#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sqp s ASN 3 N 0.00 5.52 0.25 3.42 3.04 -1.26 -4.99 114.94 120.92 1sqp s ASN 3 Ca 0.00 -0.80 -0.05 0.00 0.04 0.00 0.00 52.86 52.05 1sqp s ASN 3 Cb 0.00 -1.98 0.35 0.00 -1.54 0.00 0.00 41.25 38.08 1sqp s ASN 3 CO 0.00 -0.28 1.86 0.40 -3.04 0.00 0.00 177.10 176.04 1sqp h ILE 4 N 5.83 1.06 0.00 -5.21 5.03 -2.03 -1.61 117.51 120.58 1sqp h ILE 4 Ca -0.28 -0.35 0.00 0.00 -0.12 0.00 0.00 64.86 64.10 1sqp h ILE 4 Cb 1.12 -0.06 0.00 0.00 -3.03 0.00 0.00 36.82 34.85 1sqp h ILE 4 CO 0.63 0.19 0.00 -0.09 -0.68 0.00 0.00 178.15 178.20 1sqp h ARG 5 N 1.03 0.00 0.01 2.37 2.43 -1.94 -3.09 114.38 115.19 1sqp h ARG 5 Ca 0.39 0.00 -0.37 0.00 -0.81 0.00 0.00 59.98 59.19 1sqp h ARG 5 Cb 0.16 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 1sqp h ARG 5 CO -0.17 0.00 -2.33 1.63 -1.51 0.00 0.00 179.97 177.59 1sqp n LYS 6 N -2.87 0.67 -0.00 0.20 5.02 -0.62 -3.65 118.16 116.91 1sqp n LYS 6 Ca -0.01 0.11 0.07 0.00 -2.02 0.00 0.00 58.31 56.45 1sqp n LYS 6 Cb 0.16 -1.56 -0.08 0.00 -0.02 0.00 0.00 35.03 33.53 1sqp n LYS 6 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1sqp n SER 7 N -3.05 0.74 -4.67 4.39 3.41 -1.11 -4.45 113.62 108.88 1sqp n SER 7 Ca -0.37 -0.76 -0.43 0.00 -0.26 0.00 0.00 58.87 57.05 1sqp n SER 7 Cb 1.07 1.05 -0.02 0.00 -0.26 0.00 0.00 64.21 66.05 1sqp n SER 7 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1sqp s HIS 8 N -2.36 2.99 -1.45 7.33 5.65 -1.17 -4.90 115.29 121.37 1sqp s HIS 8 Ca 0.04 1.09 0.00 0.00 0.25 0.00 0.00 55.06 56.44 1sqp s HIS 8 Cb 0.10 -3.48 0.00 0.00 -1.18 0.00 0.00 32.58 28.03 1sqp s HIS 8 CO 0.57 -1.58 0.00 -2.30 -0.65 0.00 0.00 174.74 170.79 1sqp n PRO 9 N 5.93 0.00 0.00 2.88 -0.02 -1.26 -0.20 135.00 142.33 1sqp n PRO 9 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 1sqp n PRO 9 Cb 0.45 -0.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.95 1sqp n PRO 9 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1sqp n LEU 10 N -0.11 0.60 -0.02 2.45 7.94 -1.26 -4.77 117.00 121.83 1sqp n LEU 10 Ca 0.00 0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 54.81 1sqp n LEU 10 Cb 0.00 0.00 0.06 0.00 0.53 0.00 0.00 43.42 44.01 1sqp n LEU 10 CO 0.00 -0.05 0.53 0.24 -1.11 0.00 0.00 177.39 177.00 1sqp h MET 11 N 0.00 0.61 -0.45 1.96 2.86 -1.58 -2.94 114.93 115.39 1sqp h MET 11 Ca 0.00 -0.35 0.08 0.00 -2.06 0.00 0.00 59.70 57.38 1sqp h MET 11 Cb 0.44 0.03 -0.07 0.00 0.06 0.00 0.00 31.60 32.05 1sqp h MET 11 CO 0.00 0.95 0.01 -0.22 1.06 0.00 0.00 176.91 178.71 1sqp h LYS 12 N 0.48 0.12 -0.56 1.72 3.64 -0.65 0.72 116.57 122.04 1sqp h LYS 12 Ca 0.03 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 1sqp h LYS 12 Cb 1.01 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.78 1sqp h LYS 12 CO 0.09 0.08 0.09 0.82 -2.27 0.00 0.00 179.45 178.26 1sqp h ILE 13 N 0.12 1.24 -0.22 2.00 1.08 -1.74 -2.18 117.51 117.81 1sqp h ILE 13 Ca 0.22 -0.93 -0.07 0.00 -0.39 0.00 0.00 64.86 63.70 1sqp h ILE 13 Cb 0.32 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 34.78 1sqp h ILE 13 CO -0.36 0.34 -0.13 0.58 -0.69 0.00 0.00 178.15 177.89 1sqp h VAL 14 N 0.85 1.31 -0.85 1.67 2.07 -1.32 -3.11 116.25 116.87 1sqp h VAL 14 Ca 0.18 -1.22 0.08 0.00 0.82 0.00 0.00 66.70 66.56 1sqp h VAL 14 Cb 0.37 1.63 -0.07 0.00 -1.52 0.00 0.00 31.29 31.70 1sqp h VAL 14 CO 0.01 0.37 0.51 -1.13 0.02 0.00 0.00 177.57 177.35 1sqp h ASN 15 N 0.18 0.75 0.44 0.57 -1.24 -0.68 0.18 115.58 115.79 1sqp h ASN 15 Ca 0.05 0.04 0.00 0.00 0.71 0.00 0.00 56.30 57.09 1sqp h ASN 15 Cb 0.63 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 39.57 1sqp h ASN 15 CO 0.04 0.45 -0.10 0.59 -1.29 0.00 0.00 177.43 177.12 1sqp n ASN 16 N -4.69 0.35 -0.04 1.15 3.02 -0.84 -0.27 115.26 113.94 1sqp n ASN 16 Ca 0.14 -0.42 -0.06 0.00 -0.03 0.00 0.00 54.58 54.21 1sqp n ASN 16 Cb 0.25 -0.12 -0.04 0.00 -0.61 0.00 0.00 39.78 39.25 1sqp n ASN 16 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sqp n ALA 17 N -1.08 1.81 0.04 5.41 0.00 -0.90 -4.45 120.51 121.34 1sqp n ALA 17 Ca 0.14 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1sqp n ALA 17 Cb 0.27 0.28 -0.00 0.00 0.00 0.00 0.00 19.45 20.00 1sqp n ALA 17 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1sqp n PHE 18 N -2.70 0.00 0.02 0.00 3.72 0.58 -4.81 117.46 114.27 1sqp n PHE 18 Ca -0.15 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 1sqp n PHE 18 Cb 0.67 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.21 1sqp n PHE 18 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1sqp n ILE 19 N -0.85 0.31 1.39 4.37 -0.00 -1.02 -4.37 119.36 119.19 1sqp n ILE 19 Ca 0.00 0.10 0.14 0.00 -0.00 0.00 0.00 62.75 62.99 1sqp n ILE 19 Cb 0.01 -1.09 0.45 0.00 -0.00 0.00 0.00 39.64 39.01 1sqp n ILE 19 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 1sqp n ASP 20 N -2.77 1.50 -4.69 4.38 9.92 0.63 -1.95 116.55 123.57 1sqp n ASP 20 Ca 0.00 -1.38 -0.55 0.00 -0.53 0.00 0.00 54.79 52.33 1sqp n ASP 20 Cb 0.00 0.04 -0.06 0.00 -0.64 0.00 0.00 41.12 40.46 1sqp n ASP 20 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1sqp n LEU 21 N 0.05 2.51 -4.59 0.64 7.94 -1.24 -4.67 117.00 117.63 1sqp n LEU 21 Ca 0.17 1.06 -0.42 0.00 -1.11 0.00 0.00 56.01 55.71 1sqp n LEU 21 Cb 0.37 -1.20 -0.03 0.00 0.53 0.00 0.00 43.42 43.10 1sqp n LEU 21 CO 0.19 -0.44 1.45 -2.84 -1.11 0.00 0.00 177.39 174.63 1sqp s PRO 22 N 3.12 3.32 0.13 1.96 0.02 -1.26 -0.83 135.00 141.45 1sqp s PRO 22 Ca 0.95 1.15 0.08 0.00 0.02 0.00 0.00 61.00 63.19 1sqp s PRO 22 Cb -0.97 -4.17 -0.04 0.00 0.02 0.00 0.00 34.50 29.34 1sqp s PRO 22 CO 0.59 -1.88 -0.10 0.00 -0.33 0.00 0.00 177.00 175.29 1sqp s ALA 23 N 6.70 2.96 0.44 -1.55 0.00 0.32 -4.75 121.76 125.88 1sqp s ALA 23 Ca 0.72 -1.31 -0.25 0.00 0.00 0.00 0.00 51.96 51.12 1sqp s ALA 23 Cb -0.18 -0.86 -0.08 0.00 0.00 0.00 0.00 23.12 22.00 1sqp s ALA 23 CO 0.31 0.59 1.28 -2.14 0.00 0.00 0.00 175.76 175.81 1sqp s PRO 24 N -2.39 3.81 0.38 0.00 0.02 -1.26 0.50 135.00 136.06 1sqp s PRO 24 Ca 0.22 2.08 0.28 0.00 0.02 0.00 0.00 61.00 63.61 1sqp s PRO 24 Cb -0.10 -2.61 1.12 0.00 0.02 0.00 0.00 34.50 32.92 1sqp s PRO 24 CO 0.14 -0.60 1.83 0.66 -0.33 0.00 0.00 177.00 178.70 1sqp h SER 25 N 2.38 0.00 -0.03 2.53 4.64 -1.85 -3.34 113.55 117.87 1sqp h SER 25 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1sqp h SER 25 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1sqp h SER 25 CO 0.61 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.11 1sqp n ASN 26 N -2.62 2.33 -4.70 4.97 6.94 -1.26 -5.04 115.26 115.88 1sqp n ASN 26 Ca 0.02 -2.58 -0.42 0.00 -0.02 0.00 0.00 54.58 51.57 1sqp n ASN 26 Cb 0.28 -0.25 -0.03 0.00 -2.36 0.00 0.00 39.78 37.42 1sqp n ASN 26 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 1sqp s ILE 27 N -2.01 3.42 1.07 1.53 -4.36 -1.25 -4.50 121.20 115.10 1sqp s ILE 27 Ca 0.19 0.96 -0.12 0.00 -0.26 0.00 0.00 60.65 61.42 1sqp s ILE 27 Cb 0.16 -3.61 0.23 0.00 1.25 0.00 0.00 42.46 40.49 1sqp s ILE 27 CO 0.03 0.04 1.07 -0.44 0.24 0.00 0.00 174.94 175.88 1sqp s SER 28 N 1.45 1.80 0.63 4.36 0.01 -1.26 -4.89 113.70 115.80 1sqp s SER 28 Ca 0.65 1.64 0.28 0.00 1.31 0.00 0.00 55.95 59.83 1sqp s SER 28 Cb -0.35 -2.31 1.53 0.00 0.21 0.00 0.00 66.02 65.09 1sqp s SER 28 CO 0.29 -3.71 1.85 0.28 0.41 0.00 0.00 173.24 172.36 1sqp h SER 29 N -2.29 0.00 0.69 2.44 0.02 -2.01 0.78 113.55 113.19 1sqp h SER 29 Ca -0.56 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 1sqp h SER 29 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1sqp h SER 29 CO 0.49 0.00 0.00 -0.50 -1.14 0.00 0.00 176.83 175.68 1sqp h TRP 30 N 0.00 0.00 -0.00 3.45 4.06 -2.01 -2.50 115.95 118.95 1sqp h TRP 30 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1sqp h TRP 30 Cb 0.68 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.84 1sqp h TRP 30 CO 0.00 0.00 -0.12 0.91 -3.56 0.00 0.00 178.44 175.67 1sqp n TRP 31 N -2.95 0.00 0.21 0.49 8.01 0.27 -4.07 117.44 119.40 1sqp n TRP 31 Ca -0.00 0.00 0.09 0.00 -1.31 0.00 0.00 57.50 56.28 1sqp n TRP 31 Cb 0.23 -0.17 0.35 0.00 -2.01 0.00 0.00 31.31 29.70 1sqp n TRP 31 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.69 175.77 1sqp h ASN 32 N 0.66 0.00 0.51 -0.99 4.21 -1.59 -3.32 115.58 115.06 1sqp h ASN 32 Ca 0.00 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.48 1sqp h ASN 32 Cb 0.37 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.57 1sqp h ASN 32 CO 0.00 0.23 -0.12 -0.26 -1.29 0.00 0.00 177.43 175.99 1sqp h PHE 33 N 0.00 0.00 -0.21 1.19 0.04 -1.77 -1.84 116.94 114.35 1sqp h PHE 33 Ca -0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1sqp h PHE 33 Cb 0.89 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.03 1sqp h PHE 33 CO 0.00 0.12 0.11 0.78 -0.60 0.00 0.00 178.31 178.72 1sqp h GLY 34 N 1.15 0.32 0.88 -1.45 0.00 -1.87 0.33 103.07 102.42 1sqp h GLY 34 Ca -0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 47.33 47.06 1sqp h GLY 34 CO 0.02 0.15 -0.30 1.48 0.00 0.00 0.00 176.54 177.88 1sqp h SER 35 N 0.22 0.61 -0.24 0.19 4.64 -1.71 -3.02 113.55 114.24 1sqp h SER 35 Ca 0.07 -0.52 0.06 0.00 -0.47 0.00 0.00 61.79 60.93 1sqp h SER 35 Cb 0.10 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 1sqp h SER 35 CO -0.01 1.01 0.17 -0.07 -0.87 0.00 0.00 176.83 177.06 1sqp h LEU 36 N 0.22 0.05 -0.17 5.97 3.38 -1.19 0.20 115.31 123.78 1sqp h LEU 36 Ca 0.02 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1sqp h LEU 36 Cb 0.88 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1sqp h LEU 36 CO 0.07 0.04 0.01 -0.07 0.09 0.00 0.00 178.44 178.58 1sqp h LEU 37 N 0.06 0.28 -0.59 1.67 3.38 -0.33 -1.10 115.31 118.68 1sqp h LEU 37 Ca 0.11 -0.29 0.04 0.00 0.09 0.00 0.00 57.88 57.83 1sqp h LEU 37 Cb 0.36 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 1sqp h LEU 37 CO -0.01 0.50 0.33 1.23 0.09 0.00 0.00 178.44 180.58 1sqp h GLY 38 N 0.05 0.84 0.74 0.83 0.00 -0.61 0.38 103.07 105.29 1sqp h GLY 38 Ca 0.05 -0.23 0.03 0.00 0.00 0.00 0.00 47.33 47.18 1sqp h GLY 38 CO 0.01 0.16 0.08 -2.22 0.00 0.00 0.00 176.54 174.57 1sqp h ILE 39 N 0.62 0.91 -0.89 2.60 1.08 -0.77 -1.65 117.51 119.41 1sqp h ILE 39 Ca 0.25 -0.07 0.02 0.00 -0.39 0.00 0.00 64.86 64.68 1sqp h ILE 39 Cb 0.12 0.70 -0.05 0.00 -3.07 0.00 0.00 36.82 34.52 1sqp h ILE 39 CO -0.15 0.03 0.58 0.00 -0.69 0.00 0.00 178.15 177.93 1sqp h LEU 41 N 1.16 0.46 -0.72 0.00 5.85 -0.03 -1.40 115.31 120.63 1sqp h LEU 41 Ca 0.34 -0.30 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 1sqp h LEU 41 Cb -0.07 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1sqp h LEU 41 CO -0.09 0.65 0.23 0.40 -0.34 0.00 0.00 178.44 179.28 1sqp h ILE 42 N 0.25 1.26 -0.76 4.05 1.08 -0.89 -2.43 117.51 120.07 1sqp h ILE 42 Ca 0.08 -0.89 -0.01 0.00 -0.39 0.00 0.00 64.86 63.65 1sqp h ILE 42 Cb 0.41 0.47 -0.04 0.00 -3.07 0.00 0.00 36.82 34.59 1sqp h ILE 42 CO 0.01 0.35 0.44 0.25 -0.69 0.00 0.00 178.15 178.51 1sqp h LEU 43 N 1.06 0.92 -1.40 1.44 5.85 -0.63 -0.48 115.31 122.08 1sqp h LEU 43 Ca 0.23 -0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 1sqp h LEU 43 Cb 0.30 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1sqp h LEU 43 CO -0.01 0.73 -0.21 1.56 -0.34 0.00 0.00 178.44 180.18 1sqp h GLN 44 N 1.04 0.14 -0.08 1.25 1.08 -1.08 -1.89 115.11 115.58 1sqp h GLN 44 Ca 0.27 -0.04 -0.05 0.00 -1.45 0.00 0.00 58.65 57.39 1sqp h GLN 44 Cb -0.01 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.40 1sqp h GLN 44 CO -0.05 0.35 -0.13 0.82 -0.95 0.00 0.00 178.83 178.87 1sqp h ILE 45 N 0.13 1.40 -0.16 2.54 5.03 -0.64 0.01 117.51 125.82 1sqp h ILE 45 Ca 0.02 -1.40 -0.16 0.00 -0.12 0.00 0.00 64.86 63.21 1sqp h ILE 45 Cb 0.44 2.14 -0.01 0.00 -3.03 0.00 0.00 36.82 36.37 1sqp h ILE 45 CO 0.03 0.39 -0.56 -0.07 -0.68 0.00 0.00 178.15 177.27 1sqp h LEU 46 N -0.24 0.53 -0.02 1.44 3.38 -1.17 0.18 115.31 119.41 1sqp h LEU 46 Ca 0.01 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.63 1sqp h LEU 46 Cb 0.70 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1sqp h LEU 46 CO 0.03 0.98 -0.21 0.71 0.09 0.00 0.00 178.44 180.04 1sqp h THR 47 N 0.37 1.52 -0.70 0.22 1.35 -1.46 -3.15 112.91 111.06 1sqp h THR 47 Ca 0.01 -1.82 0.14 0.00 -0.55 0.00 0.00 66.41 64.18 1sqp h THR 47 Cb 1.09 2.64 -0.13 0.00 -1.73 0.00 0.00 68.15 70.01 1sqp h THR 47 CO 0.10 0.50 -0.21 1.23 -0.25 0.00 0.00 175.52 176.89 1sqp h GLY 48 N -0.46 0.42 0.78 5.82 0.00 -0.80 0.78 103.07 109.60 1sqp h GLY 48 Ca -0.02 0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.58 1sqp h GLY 48 CO 0.04 -0.26 0.00 -2.00 0.00 0.00 0.00 176.54 174.32 1sqp h LEU 49 N -0.03 0.02 -2.32 3.11 5.85 -0.76 0.15 115.31 121.34 1sqp h LEU 49 Ca 0.33 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1sqp h LEU 49 Cb 0.53 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 1sqp h LEU 49 CO -0.73 0.25 -0.04 -0.26 -0.34 0.00 0.00 178.44 177.31 1sqp h PHE 50 N -0.20 0.00 0.22 1.25 -1.00 -1.44 0.20 116.94 115.97 1sqp h PHE 50 Ca 0.01 0.00 -0.33 0.00 2.81 0.00 0.00 57.97 60.46 1sqp h PHE 50 Cb 0.23 0.00 0.04 0.00 3.61 0.00 0.00 35.95 39.83 1sqp h PHE 50 CO 0.00 0.04 -1.41 -0.07 -1.61 0.00 0.00 178.31 175.27 1sqp h LEU 51 N 0.00 0.85 -2.07 1.54 3.38 -0.58 -3.34 115.31 115.10 1sqp h LEU 51 Ca -0.00 -0.90 0.00 0.00 0.09 0.00 0.00 57.88 57.07 1sqp h LEU 51 Cb 0.17 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1sqp h LEU 51 CO 0.01 1.68 0.00 0.00 0.09 0.00 0.00 178.44 180.22 1sqp h ALA 52 N 0.18 1.00 -0.03 1.53 0.00 0.12 -2.48 119.26 119.58 1sqp h ALA 52 Ca -0.24 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1sqp h ALA 52 Cb 2.10 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.87 1sqp h ALA 52 CO 0.27 0.00 -0.49 0.52 0.00 0.00 0.00 179.25 179.55 1sqp h MET 53 N 0.00 0.08 -0.01 0.00 2.86 -1.27 -3.31 114.93 113.29 1sqp h MET 53 Ca 0.00 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1sqp h MET 53 Cb 0.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.93 1sqp h MET 53 CO 0.00 0.56 -0.10 0.72 1.06 0.00 0.00 176.91 179.14 1sqp n HIS 54 N -3.96 0.00 -3.68 -0.22 8.25 -1.02 -5.04 115.22 109.56 1sqp n HIS 54 Ca -0.02 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.07 1sqp n HIS 54 Cb 0.52 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.57 1sqp n HIS 54 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1sqp s TYR 55 N -0.94 3.66 0.11 4.41 5.04 -0.97 -4.82 117.35 123.84 1sqp s TYR 55 Ca 0.06 0.76 0.05 0.00 -2.44 0.00 0.00 57.07 55.50 1sqp s TYR 55 Cb 0.05 -2.12 -0.04 0.00 0.35 0.00 0.00 41.96 40.21 1sqp s TYR 55 CO 0.15 0.68 0.04 0.99 -1.34 0.00 0.00 175.55 176.07 1sqp s THR 56 N -1.09 4.20 -1.38 4.34 2.01 -1.26 -4.93 115.64 117.53 1sqp s THR 56 Ca 0.21 -0.99 0.23 0.00 0.31 0.00 0.00 61.69 61.45 1sqp s THR 56 Cb -0.14 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.28 1sqp s THR 56 CO 0.10 0.06 1.17 -0.24 -0.69 0.00 0.00 174.62 175.02 1sqp n SER 57 N 0.32 1.15 -4.87 3.53 2.88 -1.26 -3.99 113.62 111.38 1sqp n SER 57 Ca -0.10 -0.94 -0.34 0.00 -1.33 0.00 0.00 58.87 56.16 1sqp n SER 57 Cb 0.53 0.56 -0.05 0.00 -0.75 0.00 0.00 64.21 64.50 1sqp n SER 57 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1sqp s ASP 58 N -2.79 6.67 0.28 -3.46 -1.08 -1.26 -3.47 116.67 111.56 1sqp s ASP 58 Ca 0.14 0.89 -0.00 0.00 -0.52 0.00 0.00 52.55 53.05 1sqp s ASP 58 Cb 0.17 -2.21 0.64 0.00 -1.46 0.00 0.00 42.92 40.07 1sqp s ASP 58 CO 0.70 0.06 1.63 0.71 0.52 0.00 0.00 175.17 178.79 1sqp h THR 59 N 2.47 0.26 -0.09 1.71 1.35 -1.92 0.50 112.91 117.19 1sqp h THR 59 Ca -0.48 -0.05 0.03 0.00 -0.55 0.00 0.00 66.41 65.36 1sqp h THR 59 Cb 1.18 0.11 -0.00 0.00 -1.73 0.00 0.00 68.15 67.71 1sqp h THR 59 CO 0.68 0.02 0.08 0.74 -0.25 0.00 0.00 175.52 176.80 1sqp h THR 60 N 0.13 0.71 0.00 6.82 2.02 -1.99 -3.31 112.91 117.30 1sqp h THR 60 Ca 0.52 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.70 1sqp h THR 60 Cb 1.03 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 1sqp h THR 60 CO -0.71 0.00 -0.00 1.07 0.37 0.00 0.00 175.52 176.25 1sqp n THR 61 N -4.14 0.00 0.02 3.16 5.66 -0.35 -4.83 114.28 113.79 1sqp n THR 61 Ca -0.01 -0.13 -0.15 0.00 -3.05 0.00 0.00 64.05 60.71 1sqp n THR 61 Cb 0.19 1.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.87 1sqp n THR 61 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1sqp h ALA 62 N 0.00 -0.92 -0.89 1.79 0.00 -0.15 0.80 119.26 119.90 1sqp h ALA 62 Ca 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1sqp h ALA 62 Cb 0.00 0.99 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 1sqp h ALA 62 CO 0.00 -1.10 0.49 0.35 0.00 0.00 0.00 179.25 178.99 1sqp h PHE 63 N -0.62 1.22 -0.32 0.00 3.04 -1.78 -2.99 116.94 115.49 1sqp h PHE 63 Ca 0.02 -0.03 -0.18 0.00 3.98 0.00 0.00 57.97 61.77 1sqp h PHE 63 Cb 0.69 -0.39 -0.00 0.00 2.56 0.00 0.00 35.95 38.81 1sqp h PHE 63 CO -0.56 0.84 -0.49 0.77 -2.02 0.00 0.00 178.31 176.85 1sqp h SER 64 N 1.24 0.99 -0.86 0.41 0.02 -1.79 -2.81 113.55 110.75 1sqp h SER 64 Ca 0.31 -0.51 -0.01 0.00 -0.84 0.00 0.00 61.79 60.75 1sqp h SER 64 Cb 0.02 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.23 1sqp h SER 64 CO -0.05 1.30 0.51 0.77 -1.14 0.00 0.00 176.83 178.23 1sqp h SER 65 N 0.70 1.03 -0.53 3.07 4.64 -0.78 0.26 113.55 121.95 1sqp h SER 65 Ca 0.03 -0.07 0.05 0.00 -0.47 0.00 0.00 61.79 61.34 1sqp h SER 65 Cb 1.09 -0.26 -0.05 0.00 -0.31 0.00 0.00 62.40 62.87 1sqp h SER 65 CO 0.11 0.80 0.25 0.58 -0.87 0.00 0.00 176.83 177.70 1sqp h VAL 66 N 1.18 0.92 -0.11 0.95 2.07 -1.47 -0.41 116.25 119.38 1sqp h VAL 66 Ca 0.31 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 1sqp h VAL 66 Cb -0.04 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.12 1sqp h VAL 66 CO -0.06 0.09 0.02 0.74 0.02 0.00 0.00 177.57 178.38 1sqp h THR 67 N 0.48 1.22 -0.81 2.57 2.02 -1.19 -2.77 112.91 114.44 1sqp h THR 67 Ca 0.24 -0.69 0.19 0.00 0.77 0.00 0.00 66.41 66.92 1sqp h THR 67 Cb 0.18 1.47 -0.12 0.00 -1.74 0.00 0.00 68.15 67.94 1sqp h THR 67 CO -0.19 0.20 0.22 -0.74 0.37 0.00 0.00 175.52 175.38 1sqp h HIS 68 N -0.05 0.34 0.33 3.16 6.17 -0.28 0.18 115.15 125.00 1sqp h HIS 68 Ca 0.03 0.05 -0.00 0.00 0.71 0.00 0.00 60.37 61.16 1sqp h HIS 68 Cb 0.29 -0.02 -0.02 0.00 2.52 0.00 0.00 27.41 30.18 1sqp h HIS 68 CO 0.02 -0.12 -0.30 0.82 0.71 0.00 0.00 177.93 179.06 1sqp h ILE 69 N 0.27 0.38 -0.20 6.26 2.04 -0.90 0.13 117.51 125.49 1sqp h ILE 69 Ca 0.48 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.33 1sqp h ILE 69 Cb 0.88 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1sqp h ILE 69 CO -0.56 0.00 0.08 0.00 0.00 0.00 0.00 178.15 177.66 1sqp h ARG 71 N 0.17 0.00 0.11 0.00 3.08 -0.67 -3.32 114.38 113.75 1sqp h ARG 71 Ca 0.07 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.77 1sqp h ARG 71 Cb 0.19 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 1sqp h ARG 71 CO -0.00 0.53 -1.88 -0.25 -1.07 0.00 0.00 179.97 177.29 1sqp n ASP 72 N -4.67 2.09 -4.69 7.04 8.00 0.42 -4.92 116.55 119.82 1sqp n ASP 72 Ca -0.07 0.25 -0.42 0.00 0.71 0.00 0.00 54.79 55.25 1sqp n ASP 72 Cb 0.29 -0.89 -0.03 0.00 -0.02 0.00 0.00 41.12 40.47 1sqp n ASP 72 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1sqp s VAL 73 N -2.53 4.00 -0.05 2.53 1.01 -0.92 -4.93 120.40 119.51 1sqp s VAL 73 Ca -0.23 1.37 -0.30 0.00 0.00 0.00 0.00 61.98 62.81 1sqp s VAL 73 Cb 0.06 -3.88 -0.08 0.00 0.00 0.00 0.00 36.38 32.48 1sqp s VAL 73 CO 0.74 0.02 2.04 0.59 0.00 0.00 0.00 175.10 178.49 1sqp n ASN 74 N 5.05 3.82 -1.27 3.32 4.13 -1.26 -0.79 115.26 128.25 1sqp n ASN 74 Ca 0.11 0.72 -0.17 0.00 1.68 0.00 0.00 54.58 56.93 1sqp n ASN 74 Cb 0.45 -1.51 -0.07 0.00 -1.54 0.00 0.00 39.78 37.11 1sqp n ASN 74 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1sqp n TYR 75 N 8.55 0.00 -0.01 3.10 4.01 -1.26 -4.86 117.16 126.69 1sqp n TYR 75 Ca 0.23 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.96 1sqp n TYR 75 Cb 0.40 -3.10 0.26 0.00 -0.31 0.00 0.00 39.34 36.59 1sqp n TYR 75 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1sqp h GLY 76 N 0.00 0.59 0.95 2.72 0.00 -1.13 -2.73 103.07 103.47 1sqp h GLY 76 Ca -0.34 -0.38 0.05 0.00 0.00 0.00 0.00 47.33 46.65 1sqp h GLY 76 CO 0.50 0.36 0.59 0.11 0.00 0.00 0.00 176.54 178.09 1sqp h TRP 77 N 0.52 1.07 -0.16 5.60 5.08 -1.69 -0.01 115.95 126.35 1sqp h TRP 77 Ca 0.10 0.03 -0.04 0.00 1.08 0.00 0.00 58.89 60.06 1sqp h TRP 77 Cb 0.42 -0.35 -0.00 0.00 -3.00 0.00 0.00 29.16 26.22 1sqp h TRP 77 CO 0.02 0.60 -0.05 0.82 -1.28 0.00 0.00 178.44 178.54 1sqp h ILE 78 N 1.08 1.30 -0.40 0.12 2.04 -1.86 -2.05 117.51 117.75 1sqp h ILE 78 Ca 0.37 -1.05 0.03 0.00 1.00 0.00 0.00 64.86 65.21 1sqp h ILE 78 Cb 0.09 1.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.78 1sqp h ILE 78 CO -0.12 0.31 0.19 0.40 0.00 0.00 0.00 178.15 178.93 1sqp h ILE 79 N 0.02 0.96 -0.33 -0.67 2.04 -1.37 0.33 117.51 118.49 1sqp h ILE 79 Ca 0.04 -0.13 0.04 0.00 1.00 0.00 0.00 64.86 65.81 1sqp h ILE 79 Cb 0.50 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 1sqp h ILE 79 CO 0.02 0.07 0.08 -0.09 0.00 0.00 0.00 178.15 178.23 1sqp h ARG 80 N 0.39 0.20 0.01 2.37 1.12 -0.98 -1.31 114.38 116.18 1sqp h ARG 80 Ca 0.17 -0.01 -0.20 0.00 -1.11 0.00 0.00 59.98 58.83 1sqp h ARG 80 Cb 0.09 -0.05 -0.03 0.00 -0.01 0.00 0.00 29.97 29.98 1sqp h ARG 80 CO -0.13 0.13 -0.93 1.88 -3.11 0.00 0.00 179.97 177.81 1sqp h TYR 81 N 0.21 0.04 -0.55 2.20 0.05 -0.99 -2.36 116.97 115.56 1sqp h TYR 81 Ca 0.15 -0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.95 1sqp h TYR 81 Cb 0.16 -0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.85 1sqp h TYR 81 CO -0.17 0.94 0.30 0.52 -1.05 0.00 0.00 178.16 178.71 1sqp h MET 82 N 0.01 0.57 0.76 4.88 2.86 -0.19 0.74 114.93 124.55 1sqp h MET 82 Ca -0.02 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1sqp h MET 82 Cb 1.63 -0.13 0.01 0.00 0.06 0.00 0.00 31.60 33.17 1sqp h MET 82 CO 0.12 0.38 -0.36 1.25 1.06 0.00 0.00 176.91 179.36 1sqp h HIS 83 N 0.59 -0.94 -0.76 -0.22 -0.00 -1.20 0.15 115.15 112.76 1sqp h HIS 83 Ca 0.24 -0.02 0.15 0.00 -0.00 0.00 0.00 60.37 60.74 1sqp h HIS 83 Cb 0.11 0.31 -0.10 0.00 -0.00 0.00 0.00 27.41 27.73 1sqp h HIS 83 CO -0.08 -0.59 0.29 0.00 -0.00 0.00 0.00 177.93 177.55 1sqp h ALA 84 N -1.49 1.08 0.08 5.26 0.00 -1.36 0.97 119.26 123.78 1sqp h ALA 84 Ca -0.10 0.13 -0.25 0.00 0.00 0.00 0.00 54.91 54.69 1sqp h ALA 84 Cb 0.78 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1sqp h ALA 84 CO 0.17 -0.24 -1.13 -0.91 0.00 0.00 0.00 179.25 177.14 1sqp h ASN 85 N 0.41 0.30 -0.51 0.00 2.35 -0.87 -3.18 115.58 114.08 1sqp h ASN 85 Ca 0.43 -0.30 -0.02 0.00 -0.55 0.00 0.00 56.30 55.85 1sqp h ASN 85 Cb 0.68 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.92 1sqp h ASN 85 CO -0.43 1.22 0.27 1.23 -1.65 0.00 0.00 177.43 178.06 1sqp h GLY 86 N 1.98 0.81 0.34 2.83 0.00 0.32 0.12 103.07 109.47 1sqp h GLY 86 Ca -0.09 -0.37 0.08 0.00 0.00 0.00 0.00 47.33 46.95 1sqp h GLY 86 CO 0.18 0.35 0.01 0.00 0.00 0.00 0.00 176.54 177.08 1sqp h ALA 87 N 1.53 0.39 0.03 3.60 0.00 -0.83 0.55 119.26 124.54 1sqp h ALA 87 Ca 0.19 0.12 -0.24 0.00 0.00 0.00 0.00 54.91 54.98 1sqp h ALA 87 Cb 0.07 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1sqp h ALA 87 CO -0.03 -0.38 -1.20 0.66 0.00 0.00 0.00 179.25 178.30 1sqp h SER 88 N 0.12 0.10 -0.93 0.00 4.64 -1.52 -2.65 113.55 113.30 1sqp h SER 88 Ca 0.21 -0.12 0.09 0.00 -0.47 0.00 0.00 61.79 61.49 1sqp h SER 88 Cb 0.29 -0.03 -0.07 0.00 -0.31 0.00 0.00 62.40 62.28 1sqp h SER 88 CO -0.34 1.10 0.58 0.24 -0.87 0.00 0.00 176.83 177.54 1sqp h MET 89 N 0.02 0.97 -0.70 4.77 2.86 -0.28 0.16 114.93 122.73 1sqp h MET 89 Ca -0.10 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1sqp h MET 89 Cb 1.86 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 33.27 1sqp h MET 89 CO 0.14 0.64 0.46 0.35 1.06 0.00 0.00 176.91 179.56 1sqp h PHE 90 N 1.00 0.87 -0.20 -0.22 3.04 0.21 -2.27 116.94 119.37 1sqp h PHE 90 Ca 0.43 0.02 -0.18 0.00 3.98 0.00 0.00 57.97 62.22 1sqp h PHE 90 Cb 0.30 -0.29 -0.00 0.00 2.56 0.00 0.00 35.95 38.51 1sqp h PHE 90 CO -0.02 0.54 -0.61 0.74 -2.02 0.00 0.00 178.31 176.94 1sqp h PHE 91 N 0.93 0.87 -0.54 0.41 -1.00 -0.44 -1.88 116.94 115.29 1sqp h PHE 91 Ca 0.26 -0.33 -0.04 0.00 2.81 0.00 0.00 57.97 60.67 1sqp h PHE 91 Cb -0.08 -0.16 -0.03 0.00 3.61 0.00 0.00 35.95 39.30 1sqp h PHE 91 CO -0.00 1.11 0.16 0.97 -1.61 0.00 0.00 178.31 178.94 1sqp h ILE 92 N 0.50 1.21 -0.29 -0.55 2.10 -0.47 -0.21 117.51 119.80 1sqp h ILE 92 Ca -0.00 -0.74 -0.11 0.00 1.08 0.00 0.00 64.86 65.09 1sqp h ILE 92 Cb 1.19 0.63 -0.01 0.00 -1.09 0.00 0.00 36.82 37.54 1sqp h ILE 92 CO 0.12 0.28 -0.24 0.00 -1.08 0.00 0.00 178.15 177.23 1sqp h LEU 94 N 0.42 0.66 -0.17 0.00 3.38 -0.87 0.04 115.31 118.76 1sqp h LEU 94 Ca 0.05 0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 1sqp h LEU 94 Cb 0.80 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1sqp h LEU 94 CO 0.06 0.39 -0.40 1.88 0.09 0.00 0.00 178.44 180.47 1sqp h TYR 95 N 0.78 0.73 -0.40 1.13 0.05 -0.66 -0.29 116.97 118.31 1sqp h TYR 95 Ca 0.37 -0.27 0.06 0.00 0.05 0.00 0.00 58.73 58.94 1sqp h TYR 95 Cb 0.30 -0.13 -0.05 0.00 1.01 0.00 0.00 36.73 37.86 1sqp h TYR 95 CO -0.06 1.03 0.08 0.52 -1.05 0.00 0.00 178.16 178.67 1sqp h MET 96 N 0.23 0.20 -0.17 4.88 2.86 -0.69 -0.86 114.93 121.39 1sqp h MET 96 Ca -0.00 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1sqp h MET 96 Cb 1.00 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.61 1sqp h MET 96 CO 0.09 0.13 0.03 1.25 1.06 0.00 0.00 176.91 179.48 1sqp h HIS 97 N 0.21 0.29 -0.44 -0.22 -0.00 -0.82 0.13 115.15 114.29 1sqp h HIS 97 Ca 0.19 -0.04 -0.03 0.00 -0.00 0.00 0.00 60.37 60.49 1sqp h HIS 97 Cb 0.23 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 27.54 1sqp h HIS 97 CO -0.20 0.42 0.14 0.28 -0.00 0.00 0.00 177.93 178.58 1sqp h VAL 98 N 0.07 1.22 -0.42 5.26 2.07 -0.98 -2.57 116.25 120.90 1sqp h VAL 98 Ca 0.05 -0.72 0.05 0.00 0.82 0.00 0.00 66.70 66.89 1sqp h VAL 98 Cb 0.29 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 1sqp h VAL 98 CO 0.00 0.26 0.17 1.23 0.02 0.00 0.00 177.57 179.25 1sqp h GLY 99 N 0.58 0.56 0.88 2.17 0.00 -0.64 -0.82 103.07 105.80 1sqp h GLY 99 Ca 0.14 -0.10 0.03 0.00 0.00 0.00 0.00 47.33 47.40 1sqp h GLY 99 CO -0.01 0.05 0.59 -0.09 0.00 0.00 0.00 176.54 177.08 1sqp h ARG 100 N 0.35 1.12 -0.92 4.80 1.12 -0.76 -0.69 114.38 119.39 1sqp h ARG 100 Ca 0.19 -0.07 0.02 0.00 -1.11 0.00 0.00 59.98 59.01 1sqp h ARG 100 Cb 0.16 -0.25 -0.05 0.00 -0.01 0.00 0.00 29.97 29.82 1sqp h ARG 100 CO -0.18 0.74 0.61 0.78 -3.11 0.00 0.00 179.97 178.81 1sqp h GLY 101 N 1.15 1.31 0.57 2.80 0.00 -0.76 -0.87 103.07 107.28 1sqp h GLY 101 Ca 0.36 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 1sqp h GLY 101 CO -0.12 0.45 -0.01 1.41 0.00 0.00 0.00 176.54 178.27 1sqp h LEU 102 N 1.23 -0.02 -0.49 3.11 3.38 -0.50 -1.29 115.31 120.73 1sqp h LEU 102 Ca 0.35 -0.41 0.02 0.00 0.09 0.00 0.00 57.88 57.92 1sqp h LEU 102 Cb -0.11 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1sqp h LEU 102 CO -0.09 0.41 0.30 0.22 0.09 0.00 0.00 178.44 179.37 1sqp h TYR 103 N -0.45 0.55 -0.27 1.13 5.03 -1.03 -3.01 116.97 118.92 1sqp h TYR 103 Ca -0.00 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.32 1sqp h TYR 103 Cb 0.43 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 38.53 1sqp h TYR 103 CO 0.07 0.32 0.00 0.66 -1.32 0.00 0.00 178.16 177.89 1sqp n TYR 104 N -4.81 0.34 -1.25 -3.82 4.01 -0.34 -0.87 117.16 110.43 1sqp n TYR 104 Ca 0.03 -0.17 -0.08 0.00 -0.16 0.00 0.00 57.90 57.52 1sqp n TYR 104 Cb 0.07 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.06 1sqp n TYR 104 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1sqp n GLY 105 N 1.39 1.01 0.33 2.72 0.00 -0.98 -4.02 105.19 105.64 1sqp n GLY 105 Ca 0.18 -0.47 0.09 0.00 0.00 0.00 0.00 46.02 45.82 1sqp n GLY 105 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1sqp h SER 106 N 0.00 0.36 -0.04 1.61 0.02 -1.51 -2.82 113.55 111.17 1sqp h SER 106 Ca -0.17 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.79 1sqp h SER 106 Cb 0.63 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.10 1sqp h SER 106 CO 0.25 0.23 0.55 0.10 -1.14 0.00 0.00 176.83 176.82 1sqp h TYR 107 N 0.41 0.00 0.00 3.45 -0.00 -1.91 -2.14 116.97 116.78 1sqp h TYR 107 Ca 0.22 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.94 1sqp h TYR 107 Cb 0.33 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.06 1sqp h TYR 107 CO -0.00 0.00 -0.01 1.79 -0.00 0.00 0.00 178.16 179.94 1sqp h THR 108 N 0.00 0.34 -0.87 -0.90 1.35 -1.85 -3.32 112.91 107.66 1sqp h THR 108 Ca 0.02 -0.04 -0.36 0.00 -0.55 0.00 0.00 66.41 65.48 1sqp h THR 108 Cb 1.12 1.03 -0.06 0.00 -1.73 0.00 0.00 68.15 68.50 1sqp h THR 108 CO -0.00 0.01 0.91 -0.36 -0.25 0.00 0.00 175.52 175.83 1sqp s PHE 109 N -4.43 1.94 0.08 4.73 0.08 -0.81 -4.89 117.98 114.68 1sqp s PHE 109 Ca -0.05 0.35 -0.31 0.00 0.12 0.00 0.00 56.93 57.04 1sqp s PHE 109 Cb 0.14 -4.18 -0.16 0.00 -0.57 0.00 0.00 43.02 38.26 1sqp s PHE 109 CO 0.50 -1.81 1.63 -0.07 -0.10 0.00 0.00 175.22 175.37 1sqp h LEU 110 N 16.79 -0.79 0.16 -0.37 4.07 -1.89 -1.43 115.31 131.85 1sqp h LEU 110 Ca 0.09 0.05 -0.01 0.00 0.08 0.00 0.00 57.88 58.10 1sqp h LEU 110 Cb 1.01 0.24 0.00 0.00 1.08 0.00 0.00 40.66 42.99 1sqp h LEU 110 CO 1.25 -0.49 -0.08 -0.33 -1.08 0.00 0.00 178.44 177.72 1sqp h GLU 111 N -0.76 -0.20 -0.24 1.13 3.07 -1.91 0.41 114.58 116.07 1sqp h GLU 111 Ca -0.05 0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.81 1sqp h GLU 111 Cb 0.63 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.57 1sqp h GLU 111 CO 0.05 -0.03 0.08 0.00 -1.40 0.00 0.00 179.01 177.71 1sqp h THR 112 N -0.34 1.10 -0.00 1.13 1.03 -1.88 -0.52 112.91 113.42 1sqp h THR 112 Ca -0.02 -0.33 -0.00 0.00 -0.01 0.00 0.00 66.41 66.04 1sqp h THR 112 Cb 0.27 0.84 0.00 0.00 -1.07 0.00 0.00 68.15 68.19 1sqp h THR 112 CO 0.04 0.12 -0.02 -0.25 -0.01 0.00 0.00 175.52 175.40 1sqp h TRP 113 N 0.33 0.02 -0.41 0.00 2.91 -0.95 -2.89 115.95 114.95 1sqp h TRP 113 Ca 0.08 -0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.11 1sqp h TRP 113 Cb 0.09 -0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 28.72 1sqp h TRP 113 CO 0.00 0.77 0.28 -0.91 -1.03 0.00 0.00 178.44 177.54 1sqp h ASN 114 N -0.74 0.44 -0.67 2.65 -0.26 -0.55 -0.88 115.58 115.58 1sqp h ASN 114 Ca -0.00 -0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 55.69 1sqp h ASN 114 Cb 0.77 -0.11 -0.03 0.00 -1.06 0.00 0.00 38.32 37.89 1sqp h ASN 114 CO 0.00 0.32 0.28 0.40 -1.06 0.00 0.00 177.43 177.37 1sqp h ILE 115 N 0.52 1.24 -0.59 2.81 1.08 -1.18 -2.51 117.51 118.88 1sqp h ILE 115 Ca 0.16 -0.72 0.04 0.00 -0.39 0.00 0.00 64.86 63.94 1sqp h ILE 115 Cb -0.00 0.47 -0.03 0.00 -3.07 0.00 0.00 36.82 34.18 1sqp h ILE 115 CO -0.04 0.29 0.39 1.23 -0.69 0.00 0.00 178.15 179.33 1sqp h GLY 116 N 0.94 0.76 0.85 5.37 0.00 -0.96 0.24 103.07 110.27 1sqp h GLY 116 Ca 0.22 -0.26 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 1sqp h GLY 116 CO -0.02 0.22 -0.01 -2.08 0.00 0.00 0.00 176.54 174.65 1sqp h VAL 117 N 0.66 1.26 -0.42 4.60 2.07 -1.18 -0.38 116.25 122.86 1sqp h VAL 117 Ca 0.24 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.78 1sqp h VAL 117 Cb 0.13 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1sqp h VAL 117 CO -0.07 0.30 0.12 0.40 0.02 0.00 0.00 177.57 178.34 1sqp h ILE 118 N 0.21 1.18 -0.45 4.57 2.04 -0.85 -0.83 117.51 123.37 1sqp h ILE 118 Ca 0.07 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 1sqp h ILE 118 Cb 0.44 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1sqp h ILE 118 CO 0.02 0.23 0.27 -0.07 0.00 0.00 0.00 178.15 178.59 1sqp h LEU 119 N 0.60 0.55 0.59 1.44 3.38 -0.20 -0.97 115.31 120.71 1sqp h LEU 119 Ca 0.14 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1sqp h LEU 119 Cb 0.19 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1sqp h LEU 119 CO -0.01 0.45 -0.34 0.25 0.09 0.00 0.00 178.44 178.88 1sqp h LEU 120 N 0.60 -0.84 -0.78 1.67 6.46 -0.33 0.12 115.31 122.22 1sqp h LEU 120 Ca 0.16 0.04 0.16 0.00 -0.12 0.00 0.00 57.88 58.12 1sqp h LEU 120 Cb 0.00 0.24 -0.10 0.00 -0.73 0.00 0.00 40.66 40.07 1sqp h LEU 120 CO -0.03 -0.54 0.29 -0.07 -0.62 0.00 0.00 178.44 177.47 1sqp h LEU 121 N -0.87 0.24 -0.54 2.25 3.38 -1.08 0.42 115.31 119.11 1sqp h LEU 121 Ca -0.07 0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 1sqp h LEU 121 Cb 0.70 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 1sqp h LEU 121 CO 0.09 0.06 -0.07 0.74 0.09 0.00 0.00 178.44 179.36 1sqp h THR 122 N 0.41 1.27 -0.05 0.22 2.02 -0.70 0.55 112.91 116.63 1sqp h THR 122 Ca 0.44 -1.21 -0.12 0.00 0.77 0.00 0.00 66.41 66.28 1sqp h THR 122 Cb 0.71 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1sqp h THR 122 CO -0.44 0.43 -0.53 0.58 0.37 0.00 0.00 175.52 175.92 1sqp h VAL 123 N 0.87 1.37 0.15 3.16 2.07 -0.14 -0.17 116.25 123.56 1sqp h VAL 123 Ca 0.14 -1.82 -0.30 0.00 0.82 0.00 0.00 66.70 65.54 1sqp h VAL 123 Cb 0.63 1.93 0.03 0.00 -1.52 0.00 0.00 31.29 32.36 1sqp h VAL 123 CO 0.04 0.53 -1.25 0.00 0.02 0.00 0.00 177.57 176.91 1sqp h MET 124 N 0.11 0.58 -0.81 1.57 -0.00 -0.57 -1.80 114.93 114.01 1sqp h MET 124 Ca 0.00 -0.83 0.14 0.00 -0.00 0.00 0.00 59.70 59.02 1sqp h MET 124 Cb 0.98 0.28 -0.06 0.00 -0.00 0.00 0.00 31.60 32.80 1sqp h MET 124 CO 0.08 1.38 0.53 0.00 -0.00 0.00 0.00 176.91 178.90 1sqp h ALA 125 N 0.24 1.98 0.46 -3.00 0.00 0.13 -1.01 119.26 118.05 1sqp h ALA 125 Ca -0.20 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1sqp h ALA 125 Cb 1.94 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.64 1sqp h ALA 125 CO 0.24 -0.19 -0.22 1.15 0.00 0.00 0.00 179.25 180.23 1sqp h THR 126 N 0.54 0.49 -0.50 0.00 2.02 -0.85 -2.79 112.91 111.82 1sqp h THR 126 Ca 0.40 -0.38 -0.05 0.00 0.77 0.00 0.00 66.41 67.14 1sqp h THR 126 Cb 0.77 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1sqp h THR 126 CO -0.15 0.06 0.09 0.00 0.37 0.00 0.00 175.52 175.88 1sqp h ALA 127 N -0.45 1.21 -0.44 6.16 0.00 -0.85 0.98 119.26 125.88 1sqp h ALA 127 Ca -0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1sqp h ALA 127 Cb 0.57 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1sqp h ALA 127 CO 0.10 0.53 0.25 0.35 0.00 0.00 0.00 179.25 180.49 1sqp h PHE 128 N 0.75 0.60 0.00 0.00 3.57 -1.28 -1.41 116.94 119.16 1sqp h PHE 128 Ca 0.16 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.59 1sqp h PHE 128 Cb 0.33 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 1sqp h PHE 128 CO 0.02 0.44 -0.27 0.52 -2.23 0.00 0.00 178.31 176.79 1sqp h MET 129 N 0.58 0.00 0.46 1.11 2.86 -1.14 -3.33 114.93 115.47 1sqp h MET 129 Ca 0.16 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.77 1sqp h MET 129 Cb 0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.70 1sqp h MET 129 CO -0.03 0.27 -0.22 0.78 1.06 0.00 0.00 176.91 178.77 1sqp h GLY 130 N 1.09 -0.65 1.63 8.32 0.00 0.02 -3.26 103.07 110.23 1sqp h GLY 130 Ca -0.00 0.24 0.02 0.00 0.00 0.00 0.00 47.33 47.59 1sqp h GLY 130 CO 0.03 -0.24 0.16 -1.82 0.00 0.00 0.00 176.54 174.68 1sqp h TYR 131 N -0.98 0.00 -0.06 5.60 3.20 -1.40 -1.80 116.97 121.54 1sqp h TYR 131 Ca -0.06 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.69 1sqp h TYR 131 Cb 0.58 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 1sqp h TYR 131 CO 0.01 0.00 -0.51 0.28 -1.64 0.00 0.00 178.16 176.31 1sqp h VAL 132 N 0.00 1.36 -0.73 1.81 2.07 -1.68 -3.37 116.25 115.71 1sqp h VAL 132 Ca 0.04 -1.75 0.08 0.00 0.82 0.00 0.00 66.70 65.88 1sqp h VAL 132 Cb 0.36 1.88 -0.06 0.00 -1.52 0.00 0.00 31.29 31.95 1sqp h VAL 132 CO -0.00 0.51 0.39 -0.07 0.02 0.00 0.00 177.57 178.43 1sqp h LEU 133 N 0.12 0.56 -2.09 2.57 3.38 -1.44 -1.73 115.31 116.68 1sqp h LEU 133 Ca 0.00 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.09 1sqp h LEU 133 Cb 0.94 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 1sqp h LEU 133 CO 0.07 0.34 0.34 -0.65 0.09 0.00 0.00 178.44 178.63 1sqp h PRO 134 N 0.69 0.00 -5.68 1.13 0.11 -1.78 -3.44 132.00 123.03 1sqp h PRO 134 Ca 0.34 0.00 -0.40 0.00 0.11 0.00 0.00 66.00 66.05 1sqp h PRO 134 Cb 0.29 0.00 0.13 0.00 0.11 0.00 0.00 31.00 31.53 1sqp h PRO 134 CO -0.23 0.00 -0.67 1.87 -0.21 0.00 0.00 178.00 178.76 1sqp n TRP 135 N -3.59 -2.78 -1.78 0.65 -0.00 -0.65 -3.27 117.44 106.02 1sqp n TRP 135 Ca 0.04 0.96 -0.30 0.00 -0.00 0.00 0.00 57.50 58.19 1sqp n TRP 135 Cb 0.47 -4.98 0.21 0.00 -0.00 0.00 0.00 31.31 27.01 1sqp n TRP 135 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 177.69 177.89 1sqp s GLY 136 N -3.24 1.77 0.17 5.87 0.00 -1.26 -1.44 107.32 109.19 1sqp s GLY 136 Ca 0.55 -1.25 -0.13 0.00 0.00 0.00 0.00 44.72 43.90 1sqp s GLY 136 CO 0.69 -0.41 1.77 1.46 0.00 0.00 0.00 173.10 176.61 1sqp h GLN 137 N -1.92 0.82 -0.04 2.90 1.08 -1.06 -1.97 115.11 114.93 1sqp h GLN 137 Ca -0.44 -0.11 -0.12 0.00 -1.45 0.00 0.00 58.65 56.53 1sqp h GLN 137 Cb 1.23 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 28.49 1sqp h GLN 137 CO 0.33 0.65 -0.55 1.98 -0.95 0.00 0.00 178.83 180.28 1sqp h MET 138 N 0.79 0.10 0.09 1.46 4.05 -1.87 -1.19 114.93 118.37 1sqp h MET 138 Ca 0.20 -0.06 0.01 0.00 -0.28 0.00 0.00 59.70 59.57 1sqp h MET 138 Cb 0.07 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 1sqp h MET 138 CO -0.03 0.63 -0.11 0.77 0.23 0.00 0.00 176.91 178.40 1sqp h SER 139 N 0.08 -0.30 0.35 1.39 0.02 -1.71 -1.24 113.55 112.14 1sqp h SER 139 Ca -0.00 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.96 1sqp h SER 139 Cb 1.00 0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.65 1sqp h SER 139 CO 0.08 -0.17 -0.17 0.15 -1.14 0.00 0.00 176.83 175.58 1sqp h PHE 140 N -0.23 -0.43 -0.02 3.45 3.57 -1.07 -1.78 116.94 120.43 1sqp h PHE 140 Ca 0.01 -0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.37 1sqp h PHE 140 Cb 0.24 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.10 1sqp h PHE 140 CO -0.13 -0.10 -0.59 -1.49 -2.23 0.00 0.00 178.31 173.77 1sqp h TRP 141 N -0.92 0.06 -0.39 0.41 4.06 -1.31 0.14 115.95 118.01 1sqp h TRP 141 Ca -0.05 -0.02 -0.04 0.00 2.06 0.00 0.00 58.89 60.84 1sqp h TRP 141 Cb 0.53 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.66 1sqp h TRP 141 CO 0.03 0.63 0.09 0.78 -3.56 0.00 0.00 178.44 176.41 1sqp h GLY 142 N 1.71 0.67 1.00 1.49 0.00 -1.30 0.11 103.07 106.75 1sqp h GLY 142 Ca -0.01 -0.43 0.01 0.00 0.00 0.00 0.00 47.33 46.91 1sqp h GLY 142 CO 0.08 0.40 0.62 0.00 0.00 0.00 0.00 176.54 177.64 1sqp h ALA 143 N 0.94 1.19 -0.26 3.60 0.00 -0.93 -2.56 119.26 121.23 1sqp h ALA 143 Ca 0.12 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1sqp h ALA 143 Cb 0.32 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1sqp h ALA 143 CO 0.00 0.58 -0.08 1.15 0.00 0.00 0.00 179.25 180.90 1sqp h THR 144 N 1.26 1.29 -0.67 0.00 2.02 -0.45 -2.47 112.91 113.88 1sqp h THR 144 Ca 0.35 -1.11 -0.06 0.00 0.77 0.00 0.00 66.41 66.35 1sqp h THR 144 Cb -0.13 1.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 1sqp h THR 144 CO -0.08 0.35 0.18 0.58 0.37 0.00 0.00 175.52 176.93 1sqp h VAL 145 N 0.26 1.26 -0.01 3.16 2.07 -0.67 -2.60 116.25 119.72 1sqp h VAL 145 Ca 0.06 -0.92 -0.04 0.00 0.82 0.00 0.00 66.70 66.63 1sqp h VAL 145 Cb 0.56 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1sqp h VAL 145 CO 0.03 0.35 -0.15 0.40 0.02 0.00 0.00 177.57 178.22 1sqp h ILE 146 N 1.00 1.56 -0.57 4.57 1.08 -1.48 -3.31 117.51 120.37 1sqp h ILE 146 Ca 0.21 -1.86 0.00 0.00 -0.39 0.00 0.00 64.86 62.83 1sqp h ILE 146 Cb 0.34 2.76 -0.03 0.00 -3.07 0.00 0.00 36.82 36.82 1sqp h ILE 146 CO -0.00 0.50 0.37 0.71 -0.69 0.00 0.00 178.15 179.04 1sqp h THR 147 N -0.58 1.15 -0.26 -0.27 1.35 -1.50 -2.75 112.91 110.05 1sqp h THR 147 Ca -0.02 -0.28 0.08 0.00 -0.55 0.00 0.00 66.41 65.64 1sqp h THR 147 Cb 0.90 0.32 -0.01 0.00 -1.73 0.00 0.00 68.15 67.63 1sqp h THR 147 CO 0.03 0.14 0.30 0.78 -0.25 0.00 0.00 175.52 176.53 1sqp h ASN 148 N 0.77 0.00 -0.65 5.36 2.35 -1.56 0.09 115.58 121.95 1sqp h ASN 148 Ca 0.21 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.98 1sqp h ASN 148 Cb -0.08 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 1sqp h ASN 148 CO -0.04 0.00 0.43 -0.07 -1.65 0.00 0.00 177.43 176.09 1sqp h LEU 149 N 0.00 0.69 -0.24 1.61 3.38 -1.57 -2.50 115.31 116.68 1sqp h LEU 149 Ca 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1sqp h LEU 149 Cb 0.72 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1sqp h LEU 149 CO -0.00 0.49 0.00 0.18 0.09 0.00 0.00 178.44 179.20 1sqp n LEU 150 N -4.45 0.14 0.19 1.67 4.77 0.02 -2.04 117.00 117.30 1sqp n LEU 150 Ca 0.07 0.55 0.14 0.00 -0.03 0.00 0.00 56.01 56.74 1sqp n LEU 150 Cb 0.09 -0.55 0.64 0.00 -2.33 0.00 0.00 43.42 41.27 1sqp n LEU 150 CO 0.35 -0.46 0.91 0.28 -1.33 0.00 0.00 177.39 177.14 1sqp h SER 151 N 0.00 0.00 1.82 -1.43 0.02 -1.61 -3.17 113.55 109.18 1sqp h SER 151 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1sqp h SER 151 Cb 0.14 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.68 1sqp h SER 151 CO 0.00 0.00 -0.18 0.00 -1.14 0.00 0.00 176.83 175.51 1sqp h ALA 152 N 2.11 0.90 -1.81 3.77 0.00 -1.63 -3.38 119.26 119.22 1sqp h ALA 152 Ca 0.00 -0.09 -0.54 0.00 0.00 0.00 0.00 54.91 54.28 1sqp h ALA 152 Cb 0.24 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1sqp h ALA 152 CO 0.00 0.12 1.48 0.42 0.00 0.00 0.00 179.25 181.27 1sqp s ILE 153 N -3.18 3.12 0.00 0.00 1.09 -1.20 -4.66 121.20 116.37 1sqp s ILE 153 Ca 0.06 0.11 0.00 0.00 -1.10 0.00 0.00 60.65 59.72 1sqp s ILE 153 Cb 0.06 -3.21 0.00 0.00 -1.06 0.00 0.00 42.46 38.25 1sqp s ILE 153 CO 0.69 -0.16 0.00 -2.65 -0.10 0.00 0.00 174.94 172.72 1sqp n PRO 154 N 8.82 0.00 0.06 2.79 -0.02 -1.26 0.33 135.00 145.71 1sqp n PRO 154 Ca 0.30 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.72 1sqp n PRO 154 Cb 0.49 0.00 0.13 0.00 -0.02 0.00 0.00 33.50 34.10 1sqp n PRO 154 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1sqp h TYR 155 N 0.00 0.44 -0.00 6.00 3.20 -1.98 -3.26 116.97 121.37 1sqp h TYR 155 Ca 0.00 -0.14 0.00 0.00 3.14 0.00 0.00 58.73 61.73 1sqp h TYR 155 Cb 0.00 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.18 1sqp h TYR 155 CO 0.00 0.79 -0.12 -0.89 -1.64 0.00 0.00 178.16 176.30 1sqp n ILE 156 N -3.96 0.00 0.00 1.81 5.41 -1.05 -4.76 119.36 116.81 1sqp n ILE 156 Ca -0.02 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.70 1sqp n ILE 156 Cb 0.56 -0.21 0.00 0.00 -0.71 0.00 0.00 39.64 39.28 1sqp n ILE 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1sqp n GLY 157 N 1.37 -1.99 0.23 7.39 0.00 0.15 -3.21 105.19 109.13 1sqp n GLY 157 Ca 0.11 0.43 -0.10 0.00 0.00 0.00 0.00 46.02 46.46 1sqp n GLY 157 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1sqp h THR 158 N 0.00 1.26 -0.78 2.61 1.35 -1.84 -3.17 112.91 112.34 1sqp h THR 158 Ca 0.00 -1.03 0.18 0.00 -0.55 0.00 0.00 66.41 65.01 1sqp h THR 158 Cb 0.00 1.08 -0.05 0.00 -1.73 0.00 0.00 68.15 67.45 1sqp h THR 158 CO 0.00 0.35 0.53 0.78 -0.25 0.00 0.00 175.52 176.93 1sqp h ASN 159 N 0.59 0.27 -0.03 5.36 2.35 -1.92 -1.85 115.58 120.35 1sqp h ASN 159 Ca 0.12 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.87 1sqp h ASN 159 Cb 0.49 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.83 1sqp h ASN 159 CO 0.02 0.12 -0.06 0.25 -1.65 0.00 0.00 177.43 176.12 1sqp h LEU 160 N 0.28 0.10 -0.62 1.61 6.46 -1.52 -2.63 115.31 119.00 1sqp h LEU 160 Ca 0.39 -0.57 -0.10 0.00 -0.12 0.00 0.00 57.88 57.48 1sqp h LEU 160 Cb 1.10 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.98 1sqp h LEU 160 CO -0.10 0.65 -0.01 0.58 -0.62 0.00 0.00 178.44 178.94 1sqp h VAL 161 N -0.44 1.27 -0.30 1.05 2.07 -1.51 -1.77 116.25 116.61 1sqp h VAL 161 Ca 0.00 -1.17 -0.08 0.00 0.82 0.00 0.00 66.70 66.27 1sqp h VAL 161 Cb 0.63 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 1sqp h VAL 161 CO 0.01 0.42 -0.15 -0.33 0.02 0.00 0.00 177.57 177.55 1sqp h GLU 162 N 0.98 0.53 -0.48 1.57 5.08 -1.46 -1.01 114.58 119.78 1sqp h GLU 162 Ca 0.17 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 1sqp h GLU 162 Cb 0.57 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1sqp h GLU 162 CO 0.03 0.67 -0.18 2.35 -1.00 0.00 0.00 179.01 180.88 1sqp h TRP 163 N 0.49 1.11 0.00 4.33 7.01 -1.04 -0.18 115.95 127.67 1sqp h TRP 163 Ca 0.09 -0.26 -0.08 0.00 2.11 0.00 0.00 58.89 60.74 1sqp h TRP 163 Cb 0.54 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.33 1sqp h TRP 163 CO 0.02 1.08 -0.40 0.82 -2.79 0.00 0.00 178.44 177.17 1sqp h ILE 164 N 0.83 0.84 0.12 2.65 2.04 -1.27 -3.30 117.51 119.42 1sqp h ILE 164 Ca 0.11 -1.70 -0.28 0.00 1.00 0.00 0.00 64.86 63.99 1sqp h ILE 164 Cb 0.76 2.07 0.02 0.00 -0.74 0.00 0.00 36.82 38.92 1sqp h ILE 164 CO 0.06 0.39 -1.22 -0.50 0.00 0.00 0.00 178.15 176.88 1sqp h TRP 165 N 0.00 0.80 -0.96 1.37 6.55 -0.83 -3.46 115.95 119.42 1sqp h TRP 165 Ca -0.00 -0.52 -0.13 0.00 0.95 0.00 0.00 58.89 59.19 1sqp h TRP 165 Cb 1.03 -0.06 -0.00 0.00 -0.86 0.00 0.00 29.16 29.27 1sqp h TRP 165 CO 0.00 1.38 -0.17 0.41 -1.05 0.00 0.00 178.44 179.01 1sqp n GLY 166 N 1.38 0.11 0.00 1.49 0.00 -0.11 -3.61 105.19 104.45 1sqp n GLY 166 Ca -0.11 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1sqp n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sqp n GLY 167 N -1.01 -0.50 0.56 -0.02 0.00 -1.14 -4.83 105.19 98.25 1sqp n GLY 167 Ca -0.08 -0.85 0.08 0.00 0.00 0.00 0.00 46.02 45.17 1sqp n GLY 167 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1sqp n PHE 168 N 8.72 0.00 -4.03 1.61 3.72 -1.26 -4.49 117.46 121.73 1sqp n PHE 168 Ca 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 1sqp n PHE 168 Cb 0.00 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.50 1sqp n PHE 168 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1sqp s SER 169 N -1.36 0.51 -0.97 4.37 1.04 -1.26 -5.08 113.70 110.95 1sqp s SER 169 Ca 0.17 -1.29 -0.24 0.00 0.48 0.00 0.00 55.95 55.07 1sqp s SER 169 Cb 0.12 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.90 1sqp s SER 169 CO 0.22 -1.29 1.71 -0.69 0.98 0.00 0.00 173.24 174.17 1sqp s VAL 170 N -3.26 3.69 0.00 5.02 1.01 -1.26 -4.77 120.40 120.83 1sqp s VAL 170 Ca 0.27 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.64 1sqp s VAL 170 Cb -0.01 -4.55 0.00 0.00 0.00 0.00 0.00 36.38 31.83 1sqp s VAL 170 CO 0.16 -1.44 0.00 -0.67 0.00 0.00 0.00 175.10 173.15 1sqp n ASP 171 N 11.45 0.04 -0.03 3.32 -0.08 -1.26 -4.97 116.55 125.01 1sqp n ASP 171 Ca 0.37 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.53 1sqp n ASP 171 Cb 0.49 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.88 1sqp n ASP 171 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1sqp h LYS 172 N 0.00 0.17 -0.37 -0.67 3.64 -1.91 -3.29 116.57 114.13 1sqp h LYS 172 Ca 0.00 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.39 1sqp h LYS 172 Cb 0.00 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.75 1sqp h LYS 172 CO 0.00 0.40 0.08 0.00 -2.27 0.00 0.00 179.45 177.66 1sqp h ALA 173 N 0.77 0.40 -0.89 5.00 0.00 -1.88 -3.01 119.26 119.65 1sqp h ALA 173 Ca 0.03 0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.08 1sqp h ALA 173 Cb 0.31 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 1sqp h ALA 173 CO 0.00 -0.32 0.58 1.15 0.00 0.00 0.00 179.25 180.66 1sqp h THR 174 N 0.21 1.05 0.63 0.00 2.02 -1.65 -1.41 112.91 113.76 1sqp h THR 174 Ca 0.18 -0.34 -0.03 0.00 0.77 0.00 0.00 66.41 66.99 1sqp h THR 174 Cb 0.20 -0.03 0.01 0.00 -1.74 0.00 0.00 68.15 66.59 1sqp h THR 174 CO -0.23 0.18 -0.30 0.25 0.37 0.00 0.00 175.52 175.79 1sqp h LEU 175 N 0.99 -0.72 -0.63 2.58 6.46 -1.59 -0.59 115.31 121.81 1sqp h LEU 175 Ca 0.39 0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 58.09 1sqp h LEU 175 Cb 0.23 0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.32 1sqp h LEU 175 CO -0.15 -0.48 0.11 0.74 -0.62 0.00 0.00 178.44 178.04 1sqp h THR 176 N -0.90 1.26 -0.11 1.05 2.02 -1.55 -1.05 112.91 113.63 1sqp h THR 176 Ca -0.09 -0.99 -0.00 0.00 0.77 0.00 0.00 66.41 66.10 1sqp h THR 176 Cb 0.67 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1sqp h THR 176 CO 0.14 0.37 0.06 -0.09 0.37 0.00 0.00 175.52 176.38 1sqp h ARG 177 N 0.95 0.15 -0.49 6.66 2.43 -1.29 -2.02 114.38 120.77 1sqp h ARG 177 Ca 0.19 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.39 1sqp h ARG 177 Cb 0.41 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 1sqp h ARG 177 CO 0.01 0.16 0.32 0.74 -1.51 0.00 0.00 179.97 179.69 1sqp h PHE 178 N 0.10 0.48 -0.26 2.20 -1.00 -0.71 -2.05 116.94 115.70 1sqp h PHE 178 Ca 0.04 0.01 -0.02 0.00 2.81 0.00 0.00 57.97 60.81 1sqp h PHE 178 Cb 0.05 -0.16 -0.01 0.00 3.61 0.00 0.00 35.95 39.44 1sqp h PHE 178 CO -0.05 0.27 0.09 0.35 -1.61 0.00 0.00 178.31 177.36 1sqp h PHE 179 N 0.49 0.42 -0.39 -0.55 3.57 -0.63 -1.27 116.94 118.56 1sqp h PHE 179 Ca 0.20 -0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.67 1sqp h PHE 179 Cb 0.20 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 1sqp h PHE 179 CO -0.00 0.45 0.25 0.00 -2.23 0.00 0.00 178.31 176.78 1sqp h ALA 180 N 0.92 0.50 -0.16 2.41 0.00 -0.70 -1.27 119.26 120.96 1sqp h ALA 180 Ca 0.09 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1sqp h ALA 180 Cb 0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1sqp h ALA 180 CO -0.00 -0.07 -0.28 0.74 0.00 0.00 0.00 179.25 179.64 1sqp h PHE 181 N 0.51 0.33 0.00 0.00 0.04 -1.42 -1.95 116.94 114.46 1sqp h PHE 181 Ca 0.15 -0.07 0.00 0.00 2.80 0.00 0.00 57.97 60.85 1sqp h PHE 181 Cb -0.03 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.03 1sqp h PHE 181 CO -0.06 0.56 0.00 1.25 -0.60 0.00 0.00 178.31 179.46 1sqp h HIS 182 N 0.27 0.00 0.00 -0.55 2.76 -0.89 -1.41 115.15 115.32 1sqp h HIS 182 Ca 0.04 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.16 1sqp h HIS 182 Cb 0.64 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.59 1sqp h HIS 182 CO 0.01 0.00 -0.29 0.35 -1.30 0.00 0.00 177.93 176.71 1sqp h PHE 183 N 0.00 0.00 -0.29 5.26 3.04 -0.50 -3.41 116.94 121.04 1sqp h PHE 183 Ca 0.00 0.00 -0.09 0.00 3.98 0.00 0.00 57.97 61.86 1sqp h PHE 183 Cb 0.74 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.24 1sqp h PHE 183 CO 0.00 1.05 -0.19 0.97 -2.02 0.00 0.00 178.31 178.12 1sqp h ILE 184 N -1.00 1.30 -1.00 1.41 2.10 -1.42 -3.37 117.51 115.54 1sqp h ILE 184 Ca -0.08 -1.31 0.13 0.00 1.08 0.00 0.00 64.86 64.68 1sqp h ILE 184 Cb 1.01 1.52 -0.09 0.00 -1.09 0.00 0.00 36.82 38.17 1sqp h ILE 184 CO -0.05 0.42 0.62 -0.07 -1.08 0.00 0.00 178.15 177.99 1sqp h LEU 185 N 0.38 0.89 -2.07 2.19 3.38 -1.47 -0.28 115.31 118.33 1sqp h LEU 185 Ca 0.06 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1sqp h LEU 185 Cb 0.72 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1sqp h LEU 185 CO 0.05 0.45 -0.05 -0.65 0.09 0.00 0.00 178.44 178.33 1sqp h PRO 186 N 0.95 0.00 -0.08 1.13 0.11 -1.80 0.34 132.00 132.65 1sqp h PRO 186 Ca 0.51 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.53 1sqp h PRO 186 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.67 1sqp h PRO 186 CO -0.29 0.05 -0.28 0.74 -0.21 0.00 0.00 178.00 178.01 1sqp h PHE 187 N 0.00 0.43 -0.36 0.65 0.04 -1.26 -1.75 116.94 114.69 1sqp h PHE 187 Ca -0.00 -0.18 0.03 0.00 2.80 0.00 0.00 57.97 60.62 1sqp h PHE 187 Cb 0.10 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.15 1sqp h PHE 187 CO 0.00 0.90 0.16 0.82 -0.60 0.00 0.00 178.31 179.59 1sqp h ILE 188 N -0.16 0.95 -0.77 -0.55 2.04 -1.14 -1.20 117.51 116.68 1sqp h ILE 188 Ca -0.01 -0.11 0.14 0.00 1.00 0.00 0.00 64.86 65.88 1sqp h ILE 188 Cb 0.92 0.59 -0.14 0.00 -0.74 0.00 0.00 36.82 37.44 1sqp h ILE 188 CO 0.06 0.06 -0.27 0.40 0.00 0.00 0.00 178.15 178.40 1sqp h ILE 189 N 0.33 0.16 -0.52 -0.67 2.04 -0.33 0.59 117.51 119.10 1sqp h ILE 189 Ca 0.16 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.01 1sqp h ILE 189 Cb 0.10 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 1sqp h ILE 189 CO -0.13 0.00 0.29 -0.03 0.00 0.00 0.00 178.15 178.27 1sqp h MET 190 N -0.05 0.73 -0.21 2.37 4.05 -0.43 0.31 114.93 121.70 1sqp h MET 190 Ca 0.33 -0.09 0.01 0.00 -0.28 0.00 0.00 59.70 59.67 1sqp h MET 190 Cb 0.58 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.22 1sqp h MET 190 CO -0.81 0.57 0.12 0.00 0.23 0.00 0.00 176.91 177.02 1sqp h ALA 191 N 1.12 0.26 -0.47 0.39 0.00 -0.09 -0.70 119.26 119.77 1sqp h ALA 191 Ca 0.18 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1sqp h ALA 191 Cb 0.05 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1sqp h ALA 191 CO -0.03 -0.29 0.12 0.82 0.00 0.00 0.00 179.25 179.87 1sqp h ILE 192 N 0.25 1.20 -0.18 0.00 2.04 -0.33 -2.16 117.51 118.33 1sqp h ILE 192 Ca 0.08 -0.72 -0.05 0.00 1.00 0.00 0.00 64.86 65.17 1sqp h ILE 192 Cb -0.00 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 1sqp h ILE 192 CO -0.04 0.27 -0.11 0.00 0.00 0.00 0.00 178.15 178.26 1sqp h ALA 193 N 1.45 1.48 0.00 1.87 0.00 0.09 -0.43 119.26 123.72 1sqp h ALA 193 Ca 0.16 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1sqp h ALA 193 Cb 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1sqp h ALA 193 CO -0.00 0.37 -0.53 0.00 0.00 0.00 0.00 179.25 179.08 1sqp h MET 194 N 0.27 0.00 -0.11 0.00 -0.00 -0.47 -2.31 114.93 112.31 1sqp h MET 194 Ca 0.06 0.00 -0.20 0.00 -0.00 0.00 0.00 59.70 59.55 1sqp h MET 194 Cb 0.37 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 31.98 1sqp h MET 194 CO 0.02 0.53 -0.73 0.28 -0.00 0.00 0.00 176.91 177.01 1sqp h VAL 195 N 0.00 1.31 -0.59 -0.10 2.07 -1.29 -0.32 116.25 117.33 1sqp h VAL 195 Ca -0.01 -1.97 0.12 0.00 0.82 0.00 0.00 66.70 65.66 1sqp h VAL 195 Cb 1.07 2.13 -0.11 0.00 -1.52 0.00 0.00 31.29 32.86 1sqp h VAL 195 CO 0.07 0.61 -0.19 -0.74 0.02 0.00 0.00 177.57 177.34 1sqp h HIS 196 N 0.37 -0.45 0.00 1.57 6.17 -1.07 0.45 115.15 122.19 1sqp h HIS 196 Ca -0.06 0.06 -0.06 0.00 0.71 0.00 0.00 60.37 61.02 1sqp h HIS 196 Cb 1.37 0.29 -0.01 0.00 2.52 0.00 0.00 27.41 31.58 1sqp h HIS 196 CO 0.10 -0.29 -0.28 -0.07 0.71 0.00 0.00 177.93 178.10 1sqp h LEU 197 N -0.04 0.00 0.38 0.26 3.38 -1.13 -1.93 115.31 116.22 1sqp h LEU 197 Ca 0.28 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.23 1sqp h LEU 197 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1sqp h LEU 197 CO -0.63 0.28 -0.18 0.25 0.09 0.00 0.00 178.44 178.25 1sqp h LEU 198 N 0.00 -0.43 -0.90 1.67 5.85 0.58 -2.44 115.31 119.64 1sqp h LEU 198 Ca -0.00 0.01 0.23 0.00 0.84 0.00 0.00 57.88 58.97 1sqp h LEU 198 Cb 0.65 0.11 -0.13 0.00 0.37 0.00 0.00 40.66 41.66 1sqp h LEU 198 CO 0.04 -0.12 0.34 -0.26 -0.34 0.00 0.00 178.44 178.10 1sqp h PHE 199 N -0.89 0.55 -0.00 1.25 0.04 -1.03 -1.59 116.94 115.27 1sqp h PHE 199 Ca -0.05 0.04 0.01 0.00 2.80 0.00 0.00 57.97 60.77 1sqp h PHE 199 Cb 0.39 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 1sqp h PHE 199 CO 0.03 -0.12 -0.05 1.25 -0.60 0.00 0.00 178.31 178.81 1sqp h LEU 200 N 0.31 -0.15 -2.26 1.54 5.85 -1.40 -2.90 115.31 116.30 1sqp h LEU 200 Ca 0.57 0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.32 1sqp h LEU 200 Cb 1.13 0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1sqp h LEU 200 CO -0.58 -0.08 0.00 0.45 -0.34 0.00 0.00 178.44 177.88 1sqp h HIS 201 N -0.09 0.00 0.00 1.25 3.86 -0.78 -0.21 115.15 119.18 1sqp h HIS 201 Ca 0.02 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1sqp h HIS 201 Cb 0.12 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.59 1sqp h HIS 201 CO -0.13 0.00 -0.01 1.49 0.86 0.00 0.00 177.93 180.15 1sqp h GLU 202 N 0.00 0.00 0.00 2.45 4.57 -1.28 -3.16 114.58 117.16 1sqp h GLU 202 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1sqp h GLU 202 Cb 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1sqp h GLU 202 CO 0.00 0.01 -0.96 0.25 -1.18 0.00 0.00 179.01 177.13 1sqp n THR 203 N -3.43 0.00 0.00 0.32 -2.24 -0.57 -5.14 114.28 103.21 1sqp n THR 203 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1sqp n THR 203 Cb 0.10 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 1sqp n THR 203 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sqp n GLY 204 N 2.66 -1.19 3.78 3.38 0.00 -0.20 -4.96 105.19 108.66 1sqp n GLY 204 Ca 0.00 -1.60 -0.33 0.00 0.00 0.00 0.00 46.02 44.09 1sqp n GLY 204 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sqp s SER 205 N -2.66 5.19 0.89 1.61 0.01 -1.26 -4.83 113.70 112.64 1sqp s SER 205 Ca 0.00 1.97 -0.14 0.00 1.31 0.00 0.00 55.95 59.09 1sqp s SER 205 Cb 0.00 -2.55 0.14 0.00 0.21 0.00 0.00 66.02 63.82 1sqp s SER 205 CO 0.00 -1.57 1.24 0.21 0.41 0.00 0.00 173.24 173.53 1sqp s ASN 206 N -2.64 3.81 0.21 2.44 2.47 -1.26 -4.87 114.94 115.10 1sqp s ASN 206 Ca 0.66 0.56 0.01 0.00 0.42 0.00 0.00 52.86 54.52 1sqp s ASN 206 Cb -0.20 -0.86 -0.05 0.00 -1.45 0.00 0.00 41.25 38.70 1sqp s ASN 206 CO 0.41 -2.32 0.06 0.54 -3.72 0.00 0.00 177.10 172.08 1sqp s ASN 207 N -4.68 0.95 0.56 -4.21 2.20 -1.26 -4.88 114.94 103.62 1sqp s ASN 207 Ca 0.67 -1.29 0.34 0.00 -0.94 0.00 0.00 52.86 51.64 1sqp s ASN 207 Cb -0.08 0.19 1.47 0.00 -2.00 0.00 0.00 41.25 40.84 1sqp s ASN 207 CO 0.51 -0.69 1.78 -0.65 -2.94 0.00 0.00 177.10 175.11 1sqp h PRO 208 N 2.57 0.00 0.00 3.55 0.11 -1.94 -2.69 132.00 133.60 1sqp h PRO 208 Ca -0.37 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.53 1sqp h PRO 208 Cb 1.23 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 1sqp h PRO 208 CO 0.60 0.00 -1.19 1.79 -0.21 0.00 0.00 178.00 178.99 1sqp h THR 209 N 0.00 1.13 0.00 -1.15 1.35 -1.94 -3.41 112.91 108.90 1sqp h THR 209 Ca 0.47 -2.79 0.00 0.00 -0.55 0.00 0.00 66.41 63.54 1sqp h THR 209 Cb 2.04 2.52 0.00 0.00 -1.73 0.00 0.00 68.15 70.99 1sqp h THR 209 CO -0.00 0.64 0.00 0.61 -0.25 0.00 0.00 175.52 176.52 1sqp n GLY 210 N 1.40 1.82 3.85 5.82 0.00 -1.01 -4.35 105.19 112.72 1sqp n GLY 210 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 1sqp n GLY 210 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sqp s ILE 211 N -3.57 4.64 0.36 -0.61 1.01 -1.26 -4.59 121.20 117.17 1sqp s ILE 211 Ca 0.00 1.01 -0.27 0.00 0.00 0.00 0.00 60.65 61.38 1sqp s ILE 211 Cb 0.00 -3.63 -0.09 0.00 0.01 0.00 0.00 42.46 38.74 1sqp s ILE 211 CO 0.00 -0.30 1.24 -0.55 0.00 0.00 0.00 174.94 175.34 1sqp s SER 212 N -2.45 6.68 -0.10 3.58 0.15 -1.26 -4.74 113.70 115.56 1sqp s SER 212 Ca 0.55 2.54 0.16 0.00 0.70 0.00 0.00 55.95 59.91 1sqp s SER 212 Cb -0.10 -2.64 0.58 0.00 -1.71 0.00 0.00 66.02 62.15 1sqp s SER 212 CO 0.20 -0.58 1.49 -1.54 1.20 0.00 0.00 173.24 174.01 1sqp n SER 213 N 0.53 4.12 0.32 5.45 3.41 -1.26 -4.58 113.62 121.61 1sqp n SER 213 Ca 0.02 -2.46 0.20 0.00 -0.26 0.00 0.00 58.87 56.37 1sqp n SER 213 Cb 0.44 -0.48 1.07 0.00 -0.26 0.00 0.00 64.21 64.97 1sqp n SER 213 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1sqp h ASP 214 N 3.08 0.00 0.42 4.04 3.32 -1.99 0.13 116.42 125.43 1sqp h ASP 214 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1sqp h ASP 214 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1sqp h ASP 214 CO 0.17 0.00 -0.30 1.33 -1.72 0.00 0.00 179.24 178.72 1sqp n VAL 215 N -3.23 0.00 -2.88 -1.35 0.24 -1.26 -4.32 118.33 105.53 1sqp n VAL 215 Ca -0.02 -0.06 -0.12 0.00 -2.04 0.00 0.00 64.34 62.10 1sqp n VAL 215 Cb 0.15 0.17 0.05 0.00 -1.47 0.00 0.00 33.84 32.74 1sqp n VAL 215 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1sqp n ASP 216 N -1.10 -0.79 -4.80 -1.34 2.03 0.46 -5.13 116.55 105.87 1sqp n ASP 216 Ca 0.10 -3.20 -0.38 0.00 0.52 0.00 0.00 54.79 51.82 1sqp n ASP 216 Cb 0.33 0.67 -0.06 0.00 -0.72 0.00 0.00 41.12 41.34 1sqp n ASP 216 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1sqp s LYS 217 N -1.03 4.15 0.18 -0.67 -0.14 -1.14 -2.73 119.74 118.35 1sqp s LYS 217 Ca 0.29 0.62 0.11 0.00 -1.36 0.00 0.00 55.97 55.63 1sqp s LYS 217 Cb 0.34 -3.26 -0.04 0.00 -1.68 0.00 0.00 37.83 33.19 1sqp s LYS 217 CO -0.06 0.58 -0.24 0.96 -0.76 0.00 0.00 175.35 175.83 1sqp s ILE 218 N -0.84 2.28 0.10 2.17 -4.36 0.18 -4.89 121.20 115.83 1sqp s ILE 218 Ca 0.28 -1.96 -0.30 0.00 -0.26 0.00 0.00 60.65 58.40 1sqp s ILE 218 Cb -0.18 -2.06 -0.06 0.00 1.25 0.00 0.00 42.46 41.40 1sqp s ILE 218 CO 0.16 -0.09 1.14 -2.16 0.24 0.00 0.00 174.94 174.23 1sqp s PRO 219 N -2.55 4.51 0.55 0.37 0.04 -1.26 -0.52 135.00 136.14 1sqp s PRO 219 Ca 0.19 1.71 0.38 0.00 0.04 0.00 0.00 61.00 63.31 1sqp s PRO 219 Cb -0.08 -3.33 1.54 0.00 0.04 0.00 0.00 34.50 32.67 1sqp s PRO 219 CO 0.09 -0.11 1.75 0.35 0.04 0.00 0.00 177.00 179.12 1sqp h PHE 220 N 6.15 0.00 -3.63 0.56 3.04 -0.99 -3.34 116.94 118.73 1sqp h PHE 220 Ca -0.43 0.00 -0.67 0.00 3.98 0.00 0.00 57.97 60.85 1sqp h PHE 220 Cb 1.21 0.00 -0.23 0.00 2.56 0.00 0.00 35.95 39.49 1sqp h PHE 220 CO 0.65 0.00 -0.74 -1.58 -2.02 0.00 0.00 178.31 174.63 1sqp s HIS 221 N -4.88 2.83 -0.91 0.41 2.46 -0.82 -1.19 115.29 113.19 1sqp s HIS 221 Ca -0.05 -0.28 0.25 0.00 0.47 0.00 0.00 55.06 55.45 1sqp s HIS 221 Cb 0.23 -1.76 0.51 0.00 -0.13 0.00 0.00 32.58 31.43 1sqp s HIS 221 CO 0.78 0.07 1.42 -0.35 -2.47 0.00 0.00 174.74 174.20 1sqp n PRO 222 N 2.81 0.07 -0.02 2.88 -0.04 -1.25 -4.91 135.00 134.53 1sqp n PRO 222 Ca -0.18 0.02 -0.09 0.00 -0.04 0.00 0.00 63.50 63.21 1sqp n PRO 222 Cb 0.53 -1.54 -0.03 0.00 -0.04 0.00 0.00 33.50 32.41 1sqp n PRO 222 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1sqp h TYR 223 N 0.00 -0.17 0.00 0.54 0.05 -1.68 -0.32 116.97 115.39 1sqp h TYR 223 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1sqp h TYR 223 Cb 0.56 0.10 0.00 0.00 1.01 0.00 0.00 36.73 38.40 1sqp h TYR 223 CO 0.00 -0.12 -0.76 0.66 -1.05 0.00 0.00 178.16 176.89 1sqp n TYR 224 N -5.22 0.41 0.04 4.88 4.01 -0.33 -1.96 117.16 119.00 1sqp n TYR 224 Ca -0.03 0.12 -0.13 0.00 -0.16 0.00 0.00 57.90 57.70 1sqp n TYR 224 Cb 0.14 -0.55 -0.08 0.00 -0.31 0.00 0.00 39.34 38.54 1sqp n TYR 224 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1sqp h THR 225 N 0.00 1.08 -0.05 -0.72 2.02 -0.79 -1.31 112.91 113.15 1sqp h THR 225 Ca 0.00 -0.40 -0.18 0.00 0.77 0.00 0.00 66.41 66.60 1sqp h THR 225 Cb 0.72 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 68.47 1sqp h THR 225 CO 0.00 0.10 -0.75 -0.29 0.37 0.00 0.00 175.52 174.95 1sqp h ILE 226 N -0.24 1.42 -0.21 3.11 6.09 -1.13 -0.42 117.51 126.11 1sqp h ILE 226 Ca -0.01 -2.26 -0.09 0.00 -1.37 0.00 0.00 64.86 61.13 1sqp h ILE 226 Cb 0.22 2.21 -0.01 0.00 0.47 0.00 0.00 36.82 39.70 1sqp h ILE 226 CO 0.01 0.67 -0.28 0.50 -3.07 0.00 0.00 178.15 175.98 1sqp h LYS 227 N 0.19 0.41 0.02 2.19 3.64 -1.44 -1.19 116.57 120.40 1sqp h LYS 227 Ca -0.03 -0.16 -0.20 0.00 -1.27 0.00 0.00 60.65 58.99 1sqp h LYS 227 Cb 1.33 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.11 1sqp h LYS 227 CO 0.12 0.66 -0.95 -0.44 -2.27 0.00 0.00 179.45 176.57 1sqp h ASP 228 N 0.36 0.13 -0.20 4.20 5.19 -1.02 -2.24 116.42 122.85 1sqp h ASP 228 Ca 0.05 -0.12 -0.01 0.00 -0.62 0.00 0.00 57.03 56.33 1sqp h ASP 228 Cb 0.68 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.14 1sqp h ASP 228 CO 0.05 1.00 0.07 0.40 -3.12 0.00 0.00 179.24 177.64 1sqp h ILE 229 N 0.04 1.17 -0.52 0.35 1.08 -0.84 -0.83 117.51 117.97 1sqp h ILE 229 Ca -0.04 -0.53 -0.02 0.00 -0.39 0.00 0.00 64.86 63.89 1sqp h ILE 229 Cb 1.63 1.15 -0.02 0.00 -3.07 0.00 0.00 36.82 36.51 1sqp h ILE 229 CO 0.13 0.17 0.24 0.25 -0.69 0.00 0.00 178.15 178.25 1sqp h LEU 230 N 0.16 0.68 -1.15 1.44 5.85 -1.27 -2.74 115.31 118.27 1sqp h LEU 230 Ca 0.07 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 1sqp h LEU 230 Cb 0.19 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1sqp h LEU 230 CO -0.00 0.63 0.24 1.23 -0.34 0.00 0.00 178.44 180.19 1sqp h GLY 231 N 0.69 0.90 1.81 3.75 0.00 -1.33 -2.52 103.07 106.37 1sqp h GLY 231 Ca 0.18 -0.45 -0.11 0.00 0.00 0.00 0.00 47.33 46.95 1sqp h GLY 231 CO -0.02 0.42 -0.45 0.00 0.00 0.00 0.00 176.54 176.49 1sqp h ALA 232 N 1.44 1.08 -0.70 3.60 0.00 -0.97 -2.42 119.26 121.28 1sqp h ALA 232 Ca 0.20 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 1sqp h ALA 232 Cb 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1sqp h ALA 232 CO -0.02 0.61 0.19 1.25 0.00 0.00 0.00 179.25 181.29 1sqp h LEU 233 N 0.17 1.04 -0.79 0.00 5.85 -1.16 -1.30 115.31 119.12 1sqp h LEU 233 Ca 0.01 -0.20 -0.09 0.00 0.84 0.00 0.00 57.88 58.44 1sqp h LEU 233 Cb 0.87 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 1sqp h LEU 233 CO 0.07 0.98 -0.03 -0.07 -0.34 0.00 0.00 178.44 179.05 1sqp h LEU 234 N 1.05 0.86 -0.37 2.25 3.38 -1.28 -1.63 115.31 119.58 1sqp h LEU 234 Ca 0.22 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1sqp h LEU 234 Cb 0.33 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1sqp h LEU 234 CO -0.00 0.94 0.19 0.25 0.09 0.00 0.00 178.44 179.90 1sqp h LEU 235 N 0.82 0.48 -0.80 1.67 5.85 -1.10 -0.12 115.31 122.10 1sqp h LEU 235 Ca 0.15 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1sqp h LEU 235 Cb 0.52 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1sqp h LEU 235 CO 0.03 0.46 0.37 0.40 -0.34 0.00 0.00 178.44 179.36 1sqp h ILE 236 N 0.47 1.25 0.13 4.05 1.08 -1.15 0.24 117.51 123.58 1sqp h ILE 236 Ca 0.13 -0.74 0.02 0.00 -0.39 0.00 0.00 64.86 63.88 1sqp h ILE 236 Cb 0.10 0.26 -0.03 0.00 -3.07 0.00 0.00 36.82 34.08 1sqp h ILE 236 CO -0.02 0.31 -0.24 0.25 -0.69 0.00 0.00 178.15 177.76 1sqp h LEU 237 N 1.14 -0.69 -0.96 1.44 6.46 -0.91 0.70 115.31 122.49 1sqp h LEU 237 Ca 0.27 0.08 -0.06 0.00 -0.12 0.00 0.00 57.88 58.06 1sqp h LEU 237 Cb 0.15 0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 40.31 1sqp h LEU 237 CO -0.03 -0.33 0.13 0.00 -0.62 0.00 0.00 178.44 177.59 1sqp h ALA 238 N 0.30 1.16 -0.18 1.25 0.00 -0.81 0.72 119.26 121.69 1sqp h ALA 238 Ca 0.03 -0.22 -0.20 0.00 0.00 0.00 0.00 54.91 54.52 1sqp h ALA 238 Cb 0.47 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1sqp h ALA 238 CO -0.13 0.57 -0.70 1.25 0.00 0.00 0.00 179.25 180.24 1sqp h LEU 239 N 0.85 0.85 0.00 0.00 7.12 -0.22 -3.15 115.31 120.77 1sqp h LEU 239 Ca 0.18 -0.52 -0.22 0.00 0.13 0.00 0.00 57.88 57.45 1sqp h LEU 239 Cb 0.32 -0.25 -0.03 0.00 -0.53 0.00 0.00 40.66 40.16 1sqp h LEU 239 CO -0.00 1.31 -1.15 0.24 -0.13 0.00 0.00 178.44 178.70 1sqp h MET 240 N 0.52 0.00 -0.70 1.25 2.86 0.64 -2.30 114.93 117.19 1sqp h MET 240 Ca -0.03 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.57 1sqp h MET 240 Cb 1.31 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.94 1sqp h MET 240 CO 0.14 0.84 0.28 1.25 1.06 0.00 0.00 176.91 180.49 1sqp h LEU 241 N 0.00 0.95 -1.42 1.22 6.46 -0.99 0.95 115.31 122.48 1sqp h LEU 241 Ca -0.08 -0.13 -0.03 0.00 -0.12 0.00 0.00 57.88 57.51 1sqp h LEU 241 Cb 1.81 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 41.49 1sqp h LEU 241 CO 0.11 0.84 -0.16 -0.07 -0.62 0.00 0.00 178.44 178.55 1sqp h LEU 242 N 1.01 0.00 0.02 2.25 4.07 -1.49 -2.32 115.31 118.86 1sqp h LEU 242 Ca 0.24 0.00 -0.39 0.00 0.08 0.00 0.00 57.88 57.81 1sqp h LEU 242 Cb 0.19 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 41.87 1sqp h LEU 242 CO -0.02 0.16 -2.37 0.52 -1.08 0.00 0.00 178.44 175.65 1sqp n VAL 243 N -3.39 1.55 1.19 1.22 0.31 -0.88 -2.59 118.33 115.74 1sqp n VAL 243 Ca -0.00 -0.56 0.12 0.00 -0.01 0.00 0.00 64.34 63.89 1sqp n VAL 243 Cb 0.35 -1.54 0.26 0.00 -0.91 0.00 0.00 33.84 32.01 1sqp n VAL 243 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1sqp n LEU 244 N -3.42 1.57 0.00 7.52 4.77 0.30 -4.22 117.00 123.52 1sqp n LEU 244 Ca -0.44 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.03 1sqp n LEU 244 Cb 0.98 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 42.02 1sqp n LEU 244 CO 0.27 0.28 -0.29 0.49 -1.33 0.00 0.00 177.39 176.81 1sqp n PHE 245 N -0.16 0.00 -3.19 -1.77 3.72 -0.88 -4.98 117.46 110.20 1sqp n PHE 245 Ca 0.12 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.30 1sqp n PHE 245 Cb 0.41 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.89 1sqp n PHE 245 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1sqp n ALA 246 N -2.06 2.52 0.31 4.37 0.00 -1.20 -4.98 120.51 119.49 1sqp n ALA 246 Ca 0.00 -3.58 0.11 0.00 0.00 0.00 0.00 53.44 49.97 1sqp n ALA 246 Cb 0.29 -0.86 0.49 0.00 0.00 0.00 0.00 19.45 19.38 1sqp n ALA 246 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1sqp n PRO 247 N 0.83 0.16 0.00 0.00 -0.02 -1.07 -2.49 135.00 132.41 1sqp n PRO 247 Ca 0.24 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1sqp n PRO 247 Cb 0.56 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 1sqp n PRO 247 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1sqp n ASP 248 N -2.18 1.48 -0.30 2.55 8.00 -1.26 -4.75 116.55 120.09 1sqp n ASP 248 Ca 0.01 -1.62 0.05 0.00 0.71 0.00 0.00 54.79 53.94 1sqp n ASP 248 Cb 0.16 0.00 0.20 0.00 -0.02 0.00 0.00 41.12 41.46 1sqp n ASP 248 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1sqp h LEU 249 N 0.00 0.62 -0.14 0.64 5.85 -1.83 0.24 115.31 120.69 1sqp h LEU 249 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1sqp h LEU 249 Cb 0.43 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1sqp h LEU 249 CO 0.00 0.31 -0.36 0.18 -0.34 0.00 0.00 178.44 178.23 1sqp n LEU 250 N -4.80 0.59 -4.86 2.25 7.99 -1.26 -4.90 117.00 112.00 1sqp n LEU 250 Ca 0.16 -0.02 -0.35 0.00 -0.01 0.00 0.00 56.01 55.79 1sqp n LEU 250 Cb 0.36 -0.23 -0.05 0.00 -0.11 0.00 0.00 43.42 43.39 1sqp n LEU 250 CO 0.24 0.13 0.10 -0.83 -1.51 0.00 0.00 177.39 175.51 1sqp s GLY 251 N -2.83 2.36 -0.17 -0.72 0.00 0.85 -4.64 107.32 102.18 1sqp s GLY 251 Ca 0.16 -0.35 -0.21 0.00 0.00 0.00 0.00 44.72 44.32 1sqp s GLY 251 CO 0.62 -0.12 0.64 -0.35 0.00 0.00 0.00 173.10 173.89 1sqp s ASP 252 N -1.76 6.75 0.55 1.64 -1.08 -1.26 -4.95 116.67 116.56 1sqp s ASP 252 Ca 0.34 0.91 0.25 0.00 -0.52 0.00 0.00 52.55 53.53 1sqp s ASP 252 Cb -0.14 -2.36 1.48 0.00 -1.46 0.00 0.00 42.92 40.44 1sqp s ASP 252 CO 0.18 -0.23 2.08 -0.65 0.52 0.00 0.00 175.17 177.08 1sqp h PRO 253 N 7.28 0.00 -0.49 4.34 0.11 -1.98 -2.89 132.00 138.37 1sqp h PRO 253 Ca -0.34 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.83 1sqp h PRO 253 Cb 1.15 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 1sqp h PRO 253 CO 0.77 0.00 0.33 -0.44 -0.21 0.00 0.00 178.00 178.45 1sqp h ASP 254 N 0.00 0.39 0.14 -2.05 3.32 -1.95 -1.61 116.42 114.65 1sqp h ASP 254 Ca 0.11 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1sqp h ASP 254 Cb 0.52 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1sqp h ASP 254 CO -0.00 0.26 0.00 -3.20 -1.72 0.00 0.00 179.24 174.58 1sqp n ASN 255 N -4.48 0.00 -0.89 6.45 5.15 -1.09 -2.04 115.26 118.37 1sqp n ASN 255 Ca 0.06 -0.01 0.10 0.00 -0.60 0.00 0.00 54.58 54.14 1sqp n ASN 255 Cb 0.22 -0.20 0.28 0.00 -0.53 0.00 0.00 39.78 39.55 1sqp n ASN 255 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1sqp n TYR 256 N -1.20 0.44 -5.09 1.20 4.02 -0.61 -4.29 117.16 111.63 1sqp n TYR 256 Ca 0.06 -0.22 -0.30 0.00 -0.01 0.00 0.00 57.90 57.43 1sqp n TYR 256 Cb 0.07 0.00 -0.17 0.00 -0.02 0.00 0.00 39.34 39.22 1sqp n TYR 256 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1sqp s THR 257 N -1.56 1.86 0.54 -0.72 -4.23 -0.86 -5.06 115.64 105.61 1sqp s THR 257 Ca 0.35 -0.91 -0.20 0.00 -1.18 0.00 0.00 61.69 59.76 1sqp s THR 257 Cb 0.20 -1.62 -0.08 0.00 1.34 0.00 0.00 72.50 72.34 1sqp s THR 257 CO 0.28 0.52 0.81 -2.65 -0.54 0.00 0.00 174.62 173.03 1sqp n PRO 258 N 3.55 0.85 -1.70 3.99 -0.02 -1.26 -1.21 135.00 139.19 1sqp n PRO 258 Ca -0.20 0.32 -0.44 0.00 -2.02 0.00 0.00 63.50 61.17 1sqp n PRO 258 Cb 0.53 -1.95 -0.03 0.00 -0.02 0.00 0.00 33.50 32.03 1sqp n PRO 258 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1sqp n ALA 259 N -1.41 1.84 -3.92 3.55 0.00 -0.52 -4.43 120.51 115.62 1sqp n ALA 259 Ca 0.12 0.41 -0.30 0.00 0.00 0.00 0.00 53.44 53.66 1sqp n ALA 259 Cb 0.45 -2.38 -0.15 0.00 0.00 0.00 0.00 19.45 17.36 1sqp n ALA 259 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1sqp s ASN 260 N 0.60 3.92 0.00 0.00 3.84 -1.26 -4.98 114.94 117.06 1sqp s ASN 260 Ca 0.70 -1.30 0.13 0.00 0.21 0.00 0.00 52.86 52.60 1sqp s ASN 260 Cb -0.59 -1.17 0.66 0.00 -0.55 0.00 0.00 41.25 39.60 1sqp s ASN 260 CO 0.44 -0.27 1.33 -2.65 -2.79 0.00 0.00 177.10 173.16 1sqp n PRO 261 N 4.66 0.20 -0.06 0.43 -0.02 -1.26 -3.59 135.00 135.36 1sqp n PRO 261 Ca -0.10 0.16 -0.07 0.00 -2.02 0.00 0.00 63.50 61.47 1sqp n PRO 261 Cb 0.44 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.39 1sqp n PRO 261 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1sqp n LEU 262 N -1.27 1.70 -4.59 2.45 4.77 -1.26 -4.91 117.00 113.90 1sqp n LEU 262 Ca 0.06 0.28 -0.42 0.00 -0.03 0.00 0.00 56.01 55.91 1sqp n LEU 262 Cb 0.10 -0.65 -0.03 0.00 -2.33 0.00 0.00 43.42 40.51 1sqp n LEU 262 CO 0.10 -0.37 1.42 0.21 -1.33 0.00 0.00 177.39 177.41 1sqp s ASN 263 N -5.85 5.93 -0.19 -1.43 2.47 -1.24 -5.00 114.94 109.65 1sqp s ASN 263 Ca -0.22 0.80 -0.12 0.00 0.42 0.00 0.00 52.86 53.73 1sqp s ASN 263 Cb 0.03 -2.53 -0.05 0.00 -1.45 0.00 0.00 41.25 37.25 1sqp s ASN 263 CO 0.33 -1.77 0.22 0.28 -3.72 0.00 0.00 177.10 172.45 1sqp s THR 264 N 6.77 5.34 0.86 -5.21 -1.32 -1.26 -4.66 115.64 116.17 1sqp s THR 264 Ca 0.67 0.39 -0.11 0.00 -1.21 0.00 0.00 61.69 61.43 1sqp s THR 264 Cb -0.16 -3.56 0.11 0.00 -1.51 0.00 0.00 72.50 67.38 1sqp s THR 264 CO 0.29 0.40 1.11 -2.84 -2.21 0.00 0.00 174.62 171.37 1sqp s PRO 265 N 0.54 1.49 -0.00 7.08 0.02 -1.26 -5.00 135.00 137.87 1sqp s PRO 265 Ca 0.13 1.26 -0.25 0.00 0.02 0.00 0.00 61.00 62.16 1sqp s PRO 265 Cb -0.12 -1.80 -0.19 0.00 0.02 0.00 0.00 34.50 32.41 1sqp s PRO 265 CO 0.02 -2.21 1.30 -1.35 -0.33 0.00 0.00 177.00 174.43 1sqp h PRO 266 N -1.55 -0.08 -5.72 5.54 0.11 -2.05 -3.43 132.00 124.82 1sqp h PRO 266 Ca -0.45 0.01 -0.66 0.00 0.11 0.00 0.00 66.00 65.01 1sqp h PRO 266 Cb 1.26 0.02 -0.07 0.00 0.11 0.00 0.00 31.00 32.32 1sqp h PRO 266 CO 0.48 0.32 -0.43 -3.38 -0.21 0.00 0.00 178.00 174.78 1sqp s HIS 267 N -4.53 3.62 -0.78 0.65 -3.43 -1.26 -5.06 115.29 104.50 1sqp s HIS 267 Ca -0.15 0.62 -0.02 0.00 -0.80 0.00 0.00 55.06 54.70 1sqp s HIS 267 Cb 0.02 -2.00 0.20 0.00 -1.43 0.00 0.00 32.58 29.36 1sqp s HIS 267 CO 0.64 0.72 0.64 0.42 -2.00 0.00 0.00 174.74 175.16 1sqp s ILE 268 N -1.05 4.06 -0.44 -5.38 1.09 -1.26 -5.07 121.20 113.15 1sqp s ILE 268 Ca 0.17 -3.54 -0.16 0.00 -1.10 0.00 0.00 60.65 56.02 1sqp s ILE 268 Cb -0.13 -3.57 0.04 0.00 -1.06 0.00 0.00 42.46 37.74 1sqp s ILE 268 CO 0.06 -1.01 0.39 -0.75 -0.10 0.00 0.00 174.94 173.54 1sqp s LYS 269 N -0.86 3.02 0.91 2.79 2.20 -1.26 -5.03 119.74 121.51 1sqp s LYS 269 Ca 0.23 -1.04 -0.12 0.00 -0.36 0.00 0.00 55.97 54.68 1sqp s LYS 269 Cb -0.12 -4.03 0.09 0.00 -1.51 0.00 0.00 37.83 32.26 1sqp s LYS 269 CO -0.09 -0.90 0.85 -2.30 -0.36 0.00 0.00 175.35 172.55 1sqp n PRO 270 N 5.37 -0.31 -2.02 4.03 -0.02 -1.26 -4.94 135.00 135.85 1sqp n PRO 270 Ca -0.10 -0.03 -0.39 0.00 -2.02 0.00 0.00 63.50 60.95 1sqp n PRO 270 Cb 0.46 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1sqp n PRO 270 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1sqp s GLU 271 N -4.14 3.84 0.45 -0.52 0.41 -1.26 -4.88 118.70 112.59 1sqp s GLU 271 Ca 0.64 2.16 0.35 0.00 -0.41 0.00 0.00 54.97 57.70 1sqp s GLU 271 Cb -0.23 -2.67 1.51 0.00 -1.78 0.00 0.00 34.13 30.96 1sqp s GLU 271 CO 0.61 -0.60 1.53 -2.67 -0.49 0.00 0.00 175.26 173.64 1sqp n TRP 272 N -0.07 0.58 0.76 1.61 4.27 -1.26 -0.88 117.44 122.45 1sqp n TRP 272 Ca 0.05 0.59 0.08 0.00 -3.89 0.00 0.00 57.50 54.33 1sqp n TRP 272 Cb 0.44 -1.03 0.42 0.00 -1.36 0.00 0.00 31.31 29.78 1sqp n TRP 272 CO 0.00 0.00 0.00 2.48 -2.29 0.00 0.00 177.69 177.88 1sqp n TYR 273 N -4.55 0.00 0.49 -2.67 0.18 -1.26 -2.22 117.16 107.12 1sqp n TYR 273 Ca 0.40 0.00 0.05 0.00 1.88 0.00 0.00 57.90 60.24 1sqp n TYR 273 Cb 1.61 -0.34 -0.01 0.00 -0.38 0.00 0.00 39.34 40.22 1sqp n TYR 273 CO 0.00 0.00 0.00 1.19 -2.08 0.00 0.00 176.86 175.97 1sqp n PHE 274 N -1.34 0.00 -0.14 -3.48 3.72 -0.06 -4.79 117.46 111.38 1sqp n PHE 274 Ca 0.07 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.38 1sqp n PHE 274 Cb 0.15 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.69 1sqp n PHE 274 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1sqp h LEU 275 N 1.03 0.54 -0.84 4.37 3.38 -1.54 0.22 115.31 122.47 1sqp h LEU 275 Ca 0.00 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 57.86 1sqp h LEU 275 Cb 0.35 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 1sqp h LEU 275 CO 0.00 0.54 0.53 2.19 0.09 0.00 0.00 178.44 181.79 1sqp h PHE 276 N 0.51 1.00 -0.11 1.13 -5.15 -1.77 -0.80 116.94 111.74 1sqp h PHE 276 Ca 0.14 0.03 -0.22 0.00 -0.20 0.00 0.00 57.97 57.71 1sqp h PHE 276 Cb 0.15 -0.33 0.01 0.00 0.22 0.00 0.00 35.95 36.00 1sqp h PHE 276 CO -0.01 0.56 -0.82 0.00 -2.00 0.00 0.00 178.31 176.05 1sqp h ALA 277 N 1.36 0.34 -0.37 12.09 0.00 -1.75 -1.98 119.26 128.95 1sqp h ALA 277 Ca 0.34 -0.62 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1sqp h ALA 277 Cb 0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1sqp h ALA 277 CO -0.13 0.71 0.23 -0.92 0.00 0.00 0.00 179.25 179.15 1sqp h TYR 278 N 0.46 0.44 0.24 0.00 3.20 -0.47 -2.37 116.97 118.47 1sqp h TYR 278 Ca -0.06 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.83 1sqp h TYR 278 Cb 1.44 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 39.54 1sqp h TYR 278 CO 0.08 0.27 -0.30 0.00 -1.64 0.00 0.00 178.16 176.57 1sqp h ALA 279 N 1.14 -0.60 -0.80 1.82 0.00 -1.03 0.34 119.26 120.14 1sqp h ALA 279 Ca 0.14 -0.08 0.16 0.00 0.00 0.00 0.00 54.91 55.12 1sqp h ALA 279 Cb -0.04 0.45 -0.10 0.00 0.00 0.00 0.00 17.79 18.10 1sqp h ALA 279 CO -0.04 -0.88 0.35 0.82 0.00 0.00 0.00 179.25 179.50 1sqp h ILE 280 N -0.60 0.64 -0.16 0.00 2.04 -1.35 -1.79 117.51 116.30 1sqp h ILE 280 Ca 0.00 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 1sqp h ILE 280 Cb 0.57 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1sqp h ILE 280 CO -0.10 0.09 -0.01 0.25 0.00 0.00 0.00 178.15 178.38 1sqp h LEU 281 N 0.48 0.28 -1.26 1.44 5.85 -0.89 -3.20 115.31 118.01 1sqp h LEU 281 Ca 0.45 -0.33 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 1sqp h LEU 281 Cb 0.71 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1sqp h LEU 281 CO -0.42 0.55 -0.20 0.03 -0.34 0.00 0.00 178.44 178.06 1sqp h ARG 282 N 0.02 0.00 -0.53 1.25 3.08 -0.17 -3.24 114.38 114.79 1sqp h ARG 282 Ca 0.04 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.98 1sqp h ARG 282 Cb 0.41 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 1sqp h ARG 282 CO 0.01 0.20 -0.11 0.77 -1.07 0.00 0.00 179.97 179.77 1sqp h SER 283 N 0.00 0.99 -3.33 7.04 0.02 -1.34 -3.42 113.55 113.51 1sqp h SER 283 Ca -0.00 -0.32 -0.57 0.00 -0.84 0.00 0.00 61.79 60.06 1sqp h SER 283 Cb 0.67 -0.27 -0.05 0.00 0.14 0.00 0.00 62.40 62.89 1sqp h SER 283 CO 0.03 1.10 0.32 -0.51 -1.14 0.00 0.00 176.83 176.63 1sqp s ILE 284 N -4.84 4.91 0.09 3.27 2.07 -1.22 -4.84 121.20 120.64 1sqp s ILE 284 Ca -0.11 1.68 -0.17 0.00 -1.41 0.00 0.00 60.65 60.64 1sqp s ILE 284 Cb 0.13 -4.16 -0.08 0.00 0.13 0.00 0.00 42.46 38.49 1sqp s ILE 284 CO 0.86 0.10 1.48 -0.65 -1.91 0.00 0.00 174.94 174.82 1sqp h PRO 285 N 7.08 0.54 -6.99 3.50 0.11 -1.88 -3.43 132.00 130.94 1sqp h PRO 285 Ca -0.34 -0.21 -0.55 0.00 0.11 0.00 0.00 66.00 65.00 1sqp h PRO 285 Cb 1.16 -0.03 0.13 0.00 0.11 0.00 0.00 31.00 32.38 1sqp h PRO 285 CO 0.80 0.76 0.61 -1.71 -0.21 0.00 0.00 178.00 178.25 1sqp n ASN 286 N -4.50 2.84 0.19 -2.05 5.15 -1.26 -4.92 115.26 110.71 1sqp n ASN 286 Ca -0.03 1.04 -0.13 0.00 -0.60 0.00 0.00 54.58 54.85 1sqp n ASN 286 Cb 0.32 -1.57 -0.08 0.00 -0.53 0.00 0.00 39.78 37.92 1sqp n ASN 286 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1sqp h LYS 287 N 1.78 -0.48 -0.48 1.20 1.57 -1.99 -2.10 116.57 116.08 1sqp h LYS 287 Ca -0.50 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.30 1sqp h LYS 287 Cb 1.29 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.69 1sqp h LYS 287 CO 0.59 -0.17 0.25 1.25 -0.57 0.00 0.00 179.45 180.79 1sqp h LEU 288 N -0.85 0.61 -0.89 2.94 6.46 -1.92 -2.86 115.31 118.79 1sqp h LEU 288 Ca -0.05 -0.11 -0.10 0.00 -0.12 0.00 0.00 57.88 57.50 1sqp h LEU 288 Cb 0.54 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.30 1sqp h LEU 288 CO 0.08 0.54 -0.23 1.23 -0.62 0.00 0.00 178.44 179.45 1sqp h GLY 289 N 0.63 0.61 0.79 3.75 0.00 -1.97 -2.04 103.07 104.84 1sqp h GLY 289 Ca 0.17 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1sqp h GLY 289 CO -0.02 0.45 -0.18 -1.33 0.00 0.00 0.00 176.54 175.45 1sqp h GLY 290 N 1.00 -0.40 1.01 4.60 0.00 -1.15 -0.26 103.07 107.87 1sqp h GLY 290 Ca 0.07 0.21 -0.07 0.00 0.00 0.00 0.00 47.33 47.55 1sqp h GLY 290 CO 0.05 -0.18 0.08 -2.08 0.00 0.00 0.00 176.54 174.40 1sqp h VAL 291 N -0.41 1.25 0.00 4.60 2.07 -1.47 -1.12 116.25 121.17 1sqp h VAL 291 Ca -0.00 -0.98 -0.05 0.00 0.82 0.00 0.00 66.70 66.49 1sqp h VAL 291 Cb 0.38 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1sqp h VAL 291 CO -0.04 0.35 -0.24 -0.07 0.02 0.00 0.00 177.57 177.59 1sqp h LEU 292 N 0.78 0.00 -0.00 2.57 3.38 -1.28 0.72 115.31 121.48 1sqp h LEU 292 Ca 0.16 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.87 1sqp h LEU 292 Cb 0.42 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.18 1sqp h LEU 292 CO 0.01 0.24 -1.12 0.00 0.09 0.00 0.00 178.44 177.66 1sqp h ALA 293 N 1.76 0.18 -0.14 1.53 0.00 -0.61 -0.65 119.26 121.33 1sqp h ALA 293 Ca -0.00 -0.78 -0.01 0.00 0.00 0.00 0.00 54.91 54.12 1sqp h ALA 293 Cb 0.54 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1sqp h ALA 293 CO 0.03 0.82 0.05 1.25 0.00 0.00 0.00 179.25 181.40 1sqp h LEU 294 N 0.20 0.20 -0.12 0.00 5.85 -0.63 0.35 115.31 121.16 1sqp h LEU 294 Ca -0.13 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.45 1sqp h LEU 294 Cb 1.79 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 42.73 1sqp h LEU 294 CO 0.20 0.32 -0.14 0.00 -0.34 0.00 0.00 178.44 178.49 1sqp h ALA 295 N 0.88 -0.06 -0.12 1.25 0.00 -0.94 -2.60 119.26 117.68 1sqp h ALA 295 Ca 0.05 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1sqp h ALA 295 Cb 0.19 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1sqp h ALA 295 CO -0.00 -0.59 0.03 0.35 0.00 0.00 0.00 179.25 179.04 1sqp h PHE 296 N -0.17 0.16 -0.11 0.00 3.04 -0.97 -1.98 116.94 116.91 1sqp h PHE 296 Ca 0.09 -0.00 0.03 0.00 3.98 0.00 0.00 57.97 62.07 1sqp h PHE 296 Cb 0.30 -0.05 -0.00 0.00 2.56 0.00 0.00 35.95 38.75 1sqp h PHE 296 CO -0.25 0.14 0.09 1.03 -2.02 0.00 0.00 178.31 177.30 1sqp h SER 297 N 0.16 0.00 0.00 0.41 0.87 -0.51 -1.18 113.55 113.30 1sqp h SER 297 Ca 0.04 0.00 -0.33 0.00 -1.23 0.00 0.00 61.79 60.27 1sqp h SER 297 Cb 0.06 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 61.97 1sqp h SER 297 CO -0.00 0.00 -2.14 -0.38 -0.53 0.00 0.00 176.83 173.77 1sqp n ILE 298 N -4.35 1.13 0.13 2.23 2.08 -0.91 -4.58 119.36 115.09 1sqp n ILE 298 Ca -0.00 -0.34 0.07 0.00 0.56 0.00 0.00 62.75 63.04 1sqp n ILE 298 Cb 0.21 -1.56 0.39 0.00 -0.75 0.00 0.00 39.64 37.93 1sqp n ILE 298 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1sqp n LEU 299 N -3.60 0.37 -0.17 1.39 4.77 -0.79 -1.85 117.00 117.12 1sqp n LEU 299 Ca -0.39 0.67 0.10 0.00 -0.03 0.00 0.00 56.01 56.37 1sqp n LEU 299 Cb 0.82 -0.71 0.42 0.00 -2.33 0.00 0.00 43.42 41.63 1sqp n LEU 299 CO 0.09 -0.77 1.21 -0.29 -1.33 0.00 0.00 177.39 176.29 1sqp h ILE 300 N 0.00 0.92 0.00 -0.08 6.09 -1.46 -2.53 117.51 120.45 1sqp h ILE 300 Ca 0.00 -0.20 -0.01 0.00 -1.37 0.00 0.00 64.86 63.28 1sqp h ILE 300 Cb 0.02 0.27 -0.00 0.00 0.47 0.00 0.00 36.82 37.59 1sqp h ILE 300 CO 0.00 0.11 -0.03 -0.07 -3.07 0.00 0.00 178.15 175.09 1sqp h LEU 301 N 0.59 0.00 -1.03 2.19 3.38 -1.66 0.43 115.31 119.22 1sqp h LEU 301 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1sqp h LEU 301 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1sqp h LEU 301 CO -0.12 0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.44 1sqp h ALA 302 N 1.97 1.00 0.00 1.53 0.00 -1.67 -3.05 119.26 119.04 1sqp h ALA 302 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.64 1sqp h ALA 302 Cb 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 1sqp h ALA 302 CO 0.00 0.00 -1.56 -0.07 0.00 0.00 0.00 179.25 177.62 1sqp h LEU 303 N 0.00 0.00 -0.76 0.00 3.38 -0.24 -3.42 115.31 114.27 1sqp h LEU 303 Ca 0.00 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.12 1sqp h LEU 303 Cb 0.45 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.05 1sqp h LEU 303 CO 0.00 0.99 -0.18 0.40 0.09 0.00 0.00 178.44 179.73 1sqp h ILE 304 N 0.00 0.24 -0.84 1.22 2.04 -1.40 0.17 117.51 118.95 1sqp h ILE 304 Ca -0.23 -0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.76 1sqp h ILE 304 Cb 1.95 0.24 -0.09 0.00 -0.74 0.00 0.00 36.82 38.18 1sqp h ILE 304 CO 0.09 0.00 0.44 1.55 0.00 0.00 0.00 178.15 180.23 1sqp h PRO 305 N 0.00 0.64 0.00 2.37 0.13 -1.81 -0.88 132.00 132.45 1sqp h PRO 305 Ca 0.37 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.46 1sqp h PRO 305 Cb 0.57 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.55 1sqp h PRO 305 CO -0.78 0.43 0.00 -0.07 -0.23 0.00 0.00 178.00 177.34 1sqp h LEU 306 N 0.66 0.00 -3.36 1.56 3.38 -0.94 -2.40 115.31 114.20 1sqp h LEU 306 Ca 0.44 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.26 1sqp h LEU 306 Cb 0.57 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.23 1sqp h LEU 306 CO -0.33 0.00 -0.01 0.18 0.09 0.00 0.00 178.44 178.37 1sqp n LEU 307 N -2.72 4.19 -4.66 1.67 4.77 -0.39 -4.92 117.00 114.95 1sqp n LEU 307 Ca -0.00 -3.55 -0.42 0.00 -0.03 0.00 0.00 56.01 52.01 1sqp n LEU 307 Cb 0.19 -0.62 -0.04 0.00 -2.33 0.00 0.00 43.42 40.62 1sqp n LEU 307 CO 0.21 1.08 0.68 -2.28 -1.33 0.00 0.00 177.39 175.75 1sqp s HIS 308 N -3.13 3.37 -0.02 -1.77 2.46 -0.89 -4.59 115.29 110.72 1sqp s HIS 308 Ca 0.45 1.25 0.05 0.00 0.47 0.00 0.00 55.06 57.28 1sqp s HIS 308 Cb 0.39 -3.07 -0.08 0.00 -0.13 0.00 0.00 32.58 29.69 1sqp s HIS 308 CO 0.03 -0.34 0.09 -2.37 -2.47 0.00 0.00 174.74 169.68 1sqp n THR 309 N 5.03 0.09 -2.46 0.89 5.66 -1.26 -5.06 114.28 117.17 1sqp n THR 309 Ca 0.06 -0.14 -0.38 0.00 -3.05 0.00 0.00 64.05 60.53 1sqp n THR 309 Cb 0.48 0.06 -0.04 0.00 -1.55 0.00 0.00 70.33 69.28 1sqp n THR 309 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1sqp s SER 310 N -2.87 6.88 0.23 1.09 0.15 -1.26 -4.66 113.70 113.26 1sqp s SER 310 Ca -0.02 2.19 0.07 0.00 0.70 0.00 0.00 55.95 58.90 1sqp s SER 310 Cb 0.03 -2.61 0.22 0.00 -1.71 0.00 0.00 66.02 61.95 1sqp s SER 310 CO 0.22 -0.41 1.53 0.50 1.20 0.00 0.00 173.24 176.28 1sqp h LYS 311 N 2.99 0.09 -7.07 5.44 1.63 -1.97 -3.43 116.57 114.24 1sqp h LYS 311 Ca -0.48 -0.07 -0.49 0.00 -0.85 0.00 0.00 60.65 58.76 1sqp h LYS 311 Cb 1.22 0.02 0.03 0.00 -0.60 0.00 0.00 32.23 32.89 1sqp h LYS 311 CO 0.64 0.74 0.26 -0.65 -3.45 0.00 0.00 179.45 176.99 1sqp s GLN 312 N -3.50 3.74 -0.16 1.90 -0.21 -1.26 -5.04 119.66 115.13 1sqp s GLN 312 Ca -0.02 0.62 -0.25 0.00 0.02 0.00 0.00 55.36 55.73 1sqp s GLN 312 Cb 0.12 -2.25 -0.24 0.00 1.00 0.00 0.00 33.01 31.64 1sqp s GLN 312 CO 0.79 -0.25 0.55 -0.09 -2.12 0.00 0.00 175.29 174.17 1sqp h ARG 313 N 0.62 0.03 -6.43 2.91 2.43 -1.84 -3.49 114.38 108.60 1sqp h ARG 313 Ca -0.46 -0.06 -0.46 0.00 -0.81 0.00 0.00 59.98 58.19 1sqp h ARG 313 Cb 1.19 0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.77 1sqp h ARG 313 CO 0.62 1.03 -0.26 0.45 -1.51 0.00 0.00 179.97 180.30 1sqp s SER 314 N -6.55 6.17 0.00 -3.80 0.15 -1.26 -3.78 113.70 104.63 1sqp s SER 314 Ca -0.22 0.22 0.28 0.00 0.70 0.00 0.00 55.95 56.93 1sqp s SER 314 Cb 0.01 -1.78 1.10 0.00 -1.71 0.00 0.00 66.02 63.64 1sqp s SER 314 CO 0.67 -0.33 1.82 0.23 1.20 0.00 0.00 173.24 176.83 1sqp n MET 315 N -1.71 0.12 -0.33 5.44 2.81 -0.05 -4.30 117.12 119.09 1sqp n MET 315 Ca -0.04 -0.03 0.20 0.00 -1.81 0.00 0.00 57.70 56.02 1sqp n MET 315 Cb 0.57 -1.50 0.42 0.00 -0.71 0.00 0.00 33.22 32.00 1sqp n MET 315 CO 0.00 0.00 0.00 1.98 1.51 0.00 0.00 175.97 179.46 1sqp h MET 316 N 0.07 0.39 -0.35 0.03 -1.53 -1.80 0.26 114.93 112.00 1sqp h MET 316 Ca 0.00 -0.02 0.00 0.00 -3.44 0.00 0.00 59.70 56.24 1sqp h MET 316 Cb 0.46 -0.09 0.00 0.00 -0.55 0.00 0.00 31.60 31.42 1sqp h MET 316 CO 0.00 0.26 0.00 1.19 0.14 0.00 0.00 176.91 178.50 1sqp n PHE 317 N -5.01 1.08 -3.88 1.39 3.72 -1.26 -4.89 117.46 108.62 1sqp n PHE 317 Ca 0.29 -0.78 -0.30 0.00 -0.05 0.00 0.00 57.45 56.60 1sqp n PHE 317 Cb 0.86 -0.30 -0.12 0.00 -0.94 0.00 0.00 39.48 38.99 1sqp n PHE 317 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1sqp s ARG 318 N -2.49 2.43 0.13 -1.08 0.52 0.92 -5.00 118.95 114.37 1sqp s ARG 318 Ca 0.42 -3.10 -0.20 0.00 -0.52 0.00 0.00 55.73 52.33 1sqp s ARG 318 Cb 0.32 -3.47 -0.03 0.00 0.52 0.00 0.00 34.95 32.28 1sqp s ARG 318 CO 0.12 -1.23 1.70 -1.35 0.02 0.00 0.00 175.30 174.56 1sqp h PRO 319 N 5.86 -0.02 -0.86 3.54 0.11 -1.90 -0.77 132.00 137.96 1sqp h PRO 319 Ca 0.08 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.23 1sqp h PRO 319 Cb 0.81 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.87 1sqp h PRO 319 CO 0.73 -0.01 0.55 -0.07 -0.21 0.00 0.00 178.00 178.98 1sqp h LEU 320 N -0.02 0.89 -0.86 2.35 3.38 -1.94 -2.41 115.31 116.70 1sqp h LEU 320 Ca 0.09 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 1sqp h LEU 320 Cb 0.15 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1sqp h LEU 320 CO -0.20 0.60 -0.20 0.28 0.09 0.00 0.00 178.44 179.01 1sqp h SER 321 N 1.04 0.62 -0.60 -0.43 0.02 -1.82 -2.09 113.55 110.29 1sqp h SER 321 Ca 0.35 -0.20 0.07 0.00 -0.84 0.00 0.00 61.79 61.17 1sqp h SER 321 Cb 0.06 -0.17 -0.06 0.00 0.14 0.00 0.00 62.40 62.38 1sqp h SER 321 CO -0.14 0.82 0.29 1.56 -1.14 0.00 0.00 176.83 178.23 1sqp h GLN 322 N 0.55 0.53 -0.30 3.45 4.20 -0.67 0.17 115.11 123.04 1sqp h GLN 322 Ca 0.09 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.71 1sqp h GLN 322 Cb 0.65 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 1sqp h GLN 322 CO 0.05 0.35 -0.03 0.00 -0.67 0.00 0.00 178.83 178.52 1sqp h LEU 324 N 0.34 0.03 -0.12 0.00 3.38 -1.07 -0.72 115.31 117.16 1sqp h LEU 324 Ca 0.08 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1sqp h LEU 324 Cb 0.50 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1sqp h LEU 324 CO 0.02 0.15 -0.10 0.15 0.09 0.00 0.00 178.44 178.75 1sqp h PHE 325 N 0.04 0.33 0.00 1.13 3.57 -0.17 -2.43 116.94 119.42 1sqp h PHE 325 Ca 0.01 -0.10 -0.11 0.00 3.53 0.00 0.00 57.97 61.30 1sqp h PHE 325 Cb 0.22 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 1sqp h PHE 325 CO 0.00 0.67 -0.54 -1.49 -2.23 0.00 0.00 178.31 174.72 1sqp h TRP 326 N -0.10 0.00 -0.80 0.41 4.06 -1.02 -0.75 115.95 117.75 1sqp h TRP 326 Ca 0.02 0.00 0.07 0.00 2.06 0.00 0.00 58.89 61.04 1sqp h TRP 326 Cb 0.61 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 28.71 1sqp h TRP 326 CO 0.08 0.54 0.48 0.00 -3.56 0.00 0.00 178.44 175.98 1sqp h ALA 327 N 1.46 1.11 -0.49 1.49 0.00 -1.14 0.31 119.26 122.01 1sqp h ALA 327 Ca -0.01 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1sqp h ALA 327 Cb 1.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1sqp h ALA 327 CO 0.07 0.16 -0.00 1.25 0.00 0.00 0.00 179.25 180.73 1sqp h LEU 328 N 0.84 0.85 0.16 0.00 5.85 -0.74 0.23 115.31 122.51 1sqp h LEU 328 Ca 0.36 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1sqp h LEU 328 Cb 0.24 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1sqp h LEU 328 CO -0.20 0.96 -0.07 0.58 -0.34 0.00 0.00 178.44 179.36 1sqp h VAL 329 N 0.73 0.96 -0.87 1.05 2.07 -0.74 0.46 116.25 119.91 1sqp h VAL 329 Ca 0.14 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1sqp h VAL 329 Cb 0.52 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 1sqp h VAL 329 CO 0.03 0.12 0.55 0.00 0.02 0.00 0.00 177.57 178.29 1sqp h ALA 330 N 0.33 1.35 -0.78 1.67 0.00 -0.37 0.13 119.26 121.59 1sqp h ALA 330 Ca -0.02 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1sqp h ALA 330 Cb 0.36 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1sqp h ALA 330 CO 0.04 0.59 0.33 0.22 0.00 0.00 0.00 179.25 180.42 1sqp h ASP 331 N 1.18 1.06 0.41 0.00 3.58 -0.48 -1.08 116.42 121.09 1sqp h ASP 331 Ca 0.31 -0.16 -0.08 0.00 0.42 0.00 0.00 57.03 57.52 1sqp h ASP 331 Cb -0.11 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 40.66 1sqp h ASP 331 CO -0.06 0.93 -0.38 -0.07 -2.88 0.00 0.00 179.24 176.77 1sqp h LEU 332 N 1.12 0.00 -0.94 2.28 3.38 0.27 -1.28 115.31 120.14 1sqp h LEU 332 Ca 0.26 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.13 1sqp h LEU 332 Cb 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1sqp h LEU 332 CO -0.03 0.38 -0.34 0.25 0.09 0.00 0.00 178.44 178.79 1sqp h LEU 333 N 0.00 0.36 0.32 1.67 5.85 -0.21 -1.88 115.31 121.41 1sqp h LEU 333 Ca -0.00 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 1sqp h LEU 333 Cb 0.68 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.62 1sqp h LEU 333 CO 0.05 0.69 -0.15 0.74 -0.34 0.00 0.00 178.44 179.42 1sqp h THR 334 N 0.30 0.67 -0.99 1.05 2.02 -0.73 -2.44 112.91 112.80 1sqp h THR 334 Ca 0.04 -0.58 0.20 0.00 0.77 0.00 0.00 66.41 66.84 1sqp h THR 334 Cb 0.75 0.96 -0.10 0.00 -1.74 0.00 0.00 68.15 68.03 1sqp h THR 334 CO 0.06 0.11 0.62 -0.07 0.37 0.00 0.00 175.52 176.60 1sqp h LEU 335 N -0.76 0.66 0.31 2.58 3.38 -1.18 -0.62 115.31 119.67 1sqp h LEU 335 Ca -0.04 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1sqp h LEU 335 Cb 0.51 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1sqp h LEU 335 CO 0.07 0.23 -0.16 0.74 0.09 0.00 0.00 178.44 179.41 1sqp h THR 336 N 0.64 0.00 -0.70 0.22 2.02 -1.26 0.45 112.91 114.28 1sqp h THR 336 Ca 0.56 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.89 1sqp h THR 336 Cb 1.04 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 67.34 1sqp h THR 336 CO -0.32 0.00 0.10 -0.25 0.37 0.00 0.00 175.52 175.42 1sqp h TRP 337 N -0.42 0.13 -0.75 3.16 7.01 -1.08 -0.89 115.95 123.11 1sqp h TRP 337 Ca -0.04 0.05 -0.05 0.00 2.11 0.00 0.00 58.89 60.95 1sqp h TRP 337 Cb 0.33 0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.41 1sqp h TRP 337 CO 0.12 -0.13 0.26 0.82 -2.79 0.00 0.00 178.44 176.72 1sqp h ILE 338 N 0.20 1.26 -0.91 2.65 1.08 -1.05 -2.67 117.51 118.07 1sqp h ILE 338 Ca 0.38 -0.87 0.07 0.00 -0.39 0.00 0.00 64.86 64.06 1sqp h ILE 338 Cb 0.65 0.40 -0.06 0.00 -3.07 0.00 0.00 36.82 34.74 1sqp h ILE 338 CO -0.53 0.35 0.59 1.23 -0.69 0.00 0.00 178.15 179.09 1sqp h GLY 339 N 1.13 1.33 -1.34 5.37 0.00 0.53 -0.14 103.07 109.95 1sqp h GLY 339 Ca 0.25 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 1sqp h GLY 339 CO -0.01 0.28 0.00 0.61 0.00 0.00 0.00 176.54 177.42 1sqp n GLY 340 N -1.39 1.70 3.23 4.60 0.00 -1.00 -4.82 105.19 107.51 1sqp n GLY 340 Ca 0.14 -0.10 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 1sqp n GLY 340 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1sqp s GLN 341 N -1.14 0.98 0.85 1.61 -1.52 -0.07 -5.07 119.66 115.29 1sqp s GLN 341 Ca 0.06 -1.07 -0.11 0.00 -1.95 0.00 0.00 55.36 52.29 1sqp s GLN 341 Cb 0.05 -1.10 0.10 0.00 -0.22 0.00 0.00 33.01 31.84 1sqp s GLN 341 CO 0.02 0.25 1.09 -1.25 -0.25 0.00 0.00 175.29 175.15 1sqp s PRO 342 N -1.89 1.66 -0.06 2.91 0.04 -1.26 -4.92 135.00 131.48 1sqp s PRO 342 Ca 0.03 1.05 -0.00 0.00 0.04 0.00 0.00 61.00 62.11 1sqp s PRO 342 Cb -0.10 -1.84 0.05 0.00 0.04 0.00 0.00 34.50 32.65 1sqp s PRO 342 CO 0.03 -2.03 1.79 1.55 0.04 0.00 0.00 177.00 178.39 1sqp n VAL 343 N -3.77 1.93 -2.31 -0.36 3.14 -1.26 -4.78 118.33 110.93 1sqp n VAL 343 Ca 0.08 -0.60 -0.26 0.00 -2.96 0.00 0.00 64.34 60.60 1sqp n VAL 343 Cb 0.54 -1.35 0.14 0.00 -1.06 0.00 0.00 33.84 32.11 1sqp n VAL 343 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 1sqp s GLU 344 N -0.35 1.30 0.06 1.45 8.01 -1.26 -4.57 118.70 123.35 1sqp s GLU 344 Ca 0.06 -0.79 -0.12 0.00 0.01 0.00 0.00 54.97 54.12 1sqp s GLU 344 Cb 0.05 -2.13 -0.03 0.00 -4.31 0.00 0.00 34.13 27.71 1sqp s GLU 344 CO 0.00 -1.82 1.09 1.58 0.01 0.00 0.00 175.26 176.13 1sqp n HIS 345 N -3.21 -0.18 0.29 1.61 -0.00 -1.26 -1.62 115.22 110.85 1sqp n HIS 345 Ca 0.15 0.50 0.17 0.00 -0.00 0.00 0.00 57.72 58.54 1sqp n HIS 345 Cb 0.60 -0.50 0.83 0.00 -0.00 0.00 0.00 29.99 30.93 1sqp n HIS 345 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1sqp h PRO 346 N 0.00 0.00 0.04 1.57 0.13 -1.96 -3.29 132.00 128.49 1sqp h PRO 346 Ca 0.06 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.89 1sqp h PRO 346 Cb 0.17 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.26 1sqp h PRO 346 CO -0.38 0.05 -1.74 1.88 -0.23 0.00 0.00 178.00 177.59 1sqp h TYR 347 N 0.00 0.14 0.23 1.56 0.05 -1.62 -3.01 116.97 114.33 1sqp h TYR 347 Ca -0.00 -0.10 0.00 0.00 0.05 0.00 0.00 58.73 58.68 1sqp h TYR 347 Cb 0.33 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.05 1sqp h TYR 347 CO 0.00 1.21 -0.21 -0.84 -1.05 0.00 0.00 178.16 177.27 1sqp h ILE 348 N 0.02 0.55 0.82 -2.88 3.07 -1.48 -2.24 117.51 115.37 1sqp h ILE 348 Ca -0.30 0.00 -0.04 0.00 1.55 0.00 0.00 64.86 66.07 1sqp h ILE 348 Cb 2.01 0.55 0.01 0.00 -0.27 0.00 0.00 36.82 39.11 1sqp h ILE 348 CO 0.09 0.00 -0.39 0.74 -1.05 0.00 0.00 178.15 177.54 1sqp h THR 349 N -0.47 0.05 0.00 0.16 2.02 -1.68 -0.08 112.91 112.92 1sqp h THR 349 Ca -0.01 -0.17 -0.08 0.00 0.77 0.00 0.00 66.41 66.92 1sqp h THR 349 Cb 0.43 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 1sqp h THR 349 CO -0.04 0.00 -0.38 0.16 0.37 0.00 0.00 175.52 175.64 1sqp h ILE 350 N -1.26 1.17 -0.34 3.11 -0.00 -1.65 -0.24 117.51 118.30 1sqp h ILE 350 Ca -0.11 -1.35 -0.06 0.00 -0.00 0.00 0.00 64.86 63.34 1sqp h ILE 350 Cb 0.85 1.75 -0.01 0.00 -0.00 0.00 0.00 36.82 39.41 1sqp h ILE 350 CO 0.18 0.37 -0.01 1.23 -0.00 0.00 0.00 178.15 179.93 1sqp h GLY 351 N 1.32 0.66 1.32 0.16 0.00 -1.29 0.65 103.07 105.89 1sqp h GLY 351 Ca -0.00 -0.50 -0.05 0.00 0.00 0.00 0.00 47.33 46.78 1sqp h GLY 351 CO 0.05 0.46 0.14 1.46 0.00 0.00 0.00 176.54 178.65 1sqp h GLN 352 N 0.42 0.85 -0.05 4.80 4.20 -0.58 -2.72 115.11 122.03 1sqp h GLN 352 Ca 0.10 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 1sqp h GLN 352 Cb 0.47 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 1sqp h GLN 352 CO 0.02 0.76 -0.04 1.25 -0.67 0.00 0.00 178.83 180.16 1sqp h LEU 353 N 0.82 0.12 -1.05 1.46 5.85 -0.72 -2.73 115.31 119.06 1sqp h LEU 353 Ca 0.18 -0.45 0.07 0.00 0.84 0.00 0.00 57.88 58.52 1sqp h LEU 353 Cb 0.29 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.22 1sqp h LEU 353 CO -0.00 0.55 0.63 0.00 -0.34 0.00 0.00 178.44 179.28 1sqp h ALA 354 N 0.58 1.45 0.31 1.25 0.00 -0.92 -1.84 119.26 120.10 1sqp h ALA 354 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1sqp h ALA 354 Cb 0.51 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1sqp h ALA 354 CO 0.01 0.39 -0.34 0.77 0.00 0.00 0.00 179.25 180.08 1sqp h SER 355 N 1.11 -0.92 -0.76 0.00 0.02 -1.38 0.15 113.55 111.78 1sqp h SER 355 Ca 0.43 0.08 0.16 0.00 -0.84 0.00 0.00 61.79 61.62 1sqp h SER 355 Cb 0.22 0.31 -0.11 0.00 0.14 0.00 0.00 62.40 62.97 1sqp h SER 355 CO -0.18 -0.47 0.24 0.58 -1.14 0.00 0.00 176.83 175.87 1sqp h VAL 356 N -0.69 0.56 -0.54 2.27 2.07 -1.34 -2.56 116.25 116.01 1sqp h VAL 356 Ca -0.01 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.35 1sqp h VAL 356 Cb 0.63 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1sqp h VAL 356 CO -0.08 0.06 0.19 0.25 0.02 0.00 0.00 177.57 178.01 1sqp h LEU 357 N 0.34 0.78 -0.30 2.57 5.85 -0.48 0.29 115.31 124.35 1sqp h LEU 357 Ca 0.43 -0.19 0.07 0.00 0.84 0.00 0.00 57.88 59.03 1sqp h LEU 357 Cb 0.72 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 41.47 1sqp h LEU 357 CO -0.47 0.76 -0.19 0.22 -0.34 0.00 0.00 178.44 178.42 1sqp h TYR 358 N 0.75 -0.47 -0.19 1.25 3.20 -0.34 0.22 116.97 121.39 1sqp h TYR 358 Ca 0.18 0.04 -0.12 0.00 3.14 0.00 0.00 58.73 61.96 1sqp h TYR 358 Cb 0.25 0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.78 1sqp h TYR 358 CO 0.01 -0.26 -0.35 0.74 -1.64 0.00 0.00 178.16 176.66 1sqp h PHE 359 N -0.15 0.72 -0.10 -3.82 0.04 -1.28 -2.37 116.94 109.98 1sqp h PHE 359 Ca 0.16 -0.26 -0.07 0.00 2.80 0.00 0.00 57.97 60.60 1sqp h PHE 359 Cb 0.40 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.40 1sqp h PHE 359 CO -0.38 1.00 -0.25 1.25 -0.60 0.00 0.00 178.31 179.32 1sqp h LEU 360 N 0.24 0.16 0.06 1.54 5.85 -0.28 0.29 115.31 123.18 1sqp h LEU 360 Ca 0.01 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 1sqp h LEU 360 Cb 0.94 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1sqp h LEU 360 CO 0.08 0.43 -0.03 0.25 -0.34 0.00 0.00 178.44 178.83 1sqp h LEU 361 N 0.15 -0.06 -0.03 2.25 5.85 -0.45 0.37 115.31 123.39 1sqp h LEU 361 Ca 0.03 -0.40 -0.09 0.00 0.84 0.00 0.00 57.88 58.25 1sqp h LEU 361 Cb 0.54 0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.59 1sqp h LEU 361 CO 0.04 0.38 -0.35 0.40 -0.34 0.00 0.00 178.44 178.57 1sqp h ILE 362 N -0.53 1.46 0.00 4.05 2.04 -1.37 0.12 117.51 123.29 1sqp h ILE 362 Ca -0.01 -1.86 0.00 0.00 1.00 0.00 0.00 64.86 63.99 1sqp h ILE 362 Cb 0.46 2.52 0.00 0.00 -0.74 0.00 0.00 36.82 39.07 1sqp h ILE 362 CO 0.01 0.53 0.00 0.25 0.00 0.00 0.00 178.15 178.94 1sqp h LEU 363 N -0.27 0.00 0.00 1.44 5.85 -0.53 -3.41 115.31 118.40 1sqp h LEU 363 Ca -0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1sqp h LEU 363 Cb 1.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1sqp h LEU 363 CO 0.07 0.00 -0.09 0.52 -0.34 0.00 0.00 178.44 178.60 1sqp n VAL 364 N -3.02 0.03 0.01 1.05 0.31 -0.75 -4.87 118.33 111.08 1sqp n VAL 364 Ca 0.04 0.01 -0.13 0.00 -0.01 0.00 0.00 64.34 64.25 1sqp n VAL 364 Cb 0.49 -0.61 -0.09 0.00 -0.91 0.00 0.00 33.84 32.71 1sqp n VAL 364 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1sqp h LEU 365 N 0.00 -0.07 -0.65 7.52 4.07 -0.01 -2.40 115.31 123.77 1sqp h LEU 365 Ca 0.00 -0.47 -0.12 0.00 0.08 0.00 0.00 57.88 57.37 1sqp h LEU 365 Cb 0.09 0.02 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 1sqp h LEU 365 CO 0.00 0.46 -0.19 0.24 -1.08 0.00 0.00 178.44 177.87 1sqp h MET 366 N -0.64 0.86 0.00 1.13 2.86 -1.01 -1.46 114.93 116.66 1sqp h MET 366 Ca -0.01 -0.34 -0.00 0.00 -2.06 0.00 0.00 59.70 57.29 1sqp h MET 366 Cb 0.54 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.16 1sqp h MET 366 CO 0.01 0.97 -0.01 -1.35 1.06 0.00 0.00 176.91 177.60 1sqp h PRO 367 N 0.75 0.00 0.14 -0.22 0.11 -1.78 -2.67 132.00 128.32 1sqp h PRO 367 Ca 0.11 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.00 1sqp h PRO 367 Cb 0.72 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.84 1sqp h PRO 367 CO 0.06 0.01 -1.03 1.15 -0.21 0.00 0.00 178.00 177.98 1sqp h THR 368 N 0.00 1.35 -0.82 -1.15 2.02 -0.95 -3.28 112.91 110.08 1sqp h THR 368 Ca -0.00 -2.50 0.14 0.00 0.77 0.00 0.00 66.41 64.81 1sqp h THR 368 Cb 0.03 3.04 -0.09 0.00 -1.74 0.00 0.00 68.15 69.39 1sqp h THR 368 CO 0.00 0.71 0.41 0.00 0.37 0.00 0.00 175.52 177.02 1sqp h ALA 369 N 0.04 1.21 -0.66 6.16 0.00 -1.16 -0.87 119.26 123.99 1sqp h ALA 369 Ca -0.20 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1sqp h ALA 369 Cb 1.70 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.45 1sqp h ALA 369 CO 0.13 -0.09 0.31 0.78 0.00 0.00 0.00 179.25 180.38 1sqp h GLY 370 N 0.61 1.02 0.96 0.00 0.00 -1.63 0.22 103.07 104.25 1sqp h GLY 370 Ca 0.44 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 1sqp h GLY 370 CO -0.35 0.49 0.18 -0.84 0.00 0.00 0.00 176.54 176.01 1sqp h THR 371 N 0.91 1.14 -0.43 4.70 2.02 -1.36 -1.24 112.91 118.64 1sqp h THR 371 Ca 0.23 -0.37 -0.03 0.00 0.77 0.00 0.00 66.41 67.01 1sqp h THR 371 Cb 0.13 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 1sqp h THR 371 CO -0.03 0.14 0.16 0.40 0.37 0.00 0.00 175.52 176.57 1sqp h ILE 372 N 0.41 1.21 -0.58 3.11 2.04 -0.92 -2.27 117.51 120.51 1sqp h ILE 372 Ca 0.12 -0.65 -0.02 0.00 1.00 0.00 0.00 64.86 65.30 1sqp h ILE 372 Cb 0.07 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 1sqp h ILE 372 CO -0.02 0.24 0.27 -0.33 0.00 0.00 0.00 178.15 178.31 1sqp h GLU 373 N 0.56 0.81 -0.68 2.37 5.08 -0.42 0.85 114.58 123.16 1sqp h GLU 373 Ca 0.14 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1sqp h GLU 373 Cb 0.21 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 1sqp h GLU 373 CO -0.01 0.63 0.32 -0.91 -1.00 0.00 0.00 179.01 178.04 1sqp h ASN 374 N 0.81 0.89 0.15 1.42 4.21 -1.12 -2.93 115.58 119.01 1sqp h ASN 374 Ca 0.20 -0.14 -0.16 0.00 1.21 0.00 0.00 56.30 57.41 1sqp h ASN 374 Cb 0.09 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.05 1sqp h ASN 374 CO -0.03 0.78 -0.60 0.11 -1.29 0.00 0.00 177.43 176.40 1sqp h LYS 375 N 0.94 0.45 -0.11 0.81 1.57 -0.30 -1.27 116.57 118.67 1sqp h LYS 375 Ca 0.23 -0.31 -0.08 0.00 -1.87 0.00 0.00 60.65 58.62 1sqp h LYS 375 Cb 0.13 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1sqp h LYS 375 CO -0.03 0.92 -0.31 -0.07 -0.57 0.00 0.00 179.45 179.40 1sqp h LEU 376 N 0.34 0.20 -0.40 2.94 3.38 -1.06 -1.33 115.31 119.38 1sqp h LEU 376 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1sqp h LEU 376 Cb 1.14 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1sqp h LEU 376 CO 0.11 0.50 0.00 0.18 0.09 0.00 0.00 178.44 179.32 1sqp n LEU 377 N -4.12 0.60 -3.39 1.67 4.77 -1.05 -4.93 117.00 110.55 1sqp n LEU 377 Ca -0.01 -0.24 -0.24 0.00 -0.03 0.00 0.00 56.01 55.48 1sqp n LEU 377 Cb 0.39 -0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.49 1sqp n LEU 377 CO 0.40 0.12 0.09 0.29 -1.33 0.00 0.00 177.39 176.96 1sqp n LYS 378 N -0.41 -5.81 0.00 3.23 5.02 -0.50 -5.10 118.16 114.59 1sqp n LYS 378 Ca 0.16 0.79 0.14 0.00 -2.02 0.00 0.00 58.31 57.37 1sqp n LYS 378 Cb 0.17 -5.70 0.49 0.00 -0.02 0.00 0.00 35.03 29.96 1sqp n LYS 378 CO 0.00 0.00 0.00 1.87 -0.52 0.00 0.00 177.40 178.75