08 0.00 0.00 -1.32 0.00 0.00 175.29 173.89 1phd n ASN 149 N -1.62 4.72 -0.39 0.00 4.05 -1.26 -1.30 115.26 119.45 1phd n ASN 149 Ca 0.00 -3.65 0.33 0.00 0.45 0.00 0.00 54.58 51.70 1phd n ASN 149 Cb 0.00 -0.65 0.54 0.00 1.23 0.00 0.00 39.78 40.90 1phd n ASN 149 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 177.26 174.54 1phd n PHE 150 N -0.06 0.47 0.37 1.20 -0.00 -0.28 0.49 117.46 119.66 1phd n PHE 150 Ca 0.32 0.48 -0.16 0.00 -0.00 0.00 0.00 57.45 58.09 1phd n PHE 150 Cb 0.38 -0.88 -0.08 0.00 -0.00 0.00 0.00 39.48 38.89 1phd n PHE 150 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.76 178.55 1phd h THR 151 N 0.00 0.17 -0.04 -2.13 1.35 -1.92 0.19 112.91 110.54 1phd h THR 151 Ca 0.69 -0.23 -0.25 0.00 -0.55 0.00 0.00 66.41 66.07 1phd h THR 151 Cb 2.31 0.22 0.02 0.00 -1.73 0.00 0.00 68.15 68.96 1phd h THR 151 CO -0.32 0.02 -0.95 1.05 -0.25 0.00 0.00 175.52 175.07 1phd h GLU 152 N -1.13 0.71 0.00 4.72 4.11 -1.56 -0.39 114.58 121.03 1phd h GLU 152 Ca -0.10 -0.72 -0.05 0.00 0.07 0.00 0.00 59.36 58.57 1phd h GLU 152 Cb 0.75 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1phd h GLU 152 CO 0.16 1.30 -0.22 -0.44 0.07 0.00 0.00 179.01 179.88 1phd h ASP 153 N 0.41 0.00 0.00 3.06 3.32 -0.04 -3.40 116.42 119.76 1phd h ASP 153 Ca -0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1phd h ASP 153 Cb 1.60 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.15 1phd h ASP 153 CO 0.19 0.22 0.00 0.00 -1.72 0.00 0.00 179.24 177.93 1phd n TYR 154 N -3.81 -0.34 -0.21 4.55 4.19 -0.58 -4.84 117.16 116.12 1phd n TYR 154 Ca -0.02 0.00 0.01 0.00 3.31 0.00 0.00 57.90 61.21 1phd n TYR 154 Cb 0.32 0.43 0.26 0.00 0.49 0.00 0.00 39.34 40.83 1phd n TYR 154 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1phd h ALA 155 N 0.00 1.49 0.30 2.98 0.00 -0.33 -1.95 119.26 121.75 1phd h ALA 155 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1phd h ALA 155 Cb 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1phd h ALA 155 CO 0.00 0.47 -0.14 0.93 0.00 0.00 0.00 179.25 180.50 1phd h GLU 156 N 0.99 -0.39 -0.42 0.00 5.08 -1.29 -3.38 114.58 115.17 1phd h GLU 156 Ca 0.28 0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1phd h GLU 156 Cb -0.08 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1phd h GLU 156 CO -0.07 -0.22 0.25 -1.00 -1.00 0.00 0.00 179.01 176.97 1phd h PRO 157 N -1.09 0.57 0.00 2.33 0.13 -1.77 -2.36 132.00 129.81 1phd h PRO 157 Ca -0.04 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1phd h PRO 157 Cb 0.34 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.35 1phd h PRO 157 CO 0.07 0.43 0.00 0.34 -0.23 0.00 0.00 178.00 178.61 1phd n PHE 158 N -4.75 0.00 -0.27 1.56 7.35 -0.73 -0.83 117.46 119.78 1phd n PHE 158 Ca 0.01 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.66 1phd n PHE 158 Cb 0.06 -0.48 0.08 0.00 0.35 0.00 0.00 39.48 39.49 1phd n PHE 158 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 1phd h PRO 159 N 0.00 0.94 -0.20 -7.13 0.11 -1.74 -2.77 132.00 121.21 1phd h PRO 159 Ca 0.00 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.00 1phd h PRO 159 Cb 0.00 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 30.89 1phd h PRO 159 CO 0.00 0.62 -0.10 0.82 -0.21 0.00 0.00 178.00 179.13 1phd h ILE 160 N 0.97 1.31 -0.08 4.15 2.04 -1.37 -2.14 117.51 122.38 1phd h ILE 160 Ca 0.30 -1.16 -0.07 0.00 1.00 0.00 0.00 64.86 64.92 1phd h ILE 160 Cb -0.03 1.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1phd h ILE 160 CO -0.09 0.35 -0.26 0.03 0.00 0.00 0.00 178.15 178.18 1phd h ARG 161 N 0.11 0.15 -0.03 2.37 3.08 -0.96 0.14 114.38 119.24 1phd h ARG 161 Ca 0.04 -0.05 -0.13 0.00 0.07 0.00 0.00 59.98 59.91 1phd h ARG 161 Cb 0.59 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 1phd h ARG 161 CO 0.03 0.40 -0.60 0.82 -1.07 0.00 0.00 179.97 179.55 1phd h ILE 162 N 0.13 1.41 -0.09 2.04 2.04 -1.38 -2.58 117.51 119.09 1phd h ILE 162 Ca 0.02 -2.03 -0.04 0.00 1.00 0.00 0.00 64.86 63.81 1phd h ILE 162 Cb 0.54 2.07 -0.00 0.00 -0.74 0.00 0.00 36.82 38.69 1phd h ILE 162 CO 0.04 0.59 -0.11 0.15 0.00 0.00 0.00 178.15 178.82 1phd h PHE 163 N 0.06 0.28 -0.66 1.37 3.57 -0.52 -2.75 116.94 118.30 1phd h PHE 163 Ca -0.01 -0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.40 1phd h PHE 163 Cb 1.08 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.73 1phd h PHE 163 CO 0.01 0.68 0.40 0.52 -2.23 0.00 0.00 178.31 177.69 1phd h MET 164 N -0.20 0.88 -0.26 1.11 2.86 -0.67 0.16 114.93 118.81 1phd h MET 164 Ca 0.01 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1phd h MET 164 Cb 0.64 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1phd h MET 164 CO 0.03 0.62 0.16 1.25 1.06 0.00 0.00 176.91 180.03 1phd h LEU 165 N 0.90 0.27 -0.53 1.22 5.85 -1.51 0.47 115.31 121.98 1phd h LEU 165 Ca 0.24 -0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.84 1phd h LEU 165 Cb -0.04 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1phd h LEU 165 CO -0.05 0.20 -0.10 0.25 -0.34 0.00 0.00 178.44 178.41 1phd h LEU 166 N 0.33 1.00 0.00 2.25 5.85 -0.98 -3.11 115.31 120.65 1phd h LEU 166 Ca 0.10 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1phd h LEU 166 Cb -0.02 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.73 1phd h LEU 166 CO -0.03 1.11 -0.54 0.00 -0.34 0.00 0.00 178.44 178.64 1phd h ALA 167 N 0.92 0.72 -3.62 1.25 0.00 -0.28 -0.33 119.26 117.93 1phd h ALA 167 Ca 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 1phd h ALA 167 Cb 0.66 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.52 1phd h ALA 167 CO 0.05 0.00 -0.34 0.41 0.00 0.00 0.00 179.25 179.37 1phd n GLY 168 N 1.16 0.09 3.38 0.00 0.00 0.15 -4.22 105.19 105.75 1phd n GLY 168 Ca 0.02 -0.22 -0.27 0.00 0.00 0.00 0.00 46.02 45.55 1phd n GLY 168 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1phd s LEU 169 N -3.93 2.37 0.28 0.99 1.43 -0.31 -5.03 118.68 114.48 1phd s LEU 169 Ca 0.00 -0.79 -0.29 0.00 -1.03 0.00 0.00 54.13 52.02 1phd s LEU 169 Cb -0.00 -1.13 -0.10 0.00 0.03 0.00 0.00 46.19 45.00 1phd s LEU 169 CO 0.32 0.13 1.30 -2.16 0.23 0.00 0.00 176.35 176.17 1phd s PRO 170 N -2.31 4.38 0.59 1.29 0.04 -1.26 -4.55 135.00 133.18 1phd s PRO 170 Ca 0.15 2.14 0.30 0.00 0.04 0.00 0.00 61.00 63.64 1phd s PRO 170 Cb -0.09 -3.12 1.82 0.00 0.04 0.00 0.00 34.50 33.15 1phd s PRO 170 CO 0.07 -0.19 2.25 0.93 0.04 0.00 0.00 177.00 180.10 1phd h GLU 171 N 4.13 0.00 0.00 4.56 5.08 -1.99 0.33 114.58 126.69 1phd h GLU 171 Ca -0.47 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.88 1phd h GLU 171 Cb 1.22 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.47 1phd h GLU 171 CO 0.70 0.01 -0.05 0.93 -1.00 0.00 0.00 179.01 179.60 1phd h GLU 172 N 0.00 0.00 0.00 2.33 3.07 -2.05 -2.46 114.58 115.47 1phd h GLU 172 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1phd h GLU 172 Cb 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1phd h GLU 172 CO 0.00 0.05 0.00 -0.25 -1.40 0.00 0.00 179.01 177.41 1phd n ASP 173 N -4.30 0.56 -0.03 1.42 8.00 0.11 -4.31 116.55 118.00 1phd n ASP 173 Ca -0.03 0.59 -0.12 0.00 0.71 0.00 0.00 54.79 55.94 1phd n ASP 173 Cb 0.13 -0.73 -0.06 0.00 -0.02 0.00 0.00 41.12 40.45 1phd n ASP 173 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1phd h ILE 174 N 0.00 0.14 -0.94 0.53 2.04 -1.60 -0.68 117.51 116.99 1phd h ILE 174 Ca 0.00 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.95 1phd h ILE 174 Cb 0.52 0.14 -0.07 0.00 -0.74 0.00 0.00 36.82 36.67 1phd h ILE 174 CO 0.00 0.00 0.59 -0.65 0.00 0.00 0.00 178.15 178.09 1phd h PRO 175 N -0.45 0.98 0.06 2.37 0.11 -1.83 0.12 132.00 133.37 1phd h PRO 175 Ca 0.09 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.14 1phd h PRO 175 Cb 0.61 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.50 1phd h PRO 175 CO -0.44 0.65 -0.03 1.25 -0.21 0.00 0.00 178.00 179.22 1phd h HIS 176 N 1.01 -0.08 -0.39 0.65 6.17 -1.79 -2.45 115.15 118.27 1phd h HIS 176 Ca 0.44 -0.00 0.02 0.00 0.71 0.00 0.00 60.37 61.54 1phd h HIS 176 Cb 0.31 0.03 -0.03 0.00 2.52 0.00 0.00 27.41 30.24 1phd h HIS 176 CO -0.02 0.39 0.21 -0.07 0.71 0.00 0.00 177.93 179.15 1phd h LEU 177 N -0.59 0.31 -0.48 0.26 3.38 -0.75 -2.44 115.31 115.01 1phd h LEU 177 Ca -0.01 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1phd h LEU 177 Cb 0.51 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1phd h LEU 177 CO 0.01 0.23 0.20 0.50 0.09 0.00 0.00 178.44 179.48 1phd h LYS 178 N 0.42 0.71 -0.41 1.13 1.63 -0.81 -0.13 116.57 119.11 1phd h LYS 178 Ca 0.16 -0.12 0.05 0.00 -0.85 0.00 0.00 60.65 59.89 1phd h LYS 178 Cb 0.05 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.52 1phd h LYS 178 CO -0.10 0.63 0.16 -0.92 -3.45 0.00 0.00 179.45 175.77 1phd h TYR 179 N 0.63 0.29 -0.74 1.91 3.20 -1.23 0.15 116.97 121.18 1phd h TYR 179 Ca 0.16 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.01 1phd h TYR 179 Cb 0.17 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.34 1phd h TYR 179 CO 0.00 0.12 0.30 -0.07 -1.64 0.00 0.00 178.16 176.87 1phd h LEU 180 N 0.34 1.00 -0.30 2.82 3.38 -0.94 -2.20 115.31 119.41 1phd h LEU 180 Ca 0.19 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1phd h LEU 180 Cb 0.15 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1phd h LEU 180 CO -0.18 0.89 -0.09 0.74 0.09 0.00 0.00 178.44 179.89 1phd h THR 181 N 1.07 1.28 -1.01 0.22 2.02 -0.07 -3.14 112.91 113.28 1phd h THR 181 Ca 0.25 -1.14 0.03 0.00 0.77 0.00 0.00 66.41 66.32 1phd h THR 181 Cb 0.19 1.41 -0.06 0.00 -1.74 0.00 0.00 68.15 67.96 1phd h THR 181 CO -0.02 0.36 0.66 0.44 0.37 0.00 0.00 175.52 177.33 1phd h ASP 182 N 0.35 1.11 -0.01 4.18 5.19 -0.83 -1.02 116.42 125.39 1phd h ASP 182 Ca 0.07 -0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.42 1phd h ASP 182 Cb 0.58 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.82 1phd h ASP 182 CO 0.03 0.77 -0.12 1.56 -3.12 0.00 0.00 179.24 178.36 1phd h GLN 183 N 1.29 0.28 -0.25 3.56 1.08 -1.37 0.11 115.11 119.82 1phd h GLN 183 Ca 0.40 -0.07 -0.11 0.00 -1.45 0.00 0.00 58.65 57.42 1phd h GLN 183 Cb -0.03 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.36 1phd h GLN 183 CO -0.12 0.41 -0.28 0.52 -0.95 0.00 0.00 178.83 178.42 1phd h MET 184 N 0.27 0.63 0.07 1.46 2.86 -1.15 -2.90 114.93 116.16 1phd h MET 184 Ca 0.05 -0.34 -0.37 0.00 -2.06 0.00 0.00 59.70 56.98 1phd h MET 184 Cb 0.38 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.02 1phd h MET 184 CO 0.02 0.95 -2.15 0.25 1.06 0.00 0.00 176.91 177.04 1phd n THR 185 N -4.31 1.65 -3.23 2.22 -2.24 -1.10 -4.56 114.28 102.70 1phd n THR 185 Ca -0.05 -0.65 -0.26 0.00 -2.27 0.00 0.00 64.05 60.83 1phd n THR 185 Cb 0.46 -1.51 -0.06 0.00 -2.10 0.00 0.00 70.33 67.12 1phd n THR 185 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1phd n ARG 186 N -3.33 2.27 -1.60 -0.78 1.74 0.36 -1.65 116.66 113.65 1phd n ARG 186 Ca -0.35 -4.36 -0.53 0.00 -0.77 0.00 0.00 57.85 51.83 1phd n ARG 186 Cb 1.04 -2.02 -0.06 0.00 -1.02 0.00 0.00 32.46 30.39 1phd n ARG 186 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1phd n PRO 187 N 0.60 1.07 0.06 5.56 -0.02 -1.10 -4.52 135.00 136.65 1phd n PRO 187 Ca 0.28 0.39 -0.21 0.00 -2.02 0.00 0.00 63.50 61.93 1phd n PRO 187 Cb 0.45 -2.03 -0.15 0.00 -0.02 0.00 0.00 33.50 31.76 1phd n PRO 187 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1phd h ASP 188 N 4.88 0.54 0.00 2.55 1.82 -1.84 -3.48 116.42 120.89 1phd h ASP 188 Ca -0.48 -0.92 0.00 0.00 -0.39 0.00 0.00 57.03 55.24 1phd h ASP 188 Cb 1.34 -0.17 0.00 0.00 0.68 0.00 0.00 39.33 41.17 1phd h ASP 188 CO 0.80 1.53 0.00 0.61 -1.61 0.00 0.00 179.24 180.57 1phd n GLY 189 N 1.70 1.47 0.17 -0.78 0.00 -1.26 -4.97 105.19 101.53 1phd n GLY 189 Ca -0.17 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.90 1phd n GLY 189 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1phd h SER 190 N 0.00 0.00 -4.21 1.61 4.64 -1.99 -3.44 113.55 110.16 1phd h SER 190 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 1phd h SER 190 Cb 0.00 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 61.87 1phd h SER 190 CO 0.00 0.35 -0.03 0.00 -0.87 0.00 0.00 176.83 176.28 1phd s MET 191 N -3.19 0.73 0.87 4.77 0.23 -1.26 -5.14 119.30 116.31 1phd s MET 191 Ca 0.03 0.61 -0.12 0.00 -1.03 0.00 0.00 55.69 55.19 1phd s MET 191 Cb 0.08 0.35 0.12 0.00 -1.53 0.00 0.00 34.83 33.84 1phd s MET 191 CO 0.70 -0.13 1.14 0.95 -2.03 0.00 0.00 175.02 175.66 1phd s THR 192 N -0.09 2.16 0.11 3.16 -4.23 -1.26 -4.70 115.64 110.80 1phd s THR 192 Ca -0.03 0.05 -0.19 0.00 -1.18 0.00 0.00 61.69 60.34 1phd s THR 192 Cb -0.03 -2.86 -0.06 0.00 1.34 0.00 0.00 72.50 70.89 1phd s THR 192 CO 0.03 -0.07 1.70 0.15 -0.54 0.00 0.00 174.62 175.89 1phd h PHE 193 N -1.34 0.35 -0.42 3.99 3.57 -1.93 -0.07 116.94 121.09 1phd h PHE 193 Ca -0.49 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 60.96 1phd h PHE 193 Cb 1.32 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.93 1phd h PHE 193 CO 0.32 0.31 0.12 0.00 -2.23 0.00 0.00 178.31 176.83 1phd h ALA 194 N 1.01 0.56 -0.24 2.41 0.00 -1.92 0.84 119.26 121.92 1phd h ALA 194 Ca 0.09 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1phd h ALA 194 Cb 0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1phd h ALA 194 CO -0.01 0.22 0.15 0.93 0.00 0.00 0.00 179.25 180.54 1phd h GLU 195 N 0.55 0.32 -0.19 0.00 4.39 -1.87 0.53 114.58 118.31 1phd h GLU 195 Ca 0.14 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.81 1phd h GLU 195 Cb 0.28 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 1phd h GLU 195 CO -0.00 0.22 0.12 0.00 -1.16 0.00 0.00 179.01 178.19 1phd h ALA 196 N 1.07 0.24 -0.77 3.43 0.00 -0.13 -1.58 119.26 121.51 1phd h ALA 196 Ca 0.09 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1phd h ALA 196 Cb -0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1phd h ALA 196 CO -0.02 -0.26 0.48 -0.22 0.00 0.00 0.00 179.25 179.23 1phd h LYS 197 N 0.23 0.88 -0.63 0.00 3.64 0.13 -1.77 116.57 119.05 1phd h LYS 197 Ca 0.07 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1phd h LYS 197 Cb 0.01 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.60 1phd h LYS 197 CO -0.01 0.58 0.34 0.93 -2.27 0.00 0.00 179.45 179.02 1phd h GLU 198 N 0.91 0.89 -0.66 1.90 4.39 0.55 -1.85 114.58 120.70 1phd h GLU 198 Ca 0.32 -0.11 -0.04 0.00 0.34 0.00 0.00 59.36 59.88 1phd h GLU 198 Cb 0.09 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.54 1phd h GLU 198 CO -0.14 0.68 0.25 0.00 -1.16 0.00 0.00 179.01 178.63 1phd h ALA 199 N 1.16 0.86 -0.30 3.43 0.00 -0.83 0.34 119.26 123.93 1phd h ALA 199 Ca 0.22 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1phd h ALA 199 Cb 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1phd h ALA 199 CO -0.03 0.49 -0.29 1.25 0.00 0.00 0.00 179.25 180.67 1phd h LEU 200 N 0.94 0.62 -0.78 0.00 5.85 -1.23 -2.91 115.31 117.80 1phd h LEU 200 Ca 0.22 -0.24 -0.09 0.00 0.84 0.00 0.00 57.88 58.61 1phd h LEU 200 Cb 0.23 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1phd h LEU 200 CO -0.01 0.88 -0.06 1.88 -0.34 0.00 0.00 178.44 180.79 1phd h TYR 201 N 0.53 0.93 -0.96 1.25 0.05 -0.42 -2.36 116.97 115.98 1phd h TYR 201 Ca 0.07 -0.16 0.07 0.00 0.05 0.00 0.00 58.73 58.76 1phd h TYR 201 Cb 0.77 -0.24 -0.07 0.00 1.01 0.00 0.00 36.73 38.19 1phd h TYR 201 CO 0.03 0.88 0.61 -0.44 -1.05 0.00 0.00 178.16 178.20 1phd h ASP 202 N 0.78 0.97 0.45 3.88 5.19 -0.18 -1.63 116.42 125.88 1phd h ASP 202 Ca 0.14 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.54 1phd h ASP 202 Cb 0.55 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 39.88 1phd h ASP 202 CO 0.03 0.61 -0.24 0.22 -3.12 0.00 0.00 179.24 176.74 1phd h TYR 203 N 1.10 -0.63 -0.33 4.55 3.20 -1.36 -3.37 116.97 120.14 1phd h TYR 203 Ca 0.43 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.32 1phd h TYR 203 Cb 0.21 0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.66 1phd h TYR 203 CO -0.01 -0.37 0.12 -0.07 -1.64 0.00 0.00 178.16 176.19 1phd h LEU 204 N -0.63 0.14 -0.97 2.82 3.38 -1.23 -3.31 115.31 115.51 1phd h LEU 204 Ca -0.06 0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.06 1phd h LEU 204 Cb 0.50 0.01 -0.14 0.00 0.09 0.00 0.00 40.66 41.12 1phd h LEU 204 CO 0.09 0.12 -0.48 0.40 0.09 0.00 0.00 178.44 178.66 1phd h ILE 205 N 0.27 0.01 -0.89 1.22 2.04 -1.45 0.13 117.51 118.82 1phd h ILE 205 Ca 0.15 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.99 1phd h ILE 205 Cb 0.11 0.01 -0.04 0.00 -0.74 0.00 0.00 36.82 36.15 1phd h ILE 205 CO -0.14 0.00 0.48 -0.65 0.00 0.00 0.00 178.15 177.84 1phd h PRO 206 N -0.01 1.25 0.15 2.37 0.11 -1.77 -1.77 132.00 132.33 1phd h PRO 206 Ca 0.26 -0.15 -0.01 0.00 0.11 0.00 0.00 66.00 66.21 1phd h PRO 206 Cb 0.52 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.39 1phd h PRO 206 CO -0.95 0.92 -0.07 0.82 -0.21 0.00 0.00 178.00 178.51 1phd h ILE 207 N 1.25 0.90 -0.38 4.15 2.04 -0.98 -2.86 117.51 121.63 1phd h ILE 207 Ca 0.31 -0.19 0.01 0.00 1.00 0.00 0.00 64.86 65.99 1phd h ILE 207 Cb 0.04 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1phd h ILE 207 CO -0.05 0.05 0.25 0.40 0.00 0.00 0.00 178.15 178.79 1phd h ILE 208 N -0.29 1.08 -0.43 -0.67 2.04 -0.66 -1.88 117.51 116.69 1phd h ILE 208 Ca -0.02 -0.17 0.09 0.00 1.00 0.00 0.00 64.86 65.75 1phd h ILE 208 Cb 0.23 0.54 -0.08 0.00 -0.74 0.00 0.00 36.82 36.77 1phd h ILE 208 CO 0.03 0.09 -0.09 -0.33 0.00 0.00 0.00 178.15 177.86 1phd h GLU 209 N 0.50 0.02 -0.90 2.37 5.08 -1.29 -1.80 114.58 118.57 1phd h GLU 209 Ca 0.14 -0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.56 1phd h GLU 209 Cb -0.04 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.15 1phd h GLU 209 CO -0.04 0.01 0.59 0.37 -1.00 0.00 0.00 179.01 178.94 1phd h GLN 210 N 0.02 1.01 -0.00 2.33 4.15 -1.26 -2.43 115.11 118.93 1phd h GLN 210 Ca 0.21 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.57 1phd h GLN 210 Cb 0.32 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 27.78 1phd h GLN 210 CO -0.43 0.67 -0.40 0.54 -1.93 0.00 0.00 178.83 177.28 1phd n ARG 211 N -4.48 0.29 0.04 1.69 3.00 -0.73 -1.47 116.66 115.01 1phd n ARG 211 Ca 0.13 -0.17 -0.18 0.00 -0.01 0.00 0.00 57.85 57.62 1phd n ARG 211 Cb 0.18 -1.50 -0.14 0.00 0.00 0.00 0.00 32.46 31.00 1phd n ARG 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1phd h ARG 212 N 0.41 0.26 0.18 5.56 3.08 -0.89 -3.24 114.38 119.73 1phd h ARG 212 Ca 0.00 -0.44 -0.01 0.00 0.07 0.00 0.00 59.98 59.60 1phd h ARG 212 Cb 0.50 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.71 1phd h ARG 212 CO 0.00 1.11 -0.09 1.96 -1.07 0.00 0.00 179.97 181.88 1phd h GLN 213 N 0.07 -0.23 -2.84 0.04 4.20 -1.49 -3.40 115.11 111.46 1phd h GLN 213 Ca -0.32 0.02 -0.61 0.00 0.06 0.00 0.00 58.65 57.80 1phd h GLN 213 Cb 2.04 0.05 -0.40 0.00 0.30 0.00 0.00 27.48 29.47 1phd h GLN 213 CO 0.14 0.13 -0.75 -1.59 -0.67 0.00 0.00 178.83 176.08 1phd s LYS 214 N -4.49 1.57 0.55 1.46 -2.85 -0.54 -5.11 119.74 110.32 1phd s LYS 214 Ca -0.14 -2.48 -0.21 0.00 -1.00 0.00 0.00 55.97 52.14 1phd s LYS 214 Cb 0.02 -2.43 -0.05 0.00 -2.06 0.00 0.00 37.83 33.31 1phd s LYS 214 CO 0.58 -1.27 1.27 -2.14 0.10 0.00 0.00 175.35 173.90 1phd s PRO 215 N -0.33 3.19 0.00 1.78 0.02 -1.22 -4.42 135.00 134.02 1phd s PRO 215 Ca 0.24 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.28 1phd s PRO 215 Cb -0.10 -2.18 0.00 0.00 0.02 0.00 0.00 34.50 32.25 1phd s PRO 215 CO -0.11 -1.09 0.00 0.41 -0.33 0.00 0.00 177.00 175.88 1phd n GLY 216 N 0.63 5.95 0.37 0.52 0.00 -1.26 -5.04 105.19 106.35 1phd n GLY 216 Ca 0.11 -2.05 0.06 0.00 0.00 0.00 0.00 46.02 44.14 1phd n GLY 216 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1phd n THR 217 N -0.03 0.00 -1.55 2.61 -2.24 -1.26 -4.63 114.28 107.18 1phd n THR 217 Ca 0.00 -0.44 -0.29 0.00 -2.27 0.00 0.00 64.05 61.04 1phd n THR 217 Cb 0.00 1.19 0.12 0.00 -2.10 0.00 0.00 70.33 69.54 1phd n THR 217 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1phd s ASP 218 N -1.22 3.93 0.25 3.42 -4.77 -1.26 -4.84 116.67 112.18 1phd s ASP 218 Ca 0.12 1.10 -0.06 0.00 -3.30 0.00 0.00 52.55 50.41 1phd s ASP 218 Cb 0.10 -1.74 0.28 0.00 -1.09 0.00 0.00 42.92 40.47 1phd s ASP 218 CO 0.21 -2.30 1.91 0.00 0.70 0.00 0.00 175.17 175.69 1phd h ALA 219 N -1.32 1.27 -0.20 2.11 0.00 -1.24 -1.69 119.26 118.20 1phd h ALA 219 Ca -0.49 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 1phd h ALA 219 Cb 1.31 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1phd h ALA 219 CO 0.61 0.59 0.07 0.82 0.00 0.00 0.00 179.25 181.34 1phd h ILE 220 N 1.29 1.18 -0.64 0.00 2.04 -1.83 -1.21 117.51 118.34 1phd h ILE 220 Ca 0.38 -0.57 0.04 0.00 1.00 0.00 0.00 64.86 65.71 1phd h ILE 220 Cb -0.08 1.18 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 1phd h ILE 220 CO -0.10 0.18 0.38 0.28 0.00 0.00 0.00 178.15 178.89 1phd h SER 221 N 0.16 0.60 -0.48 1.72 0.02 -1.76 0.57 113.55 114.37 1phd h SER 221 Ca 0.07 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.95 1phd h SER 221 Cb 0.22 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.63 1phd h SER 221 CO -0.00 0.40 -0.02 0.40 -1.14 0.00 0.00 176.83 176.47 1phd h ILE 222 N 0.73 1.26 -0.13 3.27 1.08 -1.15 -2.45 117.51 120.13 1phd h ILE 222 Ca 0.27 -1.10 -0.02 0.00 -0.39 0.00 0.00 64.86 63.62 1phd h ILE 222 Cb 0.09 1.02 -0.00 0.00 -3.07 0.00 0.00 36.82 34.86 1phd h ILE 222 CO -0.14 0.38 0.01 0.58 -0.69 0.00 0.00 178.15 178.30 1phd h VAL 223 N 0.71 1.23 -0.55 1.67 2.07 0.02 -2.69 116.25 118.71 1phd h VAL 223 Ca 0.13 -0.73 0.06 0.00 0.82 0.00 0.00 66.70 66.99 1phd h VAL 223 Cb 0.54 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 1phd h VAL 223 CO 0.03 0.21 0.37 0.00 0.02 0.00 0.00 177.57 178.20 1phd h ALA 224 N 0.78 1.88 -0.48 1.67 0.00 0.19 -2.66 119.26 120.65 1phd h ALA 224 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1phd h ALA 224 Cb 0.31 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1phd h ALA 224 CO 0.00 0.02 0.00 0.09 0.00 0.00 0.00 179.25 179.37 1phd n ASN 225 N -4.47 4.03 -4.88 0.00 4.13 -0.93 -4.78 115.26 108.36 1phd n ASN 225 Ca 0.08 -2.43 -0.29 0.00 1.68 0.00 0.00 54.58 53.61 1phd n ASN 225 Cb 0.26 -0.47 0.07 0.00 -1.54 0.00 0.00 39.78 38.10 1phd n ASN 225 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1phd s GLY 226 N -1.17 1.61 -0.13 7.41 0.00 -1.01 -4.91 107.32 109.13 1phd s GLY 226 Ca 0.41 -0.50 -0.02 0.00 0.00 0.00 0.00 44.72 44.62 1phd s GLY 226 CO 0.19 -0.05 -0.07 1.20 0.00 0.00 0.00 173.10 174.37 1phd s GLN 227 N -5.45 3.37 -0.16 2.90 -1.52 -1.26 -2.40 119.66 115.13 1phd s GLN 227 Ca 0.60 -0.56 -0.01 0.00 -1.95 0.00 0.00 55.36 53.44 1phd s GLN 227 Cb -0.11 -2.77 0.05 0.00 -0.22 0.00 0.00 33.01 29.96 1phd s GLN 227 CO 0.51 0.35 -0.01 0.14 -0.25 0.00 0.00 175.29 176.03 1phd s VAL 228 N 0.04 0.77 -1.21 1.09 -7.23 0.10 -4.83 120.40 109.13 1phd s VAL 228 Ca -0.01 -0.49 -0.00 0.00 -1.81 0.00 0.00 61.98 59.67 1phd s VAL 228 Cb -0.14 -1.07 -0.00 0.00 0.56 0.00 0.00 36.38 35.73 1phd s VAL 228 CO 0.03 0.01 0.95 -3.20 -0.31 0.00 0.00 175.10 172.58 1phd n ASN 229 N 4.98 -2.09 0.00 4.85 2.85 -1.26 -2.81 115.26 121.78 1phd n ASN 229 Ca -0.10 -0.66 0.00 0.00 -0.11 0.00 0.00 54.58 53.71 1phd n ASN 229 Cb 0.48 -4.95 0.00 0.00 1.24 0.00 0.00 39.78 36.55 1phd n ASN 229 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1phd n GLY 230 N -1.21 1.90 3.96 8.20 0.00 -1.26 -4.94 105.19 111.83 1phd n GLY 230 Ca -0.28 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.55 1phd n GLY 230 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1phd s ARG 231 N 0.00 2.82 0.42 1.61 1.04 -1.12 -5.06 118.95 118.65 1phd s ARG 231 Ca 0.00 -1.26 -0.25 0.00 -1.04 0.00 0.00 55.73 53.18 1phd s ARG 231 Cb 0.00 -2.65 -0.08 0.00 -2.04 0.00 0.00 34.95 30.18 1phd s ARG 231 CO 0.00 -0.13 1.17 -2.14 -0.04 0.00 0.00 175.30 174.16 1phd s PRO 232 N -4.21 3.98 0.48 3.89 0.02 -1.26 -0.72 135.00 137.17 1phd s PRO 232 Ca 0.49 1.82 -0.22 0.00 0.02 0.00 0.00 61.00 63.11 1phd s PRO 232 Cb -0.08 -2.60 -0.07 0.00 0.02 0.00 0.00 34.50 31.77 1phd s PRO 232 CO 0.31 -0.38 1.14 -1.50 -0.33 0.00 0.00 177.00 176.24 1phd s ILE 233 N -1.46 3.20 0.80 2.83 2.07 -1.01 -4.77 121.20 122.86 1phd s ILE 233 Ca 0.59 0.86 -0.09 0.00 -1.41 0.00 0.00 60.65 60.59 1phd s ILE 233 Cb -0.30 -3.41 0.12 0.00 0.13 0.00 0.00 42.46 38.99 1phd s ILE 233 CO 0.37 -0.05 1.13 0.42 -1.91 0.00 0.00 174.94 174.90 1phd s THR 234 N -1.62 2.13 0.11 4.00 -4.23 -1.26 -4.92 115.64 109.84 1phd s THR 234 Ca 0.65 -0.20 -0.13 0.00 -1.18 0.00 0.00 61.69 60.83 1phd s THR 234 Cb -0.26 -2.93 -0.12 0.00 1.34 0.00 0.00 72.50 70.53 1phd s THR 234 CO 0.32 0.00 1.36 -1.28 -0.54 0.00 0.00 174.62 174.48 1phd h SER 235 N -0.96 0.95 -0.24 3.99 0.87 -1.96 -2.00 113.55 114.20 1phd h SER 235 Ca -0.43 -0.57 -0.05 0.00 -1.23 0.00 0.00 61.79 59.51 1phd h SER 235 Cb 1.29 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.96 1phd h SER 235 CO 0.51 1.34 -0.06 -0.78 -0.53 0.00 0.00 176.83 177.31 1phd h ASP 236 N 0.59 0.47 -0.65 6.23 3.58 -1.99 -0.60 116.42 124.05 1phd h ASP 236 Ca -0.01 -0.37 0.02 0.00 0.42 0.00 0.00 57.03 57.09 1phd h ASP 236 Cb 1.22 -0.13 -0.04 0.00 1.72 0.00 0.00 39.33 42.11 1phd h ASP 236 CO 0.13 0.73 0.41 -0.33 -2.88 0.00 0.00 179.24 177.31 1phd h GLU 237 N 0.20 0.79 -0.37 0.28 5.08 -1.95 -1.37 114.58 117.24 1phd h GLU 237 Ca 0.06 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.29 1phd h GLU 237 Cb 0.53 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1phd h GLU 237 CO 0.02 0.53 -0.13 0.00 -1.00 0.00 0.00 179.01 178.43 1phd h ALA 238 N 1.27 1.10 -0.26 3.43 0.00 -1.18 -1.14 119.26 122.48 1phd h ALA 238 Ca 0.26 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1phd h ALA 238 Cb -0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1phd h ALA 238 CO -0.09 0.56 0.13 -0.22 0.00 0.00 0.00 179.25 179.63 1phd h LYS 239 N 0.59 0.37 -0.29 0.00 3.64 -0.91 0.56 116.57 120.53 1phd h LYS 239 Ca 0.10 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.35 1phd h LYS 239 Cb 0.56 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 1phd h LYS 239 CO 0.04 0.36 -0.16 0.00 -2.27 0.00 0.00 179.45 177.41 1phd h ARG 240 N 0.29 0.51 0.10 1.90 3.08 -1.11 0.28 114.38 119.43 1phd h ARG 240 Ca 0.09 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 1phd h ARG 240 Cb 0.10 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1phd h ARG 240 CO -0.01 0.66 -0.05 0.52 -1.07 0.00 0.00 179.97 180.02 1phd h MET 241 N 0.46 -0.13 -0.95 0.04 2.86 -0.95 -2.35 114.93 113.92 1phd h MET 241 Ca 0.08 0.01 0.17 0.00 -2.06 0.00 0.00 59.70 57.90 1phd h MET 241 Cb 0.55 0.03 -0.08 0.00 0.06 0.00 0.00 31.60 32.16 1phd h MET 241 CO 0.04 0.27 0.60 0.00 1.06 0.00 0.00 176.91 178.88 1phd h GLY 243 N 0.69 1.13 0.88 0.00 0.00 -0.52 -1.41 103.07 103.84 1phd h GLY 243 Ca 0.51 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.55 1phd h GLY 243 CO -0.27 0.15 0.05 -2.00 0.00 0.00 0.00 176.54 174.47 1phd h LEU 244 N 0.74 0.15 -0.98 3.11 5.85 -0.77 -3.08 115.31 120.33 1phd h LEU 244 Ca 0.35 -0.15 0.11 0.00 0.84 0.00 0.00 57.88 59.03 1phd h LEU 244 Cb 0.27 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.18 1phd h LEU 244 CO -0.21 0.25 0.61 -0.07 -0.34 0.00 0.00 178.44 178.67 1phd h LEU 245 N 0.03 0.89 0.09 2.25 3.38 -0.53 -1.84 115.31 119.59 1phd h LEU 245 Ca 0.04 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1phd h LEU 245 Cb 0.15 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1phd h LEU 245 CO -0.00 0.49 -0.16 -0.07 0.09 0.00 0.00 178.44 178.78 1phd h LEU 246 N 0.97 -0.44 -0.35 1.67 -0.00 -1.23 0.16 115.31 116.10 1phd h LEU 246 Ca 0.48 0.05 0.01 0.00 -0.00 0.00 0.00 57.88 58.42 1phd h LEU 246 Cb 0.45 0.17 -0.02 0.00 -0.00 0.00 0.00 40.66 41.26 1phd h LEU 246 CO -0.26 -0.23 0.22 0.58 -0.00 0.00 0.00 178.44 178.75 1phd h VAL 247 N -0.31 1.07 -0.44 1.22 2.07 -1.45 0.28 116.25 118.69 1phd h VAL 247 Ca 0.02 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.41 1phd h VAL 247 Cb 0.33 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 1phd h VAL 247 CO -0.09 0.08 0.25 1.23 0.02 0.00 0.00 177.57 179.07 1phd h GLY 248 N 0.46 0.62 0.76 2.17 0.00 -0.90 -0.65 103.07 105.52 1phd h GLY 248 Ca 0.13 -0.19 -0.05 0.00 0.00 0.00 0.00 47.33 47.23 1phd h GLY 248 CO -0.04 0.15 -0.08 -1.33 0.00 0.00 0.00 176.54 175.24 1phd h GLY 249 N 0.50 0.37 1.29 4.60 0.00 -0.13 -3.30 103.07 106.41 1phd h GLY 249 Ca 0.18 -0.34 -0.30 0.00 0.00 0.00 0.00 47.33 46.88 1phd h GLY 249 CO -0.09 0.31 -1.49 1.41 0.00 0.00 0.00 176.54 176.67 1phd h LEU 250 N 0.01 0.35 -1.37 3.11 4.07 -0.38 -3.40 115.31 117.69 1phd h LEU 250 Ca 0.04 -0.47 0.00 0.00 0.08 0.00 0.00 57.88 57.52 1phd h LEU 250 Cb 0.56 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.19 1phd h LEU 250 CO 0.02 1.39 -0.15 -0.67 -1.08 0.00 0.00 178.44 177.95 1phd n ASP 251 N -3.43 2.19 0.00 -0.43 2.03 -0.26 -4.78 116.55 111.87 1phd n ASP 251 Ca -0.15 -1.59 0.00 0.00 0.52 0.00 0.00 54.79 53.57 1phd n ASP 251 Cb 1.04 0.20 0.00 0.00 -0.72 0.00 0.00 41.12 41.64 1phd n ASP 251 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1phd n THR 252 N 0.56 0.00 0.23 5.18 -2.24 -1.24 -4.69 114.28 112.08 1phd n THR 252 Ca 0.09 0.30 0.09 0.00 -2.27 0.00 0.00 64.05 62.27 1phd n THR 252 Cb 0.42 -1.28 0.65 0.00 -2.10 0.00 0.00 70.33 68.02 1phd n THR 252 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1phd h VAL 253 N 0.00 0.97 0.29 2.28 2.07 -1.88 -1.31 116.25 118.66 1phd h VAL 253 Ca 0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1phd h VAL 253 Cb 0.00 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1phd h VAL 253 CO 0.00 0.00 -0.24 0.58 0.02 0.00 0.00 177.57 177.93 1phd h VAL 254 N 0.00 0.48 -0.32 2.57 2.07 -1.86 -1.56 116.25 117.63 1phd h VAL 254 Ca 0.03 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.41 1phd h VAL 254 Cb 0.10 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1phd h VAL 254 CO -0.00 0.00 -0.32 0.78 0.02 0.00 0.00 177.57 178.05 1phd h ASN 255 N -0.55 0.83 -0.71 0.57 2.35 -1.64 -3.24 115.58 113.19 1phd h ASN 255 Ca -0.02 -0.47 0.14 0.00 -0.55 0.00 0.00 56.30 55.40 1phd h ASN 255 Cb 0.49 -0.23 -0.10 0.00 0.05 0.00 0.00 38.32 38.53 1phd h ASN 255 CO -0.03 1.13 0.22 0.15 -1.65 0.00 0.00 177.43 177.26 1phd h PHE 256 N 0.54 0.37 -0.51 1.19 3.57 -0.66 -2.39 116.94 119.04 1phd h PHE 256 Ca 0.05 0.04 -0.12 0.00 3.53 0.00 0.00 57.97 61.47 1phd h PHE 256 Cb 0.90 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 1phd h PHE 256 CO 0.07 -0.01 -0.14 -0.07 -2.23 0.00 0.00 178.31 175.94 1phd h LEU 257 N 0.35 1.01 -0.89 0.59 3.38 -1.33 -2.02 115.31 116.39 1phd h LEU 257 Ca 0.39 -0.36 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1phd h LEU 257 Cb 0.62 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1phd h LEU 257 CO -0.44 1.14 0.11 0.28 0.09 0.00 0.00 178.44 179.62 1phd h SER 258 N 0.86 0.88 -0.44 -0.43 0.02 -1.49 0.21 113.55 113.16 1phd h SER 258 Ca 0.13 -0.18 -0.10 0.00 -0.84 0.00 0.00 61.79 60.80 1phd h SER 258 Cb 0.71 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 1phd h SER 258 CO 0.05 0.88 -0.10 -0.26 -1.14 0.00 0.00 176.83 176.26 1phd h PHE 259 N 0.88 0.95 -0.66 3.45 0.04 -1.25 -0.33 116.94 120.02 1phd h PHE 259 Ca 0.18 -0.20 -0.08 0.00 2.80 0.00 0.00 57.97 60.67 1phd h PHE 259 Cb 0.37 -0.23 -0.03 0.00 2.20 0.00 0.00 35.95 38.26 1phd h PHE 259 CO 0.02 0.95 0.11 0.77 -0.60 0.00 0.00 178.31 179.56 1phd h SER 260 N 0.68 1.04 0.09 2.17 0.02 -1.17 -1.63 113.55 114.75 1phd h SER 260 Ca 0.11 -0.26 -0.14 0.00 -0.84 0.00 0.00 61.79 60.67 1phd h SER 260 Cb 0.64 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 1phd h SER 260 CO 0.04 1.04 -0.48 -0.03 -1.14 0.00 0.00 176.83 176.26 1phd h MET 261 N 1.01 0.45 0.06 3.45 1.85 -0.17 0.10 114.93 121.68 1phd h MET 261 Ca 0.20 -0.25 -0.00 0.00 -0.61 0.00 0.00 59.70 59.03 1phd h MET 261 Cb 0.43 0.02 0.00 0.00 0.43 0.00 0.00 31.60 32.48 1phd h MET 261 CO 0.01 0.84 -0.03 1.49 -0.40 0.00 0.00 176.91 178.82 1phd h GLU 262 N 0.36 -0.08 -0.22 0.39 4.81 -1.07 0.24 114.58 119.01 1phd h GLU 262 Ca 0.02 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.31 1phd h GLU 262 Cb 0.97 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.32 1phd h GLU 262 CO 0.09 0.08 -0.11 0.35 -0.73 0.00 0.00 179.01 178.69 1phd h PHE 263 N -0.23 -0.25 -0.64 0.92 3.57 -1.06 -2.47 116.94 116.78 1phd h PHE 263 Ca -0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1phd h PHE 263 Cb 0.20 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 1phd h PHE 263 CO -0.03 -0.16 0.41 -0.07 -2.23 0.00 0.00 178.31 176.23 1phd h LEU 264 N -0.08 0.74 -2.44 0.59 3.38 -0.39 -1.29 115.31 115.82 1phd h LEU 264 Ca 0.12 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1phd h LEU 264 Cb 0.26 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1phd h LEU 264 CO -0.27 0.56 0.03 0.00 0.09 0.00 0.00 178.44 178.85 1phd h ALA 265 N 1.22 1.56 0.00 1.53 0.00 -0.20 -2.51 119.26 120.85 1phd h ALA 265 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1phd h ALA 265 Cb -0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1phd h ALA 265 CO -0.05 -0.05 -0.88 1.63 0.00 0.00 0.00 179.25 179.91 1phd n LYS 266 N -3.82 0.06 -3.80 0.00 5.02 -0.56 -4.31 118.16 110.74 1phd n LYS 266 Ca -0.02 -0.01 -0.28 0.00 -2.02 0.00 0.00 58.31 55.98 1phd n LYS 266 Cb 0.12 -1.51 -0.12 0.00 -0.02 0.00 0.00 35.03 33.50 1phd n LYS 266 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1phd s SER 267 N -3.17 4.08 0.30 4.39 0.15 -0.75 -4.95 113.70 113.75 1phd s SER 267 Ca 0.08 -3.52 0.07 0.00 0.70 0.00 0.00 55.95 53.28 1phd s SER 267 Cb 0.16 -1.37 0.81 0.00 -1.71 0.00 0.00 66.02 63.91 1phd s SER 267 CO 0.81 -0.13 1.71 -0.65 1.20 0.00 0.00 173.24 176.18 1phd h PRO 268 N 5.67 0.47 0.00 5.44 0.11 -1.86 0.32 132.00 142.15 1phd h PRO 268 Ca 0.13 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.14 1phd h PRO 268 Cb 0.81 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 1phd h PRO 268 CO 0.63 0.31 -0.36 0.93 -0.21 0.00 0.00 178.00 179.30 1phd h GLU 269 N 0.48 0.00 -0.25 1.05 3.07 -1.93 -1.60 114.58 115.41 1phd h GLU 269 Ca 0.60 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 59.30 1phd h GLU 269 Cb 1.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.06 1phd h GLU 269 CO -0.51 0.36 -0.47 0.45 -1.40 0.00 0.00 179.01 177.44 1phd h HIS 270 N 0.00 0.95 -0.37 4.33 3.86 -0.74 -3.08 115.15 120.10 1phd h HIS 270 Ca -0.00 -0.34 0.04 0.00 -1.16 0.00 0.00 60.37 58.91 1phd h HIS 270 Cb 0.77 -0.18 -0.04 0.00 1.06 0.00 0.00 27.41 29.02 1phd h HIS 270 CO 0.00 1.14 0.13 0.00 0.86 0.00 0.00 177.93 180.06 1phd h ARG 271 N 0.49 0.28 -0.89 2.45 3.08 -1.33 -3.13 114.38 115.33 1phd h ARG 271 Ca 0.01 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.05 1phd h ARG 271 Cb 1.08 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 31.02 1phd h ARG 271 CO 0.11 0.18 0.59 1.96 -1.07 0.00 0.00 179.97 181.74 1phd h GLN 272 N 0.29 1.17 -0.63 0.04 1.08 -1.36 -1.57 115.11 114.13 1phd h GLN 272 Ca 0.17 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.27 1phd h GLN 272 Cb 0.14 -0.26 -0.03 0.00 -0.05 0.00 0.00 27.48 27.28 1phd h GLN 272 CO -0.17 0.78 0.30 1.49 -0.95 0.00 0.00 178.83 180.27 1phd h GLU 273 N 1.21 0.90 -0.00 1.46 4.81 -1.52 -0.62 114.58 120.82 1phd h GLU 273 Ca 0.33 -0.14 -0.17 0.00 -0.13 0.00 0.00 59.36 59.25 1phd h GLU 273 Cb -0.14 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.06 1phd h GLU 273 CO -0.07 0.73 -0.78 -0.07 -0.73 0.00 0.00 179.01 178.09 1phd h LEU 274 N 0.86 0.04 0.07 1.64 3.38 -1.47 -0.03 115.31 119.80 1phd h LEU 274 Ca 0.21 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 1phd h LEU 274 Cb 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1phd h LEU 274 CO -0.03 0.80 -0.03 0.40 0.09 0.00 0.00 178.44 179.67 1phd h ILE 275 N 0.02 1.09 0.00 1.22 2.04 -0.92 -3.28 117.51 117.68 1phd h ILE 275 Ca -0.01 -0.54 -0.12 0.00 1.00 0.00 0.00 64.86 65.19 1phd h ILE 275 Cb 1.37 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 38.87 1phd h ILE 275 CO 0.10 0.13 -0.74 1.05 0.00 0.00 0.00 178.15 178.70 1phd h GLU 276 N -0.33 0.00 -2.13 2.37 4.11 -1.15 -3.39 114.58 114.06 1phd h GLU 276 Ca -0.01 0.00 -0.58 0.00 0.07 0.00 0.00 59.36 58.84 1phd h GLU 276 Cb 0.29 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.13 1phd h GLU 276 CO 0.02 0.47 -0.77 0.54 0.07 0.00 0.00 179.01 179.33 1phd n ARG 277 N -3.15 1.99 0.27 1.06 5.12 -0.03 -4.94 116.66 116.99 1phd n ARG 277 Ca -0.01 -4.21 0.18 0.00 -1.93 0.00 0.00 57.85 51.88 1phd n ARG 277 Cb 0.77 -1.93 0.91 0.00 -1.16 0.00 0.00 32.46 31.05 1phd n ARG 277 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1phd h PRO 278 N 3.98 0.00 0.00 5.56 0.11 -1.76 -2.39 132.00 137.49 1phd h PRO 278 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1phd h PRO 278 Cb 0.72 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.83 1phd h PRO 278 CO 0.71 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.65 1phd n GLU 279 N -3.30 0.08 0.05 1.05 0.00 -1.26 -1.43 120.64 115.83 1phd n GLU 279 Ca -0.00 0.45 0.12 0.00 0.00 0.00 0.00 57.16 57.72 1phd n GLU 279 Cb 0.31 -1.70 0.07 0.00 0.00 0.00 0.00 31.44 30.12 1phd n GLU 279 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1phd n ARG 280 N -1.87 0.36 -0.24 3.44 1.74 -0.90 -4.52 116.66 114.67 1phd n ARG 280 Ca 0.01 0.05 -0.00 0.00 -0.77 0.00 0.00 57.85 57.14 1phd n ARG 280 Cb 0.11 -1.67 0.07 0.00 -1.02 0.00 0.00 32.46 29.95 1phd n ARG 280 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1phd h ILE 281 N 0.00 0.27 0.31 0.55 2.04 -1.42 0.15 117.51 119.41 1phd h ILE 281 Ca 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1phd h ILE 281 Cb 0.79 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1phd h ILE 281 CO 0.00 0.00 -0.27 -0.65 0.00 0.00 0.00 178.15 177.23 1phd h PRO 282 N -0.02 -0.58 -0.57 2.37 0.11 -1.82 0.54 132.00 132.03 1phd h PRO 282 Ca 0.32 0.04 0.11 0.00 0.11 0.00 0.00 66.00 66.59 1phd h PRO 282 Cb 0.52 0.13 -0.10 0.00 0.11 0.00 0.00 31.00 31.66 1phd h PRO 282 CO -0.72 -0.39 -0.10 0.00 -0.21 0.00 0.00 178.00 176.59 1phd h ALA 283 N -0.01 0.43 -0.76 -0.75 0.00 -1.71 -0.54 119.26 115.93 1phd h ALA 283 Ca -0.02 0.21 0.05 0.00 0.00 0.00 0.00 54.91 55.15 1phd h ALA 283 Cb 0.54 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 18.67 1phd h ALA 283 CO -0.04 -0.42 0.46 0.00 0.00 0.00 0.00 179.25 179.25 1phd h ALA 284 N 1.55 1.02 -0.69 0.00 0.00 -0.38 -2.01 119.26 118.75 1phd h ALA 284 Ca 0.28 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1phd h ALA 284 Cb 0.43 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1phd h ALA 284 CO -0.55 0.21 0.30 0.00 0.00 0.00 0.00 179.25 179.21 1phd h GLU 286 N 0.98 0.80 -0.87 0.00 4.39 -0.96 -1.36 114.58 117.57 1phd h GLU 286 Ca 0.23 -0.23 0.01 0.00 0.34 0.00 0.00 59.36 59.71 1phd h GLU 286 Cb 0.18 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.70 1phd h GLU 286 CO -0.02 0.83 0.57 1.49 -1.16 0.00 0.00 179.01 180.72 1phd h GLU 287 N 0.66 1.13 -0.10 2.33 4.57 -1.33 0.36 114.58 122.21 1phd h GLU 287 Ca 0.14 -0.07 -0.16 0.00 -1.18 0.00 0.00 59.36 58.09 1phd h GLU 287 Cb 0.43 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 1phd h GLU 287 CO 0.01 0.75 -0.62 -0.07 -1.18 0.00 0.00 179.01 177.90 1phd h LEU 288 N 1.16 0.40 -0.85 1.64 3.38 -1.28 -0.04 115.31 119.71 1phd h LEU 288 Ca 0.32 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1phd h LEU 288 Cb -0.12 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1phd h LEU 288 CO -0.08 0.92 0.09 -0.07 0.09 0.00 0.00 178.44 179.39 1phd h LEU 289 N 0.26 0.90 0.38 1.67 3.38 -0.51 0.12 115.31 121.51 1phd h LEU 289 Ca -0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1phd h LEU 289 Cb 1.14 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1phd h LEU 289 CO 0.10 0.91 -0.18 -0.09 0.09 0.00 0.00 178.44 179.27 1phd h ARG 290 N 0.89 -0.49 -0.35 1.13 2.43 -0.82 -2.84 114.38 114.33 1phd h ARG 290 Ca 0.18 0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.30 1phd h ARG 290 Cb 0.40 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 1phd h ARG 290 CO 0.01 -0.20 -0.11 -0.09 -1.51 0.00 0.00 179.97 178.07 1phd h ARG 291 N -0.77 0.69 -0.75 0.20 9.65 -0.97 -3.23 114.38 119.20 1phd h ARG 291 Ca -0.05 -0.28 -0.47 0.00 -1.10 0.00 0.00 59.98 58.08 1phd h ARG 291 Cb 0.52 -0.03 -0.27 0.00 -1.39 0.00 0.00 29.97 28.80 1phd h ARG 291 CO 0.09 0.86 0.19 1.19 2.80 0.00 0.00 179.97 185.10 1phd n PHE 292 N -4.38 2.43 -1.41 2.20 3.72 0.43 -4.96 117.46 115.49 1phd n PHE 292 Ca -0.02 -2.21 -0.36 0.00 -0.05 0.00 0.00 57.45 54.81 1phd n PHE 292 Cb 0.36 -0.83 0.09 0.00 -0.94 0.00 0.00 39.48 38.15 1phd n PHE 292 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1phd n SER 293 N -0.99 0.83 0.00 4.37 2.88 -1.07 -4.92 113.62 114.73 1phd n SER 293 Ca 0.49 0.69 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 1phd n SER 293 Cb 1.03 -1.44 0.00 0.00 -0.75 0.00 0.00 64.21 63.05 1phd n SER 293 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1phd n LEU 294 N -1.86 0.00 -4.84 2.46 -0.00 -1.26 -4.84 117.00 106.66 1phd n LEU 294 Ca 0.14 -0.16 -0.36 0.00 -0.00 0.00 0.00 56.01 55.63 1phd n LEU 294 Cb 0.49 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.85 1phd n LEU 294 CO 0.48 0.22 -0.20 -0.69 -0.00 0.00 0.00 177.39 177.20 1phd s VAL 295 N 0.00 5.20 -0.30 1.47 1.01 -1.26 -1.28 120.40 125.25 1phd s VAL 295 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.97 1phd s VAL 295 Cb 0.00 -3.29 0.13 0.00 0.00 0.00 0.00 36.38 33.21 1phd s VAL 295 CO 0.00 0.54 0.25 0.00 0.00 0.00 0.00 175.10 175.89 1phd s ALA 296 N -1.07 -0.15 0.00 5.51 0.00 0.55 -2.15 121.76 124.45 1phd s ALA 296 Ca 0.18 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.54 1phd s ALA 296 Cb -0.12 -1.70 0.00 0.00 0.00 0.00 0.00 23.12 21.30 1phd s ALA 296 CO 0.07 -1.73 0.00 -0.40 0.00 0.00 0.00 175.76 173.70 1phd n ASP 297 N 5.21 1.69 -0.99 0.00 5.68 -1.26 -4.51 116.55 122.37 1phd n ASP 297 Ca -0.02 -0.64 0.00 0.00 -0.50 0.00 0.00 54.79 53.63 1phd n ASP 297 Cb 0.45 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 1phd n ASP 297 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1phd n GLY 298 N 4.23 2.67 3.24 6.12 0.00 -0.33 0.35 105.19 121.47 1phd n GLY 298 Ca 0.00 -1.22 -0.10 0.00 0.00 0.00 0.00 46.02 44.70 1phd n GLY 298 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1phd s ARG 299 N -1.97 1.04 0.03 1.61 1.81 -0.85 -4.37 118.95 116.25 1phd s ARG 299 Ca 0.00 -1.31 0.07 0.00 -1.72 0.00 0.00 55.73 52.77 1phd s ARG 299 Cb 0.00 0.31 -0.03 0.00 -0.45 0.00 0.00 34.95 34.78 1phd s ARG 299 CO 0.00 -0.34 -0.20 -1.50 -0.68 0.00 0.00 175.30 172.58 1phd s ILE 300 N -4.01 2.59 0.05 1.52 2.07 0.23 -2.15 121.20 121.50 1phd s ILE 300 Ca 0.21 -1.20 -0.30 0.00 -1.41 0.00 0.00 60.65 57.94 1phd s ILE 300 Cb 0.05 -2.05 -0.05 0.00 0.13 0.00 0.00 42.46 40.54 1phd s ILE 300 CO 0.01 0.38 1.15 -0.76 -1.91 0.00 0.00 174.94 173.81 1phd s LEU 301 N -1.28 4.37 0.21 8.50 2.01 0.11 -0.70 118.68 131.91 1phd s LEU 301 Ca 0.13 1.94 0.24 0.00 0.01 0.00 0.00 54.13 56.46 1phd s LEU 301 Cb -0.10 -3.58 0.42 0.00 0.01 0.00 0.00 46.19 42.94 1phd s LEU 301 CO 0.04 -0.42 1.46 0.71 1.01 0.00 0.00 176.35 179.14 1phd h THR 302 N 4.55 0.00 -2.75 5.49 1.35 -1.55 0.53 112.91 120.53 1phd h THR 302 Ca -0.42 -0.65 0.01 0.00 -0.55 0.00 0.00 66.41 64.81 1phd h THR 302 Cb 1.22 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 1phd h THR 302 CO 0.80 0.00 0.30 -1.54 -0.25 0.00 0.00 175.52 174.82 1phd n SER 303 N -2.41 -1.87 -4.72 5.36 3.41 -1.26 -4.80 113.62 107.34 1phd n SER 303 Ca 0.04 -2.24 -0.42 0.00 -0.26 0.00 0.00 58.87 55.99 1phd n SER 303 Cb 0.47 3.10 -0.03 0.00 -0.26 0.00 0.00 64.21 67.49 1phd n SER 303 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1phd s ASP 304 N -2.84 7.15 -0.12 4.04 1.11 -1.26 -3.07 116.67 121.68 1phd s ASP 304 Ca 0.15 1.97 -0.18 0.00 0.18 0.00 0.00 52.55 54.67 1phd s ASP 304 Cb -0.04 -2.58 0.04 0.00 1.07 0.00 0.00 42.92 41.41 1phd s ASP 304 CO 0.09 -0.40 0.46 -0.47 1.18 0.00 0.00 175.17 176.03 1phd s TYR 305 N 0.86 -0.45 -0.29 4.23 5.04 -0.38 -4.90 117.35 121.47 1phd s TYR 305 Ca 0.56 0.98 -0.07 0.00 -2.44 0.00 0.00 57.07 56.11 1phd s TYR 305 Cb -0.28 0.19 0.01 0.00 0.35 0.00 0.00 41.96 42.22 1phd s TYR 305 CO 0.30 -0.33 0.08 -2.00 -1.34 0.00 0.00 175.55 172.25 1phd s GLU 306 N -0.36 3.10 -0.22 4.97 2.12 -1.26 -0.91 118.70 126.15 1phd s GLU 306 Ca -0.05 -0.85 0.02 0.00 0.36 0.00 0.00 54.97 54.45 1phd s GLU 306 Cb -0.03 -3.36 0.04 0.00 0.26 0.00 0.00 34.13 31.03 1phd s GLU 306 CO 0.03 -0.44 -0.14 0.12 -0.54 0.00 0.00 175.26 174.30 1phd s PHE 307 N 1.50 2.85 -1.40 5.30 5.36 0.26 -4.74 117.98 127.11 1phd s PHE 307 Ca 0.03 -1.88 -0.04 0.00 -0.96 0.00 0.00 56.93 54.07 1phd s PHE 307 Cb -0.17 -1.84 0.03 0.00 -0.34 0.00 0.00 43.02 40.70 1phd s PHE 307 CO 0.02 -0.82 0.70 0.72 -1.46 0.00 0.00 175.22 174.39 1phd n HIS 308 N 4.57 -1.93 -1.01 10.12 8.25 -1.26 -1.78 115.22 132.18 1phd n HIS 308 Ca -0.16 0.83 -0.00 0.00 -0.26 0.00 0.00 57.72 58.12 1phd n HIS 308 Cb 0.46 -4.08 -0.00 0.00 1.12 0.00 0.00 29.99 27.49 1phd n HIS 308 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1phd n GLY 309 N -1.69 0.37 3.47 -1.41 0.00 -1.26 -5.01 105.19 99.66 1phd n GLY 309 Ca -0.21 -0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 1phd n GLY 309 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1phd s VAL 310 N -1.73 3.03 -0.16 1.61 1.01 -0.73 -5.10 120.40 118.33 1phd s VAL 310 Ca 0.00 -0.78 -0.19 0.00 0.00 0.00 0.00 61.98 61.02 1phd s VAL 310 Cb 0.00 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 1phd s VAL 310 CO 0.00 0.56 0.52 -1.10 0.00 0.00 0.00 175.10 175.08 1phd s GLN 311 N -0.81 4.26 -0.12 2.72 -1.52 -1.26 -0.58 119.66 122.34 1phd s GLN 311 Ca 0.12 0.46 -0.01 0.00 -1.95 0.00 0.00 55.36 53.98 1phd s GLN 311 Cb -0.11 -3.51 -0.02 0.00 -0.22 0.00 0.00 33.01 29.15 1phd s GLN 311 CO 0.01 -0.03 -0.09 -0.51 -0.25 0.00 0.00 175.29 174.42 1phd s LEU 312 N 1.24 2.95 0.00 2.90 1.43 -0.09 -4.92 118.68 122.18 1phd s LEU 312 Ca 0.26 -0.21 -0.09 0.00 -1.03 0.00 0.00 54.13 53.06 1phd s LEU 312 Cb -0.15 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.34 1phd s LEU 312 CO 0.10 0.21 0.30 -0.54 0.23 0.00 0.00 176.35 176.65 1phd s LYS 313 N 0.12 3.66 0.07 1.70 1.02 -1.26 -1.25 119.74 123.80 1phd s LYS 313 Ca -0.04 0.06 -0.37 0.00 0.02 0.00 0.00 55.97 55.64 1phd s LYS 313 Cb -0.14 -3.11 -0.18 0.00 -0.52 0.00 0.00 37.83 33.88 1phd s LYS 313 CO 0.04 0.66 1.21 1.17 -0.92 0.00 0.00 175.35 177.51 1phd n LYS 314 N 1.35 0.73 0.00 1.68 4.81 -1.17 -1.42 118.16 124.14 1phd n LYS 314 Ca -0.13 0.26 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 1phd n LYS 314 Cb 0.53 -1.83 0.00 0.00 0.02 0.00 0.00 35.03 33.75 1phd n LYS 314 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1phd n GLY 315 N 2.12 1.32 3.77 3.14 0.00 0.19 -4.91 105.19 110.81 1phd n GLY 315 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 1phd n GLY 315 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1phd s ASP 316 N -1.98 6.33 -0.03 1.61 1.01 -0.51 -4.75 116.67 118.35 1phd s ASP 316 Ca 0.00 2.54 -0.03 0.00 0.71 0.00 0.00 52.55 55.77 1phd s ASP 316 Cb 0.00 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.26 1phd s ASP 316 CO 0.00 -0.83 0.14 -1.10 0.21 0.00 0.00 175.17 173.59 1phd s GLN 317 N -2.31 3.31 -0.05 8.23 -0.21 -1.26 -0.71 119.66 126.65 1phd s GLN 317 Ca 0.58 -0.34 0.02 0.00 0.02 0.00 0.00 55.36 55.64 1phd s GLN 317 Cb -0.35 -3.03 0.01 0.00 1.00 0.00 0.00 33.01 30.64 1phd s GLN 317 CO 0.45 0.69 -0.10 -1.50 -2.12 0.00 0.00 175.29 172.70 1phd s ILE 318 N -1.22 0.94 -0.10 1.08 2.07 -0.92 -1.44 121.20 121.61 1phd s ILE 318 Ca 0.23 -0.38 -0.29 0.00 -1.41 0.00 0.00 60.65 58.81 1phd s ILE 318 Cb -0.12 -0.87 -0.02 0.00 0.13 0.00 0.00 42.46 41.58 1phd s ILE 318 CO 0.14 0.31 0.97 -0.22 -1.91 0.00 0.00 174.94 174.23 1phd s LEU 319 N 0.66 4.25 -0.63 8.50 2.96 0.18 -2.01 118.68 132.59 1phd s LEU 319 Ca -0.12 1.48 0.06 0.00 -0.22 0.00 0.00 54.13 55.33 1phd s LEU 319 Cb -0.15 -3.49 0.22 0.00 0.50 0.00 0.00 46.19 43.27 1phd s LEU 319 CO 0.02 -0.41 0.63 0.18 -1.32 0.00 0.00 176.35 175.46 1phd n LEU 320 N 4.86 3.06 -4.52 -0.68 4.77 0.15 -2.09 117.00 122.55 1phd n LEU 320 Ca 0.07 -5.27 -0.44 0.00 -0.03 0.00 0.00 56.01 50.35 1phd n LEU 320 Cb 0.49 -0.54 -0.05 0.00 -2.33 0.00 0.00 43.42 40.99 1phd n LEU 320 CO 0.51 1.96 1.92 -2.65 -1.33 0.00 0.00 177.39 177.80 1phd n PRO 321 N 1.33 1.24 -0.18 3.23 -0.02 -1.25 -4.32 135.00 135.02 1phd n PRO 321 Ca 0.26 0.26 0.14 0.00 -2.02 0.00 0.00 63.50 62.14 1phd n PRO 321 Cb 0.40 -2.88 0.47 0.00 -0.02 0.00 0.00 33.50 31.48 1phd n PRO 321 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1phd h GLN 322 N 15.13 0.47 -0.77 -0.52 7.50 -1.73 -1.81 115.11 133.38 1phd h GLN 322 Ca -0.28 -0.03 0.18 0.00 0.50 0.00 0.00 58.65 59.02 1phd h GLN 322 Cb 1.28 -0.11 -0.12 0.00 0.05 0.00 0.00 27.48 28.59 1phd h GLN 322 CO 1.07 0.31 0.17 1.98 -1.50 0.00 0.00 178.83 180.86 1phd h MET 323 N 0.48 0.23 0.00 1.46 4.05 -1.71 -3.22 114.93 116.22 1phd h MET 323 Ca 0.37 -0.01 -0.20 0.00 -0.28 0.00 0.00 59.70 59.58 1phd h MET 323 Cb 0.77 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.51 1phd h MET 323 CO -0.13 0.15 -0.89 -0.07 0.23 0.00 0.00 176.91 176.20 1phd h LEU 324 N 0.24 0.32 -0.85 3.39 3.38 -1.64 -3.37 115.31 116.77 1phd h LEU 324 Ca 0.45 -0.26 0.15 0.00 0.09 0.00 0.00 57.88 58.31 1phd h LEU 324 Cb 0.80 -0.10 -0.15 0.00 0.09 0.00 0.00 40.66 41.30 1phd h LEU 324 CO -0.56 1.06 -0.31 0.28 0.09 0.00 0.00 178.44 179.00 1phd h SER 325 N 0.14 -1.12 1.11 -0.43 0.02 -1.67 -1.96 113.55 109.64 1phd h SER 325 Ca -0.05 0.27 -0.03 0.00 -0.84 0.00 0.00 61.79 61.14 1phd h SER 325 Cb 1.52 0.63 -0.00 0.00 0.14 0.00 0.00 62.40 64.68 1phd h SER 325 CO 0.14 -0.29 -0.16 1.23 -1.14 0.00 0.00 176.83 176.61 1phd h GLY 326 N -0.04 0.00 1.10 -3.77 0.00 -1.75 -3.29 103.07 95.32 1phd h GLY 326 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 1phd h GLY 326 CO -0.88 0.00 -0.43 1.04 0.00 0.00 0.00 176.54 176.27 1phd n LEU 327 N -3.27 0.45 -4.67 3.11 4.77 -0.77 -4.57 117.00 112.05 1phd n LEU 327 Ca 0.01 0.05 -0.42 0.00 -0.03 0.00 0.00 56.01 55.62 1phd n LEU 327 Cb 0.43 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 1phd n LEU 327 CO 0.32 0.11 1.12 -0.62 -1.33 0.00 0.00 177.39 177.00 1phd s ASP 328 N -2.99 6.89 0.57 -1.43 -1.08 -1.02 -4.72 116.67 112.89 1phd s ASP 328 Ca 0.12 1.91 0.26 0.00 -0.52 0.00 0.00 52.55 54.32 1phd s ASP 328 Cb 0.18 -2.55 1.66 0.00 -1.46 0.00 0.00 42.92 40.75 1phd s ASP 328 CO 0.68 -0.75 2.22 1.05 0.52 0.00 0.00 175.17 178.88 1phd h GLU 329 N 8.23 0.00 0.00 4.34 9.09 -1.90 0.17 114.58 134.51 1phd h GLU 329 Ca -0.33 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.08 1phd h GLU 329 Cb 1.14 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.24 1phd h GLU 329 CO 0.94 0.00 0.00 0.54 0.05 0.00 0.00 179.01 180.54 1phd n ARG 330 N -4.04 0.14 -0.06 1.06 1.74 -1.26 -3.69 116.66 110.54 1phd n ARG 330 Ca -0.03 0.29 -0.09 0.00 -0.77 0.00 0.00 57.85 57.26 1phd n ARG 330 Cb 0.10 -1.73 -0.05 0.00 -1.02 0.00 0.00 32.46 29.76 1phd n ARG 330 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1phd n GLU 331 N -1.98 0.30 -3.75 5.56 -0.58 0.41 -5.00 120.64 115.59 1phd n GLU 331 Ca 0.04 0.07 -0.22 0.00 -0.42 0.00 0.00 57.16 56.63 1phd n GLU 331 Cb 0.26 -1.23 -0.18 0.00 -0.57 0.00 0.00 31.44 29.73 1phd n GLU 331 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1phd s ASN 332 N -5.20 1.38 0.49 1.62 0.01 -0.11 -4.77 114.94 108.36 1phd s ASN 332 Ca -0.16 -0.03 -0.23 0.00 -0.71 0.00 0.00 52.86 51.72 1phd s ASN 332 Cb 0.04 -0.34 -0.07 0.00 0.41 0.00 0.00 41.25 41.30 1phd s ASN 332 CO 0.27 -0.20 1.34 0.00 -1.51 0.00 0.00 177.10 177.00 1phd s ALA 333 N 1.97 3.01 -1.17 0.60 0.00 -1.26 -2.83 121.76 122.08 1phd s ALA 333 Ca 0.04 1.29 -0.30 0.00 0.00 0.00 0.00 51.96 52.99 1phd s ALA 333 Cb -0.12 -3.53 0.04 0.00 0.00 0.00 0.00 23.12 19.50 1phd s ALA 333 CO -0.04 -1.14 0.69 0.00 0.00 0.00 0.00 175.76 175.27 1phd h PRO 335 N -2.34 0.00 -0.07 0.00 0.13 -1.81 -0.90 132.00 127.02 1phd h PRO 335 Ca -0.70 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 1phd h PRO 335 Cb 1.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.53 1phd h PRO 335 CO 0.50 0.00 0.00 -1.33 -0.23 0.00 0.00 178.00 176.94 1phd n MET 336 N -4.27 1.61 -3.50 0.86 2.81 -1.26 -4.78 117.12 108.59 1phd n MET 336 Ca 0.04 -0.89 -0.37 0.00 -1.81 0.00 0.00 57.70 54.67 1phd n MET 336 Cb 0.39 -1.44 -0.08 0.00 -0.71 0.00 0.00 33.22 31.38 1phd n MET 336 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1phd s HIS 337 N -1.92 3.41 -0.39 2.03 5.04 -0.34 -5.04 115.29 118.07 1phd s HIS 337 Ca 0.36 0.55 -0.19 0.00 -1.54 0.00 0.00 55.06 54.23 1phd s HIS 337 Cb 0.19 -2.40 0.01 0.00 0.04 0.00 0.00 32.58 30.42 1phd s HIS 337 CO 0.31 0.12 0.57 0.08 -2.34 0.00 0.00 174.74 173.48 1phd s VAL 338 N 0.87 4.93 -0.20 0.89 1.01 -1.26 -5.01 120.40 121.64 1phd s VAL 338 Ca 0.16 0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.39 1phd s VAL 338 Cb -0.14 -4.07 0.05 0.00 0.00 0.00 0.00 36.38 32.23 1phd s VAL 338 CO 0.05 -0.38 -0.02 -0.62 0.00 0.00 0.00 175.10 174.14 1phd s ASP 339 N 1.85 3.15 0.03 3.32 -1.08 -1.26 -5.01 116.67 117.67 1phd s ASP 339 Ca 0.21 -0.87 0.17 0.00 -0.52 0.00 0.00 52.55 51.53 1phd s ASP 339 Cb -0.15 -0.85 0.70 0.00 -1.46 0.00 0.00 42.92 41.16 1phd s ASP 339 CO 0.15 -0.25 1.53 0.49 0.52 0.00 0.00 175.17 177.61 1phd n PHE 340 N 4.89 0.11 -0.86 -5.34 3.72 -1.26 -3.18 117.46 115.53 1phd n PHE 340 Ca -0.11 0.04 0.08 0.00 -0.05 0.00 0.00 57.45 57.42 1phd n PHE 340 Cb 0.46 -0.57 0.29 0.00 -0.94 0.00 0.00 39.48 38.73 1phd n PHE 340 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1phd n SER 341 N -1.60 4.29 -4.69 4.37 3.41 -1.26 -4.51 113.62 113.63 1phd n SER 341 Ca 0.04 -2.85 -0.44 0.00 -0.26 0.00 0.00 58.87 55.35 1phd n SER 341 Cb 0.19 -0.55 -0.03 0.00 -0.26 0.00 0.00 64.21 63.56 1phd n SER 341 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1phd n ARG 342 N -0.01 2.26 -0.05 4.33 1.74 -1.19 -4.88 116.66 118.86 1phd n ARG 342 Ca 0.22 0.81 0.01 0.00 -0.77 0.00 0.00 57.85 58.12 1phd n ARG 342 Cb 0.92 -2.54 0.31 0.00 -1.02 0.00 0.00 32.46 30.13 1phd n ARG 342 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1phd h GLN 343 N 4.99 0.65 -3.10 5.56 1.08 -1.94 -3.40 115.11 118.95 1phd h GLN 343 Ca -0.45 -0.09 -0.41 0.00 -1.45 0.00 0.00 58.65 56.25 1phd h GLN 343 Cb 1.25 -0.12 -0.40 0.00 -0.05 0.00 0.00 27.48 28.17 1phd h GLN 343 CO 0.82 0.55 -0.73 0.21 -0.95 0.00 0.00 178.83 178.72 1phd s LYS 344 N -5.28 0.02 -0.50 1.46 2.47 -1.26 -5.09 119.74 111.56 1phd s LYS 344 Ca -0.09 0.15 -0.18 0.00 -1.56 0.00 0.00 55.97 54.29 1phd s LYS 344 Cb 0.16 -1.22 0.06 0.00 -1.46 0.00 0.00 37.83 35.37 1phd s LYS 344 CO 0.76 -0.53 0.56 0.08 0.16 0.00 0.00 175.35 176.39 1phd s VAL 345 N 2.18 4.97 -0.25 4.02 1.01 -1.26 -4.97 120.40 126.09 1phd s VAL 345 Ca 0.03 -0.63 -0.08 0.00 0.00 0.00 0.00 61.98 61.30 1phd s VAL 345 Cb -0.14 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 1phd s VAL 345 CO -0.07 -0.74 0.11 -0.55 0.00 0.00 0.00 175.10 173.85 1phd s SER 346 N 2.65 5.47 0.29 3.32 0.15 -1.26 -5.06 113.70 119.26 1phd s SER 346 Ca 0.12 -0.11 -0.11 0.00 0.70 0.00 0.00 55.95 56.55 1phd s SER 346 Cb -0.20 -1.99 0.01 0.00 -1.71 0.00 0.00 66.02 62.12 1phd s SER 346 CO 0.11 -0.01 0.54 -1.38 1.20 0.00 0.00 173.24 173.69 1phd s HIS 347 N 1.50 0.47 -0.27 3.44 -3.43 -1.26 -4.05 115.29 111.69 1phd s HIS 347 Ca 0.06 -0.85 0.22 0.00 -0.80 0.00 0.00 55.06 53.69 1phd s HIS 347 Cb -0.15 0.25 0.50 0.00 -1.43 0.00 0.00 32.58 31.75 1phd s HIS 347 CO 0.06 -1.12 1.11 0.25 -2.00 0.00 0.00 174.74 173.03 1phd n THR 348 N -0.45 1.34 0.03 -5.38 -2.24 -1.26 -4.89 114.28 101.42 1phd n THR 348 Ca -0.02 -3.02 0.11 0.00 -2.27 0.00 0.00 64.05 58.85 1phd n THR 348 Cb 0.61 1.10 0.55 0.00 -2.10 0.00 0.00 70.33 70.50 1phd n THR 348 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1phd h THR 349 N 5.22 0.93 -0.55 4.28 2.02 -1.87 0.23 112.91 123.18 1phd h THR 349 Ca -0.10 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 66.99 1phd h THR 349 Cb 1.28 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.33 1phd h THR 349 CO 0.24 0.05 0.00 0.49 0.37 0.00 0.00 175.52 176.67 1phd n PHE 350 N -4.47 1.44 -1.02 3.16 3.72 -1.26 -4.80 117.46 114.24 1phd n PHE 350 Ca 0.06 -0.67 0.00 0.00 -0.05 0.00 0.00 57.45 56.79 1phd n PHE 350 Cb 0.29 -0.30 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1phd n PHE 350 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1phd n GLY 351 N 0.71 -2.62 3.40 1.37 0.00 0.07 -1.86 105.19 106.26 1phd n GLY 351 Ca 0.24 -1.77 -0.15 0.00 0.00 0.00 0.00 46.02 44.34 1phd n GLY 351 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1phd s HIS 352 N -0.52 -0.45 0.00 1.61 2.46 -1.26 -4.74 115.29 112.39 1phd s HIS 352 Ca 0.00 0.68 0.00 0.00 0.47 0.00 0.00 55.06 56.21 1phd s HIS 352 Cb 0.00 0.30 0.00 0.00 -0.13 0.00 0.00 32.58 32.75 1phd s HIS 352 CO 0.00 -0.56 0.00 0.41 -2.47 0.00 0.00 174.74 172.12 1phd n GLY 353 N 0.84 -0.71 0.22 1.59 0.00 -1.26 -4.14 105.19 101.73 1phd n GLY 353 Ca -0.19 -1.32 0.15 0.00 0.00 0.00 0.00 46.02 44.66 1phd n GLY 353 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1phd h SER 354 N 4.45 0.00 -0.46 1.61 4.64 -1.91 -2.88 113.55 119.00 1phd h SER 354 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1phd h SER 354 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1phd h SER 354 CO 0.00 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.37 1phd n HIS 355 N -2.74 1.40 -1.65 4.77 -0.00 -1.26 -4.97 115.22 110.77 1phd n HIS 355 Ca 0.01 -0.51 -0.47 0.00 -0.00 0.00 0.00 57.72 56.75 1phd n HIS 355 Cb 0.25 -0.33 -0.04 0.00 -0.00 0.00 0.00 29.99 29.87 1phd n HIS 355 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 1phd n LEU 356 N 0.61 2.80 -4.44 2.41 7.94 -1.09 -4.76 117.00 120.47 1phd n LEU 356 Ca 0.20 1.09 -0.54 0.00 -1.11 0.00 0.00 56.01 55.65 1phd n LEU 356 Cb 0.86 -1.38 -0.08 0.00 0.53 0.00 0.00 43.42 43.35 1phd n LEU 356 CO 0.22 -0.46 1.70 0.00 -1.11 0.00 0.00 177.39 177.74 1phd h LEU 358 N 10.57 0.00 -0.88 0.00 3.38 -1.91 -3.09 115.31 123.38 1phd h LEU 358 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1phd h LEU 358 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1phd h LEU 358 CO 1.03 0.55 0.00 0.61 0.09 0.00 0.00 178.44 180.72 1phd n GLY 359 N 0.35 0.06 0.33 0.83 0.00 -1.26 -4.25 105.19 101.25 1phd n GLY 359 Ca -0.01 -0.32 0.05 0.00 0.00 0.00 0.00 46.02 45.75 1phd n GLY 359 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1phd h GLN 360 N 1.59 0.62 -0.09 1.61 3.07 -1.89 -0.77 115.11 119.26 1phd h GLN 360 Ca 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 58.65 58.69 1phd h GLN 360 Cb 0.35 -0.14 -0.00 0.00 0.08 0.00 0.00 27.48 27.77 1phd h GLN 360 CO 0.00 0.41 0.02 0.45 0.09 0.00 0.00 178.83 179.79 1phd h HIS 361 N 0.64 0.16 -0.10 0.06 3.86 -1.85 0.54 115.15 118.45 1phd h HIS 361 Ca 0.22 -0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.43 1phd h HIS 361 Cb 0.08 -0.04 -0.03 0.00 1.06 0.00 0.00 27.41 28.48 1phd h HIS 361 CO -0.00 0.35 -0.07 1.25 0.86 0.00 0.00 177.93 180.32 1phd h LEU 362 N -0.08 -0.23 -0.41 2.43 5.85 -1.74 -0.56 115.31 120.57 1phd h LEU 362 Ca 0.03 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.82 1phd h LEU 362 Cb 0.28 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1phd h LEU 362 CO 0.00 -0.10 0.22 0.00 -0.34 0.00 0.00 178.44 178.22 1phd h ALA 363 N 1.00 0.51 -0.74 1.25 0.00 -0.97 -0.43 119.26 119.88 1phd h ALA 363 Ca 0.06 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1phd h ALA 363 Cb 0.18 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1phd h ALA 363 CO -0.15 -0.13 0.30 0.00 0.00 0.00 0.00 179.25 179.27 1phd h ARG 364 N 0.44 1.11 -0.38 0.00 3.08 -0.61 -1.35 114.38 116.67 1phd h ARG 364 Ca 0.17 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1phd h ARG 364 Cb 0.06 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 1phd h ARG 364 CO -0.11 0.91 0.22 -0.09 -1.07 0.00 0.00 179.97 179.83 1phd h ARG 365 N 1.06 0.51 -0.28 0.04 9.65 0.12 0.42 114.38 125.90 1phd h ARG 365 Ca 0.25 -0.05 -0.07 0.00 -1.10 0.00 0.00 59.98 59.00 1phd h ARG 365 Cb 0.21 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 28.67 1phd h ARG 365 CO -0.02 0.39 -0.14 0.93 2.80 0.00 0.00 179.97 183.94 1phd h GLU 366 N 0.49 0.48 0.17 0.20 5.08 -0.78 -1.03 114.58 119.18 1phd h GLU 366 Ca 0.13 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1phd h GLU 366 Cb 0.02 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1phd h GLU 366 CO -0.02 0.61 -0.08 0.82 -1.00 0.00 0.00 179.01 179.34 1phd h ILE 367 N 0.45 0.95 -0.83 3.13 2.04 -0.77 -2.53 117.51 119.94 1phd h ILE 367 Ca 0.08 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 65.02 1phd h ILE 367 Cb 0.50 1.48 -0.04 0.00 -0.74 0.00 0.00 36.82 38.02 1phd h ILE 367 CO 0.03 0.20 0.55 0.40 0.00 0.00 0.00 178.15 179.33 1phd h ILE 368 N -0.71 1.19 0.05 -0.67 2.04 -0.77 -1.23 117.51 117.40 1phd h ILE 368 Ca -0.02 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 1phd h ILE 368 Cb 0.50 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1phd h ILE 368 CO 0.04 0.20 -0.02 0.58 0.00 0.00 0.00 178.15 178.95 1phd h VAL 369 N 1.09 1.02 -0.25 1.67 2.07 -1.16 -1.78 116.25 118.91 1phd h VAL 369 Ca 0.31 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.66 1phd h VAL 369 Cb -0.09 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1phd h VAL 369 CO -0.07 0.05 0.07 0.74 0.02 0.00 0.00 177.57 178.37 1phd h THR 370 N -0.15 0.90 -0.20 2.57 2.02 -1.31 0.28 112.91 117.03 1phd h THR 370 Ca -0.01 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 1phd h THR 370 Cb 0.13 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1phd h THR 370 CO 0.01 0.03 0.08 -0.07 0.37 0.00 0.00 175.52 175.94 1phd h LEU 371 N 0.17 0.28 -0.31 2.58 3.38 -1.17 -0.30 115.31 119.94 1phd h LEU 371 Ca 0.11 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1phd h LEU 371 Cb 0.10 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1phd h LEU 371 CO -0.14 0.36 0.12 0.50 0.09 0.00 0.00 178.44 179.37 1phd h LYS 372 N 0.18 0.46 -0.08 1.13 3.64 -1.13 -2.21 116.57 118.56 1phd h LYS 372 Ca 0.07 -0.09 -0.21 0.00 -1.27 0.00 0.00 60.65 59.15 1phd h LYS 372 Cb 0.17 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1phd h LYS 372 CO -0.01 0.48 -0.79 0.93 -2.27 0.00 0.00 179.45 177.79 1phd h GLU 373 N 0.34 0.54 -0.07 1.90 4.39 -0.39 -3.17 114.58 118.11 1phd h GLU 373 Ca 0.10 -0.47 -0.02 0.00 0.34 0.00 0.00 59.36 59.31 1phd h GLU 373 Cb 0.20 0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1phd h GLU 373 CO -0.01 1.10 -0.04 2.35 -1.16 0.00 0.00 179.01 181.25 1phd h TRP 374 N 0.35 0.18 0.00 4.33 2.91 -1.03 -3.22 115.95 119.48 1phd h TRP 374 Ca -0.05 -0.05 -0.00 0.00 1.13 0.00 0.00 58.89 59.92 1phd h TRP 374 Cb 1.40 -0.04 -0.00 0.00 -0.51 0.00 0.00 29.16 30.01 1phd h TRP 374 CO 0.06 0.53 -0.00 -0.07 -1.03 0.00 0.00 178.44 177.93 1phd h LEU 375 N -0.22 0.00 0.05 0.65 3.38 -1.53 0.56 115.31 118.20 1phd h LEU 375 Ca 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1phd h LEU 375 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1phd h LEU 375 CO 0.01 0.00 -0.02 0.74 0.09 0.00 0.00 178.44 179.26 1phd h THR 376 N 0.00 1.27 0.04 0.22 2.02 -1.58 -3.30 112.91 111.58 1phd h THR 376 Ca -0.00 -1.12 -0.14 0.00 0.77 0.00 0.00 66.41 65.92 1phd h THR 376 Cb 0.01 2.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.41 1phd h THR 376 CO 0.00 0.28 -0.74 0.03 0.37 0.00 0.00 175.52 175.46 1phd h ARG 377 N -0.57 0.09 -3.00 6.66 3.08 -1.48 -3.41 114.38 115.75 1phd h ARG 377 Ca -0.01 -0.16 -0.62 0.00 0.07 0.00 0.00 59.98 59.27 1phd h ARG 377 Cb 0.51 0.06 -0.42 0.00 0.08 0.00 0.00 29.97 30.20 1phd h ARG 377 CO 0.01 1.08 -0.61 0.42 -1.07 0.00 0.00 179.97 179.79 1phd s ILE 378 N -2.34 2.63 0.22 2.04 1.01 0.19 -0.24 121.20 124.72 1phd s ILE 378 Ca -0.21 -4.13 0.20 0.00 0.00 0.00 0.00 60.65 56.52 1phd s ILE 378 Cb 0.01 -2.73 0.17 0.00 0.01 0.00 0.00 42.46 39.92 1phd s ILE 378 CO 0.70 -1.03 1.81 1.55 0.00 0.00 0.00 174.94 177.97 1phd h PRO 379 N 5.40 0.00 -4.17 2.79 0.13 -1.72 -3.39 132.00 131.04 1phd h PRO 379 Ca 0.16 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.74 1phd h PRO 379 Cb 0.77 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.52 1phd h PRO 379 CO 0.68 0.31 -0.79 0.34 -0.23 0.00 0.00 178.00 178.31 1phd s ASP 380 N -6.40 2.70 0.14 1.44 2.15 -1.26 -4.92 116.67 110.52 1phd s ASP 380 Ca -0.01 -0.59 -0.17 0.00 0.43 0.00 0.00 52.55 52.21 1phd s ASP 380 Cb 0.12 -0.90 0.04 0.00 -0.30 0.00 0.00 42.92 41.87 1phd s ASP 380 CO 0.67 -0.17 0.45 0.72 -0.17 0.00 0.00 175.17 176.66 1phd s PHE 381 N 1.65 -0.22 0.22 -5.34 -0.71 -1.26 -4.53 117.98 107.79 1phd s PHE 381 Ca 0.02 -0.09 -0.12 0.00 -1.04 0.00 0.00 56.93 55.70 1phd s PHE 381 Cb -0.15 0.32 -0.01 0.00 -1.21 0.00 0.00 43.02 41.98 1phd s PHE 381 CO -0.08 -0.76 0.42 -1.54 -1.34 0.00 0.00 175.22 171.92 1phd s SER 382 N -2.81 -0.06 0.48 1.98 1.04 -0.92 -4.69 113.70 108.72 1phd s SER 382 Ca 0.04 -0.91 -0.21 0.00 0.48 0.00 0.00 55.95 55.35 1phd s SER 382 Cb 0.01 0.54 -0.08 0.00 0.10 0.00 0.00 66.02 66.59 1phd s SER 382 CO -0.10 -1.06 1.05 -0.63 0.98 0.00 0.00 173.24 173.48 1phd s ILE 383 N -4.01 3.69 0.39 -1.02 1.01 -1.26 -1.62 121.20 118.38 1phd s ILE 383 Ca 0.21 1.08 -0.27 0.00 0.00 0.00 0.00 60.65 61.68 1phd s ILE 383 Cb 0.01 -3.45 -0.09 0.00 0.01 0.00 0.00 42.46 38.93 1phd s ILE 383 CO 0.06 -0.20 1.33 0.00 0.00 0.00 0.00 174.94 176.14 1phd s ALA 384 N -1.91 3.33 0.20 9.38 0.00 -0.54 -4.77 121.76 127.46 1phd s ALA 384 Ca 0.67 1.29 -0.32 0.00 0.00 0.00 0.00 51.96 53.60 1phd s ALA 384 Cb -0.18 -3.51 -0.12 0.00 0.00 0.00 0.00 23.12 19.31 1phd s ALA 384 CO 0.22 -0.85 1.72 -2.14 0.00 0.00 0.00 175.76 174.71 1phd s PRO 385 N -2.16 4.13 -0.42 0.00 0.02 -1.26 -1.73 135.00 133.58 1phd s PRO 385 Ca 0.55 2.60 0.00 0.00 0.02 0.00 0.00 61.00 64.17 1phd s PRO 385 Cb -0.40 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.02 1phd s PRO 385 CO 0.52 -0.75 0.00 0.41 -0.33 0.00 0.00 177.00 176.84 1phd n GLY 386 N 3.98 0.68 3.75 0.52 0.00 -1.26 -4.99 105.19 107.87 1phd n GLY 386 Ca 0.16 -0.68 -0.39 0.00 0.00 0.00 0.00 46.02 45.11 1phd n GLY 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1phd s ALA 387 N -2.10 3.44 -0.38 4.61 0.00 -0.70 -5.03 121.76 121.59 1phd s ALA 387 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 51.96 52.04 1phd s ALA 387 Cb 0.00 -2.83 0.10 0.00 0.00 0.00 0.00 23.12 20.39 1phd s ALA 387 CO 0.00 0.11 0.16 -0.65 0.00 0.00 0.00 175.76 175.37 1phd s GLN 388 N -0.02 2.04 0.00 0.00 -0.21 -1.26 -4.96 119.66 115.25 1phd s GLN 388 Ca 0.33 -1.72 -0.30 0.00 0.02 0.00 0.00 55.36 53.70 1phd s GLN 388 Cb -0.19 -3.48 -0.06 0.00 1.00 0.00 0.00 33.01 30.28 1phd s GLN 388 CO 0.19 -0.98 1.45 0.42 -2.12 0.00 0.00 175.29 174.25 1phd s ILE 389 N 1.15 3.62 -0.11 1.08 -1.09 -1.26 -5.00 121.20 119.58 1phd s ILE 389 Ca 0.06 0.99 0.00 0.00 -2.23 0.00 0.00 60.65 59.48 1phd s ILE 389 Cb -0.22 -3.64 -0.02 0.00 -1.58 0.00 0.00 42.46 37.00 1phd s ILE 389 CO -0.04 -0.01 -0.11 -1.10 -1.23 0.00 0.00 174.94 172.45 1phd s GLN 390 N 2.56 3.13 0.50 2.79 -0.21 -1.26 -5.00 119.66 122.17 1phd s GLN 390 Ca 0.66 -0.65 0.04 0.00 0.02 0.00 0.00 55.36 55.43 1phd s GLN 390 Cb -0.32 -2.60 0.03 0.00 1.00 0.00 0.00 33.01 31.11 1phd s GLN 390 CO 0.27 0.37 0.70 -1.01 -2.12 0.00 0.00 175.29 173.50 1phd s HIS 391 N -0.05 2.78 0.01 0.91 3.76 -1.26 0.09 115.29 121.52 1phd s HIS 391 Ca -0.02 -0.19 0.01 0.00 -0.15 0.00 0.00 55.06 54.71 1phd s HIS 391 Cb -0.14 -2.60 -0.01 0.00 1.11 0.00 0.00 32.58 30.94 1phd s HIS 391 CO 0.04 -0.72 -0.04 0.15 -0.85 0.00 0.00 174.74 173.32 1phd s LYS 392 N -4.60 0.32 0.18 1.40 -0.14 1.00 -4.81 119.74 113.08 1phd s LYS 392 Ca 0.57 -0.30 0.08 0.00 -1.36 0.00 0.00 55.97 54.95 1phd s LYS 392 Cb -0.10 -0.21 -0.04 0.00 -1.68 0.00 0.00 37.83 35.80 1phd s LYS 392 CO 0.36 0.05 -0.04 0.45 -0.76 0.00 0.00 175.35 175.41 1phd s SER 393 N -0.55 4.54 0.00 2.83 0.15 -1.26 -0.21 113.70 119.20 1phd s SER 393 Ca -0.03 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.13 1phd s SER 393 Cb -0.04 -0.88 0.00 0.00 -1.71 0.00 0.00 66.02 63.39 1phd s SER 393 CO -0.00 0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.14 1phd n GLY 394 N -0.08 -0.55 0.35 9.45 0.00 -1.22 -4.69 105.19 108.44 1phd n GLY 394 Ca -0.10 -0.80 -0.03 0.00 0.00 0.00 0.00 46.02 45.10 1phd n GLY 394 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1phd h ILE 395 N 0.00 1.22 -3.38 -0.61 1.08 -1.54 -3.38 117.51 110.90 1phd h ILE 395 Ca 0.00 -0.42 -0.56 0.00 -0.39 0.00 0.00 64.86 63.48 1phd h ILE 395 Cb 0.00 -0.12 -0.33 0.00 -3.07 0.00 0.00 36.82 33.30 1phd h ILE 395 CO 0.00 0.22 -0.83 -0.69 -0.69 0.00 0.00 178.15 176.16 1phd s VAL 396 N -6.12 1.41 0.34 1.67 1.01 -1.26 -0.33 120.40 117.12 1phd s VAL 396 Ca -0.13 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 1phd s VAL 396 Cb 0.17 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 1phd s VAL 396 CO 0.81 0.42 0.56 -0.44 0.00 0.00 0.00 175.10 176.44 1phd s SER 397 N 0.61 6.32 0.32 3.32 0.01 -0.40 -4.63 113.70 119.25 1phd s SER 397 Ca -0.15 0.54 0.05 0.00 1.31 0.00 0.00 55.95 57.70 1phd s SER 397 Cb -0.16 -2.07 -0.03 0.00 0.21 0.00 0.00 66.02 63.97 1phd s SER 397 CO 0.05 -0.29 0.28 -0.83 0.41 0.00 0.00 173.24 172.86 1phd s GLY 398 N -3.84 2.14 -0.10 3.44 0.00 0.71 -4.79 107.32 104.88 1phd s GLY 398 Ca 0.41 -1.98 -0.01 0.00 0.00 0.00 0.00 44.72 43.15 1phd s GLY 398 CO 0.35 -1.42 -0.05 0.14 0.00 0.00 0.00 173.10 172.13 1phd s VAL 399 N -3.49 3.85 0.09 1.40 1.01 -1.26 -0.00 120.40 122.00 1phd s VAL 399 Ca 0.40 -0.41 -0.14 0.00 0.00 0.00 0.00 61.98 61.83 1phd s VAL 399 Cb 0.03 -2.62 -0.15 0.00 0.00 0.00 0.00 36.38 33.64 1phd s VAL 399 CO 0.25 0.56 1.31 -0.61 0.00 0.00 0.00 175.10 176.61 1phd h GLN 400 N 5.74 0.76 -2.26 2.72 4.15 -0.66 -3.47 115.11 122.10 1phd h GLN 400 Ca -0.43 -0.59 -0.06 0.00 0.77 0.00 0.00 58.65 58.34 1phd h GLN 400 Cb 1.18 0.12 -0.18 0.00 0.21 0.00 0.00 27.48 28.81 1phd h GLN 400 CO 0.56 1.21 0.15 0.00 -1.93 0.00 0.00 178.83 178.82 1phd s ALA 401 N -3.81 -1.65 -0.48 3.38 0.00 -1.26 -4.98 121.76 112.96 1phd s ALA 401 Ca -0.11 1.09 0.04 0.00 0.00 0.00 0.00 51.96 52.98 1phd s ALA 401 Cb 0.08 0.16 0.17 0.00 0.00 0.00 0.00 23.12 23.52 1phd s ALA 401 CO 0.89 -0.43 0.36 -1.17 0.00 0.00 0.00 175.76 175.41 1phd s LEU 402 N -1.47 2.31 -0.25 0.00 2.96 -1.26 -4.58 118.68 116.38 1phd s LEU 402 Ca -0.09 -3.17 -0.29 0.00 -0.22 0.00 0.00 54.13 50.36 1phd s LEU 402 Cb -0.00 -0.77 -0.03 0.00 0.50 0.00 0.00 46.19 45.88 1phd s LEU 402 CO 0.06 -0.17 1.84 -2.84 -1.32 0.00 0.00 176.35 173.92 1phd s PRO 403 N -0.22 3.50 0.14 0.98 0.02 -1.26 -1.12 135.00 137.03 1phd s PRO 403 Ca 0.29 1.71 0.08 0.00 0.02 0.00 0.00 61.00 63.09 1phd s PRO 403 Cb -0.02 -4.18 -0.04 0.00 0.02 0.00 0.00 34.50 30.28 1phd s PRO 403 CO -0.16 -1.67 -0.09 -0.51 -0.33 0.00 0.00 177.00 174.24 1phd s LEU 404 N 6.47 3.05 0.05 -5.54 1.43 -0.42 -1.47 118.68 122.25 1phd s LEU 404 Ca 0.82 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 53.49 1phd s LEU 404 Cb -0.27 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 1phd s LEU 404 CO 0.33 0.14 -0.06 0.68 0.23 0.00 0.00 176.35 177.67 1phd s VAL 405 N -1.43 0.49 0.15 -1.59 -7.23 -0.64 -2.84 120.40 107.31 1phd s VAL 405 Ca 0.23 -1.35 -0.24 0.00 -1.81 0.00 0.00 61.98 58.81 1phd s VAL 405 Cb -0.10 -0.93 0.07 0.00 0.56 0.00 0.00 36.38 35.98 1phd s VAL 405 CO 0.15 -0.59 0.74 -1.66 -0.31 0.00 0.00 175.10 173.43 1phd s TRP 406 N -2.22 -0.36 -0.15 2.82 -2.14 -0.75 -2.16 118.94 113.97 1phd s TRP 406 Ca -0.04 0.10 -0.18 0.00 2.66 0.00 0.00 56.10 58.64 1phd s TRP 406 Cb -0.04 0.60 -0.04 0.00 -3.10 0.00 0.00 33.47 30.89 1phd s TRP 406 CO -0.02 -0.86 0.49 0.34 -2.66 0.00 0.00 176.95 174.23 1phd s ASP 407 N -2.75 6.62 0.49 -2.66 -1.08 -1.26 -4.46 116.67 111.57 1phd s ASP 407 Ca 0.06 0.74 0.23 0.00 -0.52 0.00 0.00 52.55 53.06 1phd s ASP 407 Cb -0.02 -2.28 1.25 0.00 -1.46 0.00 0.00 42.92 40.40 1phd s ASP 407 CO -0.06 -0.07 2.02 -0.65 0.52 0.00 0.00 175.17 176.93 1phd h PRO 408 N 7.02 0.00 0.00 4.34 0.11 -1.88 -0.81 132.00 140.79 1phd h PRO 408 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1phd h PRO 408 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1phd h PRO 408 CO 0.75 0.17 0.00 0.00 -0.21 0.00 0.00 178.00 178.71 1phd h ALA 409 N 1.83 1.00 -0.11 -0.75 0.00 -1.94 -1.38 119.26 117.91 1phd h ALA 409 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1phd h ALA 409 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1phd h ALA 409 CO 0.02 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.52 1phd n THR 410 N -2.61 0.13 -2.05 0.00 -2.24 -0.31 -4.97 114.28 102.24 1phd n THR 410 Ca 0.01 -0.57 -0.27 0.00 -2.27 0.00 0.00 64.05 60.94 1phd n THR 410 Cb 0.21 1.30 0.09 0.00 -2.10 0.00 0.00 70.33 69.83 1phd n THR 410 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1phd s THR 411 N -1.60 2.12 -0.08 4.28 -4.23 -0.52 -4.60 115.64 111.01 1phd s THR 411 Ca 0.26 -0.13 -0.01 0.00 -1.18 0.00 0.00 61.69 60.63 1phd s THR 411 Cb 0.18 -2.99 0.03 0.00 1.34 0.00 0.00 72.50 71.05 1phd s THR 411 CO 0.26 0.00 -0.01 -0.54 -0.54 0.00 0.00 174.62 173.79 1phd s LYS 412 N -5.44 0.73 0.33 3.99 1.02 0.66 -5.02 119.74 116.01 1phd s LYS 412 Ca 0.62 0.06 -0.27 0.00 0.02 0.00 0.00 55.97 56.40 1phd s LYS 412 Cb -0.10 -1.05 -0.09 0.00 -0.52 0.00 0.00 37.83 36.06 1phd s LYS 412 CO 0.47 -0.29 1.01 0.00 -0.92 0.00 0.00 175.35 175.62 1phd s ALA 413 N 1.91 3.23 0.00 5.17 0.00 -1.26 -4.24 121.76 126.56 1phd s ALA 413 Ca 0.05 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.67 1phd s ALA 413 Cb -0.12 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1phd s ALA 413 CO -0.05 -0.01 0.37 0.28 0.00 0.00 0.00 175.76 176.34