#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2icy n GLU 6 N 0.00 0.00 -2.50 -2.82 4.71 -1.26 -4.99 120.64 113.78 2icy n GLU 6 Ca 0.00 -0.29 -0.40 0.00 -0.01 0.00 0.00 57.16 56.45 2icy n GLU 6 Cb 0.00 -0.15 -0.03 0.00 -1.01 0.00 0.00 31.44 30.25 2icy n GLU 6 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 2icy s ASN 7 N -0.29 6.20 0.55 1.62 3.84 -1.26 -4.86 114.94 120.74 2icy s ASN 7 Ca 0.00 -0.83 0.26 0.00 0.21 0.00 0.00 52.86 52.49 2icy s ASN 7 Cb 0.00 -2.56 1.57 0.00 -0.55 0.00 0.00 41.25 39.71 2icy s ASN 7 CO 0.00 -1.78 2.17 0.25 -2.79 0.00 0.00 177.10 174.96 2icy h LEU 8 N 13.36 0.00 -0.04 3.21 5.85 -1.99 -2.00 115.31 133.70 2icy h LEU 8 Ca -0.06 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 2icy h LEU 8 Cb 1.04 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.07 2icy h LEU 8 CO 1.34 0.05 -0.00 -0.65 -0.34 0.00 0.00 178.44 178.83 2icy h PRO 9 N 0.00 0.07 -0.35 5.25 0.11 -1.98 -0.03 132.00 135.08 2icy h PRO 9 Ca -0.00 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.02 2icy h PRO 9 Cb 0.11 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 2icy h PRO 9 CO 0.01 0.38 -0.02 0.37 -0.21 0.00 0.00 178.00 178.52 2icy h GLN 10 N -0.24 0.62 -0.68 1.05 4.15 -1.94 -0.37 115.11 117.70 2icy h GLN 10 Ca 0.01 -0.21 -0.08 0.00 0.77 0.00 0.00 58.65 59.14 2icy h GLN 10 Cb 0.35 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.96 2icy h GLN 10 CO 0.00 0.76 0.12 1.25 -1.93 0.00 0.00 178.83 179.03 2icy h LEU 11 N 0.43 1.07 -1.28 -2.39 5.85 -1.39 0.23 115.31 117.82 2icy h LEU 11 Ca 0.10 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 2icy h LEU 11 Cb 0.49 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 2icy h LEU 11 CO 0.02 1.05 0.17 0.50 -0.34 0.00 0.00 178.44 179.83 2icy h LYS 12 N 1.05 0.66 0.00 1.25 3.64 -0.78 0.25 116.57 122.63 2icy h LYS 12 Ca 0.21 -0.10 -0.15 0.00 -1.27 0.00 0.00 60.65 59.34 2icy h LYS 12 Cb 0.43 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 2icy h LYS 12 CO 0.01 0.56 -0.81 0.77 -2.27 0.00 0.00 179.45 177.71 2icy h SER 13 N 0.65 0.00 -0.28 4.20 0.02 -0.72 -1.58 113.55 115.84 2icy h SER 13 Ca 0.16 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.07 2icy h SER 13 Cb 0.16 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 2icy h SER 13 CO -0.01 0.66 0.04 0.00 -1.14 0.00 0.00 176.83 176.37 2icy h ALA 14 N 1.34 0.38 -0.05 3.77 0.00 0.67 -2.87 119.26 122.50 2icy h ALA 14 Ca -0.04 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 2icy h ALA 14 Cb 1.54 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 2icy h ALA 14 CO 0.08 0.08 -0.60 0.28 0.00 0.00 0.00 179.25 179.09 2icy h VAL 15 N 0.28 1.40 0.00 0.00 2.07 -0.55 -3.10 116.25 116.36 2icy h VAL 15 Ca 0.08 -2.00 0.00 0.00 0.82 0.00 0.00 66.70 65.60 2icy h VAL 15 Cb 0.36 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 2icy h VAL 15 CO 0.01 0.58 0.00 0.47 0.02 0.00 0.00 177.57 178.65 2icy n ASP 16 N -3.86 0.19 -1.28 0.57 8.00 -0.60 -2.08 116.55 117.50 2icy n ASP 16 Ca -0.02 0.55 0.12 0.00 0.71 0.00 0.00 54.79 56.15 2icy n ASP 16 Cb 0.61 -0.59 0.29 0.00 -0.02 0.00 0.00 41.12 41.41 2icy n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2icy n GLY 17 N -0.15 2.16 3.48 0.44 0.00 -1.11 -4.84 105.19 105.18 2icy n GLY 17 Ca 0.03 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 2icy n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2icy s LEU 18 N -1.17 4.24 0.43 0.99 1.43 -0.88 -4.90 118.68 118.82 2icy s LEU 18 Ca 0.45 -0.75 0.17 0.00 -1.03 0.00 0.00 54.13 52.97 2icy s LEU 18 Cb 0.24 -2.56 1.08 0.00 0.03 0.00 0.00 46.19 44.98 2icy s LEU 18 CO 0.33 -1.38 1.91 0.74 0.23 0.00 0.00 176.35 178.18 2icy h THR 19 N 5.99 0.77 0.00 5.49 2.02 -1.88 -2.32 112.91 122.97 2icy h THR 19 Ca -0.28 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 66.77 2icy h THR 19 Cb 1.07 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 2icy h THR 19 CO 1.15 0.07 0.00 -0.62 0.37 0.00 0.00 175.52 176.49 2icy n GLU 20 N -4.47 0.20 -3.14 6.66 -0.58 -1.26 -4.86 120.64 113.19 2icy n GLU 20 Ca 0.15 0.26 -0.34 0.00 -0.42 0.00 0.00 57.16 56.81 2icy n GLU 20 Cb 0.57 -1.78 -0.06 0.00 -0.57 0.00 0.00 31.44 29.60 2icy n GLU 20 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2icy s MET 21 N -3.16 4.11 0.47 3.49 -1.94 -0.88 -5.08 119.30 116.32 2icy s MET 21 Ca 0.09 0.74 -0.07 0.00 -1.71 0.00 0.00 55.69 54.74 2icy s MET 21 Cb 0.12 -2.66 -0.04 0.00 2.01 0.00 0.00 34.83 34.25 2icy s MET 21 CO 0.50 0.28 0.80 -1.54 -0.01 0.00 0.00 175.02 175.05 2icy s SER 22 N -1.97 6.32 0.25 3.03 1.04 -1.26 -4.92 113.70 116.18 2icy s SER 22 Ca 0.48 1.00 -0.06 0.00 0.48 0.00 0.00 55.95 57.85 2icy s SER 22 Cb -0.13 -2.28 0.26 0.00 0.10 0.00 0.00 66.02 63.97 2icy s SER 22 CO 0.19 -0.55 1.91 -0.33 0.98 0.00 0.00 173.24 175.44 2icy h GLU 23 N 0.43 1.24 0.00 4.02 4.39 -1.99 -0.84 114.58 121.83 2icy h GLU 23 Ca -0.47 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.08 2icy h GLU 23 Cb 1.20 -0.28 -0.01 0.00 -0.10 0.00 0.00 28.75 29.56 2icy h GLU 23 CO 0.62 0.82 -0.38 0.66 -1.16 0.00 0.00 179.01 179.57 2icy h SER 24 N 1.28 0.00 -0.27 1.42 4.64 -2.00 -1.89 113.55 116.73 2icy h SER 24 Ca 0.36 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.52 2icy h SER 24 Cb -0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 2icy h SER 24 CO -0.09 0.38 -0.48 -0.33 -0.87 0.00 0.00 176.83 175.44 2icy h GLU 25 N 0.00 0.81 -0.50 4.77 5.08 -1.69 -2.38 114.58 120.68 2icy h GLU 25 Ca -0.00 -0.50 0.02 0.00 -1.00 0.00 0.00 59.36 57.87 2icy h GLU 25 Cb 0.71 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.98 2icy h GLU 25 CO 0.05 1.13 0.31 0.87 -1.00 0.00 0.00 179.01 180.37 2icy h LYS 26 N 0.57 0.61 -0.76 2.33 1.57 -0.76 -1.95 116.57 118.16 2icy h LYS 26 Ca 0.02 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 2icy h LYS 26 Cb 1.09 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.22 2icy h LYS 26 CO 0.11 0.40 0.36 0.77 -0.57 0.00 0.00 179.45 180.52 2icy h SER 27 N 0.63 1.01 -0.36 0.86 0.02 -1.35 -1.35 113.55 113.01 2icy h SER 27 Ca 0.19 -0.14 -0.14 0.00 -0.84 0.00 0.00 61.79 60.86 2icy h SER 27 Cb -0.02 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.25 2icy h SER 27 CO -0.07 0.87 -0.30 1.23 -1.14 0.00 0.00 176.83 177.42 2icy h GLY 28 N 1.08 0.96 0.91 -3.77 0.00 -1.29 -1.17 103.07 99.80 2icy h GLY 28 Ca 0.26 -0.91 -0.05 0.00 0.00 0.00 0.00 47.33 46.63 2icy h GLY 28 CO -0.03 0.82 0.00 -2.75 0.00 0.00 0.00 176.54 174.58 2icy h PHE 29 N 0.75 0.65 -0.36 5.60 3.57 -1.22 -1.05 116.94 124.87 2icy h PHE 29 Ca 0.08 -0.11 -0.08 0.00 3.53 0.00 0.00 57.97 61.39 2icy h PHE 29 Cb 0.87 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 2icy h PHE 29 CO 0.05 0.71 -0.09 0.82 -2.23 0.00 0.00 178.31 177.57 2icy h ILE 30 N 0.41 1.24 -0.18 1.41 2.04 -1.16 -0.06 117.51 121.19 2icy h ILE 30 Ca 0.10 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 64.91 2icy h ILE 30 Cb 0.45 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 2icy h ILE 30 CO 0.02 0.35 0.10 0.28 0.00 0.00 0.00 178.15 178.90 2icy h SER 31 N 0.57 0.22 -0.78 1.72 0.02 -1.03 0.15 113.55 114.43 2icy h SER 31 Ca 0.11 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2icy h SER 31 Cb 0.50 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.94 2icy h SER 31 CO 0.03 0.23 0.49 -0.07 -1.14 0.00 0.00 176.83 176.38 2icy h LEU 32 N 0.20 0.92 -0.59 5.07 4.07 -0.52 -2.29 115.31 122.17 2icy h LEU 32 Ca 0.06 -0.04 -0.08 0.00 0.08 0.00 0.00 57.88 57.90 2icy h LEU 32 Cb 0.06 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.54 2icy h LEU 32 CO -0.01 0.69 0.06 0.58 -1.08 0.00 0.00 178.44 178.68 2icy h VAL 33 N 1.06 1.26 0.10 1.22 2.07 -0.44 -1.27 116.25 120.25 2icy h VAL 33 Ca 0.28 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.76 2icy h VAL 33 Cb -0.08 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 2icy h VAL 33 CO -0.06 0.38 -0.25 0.28 0.02 0.00 0.00 177.57 177.94 2icy h SER 34 N 0.89 -0.75 -0.97 0.57 0.02 -0.46 -0.98 113.55 111.88 2icy h SER 34 Ca 0.17 0.07 0.17 0.00 -0.84 0.00 0.00 61.79 61.37 2icy h SER 34 Cb 0.47 0.27 -0.09 0.00 0.14 0.00 0.00 62.40 63.19 2icy h SER 34 CO 0.02 -0.28 0.61 0.03 -1.14 0.00 0.00 176.83 176.06 2icy h ARG 35 N -0.39 0.71 -0.34 3.45 3.08 -1.37 0.47 114.38 119.99 2icy h ARG 35 Ca -0.01 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 2icy h ARG 35 Cb 0.38 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 2icy h ARG 35 CO -0.11 0.47 0.17 -0.92 -1.07 0.00 0.00 179.97 178.51 2icy h TYR 36 N 0.74 0.45 -0.02 3.04 3.20 -0.57 -3.36 116.97 120.44 2icy h TYR 36 Ca 0.52 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.38 2icy h TYR 36 Cb 0.83 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.95 2icy h TYR 36 CO -0.00 0.33 0.00 1.28 -1.64 0.00 0.00 178.16 178.12 2icy n LEU 37 N -4.44 0.45 0.00 2.82 4.77 0.16 -5.09 117.00 115.67 2icy n LEU 37 Ca 0.02 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 2icy n LEU 37 Cb 0.10 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 2icy n LEU 37 CO 0.36 0.10 0.14 0.00 -1.33 0.00 0.00 177.39 176.67 2icy n ALA 41 N -0.29 1.11 -2.56 -1.18 0.00 -1.26 -4.94 120.51 111.38 2icy n ALA 41 Ca 0.01 -0.29 -0.43 0.00 0.00 0.00 0.00 53.44 52.73 2icy n ALA 41 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 2icy n ALA 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2icy n GLN 42 N -0.03 3.23 -3.49 0.00 6.02 -1.26 -4.88 117.38 116.97 2icy n GLN 42 Ca 0.00 -3.37 -0.24 0.00 -0.01 0.00 0.00 57.00 53.39 2icy n GLN 42 Cb 0.19 -3.32 -0.13 0.00 1.02 0.00 0.00 30.24 28.00 2icy n GLN 42 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2icy s HIS 43 N 3.16 -0.03 0.55 1.08 3.76 -1.26 -5.02 115.29 117.53 2icy s HIS 43 Ca 0.49 -0.50 -0.20 0.00 -0.15 0.00 0.00 55.06 54.71 2icy s HIS 43 Cb 0.04 -0.68 -0.05 0.00 1.11 0.00 0.00 32.58 33.00 2icy s HIS 43 CO 0.03 -0.83 1.18 -1.50 -0.85 0.00 0.00 174.74 172.77 2icy s ILE 44 N 2.22 2.89 -0.64 0.60 1.10 -1.26 -5.03 121.20 121.08 2icy s ILE 44 Ca 0.09 0.57 -0.06 0.00 -0.51 0.00 0.00 60.65 60.74 2icy s ILE 44 Cb -0.15 -3.24 0.17 0.00 0.15 0.00 0.00 42.46 39.38 2icy s ILE 44 CO -0.32 -0.10 0.48 -1.61 -2.11 0.00 0.00 174.94 171.28 2icy s GLU 45 N -3.21 2.73 0.28 3.50 2.02 -1.26 -4.97 118.70 117.78 2icy s GLU 45 Ca 0.74 -2.39 0.19 0.00 0.02 0.00 0.00 54.97 53.52 2icy s GLU 45 Cb -0.28 -3.88 0.97 0.00 0.10 0.00 0.00 34.13 31.04 2icy s GLU 45 CO 0.31 -1.19 1.06 1.87 0.02 0.00 0.00 175.26 177.33 2icy n TRP 46 N 3.81 0.60 0.02 1.61 -0.00 -1.26 -0.33 117.44 121.89 2icy n TRP 46 Ca 0.07 0.61 0.07 0.00 -0.00 0.00 0.00 57.50 58.24 2icy n TRP 46 Cb 0.40 -1.02 0.49 0.00 -0.00 0.00 0.00 31.31 31.18 2icy n TRP 46 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 177.69 178.72 2icy h SER 47 N 0.00 0.35 -0.02 5.87 0.87 -2.05 -2.49 113.55 116.08 2icy h SER 47 Ca 0.59 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.14 2icy h SER 47 Cb 1.76 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.63 2icy h SER 47 CO -0.40 0.25 0.00 0.29 -0.53 0.00 0.00 176.83 176.44 2icy n LYS 48 N -4.48 1.06 -2.63 2.24 5.02 0.55 -4.86 118.16 115.06 2icy n LYS 48 Ca 0.04 -0.09 -0.42 0.00 -2.02 0.00 0.00 58.31 55.81 2icy n LYS 48 Cb 0.16 -1.22 -0.03 0.00 -0.02 0.00 0.00 35.03 33.92 2icy n LYS 48 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2icy s ILE 49 N -1.98 4.64 0.17 -0.18 1.01 -0.94 -4.52 121.20 119.41 2icy s ILE 49 Ca 0.21 1.91 0.07 0.00 0.00 0.00 0.00 60.65 62.84 2icy s ILE 49 Cb 0.10 -4.23 -0.04 0.00 0.01 0.00 0.00 42.46 38.30 2icy s ILE 49 CO 0.16 0.04 -0.16 -1.10 0.00 0.00 0.00 174.94 173.89 2icy s GLN 50 N 1.78 1.23 -0.03 2.79 -0.21 -0.11 -5.00 119.66 120.12 2icy s GLN 50 Ca 0.51 -1.44 -0.30 0.00 0.02 0.00 0.00 55.36 54.15 2icy s GLN 50 Cb -0.21 -1.13 -0.03 0.00 1.00 0.00 0.00 33.01 32.64 2icy s GLN 50 CO 0.22 0.21 1.09 0.99 -2.12 0.00 0.00 175.29 175.68 2icy s THR 51 N -2.47 4.50 0.68 -0.19 2.01 -1.26 -1.10 115.64 117.81 2icy s THR 51 Ca 0.17 1.79 -0.15 0.00 0.31 0.00 0.00 61.69 63.82 2icy s THR 51 Cb -0.03 -4.15 0.01 0.00 0.01 0.00 0.00 72.50 68.34 2icy s THR 51 CO 0.06 0.07 1.12 -2.84 -0.69 0.00 0.00 174.62 172.34 2icy s PRO 52 N 1.60 2.64 0.72 4.92 0.02 -1.26 -4.83 135.00 138.81 2icy s PRO 52 Ca 0.54 1.44 -0.07 0.00 0.02 0.00 0.00 61.00 62.93 2icy s PRO 52 Cb -0.23 -1.93 0.07 0.00 0.02 0.00 0.00 34.50 32.43 2icy s PRO 52 CO 0.24 -1.39 1.04 0.95 -0.33 0.00 0.00 177.00 177.51 2icy s THR 53 N -2.31 2.24 -1.08 0.99 -4.23 -1.26 -4.80 115.64 105.19 2icy s THR 53 Ca 0.68 -0.25 0.10 0.00 -1.18 0.00 0.00 61.69 61.04 2icy s THR 53 Cb -0.22 -2.99 0.10 0.00 1.34 0.00 0.00 72.50 70.74 2icy s THR 53 CO 0.43 0.00 1.30 0.47 -0.54 0.00 0.00 174.62 176.28 2icy n ASP 54 N -2.98 0.00 0.03 3.99 8.00 -1.26 -1.17 116.55 123.17 2icy n ASP 54 Ca 0.08 0.43 0.11 0.00 0.71 0.00 0.00 54.79 56.13 2icy n ASP 54 Cb 0.60 -0.46 0.05 0.00 -0.02 0.00 0.00 41.12 41.30 2icy n ASP 54 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2icy n GLU 55 N -1.46 0.29 -0.12 -1.24 4.71 -1.26 -3.45 120.64 118.11 2icy n GLU 55 Ca 0.03 0.01 -0.18 0.00 -0.01 0.00 0.00 57.16 57.01 2icy n GLU 55 Cb 0.11 -1.61 -0.12 0.00 -1.01 0.00 0.00 31.44 28.81 2icy n GLU 55 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 2icy n ILE 56 N -1.99 1.51 -3.91 -3.67 2.08 -0.47 -4.68 119.36 108.22 2icy n ILE 56 Ca 0.02 -0.60 -0.33 0.00 0.56 0.00 0.00 62.75 62.41 2icy n ILE 56 Cb 0.44 -1.38 -0.13 0.00 -0.75 0.00 0.00 39.64 37.81 2icy n ILE 56 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 2icy s VAL 57 N -2.52 2.73 -0.06 1.39 1.01 -0.32 -1.63 120.40 121.00 2icy s VAL 57 Ca -0.32 -2.43 -0.25 0.00 0.00 0.00 0.00 61.98 58.98 2icy s VAL 57 Cb 0.09 -2.93 -0.03 0.00 0.00 0.00 0.00 36.38 33.50 2icy s VAL 57 CO 0.63 -0.67 0.79 -0.69 0.00 0.00 0.00 175.10 175.15 2icy s VAL 58 N 0.75 4.98 0.12 2.92 1.01 -0.90 -4.09 120.40 125.20 2icy s VAL 58 Ca 0.11 1.63 -0.31 0.00 0.00 0.00 0.00 61.98 63.41 2icy s VAL 58 Cb -0.21 -4.13 -0.08 0.00 0.00 0.00 0.00 36.38 31.96 2icy s VAL 58 CO -0.05 0.21 1.44 -2.84 0.00 0.00 0.00 175.10 173.85 2icy s PRO 59 N 0.98 4.29 0.29 2.72 0.02 -1.26 0.67 135.00 142.71 2icy s PRO 59 Ca 0.42 2.14 0.03 0.00 0.02 0.00 0.00 61.00 63.61 2icy s PRO 59 Cb -0.19 -3.25 0.64 0.00 0.02 0.00 0.00 34.50 31.73 2icy s PRO 59 CO 0.20 -0.49 1.79 -0.92 -0.33 0.00 0.00 177.00 177.26 2icy h TYR 60 N 6.88 1.03 -0.35 6.54 3.20 2.98 0.20 116.97 137.45 2icy h TYR 60 Ca -0.42 0.03 0.10 0.00 3.14 0.00 0.00 58.73 61.59 2icy h TYR 60 Cb 1.21 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 39.15 2icy h TYR 60 CO 0.66 0.29 0.33 1.05 -1.64 0.00 0.00 178.16 178.85 2icy h GLU 61 N 0.81 0.00 0.00 1.82 4.11 -1.91 -1.05 114.58 118.36 2icy h GLU 61 Ca 0.53 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.96 2icy h GLU 61 Cb 0.73 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.98 2icy h GLU 61 CO -0.34 0.00 -0.34 0.87 0.07 0.00 0.00 179.01 179.27 2icy h LYS 62 N 0.00 0.00 -6.99 1.06 1.57 -1.31 -3.47 116.57 107.43 2icy h LYS 62 Ca 0.17 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.48 2icy h LYS 62 Cb 0.83 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.15 2icy h LYS 62 CO -0.00 0.00 0.38 1.41 -0.57 0.00 0.00 179.45 180.67 2icy s MET 63 N -3.18 4.16 -0.12 3.15 1.75 -0.40 -4.98 119.30 119.68 2icy s MET 63 Ca 0.07 1.38 -0.30 0.00 -1.25 0.00 0.00 55.69 55.59 2icy s MET 63 Cb 0.11 -2.41 -0.02 0.00 2.84 0.00 0.00 34.83 35.35 2icy s MET 63 CO 0.68 -0.12 1.18 0.99 -0.65 0.00 0.00 175.02 177.09 2icy s THR 64 N -1.82 4.37 1.22 10.11 2.01 -1.26 -5.03 115.64 125.23 2icy s THR 64 Ca 0.60 1.67 -0.20 0.00 0.31 0.00 0.00 61.69 64.07 2icy s THR 64 Cb -0.18 -4.08 0.30 0.00 0.01 0.00 0.00 72.50 68.55 2icy s THR 64 CO 0.22 -0.06 1.13 -2.84 -0.69 0.00 0.00 174.62 172.38 2icy s PRO 65 N 2.72 -1.34 0.67 4.92 0.02 -1.26 -4.80 135.00 135.92 2icy s PRO 65 Ca 0.53 -0.19 -0.11 0.00 0.02 0.00 0.00 61.00 61.25 2icy s PRO 65 Cb -0.22 -1.59 -0.01 0.00 0.02 0.00 0.00 34.50 32.70 2icy s PRO 65 CO 0.17 -3.77 1.05 0.08 -0.33 0.00 0.00 177.00 174.20 2icy s VAL 66 N -3.09 4.29 0.88 3.83 1.01 -1.26 -4.95 120.40 121.11 2icy s VAL 66 Ca 0.72 0.75 -0.11 0.00 0.00 0.00 0.00 61.98 63.34 2icy s VAL 66 Cb -0.08 -3.58 0.17 0.00 0.00 0.00 0.00 36.38 32.89 2icy s VAL 66 CO 0.56 -0.97 1.21 -0.94 0.00 0.00 0.00 175.10 174.96 2icy s SER 67 N -3.94 3.58 0.02 3.32 1.04 -1.26 -5.04 113.70 111.42 2icy s SER 67 Ca 0.57 0.09 -0.19 0.00 0.48 0.00 0.00 55.95 56.90 2icy s SER 67 Cb -0.13 -0.26 -0.24 0.00 0.10 0.00 0.00 66.02 65.48 2icy s SER 67 CO 0.54 -2.41 1.10 1.56 0.98 0.00 0.00 173.24 175.01 2icy h GLN 68 N -1.26 0.47 -6.01 4.02 1.08 -2.04 -3.44 115.11 107.93 2icy h GLN 68 Ca -0.42 -0.53 -0.62 0.00 -1.45 0.00 0.00 58.65 55.63 2icy h GLN 68 Cb 1.25 0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 28.83 2icy h GLN 68 CO 0.40 1.17 1.44 -3.47 -0.95 0.00 0.00 178.83 177.43 2icy n ASP 69 N -4.12 2.89 -0.51 1.46 -0.08 -1.26 -4.78 116.55 110.15 2icy n ASP 69 Ca -0.11 0.33 0.44 0.00 -1.51 0.00 0.00 54.79 53.94 2icy n ASP 69 Cb 0.74 -1.44 0.79 0.00 2.34 0.00 0.00 41.12 43.54 2icy n ASP 69 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 2icy h VAL 70 N 7.01 0.20 -0.77 5.18 2.07 -2.02 -1.85 116.25 126.08 2icy h VAL 70 Ca -0.37 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.29 2icy h VAL 70 Cb 1.27 0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 2icy h VAL 70 CO 0.98 0.00 0.51 0.00 0.02 0.00 0.00 177.57 179.08 2icy h ALA 71 N 1.19 2.00 0.00 1.67 0.00 -1.97 0.55 119.26 122.70 2icy h ALA 71 Ca 0.75 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.59 2icy h ALA 71 Cb 3.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 20.73 2icy h ALA 71 CO -0.01 -0.19 -0.35 1.49 0.00 0.00 0.00 179.25 180.18 2icy h GLU 72 N 0.51 0.00 0.20 0.00 4.81 -1.71 -1.17 114.58 117.23 2icy h GLU 72 Ca 0.37 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 59.29 2icy h GLU 72 Cb 0.73 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.14 2icy h GLU 72 CO -0.13 0.35 -1.38 1.15 -0.73 0.00 0.00 179.01 178.27 2icy h THR 73 N 0.00 1.36 -0.49 0.32 2.02 -1.12 -2.86 112.91 112.13 2icy h THR 73 Ca -0.00 -2.81 -0.10 0.00 0.77 0.00 0.00 66.41 64.27 2icy h THR 73 Cb 0.79 2.98 -0.02 0.00 -1.74 0.00 0.00 68.15 70.16 2icy h THR 73 CO 0.05 0.84 -0.08 0.50 0.37 0.00 0.00 175.52 177.19 2icy h LYS 74 N 0.13 0.93 -0.32 6.66 3.64 -0.90 -0.80 116.57 125.92 2icy h LYS 74 Ca -0.21 -0.34 -0.05 0.00 -1.27 0.00 0.00 60.65 58.78 2icy h LYS 74 Cb 2.08 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 33.82 2icy h LYS 74 CO 0.25 0.99 -0.03 -0.91 -2.27 0.00 0.00 179.45 177.49 2icy h ASN 75 N 0.78 0.48 -0.12 4.20 2.35 -1.29 0.76 115.58 122.75 2icy h ASN 75 Ca 0.13 -0.09 -0.11 0.00 -0.55 0.00 0.00 56.30 55.67 2icy h ASN 75 Cb 0.63 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.88 2icy h ASN 75 CO 0.04 0.57 -0.37 -0.07 -1.65 0.00 0.00 177.43 175.95 2icy h LEU 76 N 0.48 0.53 -1.70 1.61 3.38 -1.21 -3.18 115.31 115.22 2icy h LEU 76 Ca 0.10 -0.60 -0.04 0.00 0.09 0.00 0.00 57.88 57.43 2icy h LEU 76 Cb 0.36 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2icy h LEU 76 CO 0.01 1.04 -0.17 -0.07 0.09 0.00 0.00 178.44 179.34 2icy h LEU 77 N 0.04 0.00 -0.39 1.67 3.38 -0.65 -1.32 115.31 118.05 2icy h LEU 77 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2icy h LEU 77 Cb 0.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2icy h LEU 77 CO 0.08 0.17 0.00 0.47 0.09 0.00 0.00 178.44 179.25 2icy n ASP 78 N -4.17 0.22 -0.71 -0.43 8.00 0.22 -1.91 116.55 117.77 2icy n ASP 78 Ca -0.02 0.58 0.08 0.00 0.71 0.00 0.00 54.79 56.14 2icy n ASP 78 Cb 0.25 -0.62 0.10 0.00 -0.02 0.00 0.00 41.12 40.83 2icy n ASP 78 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2icy n LYS 79 N -1.77 1.56 -4.18 -1.24 5.02 -0.50 -4.68 118.16 112.37 2icy n LYS 79 Ca 0.01 -1.63 -0.36 0.00 -2.02 0.00 0.00 58.31 54.32 2icy n LYS 79 Cb 0.10 -1.33 -0.08 0.00 -0.02 0.00 0.00 35.03 33.70 2icy n LYS 79 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2icy s LEU 80 N -1.30 3.88 -0.11 -0.35 2.96 -0.80 0.12 118.68 123.07 2icy s LEU 80 Ca 0.22 0.25 0.02 0.00 -0.22 0.00 0.00 54.13 54.40 2icy s LEU 80 Cb 0.14 -1.92 -0.01 0.00 0.50 0.00 0.00 46.19 44.91 2icy s LEU 80 CO 0.21 0.38 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.74 2icy s VAL 81 N -0.85 2.52 -0.24 1.68 1.01 -0.44 -4.36 120.40 119.72 2icy s VAL 81 Ca 0.13 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 61.17 2icy s VAL 81 Cb -0.12 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 2icy s VAL 81 CO 0.03 0.54 0.11 -0.69 0.00 0.00 0.00 175.10 175.09 2icy s VAL 82 N 0.32 4.82 -0.08 2.92 1.01 -0.98 0.37 120.40 128.78 2icy s VAL 82 Ca -0.15 -0.01 0.05 0.00 0.00 0.00 0.00 61.98 61.88 2icy s VAL 82 Cb -0.17 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 2icy s VAL 82 CO 0.07 0.35 -0.24 -0.22 0.00 0.00 0.00 175.10 175.07 2icy s LEU 83 N 1.22 2.11 -0.32 3.92 0.20 0.16 -0.46 118.68 125.51 2icy s LEU 83 Ca 0.06 -0.52 -0.02 0.00 0.69 0.00 0.00 54.13 54.33 2icy s LEU 83 Cb -0.14 -1.40 0.06 0.00 -0.43 0.00 0.00 46.19 44.27 2icy s LEU 83 CO 0.05 0.21 0.03 -0.54 -0.29 0.00 0.00 176.35 175.81 2icy s LYS 84 N 0.06 2.40 -0.18 1.98 -0.14 -0.23 0.40 119.74 124.02 2icy s LYS 84 Ca -0.10 -1.32 -0.31 0.00 -1.36 0.00 0.00 55.97 52.87 2icy s LYS 84 Cb -0.16 -3.26 -0.09 0.00 -1.68 0.00 0.00 37.83 32.65 2icy s LYS 84 CO 0.06 -0.68 2.10 1.28 -0.76 0.00 0.00 175.35 177.35 2icy n LEU 85 N 4.64 3.19 -2.13 3.17 4.77 -0.55 -0.86 117.00 129.22 2icy n LEU 85 Ca -0.12 0.54 -0.01 0.00 -0.03 0.00 0.00 56.01 56.40 2icy n LEU 85 Cb 0.43 -1.44 0.05 0.00 -2.33 0.00 0.00 43.42 40.13 2icy n LEU 85 CO 0.28 -0.42 0.06 -3.20 -1.33 0.00 0.00 177.39 172.78 2icy n ASN 86 N 9.46 1.71 0.00 -1.43 5.15 0.23 -2.65 115.26 127.73 2icy n ASN 86 Ca 0.29 -2.32 0.10 0.00 -0.60 0.00 0.00 54.58 52.06 2icy n ASN 86 Cb 0.36 -0.41 -0.09 0.00 -0.53 0.00 0.00 39.78 39.11 2icy n ASN 86 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2icy n GLY 87 N -0.26 -1.03 3.88 8.20 0.00 0.20 -4.23 105.19 111.95 2icy n GLY 87 Ca 0.11 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 2icy n GLY 87 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2icy s GLY 88 N -3.20 2.17 0.04 -0.02 0.00 -1.26 -4.42 107.32 100.62 2icy s GLY 88 Ca 0.06 -0.35 -0.15 0.00 0.00 0.00 0.00 44.72 44.28 2icy s GLY 88 CO 0.86 -0.22 0.46 1.08 0.00 0.00 0.00 173.10 175.27 2icy s LEU 89 N -3.00 4.47 -1.33 0.66 1.43 -1.26 -4.23 118.68 115.41 2icy s LEU 89 Ca 0.46 1.03 -0.12 0.00 -1.03 0.00 0.00 54.13 54.47 2icy s LEU 89 Cb -0.11 -2.75 0.12 0.00 0.03 0.00 0.00 46.19 43.47 2icy s LEU 89 CO 0.24 0.28 1.91 0.61 0.23 0.00 0.00 176.35 179.62 2icy n GLY 90 N 1.63 4.21 0.13 -3.19 0.00 -1.10 -4.61 105.19 102.26 2icy n GLY 90 Ca -0.12 -1.85 -0.06 0.00 0.00 0.00 0.00 46.02 43.99 2icy n GLY 90 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2icy h THR 91 N 4.16 1.48 0.00 2.61 1.35 -1.88 1.27 112.91 121.89 2icy h THR 91 Ca 0.45 -2.43 0.00 0.00 -0.55 0.00 0.00 66.41 63.88 2icy h THR 91 Cb 0.69 2.32 0.00 0.00 -1.73 0.00 0.00 68.15 69.43 2icy h THR 91 CO 1.64 0.71 0.00 0.41 -0.25 0.00 0.00 175.52 178.03 2icy n THR 92 N -3.71 0.55 -1.32 6.82 -1.04 -1.26 0.45 114.28 114.77 2icy n THR 92 Ca -0.02 0.14 0.01 0.00 -2.04 0.00 0.00 64.05 62.13 2icy n THR 92 Cb 0.73 -1.10 0.01 0.00 -1.82 0.00 0.00 70.33 68.16 2icy n THR 92 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 2icy n MET 93 N -1.15 0.42 -3.71 -2.82 2.81 -1.09 -4.80 117.12 106.78 2icy n MET 93 Ca 0.02 -1.01 -0.25 0.00 -1.81 0.00 0.00 57.70 54.64 2icy n MET 93 Cb 0.01 -0.65 0.06 0.00 -0.71 0.00 0.00 33.22 31.93 2icy n MET 93 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2icy n GLY 94 N -0.20 -0.47 3.74 3.03 0.00 0.17 -0.88 105.19 110.58 2icy n GLY 94 Ca 0.02 0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 2icy n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2icy h THR 96 N 4.25 0.00 -0.52 0.00 1.35 -1.93 -3.40 112.91 112.67 2icy h THR 96 Ca -0.43 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 64.68 2icy h THR 96 Cb 1.20 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 2icy h THR 96 CO 0.72 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.60 2icy n GLY 97 N 0.87 5.46 3.78 5.82 0.00 -1.26 -5.01 105.19 114.85 2icy n GLY 97 Ca 0.04 -1.36 -0.37 0.00 0.00 0.00 0.00 46.02 44.33 2icy n GLY 97 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2icy s PRO 98 N 1.77 4.13 0.54 1.61 0.04 -1.26 -2.73 135.00 139.10 2icy s PRO 98 Ca 0.00 1.56 0.27 0.00 0.04 0.00 0.00 61.00 62.87 2icy s PRO 98 Cb 0.00 -2.55 1.42 0.00 0.04 0.00 0.00 34.50 33.41 2icy s PRO 98 CO 0.00 -0.18 1.97 -0.22 0.04 0.00 0.00 177.00 178.61 2icy h LYS 99 N 2.49 0.00 0.00 4.56 3.64 -1.90 -2.49 116.57 122.88 2icy h LYS 99 Ca -0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2icy h LYS 99 Cb 1.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2icy h LYS 99 CO 0.62 0.00 0.00 -1.13 -2.27 0.00 0.00 179.45 176.67 2icy n SER 100 N -4.31 0.45 -1.06 4.20 3.41 -1.26 -2.09 113.62 112.96 2icy n SER 100 Ca 0.11 0.63 0.11 0.00 -0.26 0.00 0.00 58.87 59.46 2icy n SER 100 Cb 0.67 -0.72 0.27 0.00 -0.26 0.00 0.00 64.21 64.17 2icy n SER 100 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2icy n VAL 101 N -2.02 0.60 -2.42 -3.33 0.24 -0.94 -2.25 118.33 108.21 2icy n VAL 101 Ca 0.02 -0.72 -0.40 0.00 -2.04 0.00 0.00 64.34 61.20 2icy n VAL 101 Cb 0.17 0.63 -0.04 0.00 -1.47 0.00 0.00 33.84 33.14 2icy n VAL 101 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2icy s ILE 102 N -1.40 3.38 0.20 1.34 1.01 -0.89 -4.87 121.20 119.97 2icy s ILE 102 Ca 0.39 1.31 -0.30 0.00 0.00 0.00 0.00 60.65 62.05 2icy s ILE 102 Cb 0.21 -3.80 -0.08 0.00 0.01 0.00 0.00 42.46 38.80 2icy s ILE 102 CO 0.29 0.25 1.16 -1.61 0.00 0.00 0.00 174.94 175.03 2icy s GLU 103 N -1.75 4.54 -0.26 2.79 2.02 -1.26 -3.17 118.70 121.61 2icy s GLU 103 Ca 0.49 1.83 -0.10 0.00 0.02 0.00 0.00 54.97 57.20 2icy s GLU 103 Cb -0.31 -3.24 -0.15 0.00 0.10 0.00 0.00 34.13 30.53 2icy s GLU 103 CO 0.40 0.00 -0.22 0.28 0.02 0.00 0.00 175.26 175.75 2icy n VAL 104 N 2.20 1.54 0.00 2.63 0.31 0.12 -4.92 118.33 120.21 2icy n VAL 104 Ca 0.03 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 63.95 2icy n VAL 104 Cb 0.45 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.61 2icy n VAL 104 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 2icy n ARG 105 N -3.97 0.00 -2.52 5.55 1.85 -1.13 -4.52 116.66 111.92 2icy n ARG 105 Ca -0.49 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.22 2icy n ARG 105 Cb 0.90 0.00 -0.00 0.00 -1.05 0.00 0.00 32.46 32.31 2icy n ARG 105 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2icy n ASP 106 N 0.00 -4.32 -1.62 2.89 9.92 -1.26 -1.80 116.55 120.36 2icy n ASP 106 Ca 0.00 0.10 -0.11 0.00 -0.53 0.00 0.00 54.79 54.25 2icy n ASP 106 Cb 0.00 -3.64 0.02 0.00 -0.64 0.00 0.00 41.12 36.86 2icy n ASP 106 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2icy n GLY 107 N -0.89 0.14 2.90 0.44 0.00 -1.26 -5.06 105.19 101.46 2icy n GLY 107 Ca -0.15 -0.33 -0.13 0.00 0.00 0.00 0.00 46.02 45.40 2icy n GLY 107 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2icy s LEU 108 N -3.51 1.36 0.73 0.99 1.43 -0.74 -5.04 118.68 113.90 2icy s LEU 108 Ca 0.17 0.15 -0.07 0.00 -1.03 0.00 0.00 54.13 53.35 2icy s LEU 108 Cb -0.07 0.20 0.07 0.00 0.03 0.00 0.00 46.19 46.42 2icy s LEU 108 CO 0.21 -0.08 1.05 0.42 0.23 0.00 0.00 176.35 178.18 2icy s THR 109 N 0.52 2.23 0.18 5.49 -4.23 -1.26 0.16 115.64 118.74 2icy s THR 109 Ca -0.04 -0.25 -0.13 0.00 -1.18 0.00 0.00 61.69 60.10 2icy s THR 109 Cb -0.06 -2.98 0.10 0.00 1.34 0.00 0.00 72.50 70.90 2icy s THR 109 CO -0.02 0.00 1.74 -0.26 -0.54 0.00 0.00 174.62 175.54 2icy h PHE 110 N -0.70 0.29 -0.78 3.99 0.04 -1.44 -1.44 116.94 116.91 2icy h PHE 110 Ca -0.44 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.35 2icy h PHE 110 Cb 1.31 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 39.37 2icy h PHE 110 CO 0.22 0.09 0.47 -0.07 -0.60 0.00 0.00 178.31 178.42 2icy h LEU 111 N 0.34 0.93 -0.12 1.54 3.38 -1.75 -1.34 115.31 118.28 2icy h LEU 111 Ca 0.24 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.20 2icy h LEU 111 Cb 0.27 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 2icy h LEU 111 CO -0.26 0.71 -0.07 0.44 0.09 0.00 0.00 178.44 179.35 2icy h ASP 112 N 1.07 -0.23 -0.99 -0.43 3.32 -1.59 -1.54 116.42 116.02 2icy h ASP 112 Ca 0.28 0.05 0.02 0.00 0.02 0.00 0.00 57.03 57.40 2icy h ASP 112 Cb -0.05 0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.57 2icy h ASP 112 CO -0.05 -0.10 0.66 -0.07 -1.72 0.00 0.00 179.24 177.96 2icy h LEU 113 N -0.07 1.12 -0.20 1.55 3.38 -0.79 -0.89 115.31 119.41 2icy h LEU 113 Ca 0.07 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2icy h LEU 113 Cb 0.17 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2icy h LEU 113 CO -0.17 0.81 0.11 0.40 0.09 0.00 0.00 178.44 179.68 2icy h ILE 114 N 1.32 1.11 -0.36 1.22 2.04 -0.85 0.33 117.51 122.32 2icy h ILE 114 Ca 0.37 -0.31 -0.06 0.00 1.00 0.00 0.00 64.86 65.86 2icy h ILE 114 Cb -0.12 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 2icy h ILE 114 CO -0.09 0.11 -0.00 0.58 0.00 0.00 0.00 178.15 178.75 2icy h VAL 115 N 0.22 1.26 -0.94 1.67 2.07 -1.05 -2.78 116.25 116.70 2icy h VAL 115 Ca 0.07 -0.99 0.04 0.00 0.82 0.00 0.00 66.70 66.64 2icy h VAL 115 Cb 0.08 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 30.97 2icy h VAL 115 CO -0.01 0.33 0.61 0.40 0.02 0.00 0.00 177.57 178.92 2icy h ILE 116 N 0.46 1.14 -0.80 4.57 2.04 -0.91 -1.51 117.51 122.50 2icy h ILE 116 Ca 0.10 -0.40 -0.03 0.00 1.00 0.00 0.00 64.86 65.53 2icy h ILE 116 Cb 0.46 -0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 36.38 2icy h ILE 116 CO 0.02 0.21 0.39 1.56 0.00 0.00 0.00 178.15 180.34 2icy h GLN 117 N 1.17 1.14 -0.14 2.37 4.20 -0.66 -1.25 115.11 121.95 2icy h GLN 117 Ca 0.38 -0.16 -0.18 0.00 0.06 0.00 0.00 58.65 58.76 2icy h GLN 117 Cb 0.03 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.60 2icy h GLN 117 CO -0.13 0.87 -0.65 0.82 -0.67 0.00 0.00 178.83 179.07 2icy h ILE 118 N 1.14 1.34 -0.77 2.54 1.08 -1.29 -0.12 117.51 121.42 2icy h ILE 118 Ca 0.28 -1.96 -0.06 0.00 -0.39 0.00 0.00 64.86 62.74 2icy h ILE 118 Cb 0.10 1.93 -0.03 0.00 -3.07 0.00 0.00 36.82 35.75 2icy h ILE 118 CO -0.04 0.60 0.26 -0.08 -0.69 0.00 0.00 178.15 178.20 2icy h GLU 119 N 0.38 1.18 0.06 2.37 4.81 -1.05 -2.83 114.58 119.50 2icy h GLU 119 Ca -0.01 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 58.97 2icy h GLU 119 Cb 1.21 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.42 2icy h GLU 119 CO 0.12 0.99 -0.03 -0.91 -0.73 0.00 0.00 179.01 178.45 2icy h ASN 120 N 1.14 -0.07 -0.82 1.04 2.35 -0.88 -2.50 115.58 115.84 2icy h ASN 120 Ca 0.25 -0.26 0.08 0.00 -0.55 0.00 0.00 56.30 55.82 2icy h ASN 120 Cb 0.29 0.02 -0.06 0.00 0.05 0.00 0.00 38.32 38.62 2icy h ASN 120 CO -0.01 0.23 0.53 0.25 -1.65 0.00 0.00 177.43 176.78 2icy h LEU 121 N -0.37 0.73 -0.61 1.61 5.85 -1.06 -0.03 115.31 121.43 2icy h LEU 121 Ca -0.01 0.01 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 2icy h LEU 121 Cb 0.33 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2icy h LEU 121 CO 0.01 0.45 -0.60 0.78 -0.34 0.00 0.00 178.44 178.74 2icy h ASN 122 N 0.82 0.35 0.66 1.25 2.35 -1.51 -2.44 115.58 117.06 2icy h ASN 122 Ca 0.37 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.89 2icy h ASN 122 Cb 0.36 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.62 2icy h ASN 122 CO -0.14 0.87 -0.12 0.78 -1.65 0.00 0.00 177.43 177.16 2icy h ASN 123 N 0.23 0.00 0.10 5.81 2.35 -0.56 -1.71 115.58 121.80 2icy h ASN 123 Ca -0.01 0.00 -0.37 0.00 -0.55 0.00 0.00 56.30 55.37 2icy h ASN 123 Cb 1.12 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.46 2icy h ASN 123 CO 0.10 0.12 -2.13 1.17 -1.65 0.00 0.00 177.43 175.04 2icy n LYS 124 N -3.40 0.73 -0.00 0.81 4.81 -0.73 -4.71 118.16 115.65 2icy n LYS 124 Ca -0.01 0.23 0.06 0.00 -0.87 0.00 0.00 58.31 57.73 2icy n LYS 124 Cb 0.30 -1.66 -0.09 0.00 0.02 0.00 0.00 35.03 33.61 2icy n LYS 124 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2icy n TYR 125 N -3.40 0.00 -0.17 5.64 4.01 -0.94 -5.02 117.16 117.29 2icy n TYR 125 Ca -0.35 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.39 2icy n TYR 125 Cb 1.03 -0.16 0.00 0.00 -0.31 0.00 0.00 39.34 39.90 2icy n TYR 125 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2icy n GLY 126 N 1.53 1.08 3.86 2.72 0.00 -0.64 -4.88 105.19 108.86 2icy n GLY 126 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2icy n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2icy n LYS 128 N -3.17 3.01 -2.36 0.00 5.02 -1.26 -4.55 118.16 114.84 2icy n LYS 128 Ca 0.07 -4.68 -0.42 0.00 -2.02 0.00 0.00 58.31 51.26 2icy n LYS 128 Cb 0.57 -2.31 -0.03 0.00 -0.02 0.00 0.00 35.03 33.25 2icy n LYS 128 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2icy s VAL 129 N -2.77 4.08 0.39 -0.18 1.01 -1.26 -4.97 120.40 116.70 2icy s VAL 129 Ca 0.39 1.40 -0.10 0.00 0.00 0.00 0.00 61.98 63.67 2icy s VAL 129 Cb 0.15 -3.90 -0.06 0.00 0.00 0.00 0.00 36.38 32.56 2icy s VAL 129 CO -0.00 -0.04 0.75 -2.16 0.00 0.00 0.00 175.10 173.65 2icy s PRO 130 N 2.69 3.76 -0.12 2.72 0.04 -1.26 -4.53 135.00 138.29 2icy s PRO 130 Ca 0.59 0.43 0.00 0.00 0.04 0.00 0.00 61.00 62.06 2icy s PRO 130 Cb -0.26 -2.41 -0.01 0.00 0.04 0.00 0.00 34.50 31.85 2icy s PRO 130 CO 0.22 -0.01 -0.14 -1.17 0.04 0.00 0.00 177.00 175.93 2icy s LEU 131 N -3.82 2.64 -0.04 -3.56 2.96 -0.60 -2.31 118.68 113.94 2icy s LEU 131 Ca 0.51 -0.35 0.05 0.00 -0.22 0.00 0.00 54.13 54.11 2icy s LEU 131 Cb -0.10 -1.58 -0.01 0.00 0.50 0.00 0.00 46.19 45.00 2icy s LEU 131 CO 0.31 0.17 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.63 2icy s VAL 132 N 0.32 1.60 -0.18 1.68 1.01 0.40 -0.25 120.40 124.98 2icy s VAL 132 Ca -0.11 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.02 2icy s VAL 132 Cb -0.16 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.85 2icy s VAL 132 CO 0.06 0.46 -0.09 -0.76 0.00 0.00 0.00 175.10 174.77 2icy s LEU 133 N -0.10 2.78 -0.40 3.92 1.43 -0.24 -1.07 118.68 125.00 2icy s LEU 133 Ca -0.02 -0.38 -0.23 0.00 -1.03 0.00 0.00 54.13 52.47 2icy s LEU 133 Cb -0.11 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.45 2icy s LEU 133 CO 0.02 0.06 0.79 -0.32 0.23 0.00 0.00 176.35 177.13 2icy s MET 134 N 0.99 3.61 0.43 1.70 -2.45 -0.04 -2.17 119.30 121.37 2icy s MET 134 Ca -0.01 0.15 0.08 0.00 -1.25 0.00 0.00 55.69 54.66 2icy s MET 134 Cb -0.15 -3.86 -0.01 0.00 1.25 0.00 0.00 34.83 32.06 2icy s MET 134 CO -0.01 -0.97 0.44 -0.80 1.05 0.00 0.00 175.02 174.73 2icy s ASN 135 N 1.98 5.16 0.33 1.11 0.01 0.44 0.75 114.94 124.72 2icy s ASN 135 Ca 0.31 -0.71 0.04 0.00 -0.71 0.00 0.00 52.86 51.79 2icy s ASN 135 Cb -0.13 -0.50 -0.03 0.00 0.41 0.00 0.00 41.25 41.00 2icy s ASN 135 CO 0.20 -0.73 0.17 -0.94 -1.51 0.00 0.00 177.10 174.28 2icy s SER 136 N -4.21 1.88 0.40 -1.22 1.04 -1.26 0.42 113.70 110.74 2icy s SER 136 Ca 0.49 -1.61 0.26 0.00 0.48 0.00 0.00 55.95 55.58 2icy s SER 136 Cb -0.05 0.43 1.44 0.00 0.10 0.00 0.00 66.02 67.94 2icy s SER 136 CO 0.29 -0.92 1.81 2.19 0.98 0.00 0.00 173.24 177.59 2icy h PHE 137 N 2.10 0.00 0.16 5.02 -5.15 -1.89 -2.73 116.94 114.46 2icy h PHE 137 Ca -0.33 0.00 -0.36 0.00 -0.20 0.00 0.00 57.97 57.09 2icy h PHE 137 Cb 1.25 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.42 2icy h PHE 137 CO 1.24 0.00 -1.84 -0.91 -2.00 0.00 0.00 178.31 174.80 2icy h ASN 138 N 0.00 0.53 0.10 -0.68 2.35 -1.95 -3.41 115.58 112.52 2icy h ASN 138 Ca 0.00 -0.92 0.00 0.00 -0.55 0.00 0.00 56.30 54.83 2icy h ASN 138 Cb 0.01 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.21 2icy h ASN 138 CO 0.00 1.80 -0.69 0.35 -1.65 0.00 0.00 177.43 177.24 2icy n THR 139 N -3.54 0.00 -0.18 2.81 -2.24 -1.06 -4.58 114.28 105.48 2icy n THR 139 Ca -0.27 -0.09 -0.07 0.00 -2.27 0.00 0.00 64.05 61.35 2icy n THR 139 Cb 1.07 0.88 0.02 0.00 -2.10 0.00 0.00 70.33 70.20 2icy n THR 139 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 2icy h HIS 140 N 0.83 0.70 -0.26 4.78 -0.00 -1.74 -2.70 115.15 116.77 2icy h HIS 140 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 2icy h HIS 140 Cb 0.57 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.74 2icy h HIS 140 CO 0.00 0.48 0.17 -0.44 -0.00 0.00 0.00 177.93 178.14 2icy h ASP 141 N 0.72 0.29 0.03 3.26 3.32 -1.89 0.19 116.42 122.33 2icy h ASP 141 Ca 0.19 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.15 2icy h ASP 141 Cb -0.01 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 2icy h ASP 141 CO -0.04 0.21 -0.26 0.44 -1.72 0.00 0.00 179.24 177.87 2icy h ASP 142 N 0.34 0.38 -0.20 6.45 3.32 -1.87 -3.10 116.42 121.74 2icy h ASP 142 Ca 0.09 -0.12 -0.13 0.00 0.02 0.00 0.00 57.03 56.89 2icy h ASP 142 Cb -0.04 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.41 2icy h ASP 142 CO -0.02 0.64 -0.40 0.74 -1.72 0.00 0.00 179.24 178.48 2icy h THR 143 N 0.34 1.32 -0.92 0.35 2.02 -1.10 -3.17 112.91 111.74 2icy h THR 143 Ca 0.05 -1.62 0.08 0.00 0.77 0.00 0.00 66.41 65.69 2icy h THR 143 Cb 0.64 1.85 -0.07 0.00 -1.74 0.00 0.00 68.15 68.83 2icy h THR 143 CO 0.05 0.50 0.58 -0.74 0.37 0.00 0.00 175.52 176.28 2icy h HIS 144 N 0.32 1.06 0.25 3.16 -0.00 -0.58 -0.42 115.15 118.94 2icy h HIS 144 Ca 0.01 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.41 2icy h HIS 144 Cb 1.00 -0.34 -0.02 0.00 -0.00 0.00 0.00 27.41 28.04 2icy h HIS 144 CO 0.09 0.51 -0.26 0.87 -0.00 0.00 0.00 177.93 179.14 2icy h LYS 145 N 1.02 -0.53 -0.61 5.26 1.57 -1.52 -0.25 116.57 121.51 2icy h LYS 145 Ca 0.41 0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 59.19 2icy h LYS 145 Cb 0.24 0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.64 2icy h LYS 145 CO -0.20 -0.35 0.21 0.82 -0.57 0.00 0.00 179.45 179.37 2icy h ILE 146 N -0.55 1.23 -0.34 1.86 1.08 -1.48 -3.24 117.51 116.07 2icy h ILE 146 Ca -0.01 -0.75 -0.08 0.00 -0.39 0.00 0.00 64.86 63.63 2icy h ILE 146 Cb 0.51 0.53 -0.01 0.00 -3.07 0.00 0.00 36.82 34.77 2icy h ILE 146 CO -0.06 0.29 -0.12 0.58 -0.69 0.00 0.00 178.15 178.16 2icy h VAL 147 N 0.89 1.28 -0.13 1.67 2.07 -0.27 -2.76 116.25 119.00 2icy h VAL 147 Ca 0.21 -1.20 0.04 0.00 0.82 0.00 0.00 66.70 66.56 2icy h VAL 147 Cb 0.22 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 2icy h VAL 147 CO -0.01 0.39 0.15 -0.08 0.02 0.00 0.00 177.57 178.04 2icy h GLU 148 N 0.46 0.00 -0.06 1.57 4.81 -1.09 0.08 114.58 120.34 2icy h GLU 148 Ca 0.08 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2icy h GLU 148 Cb 0.63 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.01 2icy h GLU 148 CO 0.04 0.00 0.09 0.87 -0.73 0.00 0.00 179.01 179.28 2icy h LYS 149 N 0.00 0.00 -0.51 1.92 1.57 -1.53 -2.93 116.57 115.09 2icy h LYS 149 Ca 0.06 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.71 2icy h LYS 149 Cb 0.36 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.60 2icy h LYS 149 CO -0.00 0.00 0.11 0.66 -0.57 0.00 0.00 179.45 179.65 2icy n TYR 150 N -3.58 1.73 -0.30 -1.35 4.02 0.02 -4.67 117.16 113.02 2icy n TYR 150 Ca -0.01 -1.13 0.08 0.00 -0.01 0.00 0.00 57.90 56.83 2icy n TYR 150 Cb 0.18 -0.53 0.24 0.00 -0.02 0.00 0.00 39.34 39.22 2icy n TYR 150 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 176.86 177.00 2icy h THR 151 N 2.22 0.71 -0.58 -0.72 2.02 -1.64 0.80 112.91 115.72 2icy h THR 151 Ca 0.16 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.12 2icy h THR 151 Cb 1.93 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 2icy h THR 151 CO 0.50 0.12 0.00 0.59 0.37 0.00 0.00 175.52 177.10 2icy n ASN 152 N -4.86 3.61 -4.86 4.18 3.02 -1.26 -4.95 115.26 110.13 2icy n ASN 152 Ca 0.18 -2.16 -0.31 0.00 -0.03 0.00 0.00 54.58 52.26 2icy n ASN 152 Cb 0.46 -0.46 0.04 0.00 -0.61 0.00 0.00 39.78 39.21 2icy n ASN 152 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2icy s SER 153 N -0.92 5.60 -0.90 6.41 0.01 0.27 -4.92 113.70 119.24 2icy s SER 153 Ca 0.42 1.31 -0.06 0.00 1.31 0.00 0.00 55.95 58.93 2icy s SER 153 Cb 0.24 -2.20 -0.03 0.00 0.21 0.00 0.00 66.02 64.24 2icy s SER 153 CO 0.25 -1.27 2.89 -3.20 0.41 0.00 0.00 173.24 172.32 2icy n ASN 154 N -2.98 7.25 -3.62 2.44 5.15 -1.26 -4.73 115.26 117.51 2icy n ASN 154 Ca 0.07 -2.88 -0.04 0.00 -0.60 0.00 0.00 54.58 51.13 2icy n ASN 154 Cb 0.55 -1.39 -0.06 0.00 -0.53 0.00 0.00 39.78 38.35 2icy n ASN 154 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2icy s VAL 155 N -0.15 -0.21 -0.10 3.44 0.11 -1.26 -3.80 120.40 118.44 2icy s VAL 155 Ca 0.62 0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 59.39 2icy s VAL 155 Cb 0.26 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 34.09 2icy s VAL 155 CO -0.10 0.00 0.94 -1.81 -3.33 0.00 0.00 175.10 170.80 2icy s ASP 156 N 1.83 7.18 -0.24 3.54 1.01 -1.26 -4.97 116.67 123.75 2icy s ASP 156 Ca -0.08 1.44 -0.06 0.00 0.71 0.00 0.00 52.55 54.55 2icy s ASP 156 Cb -0.06 -2.52 -0.02 0.00 1.01 0.00 0.00 42.92 41.33 2icy s ASP 156 CO -0.18 -0.39 0.03 -0.63 0.21 0.00 0.00 175.17 174.21 2icy s ILE 157 N 1.84 3.98 0.07 0.77 1.01 -1.26 -1.56 121.20 126.04 2icy s ILE 157 Ca 0.46 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.83 2icy s ILE 157 Cb -0.18 -2.85 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 2icy s ILE 157 CO 0.18 0.36 0.13 -1.00 0.00 0.00 0.00 174.94 174.61 2icy s HIS 158 N 1.57 3.32 0.01 3.97 3.76 0.65 -5.00 115.29 123.57 2icy s HIS 158 Ca 0.06 0.15 0.01 0.00 -0.15 0.00 0.00 55.06 55.13 2icy s HIS 158 Cb -0.15 -1.68 -0.01 0.00 1.11 0.00 0.00 32.58 31.85 2icy s HIS 158 CO 0.01 0.55 -0.03 0.95 -0.85 0.00 0.00 174.74 175.37 2icy s THR 159 N -1.42 0.19 0.01 1.30 -4.23 -1.26 -1.08 115.64 109.14 2icy s THR 159 Ca 0.31 -0.53 -0.05 0.00 -1.18 0.00 0.00 61.69 60.24 2icy s THR 159 Cb -0.12 -0.24 -0.00 0.00 1.34 0.00 0.00 72.50 73.47 2icy s THR 159 CO 0.24 -0.22 0.09 0.72 -0.54 0.00 0.00 174.62 174.90 2icy s PHE 160 N -0.75 0.10 0.06 3.99 -0.12 -0.92 -4.97 117.98 115.36 2icy s PHE 160 Ca -0.07 -0.25 -0.16 0.00 -0.05 0.00 0.00 56.93 56.40 2icy s PHE 160 Cb -0.05 -0.09 -0.06 0.00 -0.63 0.00 0.00 43.02 42.18 2icy s PHE 160 CO -0.00 -0.26 0.49 -0.80 -0.05 0.00 0.00 175.22 174.60 2icy s ASN 161 N -1.39 6.91 0.86 1.98 -0.87 -1.25 0.17 114.94 121.34 2icy s ASN 161 Ca -0.15 1.09 0.00 0.00 -1.57 0.00 0.00 52.86 52.23 2icy s ASN 161 Cb -0.08 -2.30 0.00 0.00 -0.02 0.00 0.00 41.25 38.85 2icy s ASN 161 CO 0.01 0.26 0.00 0.00 -2.57 0.00 0.00 177.10 174.80 2icy n GLN 162 N 1.58 -0.17 -1.52 -0.60 10.64 1.41 -4.86 117.38 123.85 2icy n GLN 162 Ca -0.11 0.00 -0.31 0.00 -1.83 0.00 0.00 57.00 54.75 2icy n GLN 162 Cb 0.52 0.00 0.06 0.00 -0.86 0.00 0.00 30.24 29.96 2icy n GLN 162 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 2icy s SER 163 N -1.18 5.11 -0.21 2.61 0.01 -1.26 -4.74 113.70 114.04 2icy s SER 163 Ca 0.00 1.73 -0.01 0.00 1.31 0.00 0.00 55.95 58.98 2icy s SER 163 Cb 0.00 -2.51 0.06 0.00 0.21 0.00 0.00 66.02 63.78 2icy s SER 163 CO 0.00 -1.62 -0.02 -0.75 0.41 0.00 0.00 173.24 171.26 2icy s LYS 164 N -4.85 1.20 0.22 12.44 2.20 -1.26 -4.23 119.74 125.46 2icy s LYS 164 Ca 0.60 -0.70 0.08 0.00 -0.36 0.00 0.00 55.97 55.59 2icy s LYS 164 Cb -0.16 -2.33 -0.04 0.00 -1.51 0.00 0.00 37.83 33.80 2icy s LYS 164 CO 0.53 -0.60 0.04 0.71 -0.36 0.00 0.00 175.35 175.67 2icy s TYR 165 N 1.61 2.86 0.19 4.03 2.02 -0.54 -4.92 117.35 122.60 2icy s TYR 165 Ca -0.03 -0.15 -0.28 0.00 -0.37 0.00 0.00 57.07 56.24 2icy s TYR 165 Cb -0.18 -1.33 -0.08 0.00 -0.40 0.00 0.00 41.96 39.97 2icy s TYR 165 CO -0.07 0.55 0.87 -1.25 -1.57 0.00 0.00 175.55 174.08 2icy s PRO 166 N -3.35 4.71 0.61 -1.71 0.04 -1.26 -0.80 135.00 133.24 2icy s PRO 166 Ca 0.30 1.34 -0.18 0.00 0.04 0.00 0.00 61.00 62.49 2icy s PRO 166 Cb -0.08 -3.29 -0.03 0.00 0.04 0.00 0.00 34.50 31.14 2icy s PRO 166 CO 0.20 0.49 1.22 1.03 0.04 0.00 0.00 177.00 179.99 2icy s ARG 167 N -0.96 2.86 -0.11 4.56 0.52 0.82 -4.82 118.95 121.81 2icy s ARG 167 Ca 0.40 1.86 0.00 0.00 -0.52 0.00 0.00 55.73 57.47 2icy s ARG 167 Cb -0.24 -1.91 -0.02 0.00 0.52 0.00 0.00 34.95 33.30 2icy s ARG 167 CO 0.29 -1.30 -0.11 0.08 0.02 0.00 0.00 175.30 174.27 2icy s VAL 168 N -1.58 3.24 -0.32 3.52 1.01 -1.12 -0.00 120.40 125.14 2icy s VAL 168 Ca 0.78 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.86 2icy s VAL 168 Cb -0.32 -2.35 0.01 0.00 0.00 0.00 0.00 36.38 33.72 2icy s VAL 168 CO 0.35 0.54 1.17 -0.69 0.00 0.00 0.00 175.10 176.47 2icy s VAL 169 N 0.03 4.34 0.28 2.92 1.01 0.06 -1.52 120.40 127.53 2icy s VAL 169 Ca -0.03 1.52 0.01 0.00 0.00 0.00 0.00 61.98 63.47 2icy s VAL 169 Cb -0.14 -4.33 0.28 0.00 0.00 0.00 0.00 36.38 32.19 2icy s VAL 169 CO 0.04 -0.52 1.86 0.00 0.00 0.00 0.00 175.10 176.48 2icy h ALA 170 N 8.64 1.50 0.59 5.51 0.00 1.50 0.78 119.26 137.78 2icy h ALA 170 Ca -0.23 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2icy h ALA 170 Cb 1.07 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.63 2icy h ALA 170 CO 1.04 0.29 -0.28 0.38 0.00 0.00 0.00 179.25 180.68 2icy h ASP 171 N 1.04 -0.67 1.62 0.00 3.04 -1.91 -3.23 116.42 116.32 2icy h ASP 171 Ca 0.46 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 54.28 2icy h ASP 171 Cb 0.37 0.17 0.00 0.00 -1.04 0.00 0.00 39.33 38.83 2icy h ASP 171 CO -0.22 -0.47 -0.14 -0.08 -2.04 0.00 0.00 179.24 176.29 2icy h GLU 172 N -0.81 0.00 -5.66 4.15 4.81 -1.93 -3.43 114.58 111.71 2icy h GLU 172 Ca -0.08 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.83 2icy h GLU 172 Cb 0.61 0.00 0.16 0.00 0.63 0.00 0.00 28.75 30.15 2icy h GLU 172 CO 0.13 0.00 -0.82 0.34 -0.73 0.00 0.00 179.01 177.93 2icy n PHE 173 N -2.66 -2.24 -4.19 0.92 7.35 0.27 -4.61 117.46 112.30 2icy n PHE 173 Ca 0.04 0.87 -0.11 0.00 -0.76 0.00 0.00 57.45 57.49 2icy n PHE 173 Cb 0.49 -4.55 -0.10 0.00 0.35 0.00 0.00 39.48 35.66 2icy n PHE 173 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 2icy s VAL 174 N -3.41 0.80 0.25 -2.13 -7.23 -1.19 -4.79 120.40 102.69 2icy s VAL 174 Ca 0.20 -1.95 -0.30 0.00 -1.81 0.00 0.00 61.98 58.12 2icy s VAL 174 Cb -0.03 -1.70 -0.10 0.00 0.56 0.00 0.00 36.38 35.10 2icy s VAL 174 CO 0.75 -0.84 1.48 -2.84 -0.31 0.00 0.00 175.10 173.35 2icy s PRO 175 N -3.77 4.23 0.32 4.82 0.02 -1.26 -0.76 135.00 138.60 2icy s PRO 175 Ca 0.13 2.36 0.00 0.00 0.02 0.00 0.00 61.00 63.51 2icy s PRO 175 Cb 0.04 -3.10 0.54 0.00 0.02 0.00 0.00 34.50 32.00 2icy s PRO 175 CO -0.04 -0.48 1.97 2.35 -0.33 0.00 0.00 177.00 180.47 2icy h TRP 176 N 5.20 0.88 0.00 6.54 7.01 -0.70 -0.47 115.95 134.40 2icy h TRP 176 Ca -0.46 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 60.53 2icy h TRP 176 Cb 1.22 -0.29 -0.00 0.00 -2.10 0.00 0.00 29.16 27.98 2icy h TRP 176 CO 0.60 0.58 -0.10 -1.35 -2.79 0.00 0.00 178.44 175.39 2icy h PRO 177 N 0.93 0.00 0.00 2.65 0.11 -1.77 -0.87 132.00 133.05 2icy h PRO 177 Ca 0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.35 2icy h PRO 177 Cb -0.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.06 2icy h PRO 177 CO -0.05 0.10 0.00 0.77 -0.21 0.00 0.00 178.00 178.61 2icy h SER 178 N 0.00 0.00 -0.33 -2.05 0.02 -1.41 -1.33 113.55 108.46 2icy h SER 178 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2icy h SER 178 Cb 0.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2icy h SER 178 CO 0.01 0.00 0.00 0.29 -1.14 0.00 0.00 176.83 175.99 2icy n LYS 179 N -2.77 2.35 0.00 3.45 5.02 -0.37 -4.95 118.16 120.88 2icy n LYS 179 Ca 0.01 -2.04 0.00 0.00 -2.02 0.00 0.00 58.31 54.26 2icy n LYS 179 Cb 0.27 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 2icy n LYS 179 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2icy n GLY 180 N 1.43 0.76 3.37 0.72 0.00 -0.50 -5.03 105.19 105.94 2icy n GLY 180 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.77 2icy n GLY 180 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2icy n LYS 181 N -0.99 3.39 0.00 1.61 3.00 -0.94 -4.66 118.16 119.56 2icy n LYS 181 Ca 0.00 -3.74 0.11 0.00 -0.00 0.00 0.00 58.31 54.69 2icy n LYS 181 Cb 0.00 -3.06 0.11 0.00 0.00 0.00 0.00 35.03 32.07 2icy n LYS 181 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2icy n THR 182 N 4.56 0.00 -1.28 3.15 -2.24 -1.26 -3.62 114.28 113.59 2icy n THR 182 Ca 0.39 -0.13 -0.30 0.00 -2.27 0.00 0.00 64.05 61.73 2icy n THR 182 Cb 0.42 0.83 0.23 0.00 -2.10 0.00 0.00 70.33 69.71 2icy n THR 182 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2icy s ASP 183 N -2.67 1.47 0.64 3.42 1.47 -1.26 -4.82 116.67 114.93 2icy s ASP 183 Ca 0.17 0.56 0.33 0.00 1.18 0.00 0.00 52.55 54.79 2icy s ASP 183 Cb 0.18 -0.77 1.84 0.00 -0.34 0.00 0.00 42.92 43.82 2icy s ASP 183 CO 0.64 -3.78 2.08 0.07 0.68 0.00 0.00 175.17 174.87 2icy h LYS 184 N -2.35 0.00 0.00 2.11 2.10 -1.96 0.32 116.57 116.80 2icy h LYS 184 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 2icy h LYS 184 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 2icy h LYS 184 CO 0.36 0.00 0.00 0.93 -2.00 0.00 0.00 179.45 178.74 2icy h GLU 185 N 0.00 0.00 -0.14 0.07 5.08 -1.89 -3.08 114.58 114.62 2icy h GLU 185 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2icy h GLU 185 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2icy h GLU 185 CO -0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 2icy n GLY 186 N 0.42 0.25 3.35 -3.84 0.00 0.10 -4.91 105.19 100.56 2icy n GLY 186 Ca 0.03 -0.43 -0.18 0.00 0.00 0.00 0.00 46.02 45.45 2icy n GLY 186 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2icy s TRP 187 N -1.83 1.63 0.05 1.61 0.52 -1.17 -0.13 118.94 119.62 2icy s TRP 187 Ca 0.33 -1.11 -0.25 0.00 0.02 0.00 0.00 56.10 55.09 2icy s TRP 187 Cb 0.18 -0.98 0.06 0.00 -1.15 0.00 0.00 33.47 31.58 2icy s TRP 187 CO 0.28 -0.24 0.59 1.52 0.02 0.00 0.00 176.95 179.12 2icy s TYR 188 N -3.63 -0.52 -0.05 -1.98 -0.85 0.02 -4.72 117.35 105.62 2icy s TYR 188 Ca 0.37 0.63 -0.27 0.00 -0.52 0.00 0.00 57.07 57.28 2icy s TYR 188 Cb 0.08 0.41 -0.03 0.00 0.38 0.00 0.00 41.96 42.80 2icy s TYR 188 CO 0.14 -0.68 0.85 -1.25 -1.52 0.00 0.00 175.55 173.08 2icy s PRO 189 N -2.38 4.48 0.00 -3.49 0.04 -1.26 -1.46 135.00 130.92 2icy s PRO 189 Ca -0.05 1.15 -0.03 0.00 0.04 0.00 0.00 61.00 62.11 2icy s PRO 189 Cb -0.01 -3.47 -0.14 0.00 0.04 0.00 0.00 34.50 30.92 2icy s PRO 189 CO -0.01 -0.04 2.84 -0.35 0.04 0.00 0.00 177.00 179.48 2icy n PRO 190 N 4.03 1.52 0.00 0.56 -0.04 -1.26 -4.94 135.00 134.87 2icy n PRO 190 Ca 0.03 -0.52 0.00 0.00 -0.04 0.00 0.00 63.50 62.97 2icy n PRO 190 Cb 0.51 -1.52 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 2icy n PRO 190 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2icy n GLY 191 N 2.02 -1.19 0.00 0.55 0.00 -1.26 -2.64 105.19 102.68 2icy n GLY 191 Ca 0.22 -1.61 0.11 0.00 0.00 0.00 0.00 46.02 44.74 2icy n GLY 191 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2icy n HIS 192 N -1.41 0.00 0.30 1.61 1.44 -1.25 -2.13 115.22 113.78 2icy n HIS 192 Ca 0.00 0.00 0.19 0.00 -2.01 0.00 0.00 57.72 55.90 2icy n HIS 192 Cb 0.00 -0.50 0.89 0.00 0.12 0.00 0.00 29.99 30.51 2icy n HIS 192 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 2icy h GLY 193 N 3.91 0.00 1.90 -1.39 0.00 0.40 -0.82 103.07 107.08 2icy h GLY 193 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2icy h GLY 193 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 176.54 177.88 2icy n ASP 194 N -3.19 0.00 -0.25 0.19 2.03 -0.91 -3.28 116.55 111.15 2icy n ASP 194 Ca -0.01 0.40 0.10 0.00 0.52 0.00 0.00 54.79 55.80 2icy n ASP 194 Cb 0.21 -0.45 0.36 0.00 -0.72 0.00 0.00 41.12 40.51 2icy n ASP 194 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 2icy h VAL 195 N 0.00 0.91 0.25 5.18 3.04 -1.34 -0.40 116.25 123.89 2icy h VAL 195 Ca 0.00 -0.25 -0.01 0.00 -1.01 0.00 0.00 66.70 65.42 2icy h VAL 195 Cb 0.23 0.11 0.00 0.00 -2.01 0.00 0.00 31.29 29.61 2icy h VAL 195 CO 0.00 0.14 -0.12 -0.26 -1.01 0.00 0.00 177.57 176.31 2icy h PHE 196 N 0.74 -0.31 -0.16 3.17 0.04 -1.80 -0.08 116.94 118.54 2icy h PHE 196 Ca 0.40 -0.01 -0.08 0.00 2.80 0.00 0.00 57.97 61.09 2icy h PHE 196 Cb 0.53 0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.77 2icy h PHE 196 CO -0.00 0.06 -0.24 -1.00 -0.60 0.00 0.00 178.31 176.53 2icy h PRO 197 N -0.84 0.28 -0.19 1.51 0.13 -1.76 -2.67 132.00 128.45 2icy h PRO 197 Ca -0.03 -0.09 -0.14 0.00 -0.87 0.00 0.00 66.00 64.86 2icy h PRO 197 Cb 0.51 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.61 2icy h PRO 197 CO 0.06 0.51 -0.47 0.00 -0.23 0.00 0.00 178.00 177.86 2icy h ALA 198 N 1.50 0.82 -0.74 -0.56 0.00 -1.07 0.18 119.26 119.39 2icy h ALA 198 Ca 0.04 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 2icy h ALA 198 Cb 0.57 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2icy h ALA 198 CO 0.04 0.66 0.31 -0.07 0.00 0.00 0.00 179.25 180.19 2icy h LEU 199 N 0.40 0.99 -0.03 0.00 3.38 -0.76 -1.27 115.31 118.02 2icy h LEU 199 Ca 0.02 -0.14 -0.21 0.00 0.09 0.00 0.00 57.88 57.65 2icy h LEU 199 Cb 0.98 -0.26 0.02 0.00 0.09 0.00 0.00 40.66 41.49 2icy h LEU 199 CO 0.09 0.87 -0.79 -0.03 0.09 0.00 0.00 178.44 178.67 2icy h MET 200 N 1.06 0.59 0.00 1.13 4.05 -1.17 -2.94 114.93 117.65 2icy h MET 200 Ca 0.25 -0.59 -0.03 0.00 -0.28 0.00 0.00 59.70 59.05 2icy h MET 200 Cb 0.18 0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 31.14 2icy h MET 200 CO -0.02 1.21 -0.14 -0.91 0.23 0.00 0.00 176.91 177.28 2icy h ASN 201 N 0.20 0.00 1.36 1.39 2.35 -0.54 -3.06 115.58 117.27 2icy h ASN 201 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 2icy h ASN 201 Cb 1.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.83 2icy h ASN 201 CO 0.16 0.14 0.00 0.77 -1.65 0.00 0.00 177.43 176.85 2icy h SER 202 N 0.00 0.00 0.00 5.81 4.64 -1.29 -3.47 113.55 119.23 2icy h SER 202 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2icy h SER 202 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 2icy h SER 202 CO 0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 2icy n GLY 203 N 0.92 1.70 0.23 -0.77 0.00 -1.16 -4.94 105.19 101.16 2icy n GLY 203 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 2icy n GLY 203 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2icy h LYS 204 N 2.88 0.49 -0.53 1.61 1.79 -1.83 -2.22 116.57 118.76 2icy h LYS 204 Ca 0.00 -0.22 -0.10 0.00 -2.18 0.00 0.00 60.65 58.15 2icy h LYS 204 Cb 0.00 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.62 2icy h LYS 204 CO 0.00 0.77 -0.07 1.25 -1.08 0.00 0.00 179.45 180.32 2icy h LEU 205 N 0.42 0.96 -0.76 2.94 6.46 -1.84 0.16 115.31 123.66 2icy h LEU 205 Ca 0.05 -0.30 -0.11 0.00 -0.12 0.00 0.00 57.88 57.40 2icy h LEU 205 Cb 0.80 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 2icy h LEU 205 CO 0.06 1.06 -0.27 0.44 -0.62 0.00 0.00 178.44 179.11 2icy h ASP 206 N 0.88 0.66 0.85 1.25 5.19 -1.81 -0.47 116.42 122.96 2icy h ASP 206 Ca 0.15 -0.24 -0.04 0.00 -0.62 0.00 0.00 57.03 56.27 2icy h ASP 206 Cb 0.61 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.94 2icy h ASP 206 CO 0.04 0.90 -0.48 0.74 -3.12 0.00 0.00 179.24 177.32 2icy h THR 207 N 0.56 0.03 -0.87 0.35 2.02 -0.77 -1.22 112.91 113.01 2icy h THR 207 Ca 0.07 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.31 2icy h THR 207 Cb 0.76 0.03 -0.05 0.00 -1.74 0.00 0.00 68.15 67.14 2icy h THR 207 CO 0.06 0.00 0.57 -0.26 0.37 0.00 0.00 175.52 176.26 2icy h PHE 208 N -1.23 1.00 -0.58 3.16 0.04 -0.53 -1.37 116.94 117.41 2icy h PHE 208 Ca -0.11 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.67 2icy h PHE 208 Cb 0.97 -0.33 -0.03 0.00 2.20 0.00 0.00 35.95 38.77 2icy h PHE 208 CO -0.07 0.53 0.34 -0.07 -0.60 0.00 0.00 178.31 178.45 2icy h LEU 209 N 0.99 0.71 -1.64 1.54 3.38 -0.88 -2.27 115.31 117.15 2icy h LEU 209 Ca 0.37 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.23 2icy h LEU 209 Cb 0.18 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2icy h LEU 209 CO -0.13 0.57 -0.17 0.77 0.09 0.00 0.00 178.44 179.57 2icy h SER 210 N 0.79 0.00 0.00 -0.43 4.64 -0.16 -1.75 113.55 116.64 2icy h SER 210 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2icy h SER 210 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2icy h SER 210 CO -0.04 0.17 0.00 0.00 -0.87 0.00 0.00 176.83 176.09 2icy n GLN 211 N -3.59 0.96 -1.12 4.77 6.02 -0.77 -4.77 117.38 118.88 2icy n GLN 211 Ca -0.01 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.94 2icy n GLN 211 Cb 0.31 -1.46 -0.02 0.00 1.02 0.00 0.00 30.24 30.08 2icy n GLN 211 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2icy n GLY 212 N 0.03 0.58 3.80 1.08 0.00 -0.66 -4.96 105.19 105.06 2icy n GLY 212 Ca 0.00 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 2icy n GLY 212 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2icy s LYS 213 N -1.83 3.93 0.00 1.61 -0.14 -0.90 -4.86 119.74 117.55 2icy s LYS 213 Ca 0.00 1.33 0.00 0.00 -1.36 0.00 0.00 55.97 55.94 2icy s LYS 213 Cb 0.00 -2.16 0.00 0.00 -1.68 0.00 0.00 37.83 33.99 2icy s LYS 213 CO 0.00 -0.32 0.00 0.39 -0.76 0.00 0.00 175.35 174.66 2icy n GLU 214 N -0.79 1.97 -4.09 1.68 1.02 -1.15 -4.41 120.64 114.87 2icy n GLU 214 Ca 0.08 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.09 2icy n GLU 214 Cb 0.52 -0.84 -0.12 0.00 -0.02 0.00 0.00 31.44 30.98 2icy n GLU 214 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2icy s TYR 215 N -1.38 0.59 -0.09 -0.32 2.02 0.12 -0.62 117.35 117.67 2icy s TYR 215 Ca 0.00 -0.37 0.03 0.00 -0.37 0.00 0.00 57.07 56.36 2icy s TYR 215 Cb 0.00 -0.36 -0.01 0.00 -0.40 0.00 0.00 41.96 41.18 2icy s TYR 215 CO 0.00 -0.06 -0.19 0.54 -1.57 0.00 0.00 175.55 174.26 2icy s VAL 216 N -0.98 2.52 -0.40 0.71 0.11 0.03 -1.33 120.40 121.06 2icy s VAL 216 Ca -0.06 -0.88 -0.14 0.00 -2.93 0.00 0.00 61.98 57.97 2icy s VAL 216 Cb -0.07 -1.99 0.02 0.00 -1.53 0.00 0.00 36.38 32.81 2icy s VAL 216 CO 0.00 0.56 0.27 0.12 -3.33 0.00 0.00 175.10 172.72 2icy s PHE 217 N 0.04 3.24 -0.08 1.54 5.36 1.15 -0.88 117.98 128.36 2icy s PHE 217 Ca -0.08 -0.69 -0.08 0.00 -0.96 0.00 0.00 56.93 55.13 2icy s PHE 217 Cb -0.15 -2.55 -0.04 0.00 -0.34 0.00 0.00 43.02 39.94 2icy s PHE 217 CO 0.05 -0.60 0.21 0.08 -1.46 0.00 0.00 175.22 173.49 2icy s VAL 218 N 1.65 5.40 0.16 3.12 1.01 0.16 0.37 120.40 132.26 2icy s VAL 218 Ca 0.04 0.31 -0.20 0.00 0.00 0.00 0.00 61.98 62.14 2icy s VAL 218 Cb -0.19 -3.48 0.05 0.00 0.00 0.00 0.00 36.38 32.76 2icy s VAL 218 CO 0.09 0.58 0.52 0.00 0.00 0.00 0.00 175.10 176.29 2icy s ALA 219 N -1.08 -1.27 0.35 5.51 0.00 0.16 -0.55 121.76 124.88 2icy s ALA 219 Ca 0.18 0.19 -0.28 0.00 0.00 0.00 0.00 51.96 52.05 2icy s ALA 219 Cb -0.13 0.82 -0.10 0.00 0.00 0.00 0.00 23.12 23.71 2icy s ALA 219 CO 0.07 -0.74 1.29 -0.80 0.00 0.00 0.00 175.76 175.58 2icy s ASN 220 N -2.79 6.67 0.08 0.00 0.01 -1.26 -1.49 114.94 116.18 2icy s ASN 220 Ca 0.03 2.64 0.19 0.00 -0.71 0.00 0.00 52.86 55.01 2icy s ASN 220 Cb -0.00 -2.64 0.78 0.00 0.41 0.00 0.00 41.25 39.80 2icy s ASN 220 CO -0.11 -0.60 1.59 -1.54 -1.51 0.00 0.00 177.10 174.93 2icy n SER 221 N 0.61 0.23 -0.00 -1.22 3.41 -1.08 -2.46 113.62 113.11 2icy n SER 221 Ca 0.01 0.55 0.14 0.00 -0.26 0.00 0.00 58.87 59.31 2icy n SER 221 Cb 0.43 -0.60 0.54 0.00 -0.26 0.00 0.00 64.21 64.31 2icy n SER 221 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2icy n ASP 222 N -1.75 0.13 -4.29 4.04 5.68 -1.26 -4.75 116.55 114.34 2icy n ASP 222 Ca 0.03 0.29 -0.45 0.00 -0.50 0.00 0.00 54.79 54.16 2icy n ASP 222 Cb 0.21 -0.31 -0.05 0.00 -1.14 0.00 0.00 41.12 39.83 2icy n ASP 222 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 2icy s ASN 223 N -2.98 6.24 0.00 -1.12 2.47 -1.03 -4.01 114.94 114.52 2icy s ASN 223 Ca 0.14 -2.10 0.20 0.00 0.42 0.00 0.00 52.86 51.52 2icy s ASN 223 Cb 0.19 -2.17 0.91 0.00 -1.45 0.00 0.00 41.25 38.72 2icy s ASN 223 CO 0.57 -0.74 1.65 0.18 -3.72 0.00 0.00 177.10 175.04 2icy n LEU 224 N 4.77 0.00 0.05 3.21 4.77 -1.26 -1.94 117.00 126.60 2icy n LEU 224 Ca -0.04 0.46 0.14 0.00 -0.03 0.00 0.00 56.01 56.53 2icy n LEU 224 Cb 0.42 -0.46 0.52 0.00 -2.33 0.00 0.00 43.42 41.58 2icy n LEU 224 CO 0.46 -0.14 0.93 0.61 -1.33 0.00 0.00 177.39 177.92 2icy n GLY 225 N 0.58 -1.59 3.14 -0.72 0.00 -1.26 -4.57 105.19 100.76 2icy n GLY 225 Ca 0.06 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 2icy n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2icy n ALA 226 N -1.63 4.28 -2.91 4.61 0.00 -0.82 -4.33 120.51 119.72 2icy n ALA 226 Ca 0.06 -3.73 -0.26 0.00 0.00 0.00 0.00 53.44 49.51 2icy n ALA 226 Cb 0.38 -3.57 -0.04 0.00 0.00 0.00 0.00 19.45 16.22 2icy n ALA 226 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2icy s ILE 227 N 4.41 5.12 0.09 0.00 -4.36 -1.26 -5.04 121.20 120.16 2icy s ILE 227 Ca 0.52 -0.77 -0.35 0.00 -0.26 0.00 0.00 60.65 59.79 2icy s ILE 227 Cb 0.09 -3.63 -0.15 0.00 1.25 0.00 0.00 42.46 40.03 2icy s ILE 227 CO 0.01 -0.09 1.55 0.52 0.24 0.00 0.00 174.94 177.18 2icy n VAL 228 N -0.46 0.08 -4.05 8.37 0.31 -1.26 -4.96 118.33 116.36 2icy n VAL 228 Ca -0.07 -0.01 -0.32 0.00 -0.01 0.00 0.00 64.34 63.93 2icy n VAL 228 Cb 0.54 -1.34 -0.15 0.00 -0.91 0.00 0.00 33.84 31.97 2icy n VAL 228 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2icy s ASP 229 N 1.28 3.92 0.42 4.52 2.15 -1.26 -5.00 116.67 122.70 2icy s ASP 229 Ca 0.83 -1.13 0.22 0.00 0.43 0.00 0.00 52.55 52.90 2icy s ASP 229 Cb -0.79 -1.44 0.86 0.00 -0.30 0.00 0.00 42.92 41.26 2icy s ASP 229 CO 0.44 -0.15 1.81 -0.07 -0.17 0.00 0.00 175.17 177.03 2icy h LEU 230 N 7.86 0.00 -0.53 -1.34 3.38 -1.96 -2.65 115.31 120.07 2icy h LEU 230 Ca -0.26 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.58 2icy h LEU 230 Cb 1.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2icy h LEU 230 CO 0.50 0.28 -0.25 0.74 0.09 0.00 0.00 178.44 179.80 2icy h THR 231 N 0.00 1.27 -0.15 0.22 2.02 -1.92 -0.23 112.91 114.12 2icy h THR 231 Ca -0.00 -1.41 -0.06 0.00 0.77 0.00 0.00 66.41 65.71 2icy h THR 231 Cb 0.77 1.19 -0.00 0.00 -1.74 0.00 0.00 68.15 68.37 2icy h THR 231 CO 0.04 0.48 -0.16 0.40 0.37 0.00 0.00 175.52 176.65 2icy h ILE 232 N 0.80 1.35 -0.68 3.11 2.04 -1.84 -2.21 117.51 120.06 2icy h ILE 232 Ca 0.10 -1.33 0.00 0.00 1.00 0.00 0.00 64.86 64.63 2icy h ILE 232 Cb 0.81 1.88 -0.03 0.00 -0.74 0.00 0.00 36.82 38.74 2icy h ILE 232 CO 0.07 0.39 0.44 0.25 0.00 0.00 0.00 178.15 179.30 2icy h LEU 233 N 0.00 0.80 -0.84 1.44 5.85 -1.30 -0.02 115.31 121.24 2icy h LEU 233 Ca 0.02 -0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.78 2icy h LEU 233 Cb 0.69 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 2icy h LEU 233 CO 0.04 0.59 0.51 0.50 -0.34 0.00 0.00 178.44 179.74 2icy h LYS 234 N 0.93 0.88 -0.55 1.25 3.64 -1.00 -2.51 116.57 119.21 2icy h LYS 234 Ca 0.25 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.58 2icy h LYS 234 Cb -0.08 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.51 2icy h LYS 234 CO -0.05 0.58 0.36 1.25 -2.27 0.00 0.00 179.45 179.32 2icy h HIS 235 N 0.91 0.69 -0.72 1.91 2.76 -0.39 -2.10 115.15 118.21 2icy h HIS 235 Ca 0.38 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.59 2icy h HIS 235 Cb 0.22 -0.23 -0.04 0.00 1.55 0.00 0.00 27.41 28.91 2icy h HIS 235 CO -0.04 0.43 0.46 -0.07 -1.30 0.00 0.00 177.93 177.41 2icy h LEU 236 N 0.74 0.75 -0.06 0.26 3.38 -0.89 -0.95 115.31 118.55 2icy h LEU 236 Ca 0.20 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 2icy h LEU 236 Cb -0.08 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 2icy h LEU 236 CO -0.05 0.52 -0.04 0.40 0.09 0.00 0.00 178.44 179.37 2icy h ILE 237 N 0.89 1.34 -0.33 1.22 2.04 -1.32 -0.96 117.51 120.39 2icy h ILE 237 Ca 0.29 -1.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.03 2icy h ILE 237 Cb 0.01 1.95 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 2icy h ILE 237 CO -0.11 0.30 0.08 1.56 0.00 0.00 0.00 178.15 179.98 2icy h GLN 238 N -0.27 0.48 -0.35 2.37 4.20 -1.28 -3.10 115.11 117.16 2icy h GLN 238 Ca 0.01 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.65 2icy h GLN 238 Cb 0.50 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.19 2icy h GLN 238 CO 0.01 0.45 0.00 0.09 -0.67 0.00 0.00 178.83 178.71 2icy n ASN 239 N -4.35 3.37 -3.70 1.46 3.02 -0.37 -4.96 115.26 109.71 2icy n ASN 239 Ca 0.02 -1.97 -0.25 0.00 -0.03 0.00 0.00 54.58 52.34 2icy n ASN 239 Cb 0.18 -0.22 0.06 0.00 -0.61 0.00 0.00 39.78 39.19 2icy n ASN 239 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2icy n LYS 240 N 1.42 -6.81 -2.99 3.52 5.02 -0.47 -4.94 118.16 112.92 2icy n LYS 240 Ca 0.18 0.74 -0.42 0.00 -2.02 0.00 0.00 58.31 56.79 2icy n LYS 240 Cb 0.59 -5.70 -0.05 0.00 -0.02 0.00 0.00 35.03 29.85 2icy n LYS 240 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2icy s ASN 241 N -3.47 6.58 0.13 4.39 -0.87 -0.60 -4.61 114.94 116.48 2icy s ASN 241 Ca 0.53 0.48 0.27 0.00 -1.57 0.00 0.00 52.86 52.56 2icy s ASN 241 Cb -0.25 -2.38 0.86 0.00 -0.02 0.00 0.00 41.25 39.46 2icy s ASN 241 CO 0.77 -0.62 1.75 -0.62 -2.57 0.00 0.00 177.10 175.81 2icy n GLU 242 N 6.20 0.18 -3.71 -0.60 1.02 -0.84 -4.76 120.64 118.13 2icy n GLU 242 Ca 0.02 0.13 -0.12 0.00 -0.02 0.00 0.00 57.16 57.17 2icy n GLU 242 Cb 0.48 -1.69 -0.10 0.00 -0.02 0.00 0.00 31.44 30.11 2icy n GLU 242 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 2icy s TYR 243 N -3.07 -0.55 -0.07 -0.32 5.04 -1.26 -1.12 117.35 115.99 2icy s TYR 243 Ca 0.11 1.25 -0.03 0.00 -2.44 0.00 0.00 57.07 55.97 2icy s TYR 243 Cb 0.15 0.23 0.04 0.00 0.35 0.00 0.00 41.96 42.72 2icy s TYR 243 CO 0.60 -0.29 0.06 0.00 -1.34 0.00 0.00 175.55 174.58 2icy s MET 245 N 2.15 4.13 -0.04 0.00 1.75 -0.09 -0.73 119.30 126.46 2icy s MET 245 Ca 0.04 0.17 -0.30 0.00 -1.25 0.00 0.00 55.69 54.36 2icy s MET 245 Cb -0.13 -3.57 -0.03 0.00 2.84 0.00 0.00 34.83 33.94 2icy s MET 245 CO -0.04 -0.12 1.03 -1.21 -0.65 0.00 0.00 175.02 174.03 2icy s GLU 246 N 1.57 4.48 0.33 4.11 2.02 -0.19 -0.58 118.70 130.44 2icy s GLU 246 Ca 0.18 1.47 0.08 0.00 0.02 0.00 0.00 54.97 56.72 2icy s GLU 246 Cb -0.15 -3.49 -0.06 0.00 0.10 0.00 0.00 34.13 30.53 2icy s GLU 246 CO 0.08 -0.21 -0.07 0.14 0.02 0.00 0.00 175.26 175.23 2icy s VAL 247 N 1.50 2.01 0.06 2.63 -7.23 0.59 -2.05 120.40 117.91 2icy s VAL 247 Ca 0.52 -2.16 -0.04 0.00 -1.81 0.00 0.00 61.98 58.48 2icy s VAL 247 Cb -0.21 -2.63 -0.02 0.00 0.56 0.00 0.00 36.38 34.08 2icy s VAL 247 CO 0.24 -0.20 0.07 0.28 -0.31 0.00 0.00 175.10 175.17 2icy s THR 248 N -2.76 0.18 0.23 5.32 -1.32 -0.10 -0.01 115.64 117.18 2icy s THR 248 Ca 0.32 -1.45 -0.32 0.00 -1.21 0.00 0.00 61.69 59.03 2icy s THR 248 Cb 0.04 -1.32 -0.12 0.00 -1.51 0.00 0.00 72.50 69.58 2icy s THR 248 CO 0.15 -0.80 1.63 -2.65 -2.21 0.00 0.00 174.62 170.74 2icy n PRO 249 N 0.19 2.59 -2.19 7.08 -0.02 -1.26 -0.54 135.00 140.85 2icy n PRO 249 Ca -0.15 0.93 -0.42 0.00 -2.02 0.00 0.00 63.50 61.83 2icy n PRO 249 Cb 0.61 -2.72 -0.03 0.00 -0.02 0.00 0.00 33.50 31.34 2icy n PRO 249 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2icy s LYS 250 N 0.39 4.28 0.42 -0.52 2.20 0.81 -4.73 119.74 122.59 2icy s LYS 250 Ca 0.71 2.01 0.07 0.00 -0.36 0.00 0.00 55.97 58.40 2icy s LYS 250 Cb -0.54 -3.53 -0.06 0.00 -1.51 0.00 0.00 37.83 32.19 2icy s LYS 250 CO 0.40 -0.57 0.12 0.95 -0.36 0.00 0.00 175.35 175.90 2icy s THR 251 N 2.23 2.14 0.63 3.43 -4.23 -1.26 -4.86 115.64 113.72 2icy s THR 251 Ca 0.65 -1.81 0.37 0.00 -1.18 0.00 0.00 61.69 59.72 2icy s THR 251 Cb -0.33 -2.95 0.40 0.00 1.34 0.00 0.00 72.50 70.96 2icy s THR 251 CO 0.27 0.00 2.31 -0.07 -0.54 0.00 0.00 174.62 176.60 2icy h LEU 252 N 1.53 0.00 0.00 4.79 3.38 -1.95 -0.42 115.31 122.64 2icy h LEU 252 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2icy h LEU 252 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2icy h LEU 252 CO 0.74 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.27 2icy n ALA 253 N -2.20 2.27 -2.97 1.53 0.00 -1.26 -4.56 120.51 113.32 2icy n ALA 253 Ca -0.03 -0.10 -0.44 0.00 0.00 0.00 0.00 53.44 52.87 2icy n ALA 253 Cb 0.08 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.06 2icy n ALA 253 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2icy s ASP 254 N -2.96 6.49 -0.03 0.00 1.01 -0.17 -4.71 116.67 116.30 2icy s ASP 254 Ca 0.15 -1.81 0.01 0.00 0.71 0.00 0.00 52.55 51.61 2icy s ASP 254 Cb 0.18 -2.37 -0.03 0.00 1.01 0.00 0.00 42.92 41.71 2icy s ASP 254 CO 0.49 -1.10 -0.01 0.52 0.21 0.00 0.00 175.17 175.28 2icy n VAL 255 N 5.45 0.20 -3.62 -1.27 0.31 -1.26 -4.86 118.33 113.28 2icy n VAL 255 Ca 0.13 -0.10 -0.40 0.00 -0.01 0.00 0.00 64.34 63.96 2icy n VAL 255 Cb 0.47 -0.78 -0.10 0.00 -0.91 0.00 0.00 33.84 32.52 2icy n VAL 255 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2icy s LYS 256 N -2.07 2.63 0.00 5.55 2.20 -1.26 -4.93 119.74 121.86 2icy s LYS 256 Ca -0.03 -1.37 0.00 0.00 -0.36 0.00 0.00 55.97 54.21 2icy s LYS 256 Cb 0.01 -3.74 0.00 0.00 -1.51 0.00 0.00 37.83 32.59 2icy s LYS 256 CO 0.10 -0.88 0.00 0.41 -0.36 0.00 0.00 175.35 174.62 2icy n GLY 257 N 4.92 -0.50 3.21 5.54 0.00 -1.26 -5.04 105.19 112.06 2icy n GLY 257 Ca -0.10 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.81 2icy n GLY 257 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2icy s GLY 258 N 0.00 1.22 0.36 -0.02 0.00 -1.26 -1.18 107.32 106.44 2icy s GLY 258 Ca 0.00 -1.59 0.08 0.00 0.00 0.00 0.00 44.72 43.21 2icy s GLY 258 CO 0.00 -1.47 -0.06 -1.08 0.00 0.00 0.00 173.10 170.50 2icy s THR 259 N -3.85 2.11 -0.17 0.90 -1.32 -0.48 -0.81 115.64 112.02 2icy s THR 259 Ca 0.27 -2.13 -0.02 0.00 -1.21 0.00 0.00 61.69 58.60 2icy s THR 259 Cb 0.07 -2.75 -0.01 0.00 -1.51 0.00 0.00 72.50 68.30 2icy s THR 259 CO 0.05 -0.14 -0.10 -0.22 -2.21 0.00 0.00 174.62 172.00 2icy s LEU 260 N -3.63 2.77 0.46 9.08 2.96 -1.26 -1.44 118.68 127.62 2icy s LEU 260 Ca 0.33 -0.36 0.06 0.00 -0.22 0.00 0.00 54.13 53.93 2icy s LEU 260 Cb 0.05 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 45.05 2icy s LEU 260 CO 0.17 0.08 0.17 0.27 -1.32 0.00 0.00 176.35 175.72 2icy s ILE 261 N 0.85 1.89 -0.31 6.68 -4.36 -0.70 -4.79 121.20 120.45 2icy s ILE 261 Ca -0.03 -1.75 -0.06 0.00 -0.26 0.00 0.00 60.65 58.55 2icy s ILE 261 Cb -0.15 -2.65 0.03 0.00 1.25 0.00 0.00 42.46 40.95 2icy s ILE 261 CO 0.01 0.00 0.07 -0.55 0.24 0.00 0.00 174.94 174.71 2icy s SER 262 N -3.95 5.14 -0.04 4.36 0.15 -0.26 -1.98 113.70 117.12 2icy s SER 262 Ca 0.31 -1.00 -0.01 0.00 0.70 0.00 0.00 55.95 55.95 2icy s SER 262 Cb 0.03 -1.84 0.03 0.00 -1.71 0.00 0.00 66.02 62.53 2icy s SER 262 CO 0.17 -0.26 0.04 -0.47 1.20 0.00 0.00 173.24 173.92 2icy s TYR 263 N 1.41 0.19 -1.51 3.44 5.04 -0.48 -0.94 117.35 124.51 2icy s TYR 263 Ca -0.01 0.13 -0.13 0.00 -2.44 0.00 0.00 57.07 54.62 2icy s TYR 263 Cb -0.19 -0.49 0.08 0.00 0.35 0.00 0.00 41.96 41.71 2icy s TYR 263 CO 0.02 -0.19 1.01 -1.91 -1.34 0.00 0.00 175.55 173.13 2icy n GLU 264 N 4.94 -5.81 -0.91 4.97 2.13 -1.26 -2.13 120.64 122.58 2icy n GLU 264 Ca -0.11 0.62 0.00 0.00 0.66 0.00 0.00 57.16 58.34 2icy n GLU 264 Cb 0.50 -5.53 0.00 0.00 0.27 0.00 0.00 31.44 26.68 2icy n GLU 264 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2icy n GLY 265 N -1.73 0.78 3.00 8.31 0.00 -1.26 -5.03 105.19 109.26 2icy n GLY 265 Ca 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 2icy n GLY 265 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2icy s LYS 266 N -0.09 0.38 0.42 1.61 1.02 -0.90 -5.13 119.74 117.04 2icy s LYS 266 Ca 0.00 -0.59 -0.24 0.00 0.02 0.00 0.00 55.97 55.16 2icy s LYS 266 Cb 0.00 -0.08 -0.08 0.00 -0.52 0.00 0.00 37.83 37.14 2icy s LYS 266 CO 0.00 0.00 1.12 0.54 -0.92 0.00 0.00 175.35 176.09 2icy s VAL 267 N -1.24 3.38 -0.07 3.17 0.11 -1.26 -1.38 120.40 123.11 2icy s VAL 267 Ca -0.11 1.07 -0.20 0.00 -2.93 0.00 0.00 61.98 59.81 2icy s VAL 267 Cb -0.09 -3.56 0.04 0.00 -1.53 0.00 0.00 36.38 31.25 2icy s VAL 267 CO -0.00 0.02 0.47 -1.58 -3.33 0.00 0.00 175.10 170.68 2icy s GLN 268 N -2.52 0.75 0.05 1.54 0.74 -0.84 -4.20 119.66 115.18 2icy s GLN 268 Ca 0.60 0.20 -0.18 0.00 0.05 0.00 0.00 55.36 56.02 2icy s GLN 268 Cb -0.26 0.35 -0.06 0.00 1.10 0.00 0.00 33.01 34.14 2icy s GLN 268 CO 0.32 -0.19 0.52 -1.17 -0.55 0.00 0.00 175.29 174.23 2icy s LEU 269 N -0.82 4.51 -0.30 3.68 2.96 -1.26 -1.73 118.68 125.72 2icy s LEU 269 Ca -0.09 1.18 0.02 0.00 -0.22 0.00 0.00 54.13 55.02 2icy s LEU 269 Cb -0.03 -2.81 0.09 0.00 0.50 0.00 0.00 46.19 43.93 2icy s LEU 269 CO 0.05 0.28 0.01 -0.22 -1.32 0.00 0.00 176.35 175.15 2icy s LEU 270 N -1.07 3.68 0.51 -0.68 2.96 -0.52 -4.94 118.68 118.61 2icy s LEU 270 Ca 0.28 -1.75 -0.14 0.00 -0.22 0.00 0.00 54.13 52.30 2icy s LEU 270 Cb -0.19 -1.39 -0.07 0.00 0.50 0.00 0.00 46.19 45.04 2icy s LEU 270 CO 0.17 -0.33 0.94 -1.61 -1.32 0.00 0.00 176.35 174.21 2icy s GLU 271 N 1.16 3.83 0.28 1.98 0.41 -1.26 -1.38 118.70 123.72 2icy s GLU 271 Ca 0.04 0.78 -0.01 0.00 -0.41 0.00 0.00 54.97 55.37 2icy s GLU 271 Cb -0.19 -2.19 0.41 0.00 -1.78 0.00 0.00 34.13 30.38 2icy s GLU 271 CO -0.10 -0.27 1.83 0.97 -0.49 0.00 0.00 175.26 177.20 2icy h ILE 272 N 0.70 1.22 -0.03 -1.63 6.09 -1.51 -0.30 117.51 122.06 2icy h ILE 272 Ca -0.46 -0.81 0.01 0.00 -1.37 0.00 0.00 64.86 62.23 2icy h ILE 272 Cb 1.19 0.68 -0.00 0.00 0.47 0.00 0.00 36.82 39.15 2icy h ILE 272 CO 0.62 0.30 0.10 0.00 -3.07 0.00 0.00 178.15 176.10 2icy h ALA 273 N 1.35 1.27 -0.01 0.18 0.00 -1.93 -0.72 119.26 119.40 2icy h ALA 273 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2icy h ALA 273 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2icy h ALA 273 CO -0.00 -0.12 -0.11 1.04 0.00 0.00 0.00 179.25 180.07 2icy n GLN 274 N -3.27 1.37 -3.27 0.00 6.02 -0.13 -4.88 117.38 113.23 2icy n GLN 274 Ca -0.02 -0.83 -0.39 0.00 -0.01 0.00 0.00 57.00 55.75 2icy n GLN 274 Cb 0.18 -1.48 -0.07 0.00 1.02 0.00 0.00 30.24 29.88 2icy n GLN 274 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2icy s VAL 275 N -2.20 5.12 0.34 5.09 1.01 -0.28 -4.99 120.40 124.49 2icy s VAL 275 Ca 0.32 0.91 -0.28 0.00 0.00 0.00 0.00 61.98 62.92 2icy s VAL 275 Cb 0.20 -3.82 -0.12 0.00 0.00 0.00 0.00 36.38 32.64 2icy s VAL 275 CO 0.41 0.18 1.36 -2.65 0.00 0.00 0.00 175.10 174.39 2icy n PRO 276 N 4.84 2.28 -0.11 2.72 -0.02 -1.26 -4.74 135.00 138.70 2icy n PRO 276 Ca -0.05 0.80 0.26 0.00 -2.02 0.00 0.00 63.50 62.48 2icy n PRO 276 Cb 0.50 -2.43 0.71 0.00 -0.02 0.00 0.00 33.50 32.27 2icy n PRO 276 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2icy h ASP 277 N 2.83 0.00 0.47 2.55 5.19 -1.97 0.67 116.42 126.15 2icy h ASP 277 Ca -0.47 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 2icy h ASP 277 Cb 1.27 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.78 2icy h ASP 277 CO 0.64 0.00 0.00 -1.84 -3.12 0.00 0.00 179.24 174.92 2icy n GLU 278 N -4.28 0.43 -0.00 3.56 0.28 -1.26 -2.89 120.64 116.48 2icy n GLU 278 Ca 0.15 0.02 0.00 0.00 -0.16 0.00 0.00 57.16 57.18 2icy n GLU 278 Cb 0.84 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 32.21 2icy n GLU 278 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2icy n HIS 279 N -1.26 0.00 -0.08 -1.84 8.25 0.23 -4.75 115.22 115.78 2icy n HIS 279 Ca 0.14 -0.39 -0.08 0.00 -0.26 0.00 0.00 57.72 57.13 2icy n HIS 279 Cb 0.21 -0.04 0.09 0.00 1.12 0.00 0.00 29.99 31.37 2icy n HIS 279 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2icy h VAL 280 N 0.02 1.27 -0.71 1.59 2.07 -1.32 -2.34 116.25 116.83 2icy h VAL 280 Ca 0.00 -1.37 -0.05 0.00 0.82 0.00 0.00 66.70 66.10 2icy h VAL 280 Cb 0.40 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 2icy h VAL 280 CO 0.00 0.46 0.26 0.78 0.02 0.00 0.00 177.57 179.09 2icy h ASN 281 N 0.65 1.00 0.00 0.57 2.35 -1.85 -2.52 115.58 115.78 2icy h ASN 281 Ca 0.08 -0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.57 2icy h ASN 281 Cb 0.77 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.86 2icy h ASN 281 CO 0.06 0.92 -0.20 -0.33 -1.65 0.00 0.00 177.43 176.23 2icy h GLU 282 N 1.03 0.36 -0.27 0.81 5.08 -1.85 -2.96 114.58 116.78 2icy h GLU 282 Ca 0.23 -0.11 -0.19 0.00 -1.00 0.00 0.00 59.36 58.30 2icy h GLU 282 Cb 0.24 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2icy h GLU 282 CO -0.02 0.55 -0.56 0.35 -1.00 0.00 0.00 179.01 178.33 2icy h PHE 283 N 0.33 1.05 0.00 4.33 3.57 -1.04 -3.17 116.94 122.00 2icy h PHE 283 Ca 0.06 -0.38 0.00 0.00 3.53 0.00 0.00 57.97 61.18 2icy h PHE 283 Cb 0.54 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.09 2icy h PHE 283 CO 0.01 1.20 0.00 1.63 -2.23 0.00 0.00 178.31 178.92 2icy n LYS 284 N -3.99 0.32 -2.59 1.11 5.02 -0.99 -4.77 118.16 112.27 2icy n LYS 284 Ca -0.04 0.05 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 2icy n LYS 284 Cb 0.63 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.11 2icy n LYS 284 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2icy s SER 285 N -2.63 7.22 -0.03 4.39 1.04 -1.13 -4.88 113.70 117.69 2icy s SER 285 Ca 0.23 1.76 0.02 0.00 0.48 0.00 0.00 55.95 58.43 2icy s SER 285 Cb 0.17 -2.57 0.12 0.00 0.10 0.00 0.00 66.02 63.84 2icy s SER 285 CO 0.40 -0.40 0.68 2.30 0.98 0.00 0.00 173.24 177.20 2icy n ILE 286 N 4.14 0.39 -0.07 -1.02 -5.35 -1.26 -2.96 119.36 113.22 2icy n ILE 286 Ca 0.08 -0.20 -0.09 0.00 -0.27 0.00 0.00 62.75 62.27 2icy n ILE 286 Cb 0.49 -0.46 -0.08 0.00 -1.74 0.00 0.00 39.64 37.85 2icy n ILE 286 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 2icy n GLU 287 N 0.08 0.93 -0.03 6.28 2.13 -1.26 -4.66 120.64 124.12 2icy n GLU 287 Ca 0.04 0.06 -0.14 0.00 0.66 0.00 0.00 57.16 57.78 2icy n GLU 287 Cb 0.38 -1.32 -0.10 0.00 0.27 0.00 0.00 31.44 30.66 2icy n GLU 287 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 2icy h LYS 288 N 0.00 0.08 -5.82 5.31 3.11 -1.80 -3.43 116.57 114.02 2icy h LYS 288 Ca -0.35 -0.06 -0.68 0.00 -2.81 0.00 0.00 60.65 56.74 2icy h LYS 288 Cb 1.63 0.01 -0.30 0.00 -1.00 0.00 0.00 32.23 32.57 2icy h LYS 288 CO -0.03 0.71 -0.85 -0.06 -2.81 0.00 0.00 179.45 176.41 2icy s PHE 289 N -3.63 2.56 -0.93 1.91 0.08 -1.21 -5.00 117.98 111.75 2icy s PHE 289 Ca -0.16 -0.70 0.11 0.00 0.12 0.00 0.00 56.93 56.30 2icy s PHE 289 Cb 0.01 -1.66 -0.03 0.00 -0.57 0.00 0.00 43.02 40.77 2icy s PHE 289 CO 0.70 -0.20 0.63 1.63 -0.10 0.00 0.00 175.22 177.88 2icy n LYS 290 N 3.07 2.29 -4.28 0.44 5.02 -1.26 -4.48 118.16 118.97 2icy n LYS 290 Ca -0.18 -0.51 -0.23 0.00 -2.02 0.00 0.00 58.31 55.37 2icy n LYS 290 Cb 0.52 -1.10 -0.12 0.00 -0.02 0.00 0.00 35.03 34.31 2icy n LYS 290 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2icy s ILE 291 N -1.59 1.64 -0.02 -0.18 -4.36 -1.26 -0.14 121.20 115.30 2icy s ILE 291 Ca 0.08 -1.57 0.01 0.00 -0.26 0.00 0.00 60.65 58.92 2icy s ILE 291 Cb 0.09 -1.53 0.00 0.00 1.25 0.00 0.00 42.46 42.27 2icy s ILE 291 CO 0.32 -0.13 -0.05 0.12 0.24 0.00 0.00 174.94 175.44 2icy s PHE 292 N -1.32 0.53 0.11 1.37 5.36 0.30 -4.35 117.98 119.97 2icy s PHE 292 Ca 0.07 -0.11 -0.31 0.00 -0.96 0.00 0.00 56.93 55.62 2icy s PHE 292 Cb -0.09 -0.40 -0.07 0.00 -0.34 0.00 0.00 43.02 42.11 2icy s PHE 292 CO 0.04 -0.06 1.28 1.21 -1.46 0.00 0.00 175.22 176.23 2icy s ASN 293 N 0.22 6.97 0.05 6.13 2.47 0.01 -0.93 114.94 129.86 2icy s ASN 293 Ca -0.02 2.19 0.24 0.00 0.42 0.00 0.00 52.86 55.69 2icy s ASN 293 Cb -0.06 -2.59 0.37 0.00 -1.45 0.00 0.00 41.25 37.52 2icy s ASN 293 CO -0.00 -0.53 1.31 0.35 -3.72 0.00 0.00 177.10 174.51 2icy n THR 294 N 3.63 0.15 -1.21 -5.21 -2.24 -0.87 -4.70 114.28 103.83 2icy n THR 294 Ca 0.09 -0.14 -0.07 0.00 -2.27 0.00 0.00 64.05 61.66 2icy n THR 294 Cb 0.44 0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.76 2icy n THR 294 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2icy n ASN 295 N -1.79 -4.59 -4.53 3.42 5.15 -1.26 -4.74 115.26 106.92 2icy n ASN 295 Ca 0.04 0.18 -0.43 0.00 -0.60 0.00 0.00 54.58 53.77 2icy n ASN 295 Cb 0.39 -2.73 -0.05 0.00 -0.53 0.00 0.00 39.78 36.86 2icy n ASN 295 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2icy s ASN 296 N -2.52 6.39 -0.05 1.20 0.01 -1.26 -3.95 114.94 114.76 2icy s ASN 296 Ca 0.00 -0.19 0.06 0.00 -0.71 0.00 0.00 52.86 52.02 2icy s ASN 296 Cb 0.00 -2.39 -0.01 0.00 0.41 0.00 0.00 41.25 39.25 2icy s ASN 296 CO 0.00 -0.99 -0.25 -0.76 -1.51 0.00 0.00 177.10 173.60 2icy s LEU 297 N 3.41 2.10 -0.17 0.60 1.43 0.29 -1.02 118.68 125.31 2icy s LEU 297 Ca 0.30 -0.49 -0.02 0.00 -1.03 0.00 0.00 54.13 52.89 2icy s LEU 297 Cb -0.12 -1.38 -0.01 0.00 0.03 0.00 0.00 46.19 44.71 2icy s LEU 297 CO 0.22 0.26 -0.09 0.26 0.23 0.00 0.00 176.35 177.23 2icy s TRP 298 N -0.25 2.90 -0.02 0.29 0.52 0.09 0.37 118.94 122.84 2icy s TRP 298 Ca -0.01 -0.78 0.01 0.00 0.02 0.00 0.00 56.10 55.34 2icy s TRP 298 Cb -0.13 -1.97 0.01 0.00 -1.15 0.00 0.00 33.47 30.23 2icy s TRP 298 CO 0.03 -0.36 -0.02 0.08 0.02 0.00 0.00 176.95 176.69 2icy s VAL 299 N 0.87 0.25 -0.10 4.03 1.01 -0.06 -0.43 120.40 125.98 2icy s VAL 299 Ca -0.02 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.61 2icy s VAL 299 Cb -0.15 -0.27 -0.03 0.00 0.00 0.00 0.00 36.38 35.93 2icy s VAL 299 CO 0.01 0.11 1.37 0.21 0.00 0.00 0.00 175.10 176.80 2icy s ASN 300 N 0.42 6.88 0.16 3.32 3.84 -0.27 -0.79 114.94 128.49 2icy s ASN 300 Ca -0.04 1.91 -0.14 0.00 0.21 0.00 0.00 52.86 54.80 2icy s ASN 300 Cb -0.07 -2.54 0.04 0.00 -0.55 0.00 0.00 41.25 38.13 2icy s ASN 300 CO -0.01 -0.77 1.74 -0.07 -2.79 0.00 0.00 177.10 175.20 2icy h LEU 301 N 9.39 0.67 -1.40 3.21 3.38 -1.21 -1.88 115.31 127.47 2icy h LEU 301 Ca -0.32 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.48 2icy h LEU 301 Cb 1.14 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 2icy h LEU 301 CO 0.94 0.61 -0.00 0.11 0.09 0.00 0.00 178.44 180.19 2icy h LYS 302 N 0.68 0.39 -0.47 1.13 1.57 -1.92 -1.27 116.57 116.67 2icy h LYS 302 Ca 0.17 -0.07 -0.14 0.00 -1.87 0.00 0.00 60.65 58.75 2icy h LYS 302 Cb 0.12 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2icy h LYS 302 CO -0.02 0.42 -0.24 0.00 -0.57 0.00 0.00 179.45 179.04 2icy h ALA 303 N 1.63 0.66 -0.43 3.86 0.00 -1.84 -1.64 119.26 121.51 2icy h ALA 303 Ca 0.09 -0.40 0.02 0.00 0.00 0.00 0.00 54.91 54.61 2icy h ALA 303 Cb 0.26 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2icy h ALA 303 CO 0.01 0.67 0.25 0.82 0.00 0.00 0.00 179.25 181.00 2icy h ILE 304 N 0.84 1.04 0.10 0.00 2.04 -0.51 -0.38 117.51 120.64 2icy h ILE 304 Ca 0.10 -0.17 0.01 0.00 1.00 0.00 0.00 64.86 65.81 2icy h ILE 304 Cb 0.82 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 2icy h ILE 304 CO 0.07 0.09 -0.19 0.50 0.00 0.00 0.00 178.15 178.62 2icy h LYS 305 N 0.50 -0.35 0.17 2.37 3.64 -1.06 0.05 116.57 121.89 2icy h LYS 305 Ca 0.17 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.58 2icy h LYS 305 Cb 0.02 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 2icy h LYS 305 CO -0.08 -0.23 -0.23 -0.22 -2.27 0.00 0.00 179.45 176.42 2icy h LYS 306 N -0.36 -0.44 -0.51 1.90 3.64 -1.02 -1.13 116.57 118.66 2icy h LYS 306 Ca 0.03 0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.36 2icy h LYS 306 Cb 0.38 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 2icy h LYS 306 CO -0.11 -0.29 0.00 -0.07 -2.27 0.00 0.00 179.45 176.71 2icy h LEU 307 N -0.45 0.82 -0.30 5.20 3.38 -1.00 -0.60 115.31 122.35 2icy h LEU 307 Ca 0.01 -0.20 -0.15 0.00 0.09 0.00 0.00 57.88 57.63 2icy h LEU 307 Cb 0.45 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2icy h LEU 307 CO -0.09 0.88 -0.39 0.58 0.09 0.00 0.00 178.44 179.50 2icy h VAL 308 N 0.79 1.29 0.00 1.22 2.07 -0.91 0.12 116.25 120.83 2icy h VAL 308 Ca 0.15 -1.57 -0.05 0.00 0.82 0.00 0.00 66.70 66.05 2icy h VAL 308 Cb 0.47 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 2icy h VAL 308 CO 0.02 0.51 -0.25 -0.33 0.02 0.00 0.00 177.57 177.54 2icy h GLU 309 N 0.57 0.00 -0.01 1.57 5.08 -0.97 -1.61 114.58 119.20 2icy h GLU 309 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2icy h GLU 309 Cb 0.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 2icy h GLU 309 CO 0.09 0.25 -0.05 0.00 -1.00 0.00 0.00 179.01 178.30 2icy n ALA 310 N -2.33 2.67 -3.39 3.43 0.00 -0.25 -4.91 120.51 115.73 2icy n ALA 310 Ca -0.01 -0.45 -0.23 0.00 0.00 0.00 0.00 53.44 52.75 2icy n ALA 310 Cb 0.36 -1.14 0.06 0.00 0.00 0.00 0.00 19.45 18.74 2icy n ALA 310 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2icy n ASP 311 N 0.09 -6.18 0.04 0.00 2.03 -0.61 -4.91 116.55 107.01 2icy n ASP 311 Ca 0.17 -0.45 0.12 0.00 0.52 0.00 0.00 54.79 55.16 2icy n ASP 311 Cb 0.37 -4.86 0.14 0.00 -0.72 0.00 0.00 41.12 36.05 2icy n ASP 311 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2icy n ALA 312 N -4.49 3.19 -2.72 -1.67 0.00 0.34 -4.79 120.51 110.37 2icy n ALA 312 Ca -0.03 -0.31 -0.42 0.00 0.00 0.00 0.00 53.44 52.68 2icy n ALA 312 Cb 0.58 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.89 2icy n ALA 312 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2icy s LEU 313 N -3.89 3.94 -0.71 0.00 1.43 -1.25 -4.89 118.68 113.31 2icy s LEU 313 Ca 0.06 -1.03 0.04 0.00 -1.03 0.00 0.00 54.13 52.17 2icy s LEU 313 Cb 0.14 -2.49 0.29 0.00 0.03 0.00 0.00 46.19 44.17 2icy s LEU 313 CO 0.74 -1.53 1.01 0.29 0.23 0.00 0.00 176.35 177.09 2icy n LYS 314 N 8.28 3.30 -1.74 1.70 4.76 -1.26 -5.07 118.16 128.14 2icy n LYS 314 Ca 0.08 -4.73 -0.36 0.00 -2.87 0.00 0.00 58.31 50.44 2icy n LYS 314 Cb 0.48 -2.30 0.06 0.00 -1.84 0.00 0.00 35.03 31.43 2icy n LYS 314 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 2icy s MET 315 N -3.04 2.57 0.34 1.97 -1.94 -1.26 -4.92 119.30 113.03 2icy s MET 315 Ca 0.42 1.86 -0.29 0.00 -1.71 0.00 0.00 55.69 55.98 2icy s MET 315 Cb 0.19 -1.87 -0.12 0.00 2.01 0.00 0.00 34.83 35.04 2icy s MET 315 CO -0.05 -1.53 1.47 0.39 -0.01 0.00 0.00 175.02 175.30 2icy n GLU 316 N -2.07 2.55 -2.88 2.03 4.71 -1.26 -4.94 120.64 118.77 2icy n GLU 316 Ca 0.14 0.90 -0.41 0.00 -0.01 0.00 0.00 57.16 57.78 2icy n GLU 316 Cb 0.49 -2.61 -0.04 0.00 -1.01 0.00 0.00 31.44 28.28 2icy n GLU 316 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2icy s ILE 317 N -0.79 4.90 -0.28 -3.67 -1.09 -1.26 -4.56 121.20 114.45 2icy s ILE 317 Ca 0.57 1.68 -0.08 0.00 -2.23 0.00 0.00 60.65 60.58 2icy s ILE 317 Cb -0.51 -4.15 -0.01 0.00 -1.58 0.00 0.00 42.46 36.21 2icy s ILE 317 CO 0.59 0.08 0.11 -0.63 -1.23 0.00 0.00 174.94 173.86 2icy s ILE 318 N 1.79 4.38 0.32 2.92 1.01 -0.41 -4.93 121.20 126.28 2icy s ILE 318 Ca 0.40 -0.37 0.03 0.00 0.00 0.00 0.00 60.65 60.72 2icy s ILE 318 Cb -0.17 -3.17 0.15 0.00 0.01 0.00 0.00 42.46 39.28 2icy s ILE 318 CO 0.15 0.17 1.85 1.55 0.00 0.00 0.00 174.94 178.67 2icy h PRO 319 N 8.29 0.57 -6.47 2.79 0.13 -1.86 -0.42 132.00 135.02 2icy h PRO 319 Ca -0.34 -0.13 -0.50 0.00 -0.87 0.00 0.00 66.00 64.16 2icy h PRO 319 Cb 1.15 -0.08 -0.05 0.00 0.13 0.00 0.00 31.00 32.15 2icy h PRO 319 CO 0.60 0.60 -0.88 -1.71 -0.23 0.00 0.00 178.00 176.38 2icy n ASN 320 N -4.26 -0.55 -4.71 1.44 4.05 -1.26 -0.09 115.26 109.88 2icy n ASN 320 Ca 0.02 -0.99 -0.42 0.00 0.45 0.00 0.00 54.58 53.64 2icy n ASN 320 Cb 0.26 -3.13 -0.00 0.00 1.23 0.00 0.00 39.78 38.14 2icy n ASN 320 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 2icy n PRO 321 N -4.39 2.18 -3.83 1.20 -0.04 -1.26 -3.83 135.00 125.02 2icy n PRO 321 Ca -0.29 0.77 -0.12 0.00 -0.04 0.00 0.00 63.50 63.82 2icy n PRO 321 Cb 0.68 -2.41 -0.10 0.00 -0.04 0.00 0.00 33.50 31.63 2icy n PRO 321 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2icy s LYS 322 N -2.01 0.51 -0.23 0.54 2.20 -0.77 -4.99 119.74 114.98 2icy s LYS 322 Ca 0.56 -0.25 -0.07 0.00 -0.36 0.00 0.00 55.97 55.86 2icy s LYS 322 Cb -0.53 0.22 -0.03 0.00 -1.51 0.00 0.00 37.83 35.98 2icy s LYS 322 CO 0.61 -0.12 0.05 -2.00 -0.36 0.00 0.00 175.35 173.53 2icy s GLU 323 N -1.18 3.64 -0.15 4.03 2.12 -1.26 -0.84 118.70 125.06 2icy s GLU 323 Ca -0.13 -0.49 0.01 0.00 0.36 0.00 0.00 54.97 54.73 2icy s GLU 323 Cb -0.06 -3.24 0.02 0.00 0.26 0.00 0.00 34.13 31.11 2icy s GLU 323 CO 0.02 -0.12 -0.18 0.08 -0.54 0.00 0.00 175.26 174.53 2icy s VAL 324 N 1.40 1.80 -1.52 3.70 1.01 0.19 -4.75 120.40 122.24 2icy s VAL 324 Ca 0.05 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.19 2icy s VAL 324 Cb -0.15 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.61 2icy s VAL 324 CO 0.02 0.50 0.51 -0.67 0.00 0.00 0.00 175.10 175.46 2icy n ASP 325 N 4.48 -5.62 0.00 3.32 -0.08 -1.26 -0.62 116.55 116.76 2icy n ASP 325 Ca -0.19 -0.26 0.00 0.00 -1.51 0.00 0.00 54.79 52.83 2icy n ASP 325 Cb 0.51 -4.58 0.00 0.00 2.34 0.00 0.00 41.12 39.39 2icy n ASP 325 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2icy n GLY 326 N -1.39 0.96 3.44 0.27 0.00 -1.26 -5.01 105.19 102.20 2icy n GLY 326 Ca -0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 2icy n GLY 326 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2icy s VAL 327 N -3.84 3.95 -0.24 1.61 1.01 0.21 -5.07 120.40 118.03 2icy s VAL 327 Ca 0.00 -0.31 -0.26 0.00 0.00 0.00 0.00 61.98 61.41 2icy s VAL 327 Cb 0.00 -2.79 -0.00 0.00 0.00 0.00 0.00 36.38 33.59 2icy s VAL 327 CO 0.00 0.42 0.89 -0.54 0.00 0.00 0.00 175.10 175.88 2icy s LYS 328 N 1.03 4.20 0.20 2.72 1.02 -1.26 -0.64 119.74 127.01 2icy s LYS 328 Ca 0.02 1.06 0.09 0.00 0.02 0.00 0.00 55.97 57.16 2icy s LYS 328 Cb -0.14 -3.65 -0.04 0.00 -0.52 0.00 0.00 37.83 33.48 2icy s LYS 328 CO 0.02 -0.56 -0.18 0.14 -0.92 0.00 0.00 175.35 173.85 2icy s VAL 329 N 2.96 1.97 -0.01 3.17 -7.23 -0.02 0.57 120.40 121.80 2icy s VAL 329 Ca 0.38 -2.10 -0.00 0.00 -1.81 0.00 0.00 61.98 58.45 2icy s VAL 329 Cb -0.15 -2.01 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 2icy s VAL 329 CO 0.07 -0.38 0.06 -0.76 -0.31 0.00 0.00 175.10 173.78 2icy s LEU 330 N -2.99 3.82 -0.52 1.32 1.43 -0.58 -1.84 118.68 119.32 2icy s LEU 330 Ca 0.21 0.13 0.07 0.00 -1.03 0.00 0.00 54.13 53.51 2icy s LEU 330 Cb -0.05 -2.18 0.32 0.00 0.03 0.00 0.00 46.19 44.31 2icy s LEU 330 CO 0.08 0.29 0.82 0.00 0.23 0.00 0.00 176.35 177.78 2icy n GLN 331 N 1.33 2.36 -1.65 1.70 6.02 0.87 -2.81 117.38 125.20 2icy n GLN 331 Ca -0.14 -4.33 -0.56 0.00 -0.01 0.00 0.00 57.00 51.95 2icy n GLN 331 Cb 0.53 -2.03 -0.07 0.00 1.02 0.00 0.00 30.24 29.69 2icy n GLN 331 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2icy n LEU 332 N 0.21 1.86 -4.08 1.08 4.77 -1.15 -4.32 117.00 115.36 2icy n LEU 332 Ca 0.29 1.11 -0.13 0.00 -0.03 0.00 0.00 56.01 57.24 2icy n LEU 332 Cb 0.47 -1.13 -0.05 0.00 -2.33 0.00 0.00 43.42 40.39 2icy n LEU 332 CO 0.31 -0.80 0.11 -1.83 -1.33 0.00 0.00 177.39 173.85 2icy s GLU 333 N 2.08 1.77 0.07 3.23 -1.05 -0.17 -4.71 118.70 119.92 2icy s GLU 333 Ca 0.93 -1.64 0.00 0.00 -0.15 0.00 0.00 54.97 54.11 2icy s GLU 333 Cb -1.07 0.43 -0.04 0.00 -0.44 0.00 0.00 34.13 33.02 2icy s GLU 333 CO 0.59 -0.72 -0.05 0.95 0.95 0.00 0.00 175.26 176.98 2icy s THR 334 N -3.35 0.42 -0.15 1.83 -4.23 -1.08 -1.29 115.64 107.79 2icy s THR 334 Ca 0.30 -1.77 -0.07 0.00 -1.18 0.00 0.00 61.69 58.97 2icy s THR 334 Cb 0.00 -1.46 -0.04 0.00 1.34 0.00 0.00 72.50 72.34 2icy s THR 334 CO 0.17 -0.88 0.10 0.00 -0.54 0.00 0.00 174.62 173.46 2icy s ALA 335 N -3.51 3.61 0.32 3.99 0.00 -1.26 0.29 121.76 125.20 2icy s ALA 335 Ca 0.07 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.33 2icy s ALA 335 Cb 0.05 -1.94 0.57 0.00 0.00 0.00 0.00 23.12 21.79 2icy s ALA 335 CO -0.07 0.37 1.95 0.00 0.00 0.00 0.00 175.76 178.01 2icy h ALA 336 N 5.95 1.53 0.00 0.00 0.00 -1.80 -2.07 119.26 122.88 2icy h ALA 336 Ca -0.45 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 2icy h ALA 336 Cb 1.19 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2icy h ALA 336 CO 0.66 0.37 -0.12 0.78 0.00 0.00 0.00 179.25 180.94 2icy h GLY 337 N 0.97 0.00 2.00 0.00 0.00 -1.96 -2.69 103.07 101.40 2icy h GLY 337 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 2icy h GLY 337 CO -0.10 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.44 2icy h ALA 338 N 1.88 1.00 0.00 3.60 0.00 -1.73 -2.77 119.26 121.23 2icy h ALA 338 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2icy h ALA 338 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2icy h ALA 338 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.27 2icy n ALA 339 N -1.85 1.86 -0.19 0.00 0.00 -1.01 -3.43 120.51 115.88 2icy n ALA 339 Ca 0.02 -0.07 0.18 0.00 0.00 0.00 0.00 53.44 53.58 2icy n ALA 339 Cb 0.27 -1.30 0.53 0.00 0.00 0.00 0.00 19.45 18.96 2icy n ALA 339 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2icy h ILE 340 N 0.00 0.73 0.00 0.00 2.10 -1.70 -1.55 117.51 117.08 2icy h ILE 340 Ca 0.00 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 65.82 2icy h ILE 340 Cb 0.30 0.33 0.00 0.00 -1.09 0.00 0.00 36.82 36.36 2icy h ILE 340 CO 0.00 0.07 0.00 -0.09 -1.08 0.00 0.00 178.15 177.05 2icy h ARG 341 N 0.36 0.00 -0.00 2.19 2.43 -1.72 -3.05 114.38 114.58 2icy h ARG 341 Ca 0.41 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.58 2icy h ARG 341 Cb 1.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 2icy h ARG 341 CO -0.13 0.00 -0.73 1.19 -1.51 0.00 0.00 179.97 178.79 2icy n PHE 342 N -2.52 0.00 -3.73 2.20 3.72 -0.58 -4.98 117.46 111.57 2icy n PHE 342 Ca -0.00 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.12 2icy n PHE 342 Cb 0.16 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.66 2icy n PHE 342 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2icy s PHE 343 N -2.59 3.48 0.38 1.38 0.08 -1.15 -5.06 117.98 114.50 2icy s PHE 343 Ca 0.10 0.35 -0.24 0.00 0.12 0.00 0.00 56.93 57.26 2icy s PHE 343 Cb 0.15 -1.86 -0.10 0.00 -0.57 0.00 0.00 43.02 40.64 2icy s PHE 343 CO 0.68 0.42 1.00 -0.51 -0.10 0.00 0.00 175.22 176.71 2icy s ASP 344 N -2.99 6.98 -1.65 1.36 1.01 -1.26 -3.65 116.67 116.47 2icy s ASP 344 Ca 0.38 1.93 -0.10 0.00 0.71 0.00 0.00 52.55 55.47 2icy s ASP 344 Cb -0.11 -2.58 0.09 0.00 1.01 0.00 0.00 42.92 41.33 2icy s ASP 344 CO 0.28 -0.33 0.36 0.59 0.21 0.00 0.00 175.17 176.28 2icy n ASN 345 N 0.07 -0.71 -4.77 0.27 3.02 -1.26 -1.99 115.26 109.88 2icy n ASN 345 Ca 0.04 -1.19 -0.38 0.00 -0.03 0.00 0.00 54.58 53.03 2icy n ASN 345 Cb 0.50 -2.01 -0.04 0.00 -0.61 0.00 0.00 39.78 37.63 2icy n ASN 345 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2icy s ALA 346 N -3.82 3.17 0.23 5.41 0.00 -1.24 -3.88 121.76 121.64 2icy s ALA 346 Ca 0.36 0.75 -0.02 0.00 0.00 0.00 0.00 51.96 53.05 2icy s ALA 346 Cb -0.20 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 2icy s ALA 346 CO 0.98 -0.19 0.24 0.96 0.00 0.00 0.00 175.76 177.74 2icy s ILE 347 N -1.52 0.00 0.22 0.00 -4.36 -0.65 -4.99 121.20 109.90 2icy s ILE 347 Ca 0.54 -1.86 0.11 0.00 -0.26 0.00 0.00 60.65 59.18 2icy s ILE 347 Cb -0.25 -2.45 -0.05 0.00 1.25 0.00 0.00 42.46 40.96 2icy s ILE 347 CO 0.31 0.00 -0.18 -0.83 0.24 0.00 0.00 174.94 174.49 2icy s GLY 348 N -3.16 1.76 -0.07 6.27 0.00 -0.65 -0.92 107.32 110.56 2icy s GLY 348 Ca 0.36 -1.68 0.02 0.00 0.00 0.00 0.00 44.72 43.42 2icy s GLY 348 CO 0.14 -1.73 -0.11 0.54 0.00 0.00 0.00 173.10 171.94 2icy s VAL 349 N -1.99 1.10 -0.41 1.40 0.11 0.25 -2.11 120.40 118.75 2icy s VAL 349 Ca 0.25 -0.45 -0.21 0.00 -2.93 0.00 0.00 61.98 58.64 2icy s VAL 349 Cb -0.07 -1.01 0.02 0.00 -1.53 0.00 0.00 36.38 33.78 2icy s VAL 349 CO 0.13 0.35 0.69 0.21 -3.33 0.00 0.00 175.10 173.15 2icy s ASN 350 N 0.74 6.40 0.26 3.54 3.84 3.12 -0.30 114.94 132.54 2icy s ASN 350 Ca -0.13 -0.07 0.09 0.00 0.21 0.00 0.00 52.86 52.95 2icy s ASN 350 Cb -0.16 -2.35 -0.04 0.00 -0.55 0.00 0.00 41.25 38.16 2icy s ASN 350 CO 0.03 -0.75 0.07 0.68 -2.79 0.00 0.00 177.10 174.34 2icy s VAL 351 N 2.93 3.82 0.74 -5.21 -7.23 0.98 0.79 120.40 117.22 2icy s VAL 351 Ca 0.26 -1.72 -0.13 0.00 -1.81 0.00 0.00 61.98 58.58 2icy s VAL 351 Cb -0.14 -3.06 0.04 0.00 0.56 0.00 0.00 36.38 33.79 2icy s VAL 351 CO 0.18 -0.36 1.12 -2.16 -0.31 0.00 0.00 175.10 173.57 2icy s PRO 352 N -3.74 2.31 0.36 4.82 0.04 -1.26 -4.40 135.00 133.13 2icy s PRO 352 Ca 0.32 1.37 0.26 0.00 0.04 0.00 0.00 61.00 62.99 2icy s PRO 352 Cb -0.07 -1.89 1.26 0.00 0.04 0.00 0.00 34.50 33.84 2icy s PRO 352 CO 0.22 -1.63 1.80 -0.09 0.04 0.00 0.00 177.00 177.34 2icy h ARG 353 N -0.67 0.00 -0.36 4.56 2.43 -1.97 -2.22 114.38 116.15 2icy h ARG 353 Ca -0.45 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 58.82 2icy h ARG 353 Cb 1.25 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 2icy h ARG 353 CO 0.51 0.00 0.40 0.66 -1.51 0.00 0.00 179.97 180.03 2icy h SER 354 N 0.00 0.00 -0.35 -3.80 4.64 -1.96 0.14 113.55 112.22 2icy h SER 354 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2icy h SER 354 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2icy h SER 354 CO 0.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 2icy n ARG 355 N -3.71 1.94 -3.45 4.77 1.74 -0.83 -4.52 116.66 112.61 2icy n ARG 355 Ca 0.06 -1.45 -0.26 0.00 -0.77 0.00 0.00 57.85 55.43 2icy n ARG 355 Cb 0.56 -1.36 -0.12 0.00 -1.02 0.00 0.00 32.46 30.53 2icy n ARG 355 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2icy s PHE 356 N -1.54 0.36 -0.67 -1.55 5.36 0.48 -3.76 117.98 116.66 2icy s PHE 356 Ca 0.30 -1.23 0.04 0.00 -0.96 0.00 0.00 56.93 55.09 2icy s PHE 356 Cb 0.16 -0.78 0.30 0.00 -0.34 0.00 0.00 43.02 42.37 2icy s PHE 356 CO 0.22 -0.86 0.98 1.28 -1.46 0.00 0.00 175.22 175.37 2icy n LEU 357 N 4.39 4.58 -4.76 6.12 4.77 -1.26 -4.92 117.00 125.92 2icy n LEU 357 Ca 0.08 -5.55 -0.39 0.00 -0.03 0.00 0.00 56.01 50.12 2icy n LEU 357 Cb 0.40 -0.69 0.03 0.00 -2.33 0.00 0.00 43.42 40.83 2icy n LEU 357 CO 0.10 2.19 0.99 -2.16 -1.33 0.00 0.00 177.39 177.18 2icy s PRO 358 N -3.15 3.38 -0.49 3.23 0.04 -1.26 -4.15 135.00 132.59 2icy s PRO 358 Ca 0.44 2.24 0.03 0.00 0.04 0.00 0.00 61.00 63.75 2icy s PRO 358 Cb 0.21 -2.40 0.14 0.00 0.04 0.00 0.00 34.50 32.49 2icy s PRO 358 CO -0.08 -1.00 0.27 0.08 0.04 0.00 0.00 177.00 176.31 2icy s VAL 359 N -1.30 1.95 -0.15 -0.36 1.01 -1.26 -4.75 120.40 115.56 2icy s VAL 359 Ca 0.67 -2.99 0.19 0.00 0.00 0.00 0.00 61.98 59.85 2icy s VAL 359 Cb -0.40 -2.36 -0.27 0.00 0.00 0.00 0.00 36.38 33.36 2icy s VAL 359 CO 0.49 -0.87 0.23 0.29 0.00 0.00 0.00 175.10 175.23 2icy n LYS 360 N 3.24 0.68 -4.23 2.72 4.76 -1.26 -4.93 118.16 119.14 2icy n LYS 360 Ca 0.08 -0.04 -0.15 0.00 -2.87 0.00 0.00 58.31 55.34 2icy n LYS 360 Cb 0.34 -1.54 -0.09 0.00 -1.84 0.00 0.00 35.03 31.89 2icy n LYS 360 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2icy s ALA 361 N -2.77 1.40 0.49 7.82 0.00 -1.26 -4.76 121.76 122.67 2icy s ALA 361 Ca -0.09 -1.83 0.21 0.00 0.00 0.00 0.00 51.96 50.25 2icy s ALA 361 Cb 0.08 1.42 1.34 0.00 0.00 0.00 0.00 23.12 25.95 2icy s ALA 361 CO 0.85 -0.62 2.10 0.66 0.00 0.00 0.00 175.76 178.74 2icy h SER 362 N 2.43 0.00 -0.07 0.00 4.64 -1.83 -1.91 113.55 116.81 2icy h SER 362 Ca -0.32 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.92 2icy h SER 362 Cb 1.24 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 2icy h SER 362 CO 0.46 0.09 -0.19 0.77 -0.87 0.00 0.00 176.83 177.10 2icy h SER 363 N 0.00 0.44 -0.17 4.97 4.64 -1.89 -0.95 113.55 120.59 2icy h SER 363 Ca -0.00 -0.13 -0.21 0.00 -0.47 0.00 0.00 61.79 60.98 2icy h SER 363 Cb 0.20 -0.12 0.01 0.00 -0.31 0.00 0.00 62.40 62.17 2icy h SER 363 CO 0.01 0.65 -0.70 0.44 -0.87 0.00 0.00 176.83 176.36 2icy h ASP 364 N 0.41 0.93 -0.76 4.97 3.32 -1.68 -2.91 116.42 120.71 2icy h ASP 364 Ca 0.07 -0.58 -0.06 0.00 0.02 0.00 0.00 57.03 56.49 2icy h ASP 364 Cb 0.56 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 2icy h ASP 364 CO 0.04 1.37 0.25 0.25 -1.72 0.00 0.00 179.24 179.43 2icy h LEU 365 N 0.57 1.10 -0.53 1.55 5.85 -1.04 -2.02 115.31 120.79 2icy h LEU 365 Ca -0.03 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.50 2icy h LEU 365 Cb 1.32 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 2icy h LEU 365 CO 0.15 1.01 0.34 0.25 -0.34 0.00 0.00 178.44 179.84 2icy h LEU 366 N 1.13 0.57 -0.04 2.25 6.46 -1.11 -0.57 115.31 124.01 2icy h LEU 366 Ca 0.25 -0.01 0.03 0.00 -0.12 0.00 0.00 57.88 58.03 2icy h LEU 366 Cb 0.29 -0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 40.04 2icy h LEU 366 CO -0.01 0.41 -0.21 -0.07 -0.62 0.00 0.00 178.44 177.94 2icy h LEU 367 N 0.68 -0.62 -1.14 2.25 3.38 -1.22 -2.53 115.31 116.11 2icy h LEU 367 Ca 0.20 0.09 -0.06 0.00 0.09 0.00 0.00 57.88 58.21 2icy h LEU 367 Cb -0.04 0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2icy h LEU 367 CO -0.06 -0.27 -0.27 0.58 0.09 0.00 0.00 178.44 178.51 2icy h VAL 368 N -0.31 0.68 -0.00 1.22 2.07 -1.00 -2.63 116.25 116.28 2icy h VAL 368 Ca 0.07 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.40 2icy h VAL 368 Cb 0.41 1.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 2icy h VAL 368 CO -0.22 0.26 -0.12 0.00 0.02 0.00 0.00 177.57 177.51 2icy n GLN 369 N -3.48 0.61 -2.75 1.57 6.02 -0.26 -4.85 117.38 114.25 2icy n GLN 369 Ca -0.00 -0.20 -0.21 0.00 -0.01 0.00 0.00 57.00 56.57 2icy n GLN 369 Cb 0.44 -1.50 0.06 0.00 1.02 0.00 0.00 30.24 30.27 2icy n GLN 369 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2icy s SER 370 N -2.53 4.94 0.00 1.08 1.04 -0.98 -4.94 113.70 112.30 2icy s SER 370 Ca 0.27 -0.37 0.04 0.00 0.48 0.00 0.00 55.95 56.38 2icy s SER 370 Cb 0.20 -0.28 0.27 0.00 0.10 0.00 0.00 66.02 66.30 2icy s SER 370 CO 0.49 -1.41 0.73 -0.90 0.98 0.00 0.00 173.24 173.13 2icy n ASP 371 N -2.44 0.00 0.26 7.02 5.75 -1.26 -2.04 116.55 123.83 2icy n ASP 371 Ca 0.12 -0.82 0.15 0.00 -0.01 0.00 0.00 54.79 54.24 2icy n ASP 371 Cb 0.60 0.00 0.63 0.00 -1.03 0.00 0.00 41.12 41.32 2icy n ASP 371 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2icy h LEU 372 N 0.00 0.00 -9.20 -2.12 5.85 -1.90 -3.42 115.31 104.52 2icy h LEU 372 Ca 0.00 0.00 -0.49 0.00 0.84 0.00 0.00 57.88 58.23 2icy h LEU 372 Cb 0.00 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 40.89 2icy h LEU 372 CO 0.00 0.08 -0.64 -0.31 -0.34 0.00 0.00 178.44 177.23 2icy s TYR 373 N -3.71 1.97 0.20 1.25 1.51 -0.87 -0.44 117.35 117.26 2icy s TYR 373 Ca 0.01 -0.82 0.08 0.00 -1.01 0.00 0.00 57.07 55.33 2icy s TYR 373 Cb 0.10 -1.22 -0.05 0.00 -0.11 0.00 0.00 41.96 40.68 2icy s TYR 373 CO 0.57 0.16 -0.16 0.95 -1.11 0.00 0.00 175.55 175.97 2icy s THR 374 N -3.13 1.78 -0.28 -0.71 -4.23 0.42 -4.69 115.64 104.79 2icy s THR 374 Ca 0.33 -2.13 0.03 0.00 -1.18 0.00 0.00 61.69 58.73 2icy s THR 374 Cb 0.06 -1.99 0.07 0.00 1.34 0.00 0.00 72.50 71.99 2icy s THR 374 CO 0.14 -0.51 -0.05 -0.22 -0.54 0.00 0.00 174.62 173.43 2icy s LEU 375 N -3.14 3.55 -0.03 4.79 2.96 -1.26 -1.84 118.68 123.71 2icy s LEU 375 Ca 0.21 -1.55 -0.01 0.00 -0.22 0.00 0.00 54.13 52.56 2icy s LEU 375 Cb -0.02 -1.47 0.03 0.00 0.50 0.00 0.00 46.19 45.23 2icy s LEU 375 CO 0.07 -0.26 0.05 -0.69 -1.32 0.00 0.00 176.35 174.21 2icy s VAL 376 N 1.13 -0.06 -2.00 1.68 1.01 -0.80 -4.82 120.40 116.54 2icy s VAL 376 Ca -0.03 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.17 2icy s VAL 376 Cb -0.19 -0.11 0.00 0.00 0.00 0.00 0.00 36.38 36.08 2icy s VAL 376 CO -0.07 0.09 0.00 0.47 0.00 0.00 0.00 175.10 175.59 2icy n ASP 377 N 4.20 -5.62 0.00 3.32 8.00 -1.26 -2.12 116.55 123.07 2icy n ASP 377 Ca -0.28 0.29 0.00 0.00 0.71 0.00 0.00 54.79 55.51 2icy n ASP 377 Cb 0.50 -4.81 0.00 0.00 -0.02 0.00 0.00 41.12 36.80 2icy n ASP 377 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2icy n GLY 378 N -0.69 1.15 3.80 0.44 0.00 -1.26 -5.03 105.19 103.59 2icy n GLY 378 Ca -0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 2icy n GLY 378 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2icy s PHE 379 N -2.85 3.44 -0.34 1.61 2.99 -0.90 -4.81 117.98 117.11 2icy s PHE 379 Ca 0.00 0.39 -0.13 0.00 0.00 0.00 0.00 56.93 57.19 2icy s PHE 379 Cb 0.00 -1.92 -0.02 0.00 0.00 0.00 0.00 43.02 41.09 2icy s PHE 379 CO 0.00 0.60 0.25 0.08 -0.00 0.00 0.00 175.22 176.15 2icy s VAL 380 N -0.82 5.28 0.10 -0.44 1.01 -1.26 -1.91 120.40 122.36 2icy s VAL 380 Ca 0.13 -0.18 0.04 0.00 0.00 0.00 0.00 61.98 61.97 2icy s VAL 380 Cb -0.12 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 2icy s VAL 380 CO 0.03 -0.01 -0.10 0.42 0.00 0.00 0.00 175.10 175.44 2icy s THR 381 N 1.75 0.94 0.25 3.92 -4.23 -0.76 -4.85 115.64 112.65 2icy s THR 381 Ca 0.07 -1.65 -0.31 0.00 -1.18 0.00 0.00 61.69 58.62 2icy s THR 381 Cb -0.17 -1.37 -0.13 0.00 1.34 0.00 0.00 72.50 72.16 2icy s THR 381 CO 0.11 -0.57 1.43 -1.14 -0.54 0.00 0.00 174.62 173.91 2icy n ARG 382 N 0.53 2.15 -2.11 3.99 3.00 -1.26 -0.44 116.66 122.52 2icy n ARG 382 Ca -0.16 0.76 -0.40 0.00 -0.00 0.00 0.00 57.85 58.05 2icy n ARG 382 Cb 0.58 -2.44 -0.03 0.00 0.00 0.00 0.00 32.46 30.57 2icy n ARG 382 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 2icy s ASN 383 N 0.30 5.60 0.60 6.15 3.84 0.42 -4.74 114.94 127.12 2icy s ASN 383 Ca 0.67 0.54 0.13 0.00 0.21 0.00 0.00 52.86 54.41 2icy s ASN 383 Cb -0.62 -2.53 0.70 0.00 -0.55 0.00 0.00 41.25 38.25 2icy s ASN 383 CO 0.50 -2.08 1.36 0.11 -2.79 0.00 0.00 177.10 174.20 2icy h LYS 384 N 13.62 0.00 0.00 0.43 1.57 -1.90 0.34 116.57 130.63 2icy h LYS 384 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2icy h LYS 384 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2icy h LYS 384 CO 1.17 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 180.05 2icy h ALA 385 N 0.63 1.00 -2.90 3.86 0.00 -1.96 -3.44 119.26 116.46 2icy h ALA 385 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 2icy h ALA 385 Cb 1.31 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 19.03 2icy h ALA 385 CO 0.00 0.00 -0.13 0.50 0.00 0.00 0.00 179.25 179.62 2icy s ARG 386 N -3.29 4.33 -0.03 0.00 3.52 0.11 -5.00 118.95 118.59 2icy s ARG 386 Ca 0.06 0.48 -0.13 0.00 -0.13 0.00 0.00 55.73 56.00 2icy s ARG 386 Cb 0.10 -3.43 -0.07 0.00 -1.56 0.00 0.00 34.95 29.99 2icy s ARG 386 CO 0.46 0.18 0.62 0.00 -0.81 0.00 0.00 175.30 175.75 2icy h THR 387 N 4.67 0.00 -0.73 4.11 1.03 -1.85 -3.46 112.91 116.68 2icy h THR 387 Ca -0.41 -0.48 -0.76 0.00 -0.01 0.00 0.00 66.41 64.74 2icy h THR 387 Cb 1.18 0.00 -0.01 0.00 -1.07 0.00 0.00 68.15 68.25 2icy h THR 387 CO 0.75 0.00 1.14 -3.20 -0.01 0.00 0.00 175.52 174.20 2icy n ASN 388 N -4.64 1.46 0.24 0.00 2.85 -1.26 -4.83 115.26 109.09 2icy n ASN 388 Ca -0.06 0.80 0.08 0.00 -0.11 0.00 0.00 54.58 55.29 2icy n ASN 388 Cb 0.19 -1.02 0.61 0.00 1.24 0.00 0.00 39.78 40.80 2icy n ASN 388 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2icy h PRO 389 N 8.60 0.00 -6.28 1.20 0.13 -2.03 -3.42 132.00 130.21 2icy h PRO 389 Ca -0.27 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.29 2icy h PRO 389 Cb 1.37 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.46 2icy h PRO 389 CO 1.03 0.12 -0.15 -1.12 -0.23 0.00 0.00 178.00 177.65 2icy s SER 390 N -6.78 6.72 0.62 1.44 0.01 -1.26 -5.07 113.70 109.37 2icy s SER 390 Ca -0.04 0.94 -0.17 0.00 1.31 0.00 0.00 55.95 58.00 2icy s SER 390 Cb 0.15 -2.23 -0.02 0.00 0.21 0.00 0.00 66.02 64.13 2icy s SER 390 CO 0.66 0.09 1.11 0.20 0.41 0.00 0.00 173.24 175.71 2icy s ASN 391 N -1.88 5.36 0.45 2.44 0.01 -1.26 -5.00 114.94 115.05 2icy s ASN 391 Ca 0.38 2.04 -0.23 0.00 -0.71 0.00 0.00 52.86 54.35 2icy s ASN 391 Cb -0.14 -2.56 -0.08 0.00 0.41 0.00 0.00 41.25 38.89 2icy s ASN 391 CO 0.19 -1.46 1.15 -2.84 -1.51 0.00 0.00 177.10 172.64 2icy s PRO 392 N -3.82 3.83 0.07 -0.60 0.02 -1.26 -4.97 135.00 128.27 2icy s PRO 392 Ca 0.69 1.75 -0.24 0.00 0.02 0.00 0.00 61.00 63.22 2icy s PRO 392 Cb -0.21 -2.45 -0.06 0.00 0.02 0.00 0.00 34.50 31.80 2icy s PRO 392 CO 0.36 -0.48 0.74 -1.54 -0.33 0.00 0.00 177.00 175.75 2icy s SER 393 N -1.36 7.22 -0.18 2.53 1.04 -0.16 -4.91 113.70 117.87 2icy s SER 393 Ca 0.62 1.45 0.01 0.00 0.48 0.00 0.00 55.95 58.51 2icy s SER 393 Cb -0.28 -2.46 0.02 0.00 0.10 0.00 0.00 66.02 63.41 2icy s SER 393 CO 0.34 0.08 -0.17 -0.63 0.98 0.00 0.00 173.24 173.84 2icy s ILE 394 N -0.37 1.94 -0.15 -1.02 -1.09 -1.26 0.39 121.20 119.64 2icy s ILE 394 Ca 0.36 -0.94 0.00 0.00 -2.23 0.00 0.00 60.65 57.85 2icy s ILE 394 Cb -0.21 -1.81 0.02 0.00 -1.58 0.00 0.00 42.46 38.89 2icy s ILE 394 CO 0.23 0.46 -0.14 -0.70 -1.23 0.00 0.00 174.94 173.56 2icy s GLU 395 N 1.32 2.26 0.03 2.79 2.12 0.06 -4.87 118.70 122.41 2icy s GLU 395 Ca 0.04 -0.58 0.07 0.00 0.36 0.00 0.00 54.97 54.86 2icy s GLU 395 Cb -0.14 -2.13 -0.02 0.00 0.26 0.00 0.00 34.13 32.10 2icy s GLU 395 CO -0.12 -0.26 -0.21 -0.51 -0.54 0.00 0.00 175.26 173.63 2icy s LEU 396 N 1.48 2.13 1.03 2.70 1.43 -1.26 -0.70 118.68 125.50 2icy s LEU 396 Ca 0.04 -0.48 -0.14 0.00 -1.03 0.00 0.00 54.13 52.52 2icy s LEU 396 Cb -0.13 -1.02 0.21 0.00 0.03 0.00 0.00 46.19 45.27 2icy s LEU 396 CO -0.10 0.19 1.12 -0.83 0.23 0.00 0.00 176.35 176.96 2icy s GLY 397 N -0.97 1.58 0.41 -3.19 0.00 -0.65 -4.85 107.32 99.65 2icy s GLY 397 Ca 0.08 -0.63 0.24 0.00 0.00 0.00 0.00 44.72 44.41 2icy s GLY 397 CO 0.01 0.06 1.68 -2.55 0.00 0.00 0.00 173.10 172.30 2icy h PRO 398 N -1.98 0.21 -0.01 2.90 0.11 -1.95 0.31 132.00 131.58 2icy h PRO 398 Ca -0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2icy h PRO 398 Cb 1.32 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 2icy h PRO 398 CO 0.51 0.14 0.09 0.93 -0.21 0.00 0.00 178.00 179.46 2icy h GLU 399 N 0.21 0.00 -0.45 1.05 3.07 -1.91 -0.37 114.58 116.18 2icy h GLU 399 Ca 0.73 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.59 2icy h GLU 399 Cb 2.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.02 2icy h GLU 399 CO -0.41 0.00 0.00 1.19 -1.40 0.00 0.00 179.01 178.39 2icy n PHE 400 N -3.13 0.60 -0.15 4.33 3.72 0.11 -4.43 117.46 118.51 2icy n PHE 400 Ca -0.02 -0.47 -0.10 0.00 -0.05 0.00 0.00 57.45 56.80 2icy n PHE 400 Cb 0.16 -0.02 -0.00 0.00 -0.94 0.00 0.00 39.48 38.68 2icy n PHE 400 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2icy h LYS 401 N 2.79 0.74 -6.61 -1.08 3.64 -1.09 -3.38 116.57 111.57 2icy h LYS 401 Ca 0.00 -0.20 -0.51 0.00 -1.27 0.00 0.00 60.65 58.67 2icy h LYS 401 Cb 0.81 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.52 2icy h LYS 401 CO 0.00 0.77 0.26 0.15 -2.27 0.00 0.00 179.45 178.36 2icy s LYS 402 N -5.17 4.70 0.44 1.90 1.02 -1.26 -4.45 119.74 116.92 2icy s LYS 402 Ca -0.13 1.31 0.16 0.00 0.02 0.00 0.00 55.97 57.33 2icy s LYS 402 Cb 0.11 -3.28 1.07 0.00 -0.52 0.00 0.00 37.83 35.21 2icy s LYS 402 CO 0.79 0.52 1.94 0.28 -0.92 0.00 0.00 175.35 177.97 2icy h VAL 403 N 3.32 0.82 -0.08 3.17 2.07 -1.28 0.33 116.25 124.60 2icy h VAL 403 Ca -0.46 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 2icy h VAL 403 Cb 1.20 0.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 2icy h VAL 403 CO 0.67 0.07 -0.00 0.00 0.02 0.00 0.00 177.57 178.33 2icy h ALA 404 N 1.67 0.10 -0.03 1.67 0.00 -1.88 -1.36 119.26 119.43 2icy h ALA 404 Ca 0.33 -0.18 -0.22 0.00 0.00 0.00 0.00 54.91 54.84 2icy h ALA 404 Cb 0.77 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2icy h ALA 404 CO -0.10 -0.21 -0.90 1.79 0.00 0.00 0.00 179.25 179.83 2icy h THR 405 N -0.15 1.37 -0.02 0.00 1.35 -1.73 -2.80 112.91 110.92 2icy h THR 405 Ca 0.02 -2.32 0.03 0.00 -0.55 0.00 0.00 66.41 63.60 2icy h THR 405 Cb 0.34 2.31 -0.06 0.00 -1.73 0.00 0.00 68.15 69.02 2icy h THR 405 CO 0.00 0.70 -0.38 0.15 -0.25 0.00 0.00 175.52 175.75 2icy h PHE 406 N 0.29 -1.06 -0.80 4.73 3.57 -0.34 -1.98 116.94 121.35 2icy h PHE 406 Ca -0.07 0.04 0.09 0.00 3.53 0.00 0.00 57.97 61.56 2icy h PHE 406 Cb 1.52 0.47 -0.07 0.00 2.79 0.00 0.00 35.95 40.66 2icy h PHE 406 CO 0.06 -0.46 0.45 -0.07 -2.23 0.00 0.00 178.31 176.07 2icy h LEU 407 N -0.52 0.64 -1.22 0.59 3.38 -1.27 -2.35 115.31 114.56 2icy h LEU 407 Ca 0.06 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.09 2icy h LEU 407 Cb 0.61 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 2icy h LEU 407 CO -0.31 0.37 0.53 0.28 0.09 0.00 0.00 178.44 179.39 2icy h SER 408 N 0.76 0.91 -0.01 -0.43 0.02 -1.16 -2.56 113.55 111.09 2icy h SER 408 Ca 0.39 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.31 2icy h SER 408 Cb 0.35 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.67 2icy h SER 408 CO -0.25 0.66 0.00 0.54 -1.14 0.00 0.00 176.83 176.64 2icy n ARG 409 N -4.41 1.07 -3.66 3.45 1.74 -0.79 -4.42 116.66 109.63 2icy n ARG 409 Ca 0.09 -0.10 -0.29 0.00 -0.77 0.00 0.00 57.85 56.78 2icy n ARG 409 Cb 0.03 -1.41 -0.13 0.00 -1.02 0.00 0.00 32.46 29.93 2icy n ARG 409 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2icy s PHE 410 N -1.99 1.81 0.30 -1.55 0.40 -0.96 0.98 117.98 116.97 2icy s PHE 410 Ca 0.39 -2.35 0.05 0.00 -0.60 0.00 0.00 56.93 54.41 2icy s PHE 410 Cb 0.18 -1.70 0.80 0.00 0.51 0.00 0.00 43.02 42.80 2icy s PHE 410 CO 0.30 -0.78 1.64 0.87 0.70 0.00 0.00 175.22 177.96 2icy h LYS 411 N 6.58 0.20 -4.04 0.44 1.57 -1.17 -3.40 116.57 116.75 2icy h LYS 411 Ca 0.04 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 2icy h LYS 411 Cb 0.92 -0.05 -0.14 0.00 0.08 0.00 0.00 32.23 33.04 2icy h LYS 411 CO 0.45 0.13 -0.50 -1.54 -0.57 0.00 0.00 179.45 177.43 2icy s SER 412 N -5.03 0.26 -0.28 0.86 1.04 -1.25 -4.88 113.70 104.42 2icy s SER 412 Ca -0.12 -0.87 -0.27 0.00 0.48 0.00 0.00 55.95 55.18 2icy s SER 412 Cb 0.27 0.30 0.01 0.00 0.10 0.00 0.00 66.02 66.70 2icy s SER 412 CO 0.78 -0.71 0.95 -0.63 0.98 0.00 0.00 173.24 174.61 2icy s ILE 413 N -3.92 4.68 0.96 -1.02 -1.09 -1.26 -4.79 121.20 114.75 2icy s ILE 413 Ca 0.10 1.64 -0.12 0.00 -2.23 0.00 0.00 60.65 60.04 2icy s ILE 413 Cb 0.06 -4.27 0.11 0.00 -1.58 0.00 0.00 42.46 36.77 2icy s ILE 413 CO -0.08 -0.28 0.76 -0.81 -1.23 0.00 0.00 174.94 173.30 2icy n PRO 414 N 6.43 -0.57 -2.49 2.79 -0.04 -1.26 -4.87 135.00 134.99 2icy n PRO 414 Ca 0.09 -0.12 -0.42 0.00 -0.04 0.00 0.00 63.50 63.01 2icy n PRO 414 Cb 0.47 -2.11 -0.03 0.00 -0.04 0.00 0.00 33.50 31.79 2icy n PRO 414 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2icy s SER 415 N -2.32 7.15 -0.02 3.54 0.15 0.05 -4.63 113.70 117.63 2icy s SER 415 Ca 0.62 1.94 0.03 0.00 0.70 0.00 0.00 55.95 59.24 2icy s SER 415 Cb -0.22 -2.58 0.04 0.00 -1.71 0.00 0.00 66.02 61.55 2icy s SER 415 CO 0.63 -0.41 0.90 2.30 1.20 0.00 0.00 173.24 177.85 2icy n ILE 416 N 3.86 0.82 0.21 6.45 -5.35 -1.26 -1.41 119.36 122.67 2icy n ILE 416 Ca 0.08 -0.87 0.15 0.00 -0.27 0.00 0.00 62.75 61.85 2icy n ILE 416 Cb 0.47 0.52 0.80 0.00 -1.74 0.00 0.00 39.64 39.69 2icy n ILE 416 CO 0.00 0.00 0.00 1.62 -1.76 0.00 0.00 176.55 176.41 2icy h VAL 417 N 1.14 0.61 -0.41 7.28 3.04 -1.83 0.14 116.25 126.23 2icy h VAL 417 Ca 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 66.70 65.59 2icy h VAL 417 Cb 0.74 0.89 -0.06 0.00 -2.01 0.00 0.00 31.29 30.85 2icy h VAL 417 CO 0.00 0.00 0.05 -0.62 -1.01 0.00 0.00 177.57 175.99 2icy n GLU 418 N -4.02 2.87 -3.68 4.17 1.02 -1.26 -4.60 120.64 115.14 2icy n GLU 418 Ca 0.01 -2.99 -0.36 0.00 -0.02 0.00 0.00 57.16 53.79 2icy n GLU 418 Cb 0.26 -1.94 -0.06 0.00 -0.02 0.00 0.00 31.44 29.69 2icy n GLU 418 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2icy s LEU 419 N -2.98 4.39 -0.13 -4.62 0.20 0.03 -1.74 118.68 113.84 2icy s LEU 419 Ca 0.46 0.68 0.05 0.00 0.69 0.00 0.00 54.13 56.02 2icy s LEU 419 Cb 0.38 -2.62 -0.11 0.00 -0.43 0.00 0.00 46.19 43.41 2icy s LEU 419 CO 0.08 0.28 -0.05 0.47 -0.29 0.00 0.00 176.35 176.84 2icy n ASP 420 N 1.37 2.60 -3.70 3.68 8.00 0.48 -4.35 116.55 124.63 2icy n ASP 420 Ca -0.13 -0.04 -0.14 0.00 0.71 0.00 0.00 54.79 55.20 2icy n ASP 420 Cb 0.53 0.26 -0.09 0.00 -0.02 0.00 0.00 41.12 41.80 2icy n ASP 420 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2icy s SER 421 N -4.88 -0.50 -0.05 -2.24 1.04 -1.01 -0.99 113.70 105.07 2icy s SER 421 Ca -0.12 0.90 0.01 0.00 0.48 0.00 0.00 55.95 57.22 2icy s SER 421 Cb 0.04 0.93 0.02 0.00 0.10 0.00 0.00 66.02 67.11 2icy s SER 421 CO 0.39 -0.22 -0.07 -0.22 0.98 0.00 0.00 173.24 174.09 2icy s LEU 422 N 0.03 1.45 -0.08 2.42 2.96 0.16 -1.02 118.68 124.61 2icy s LEU 422 Ca -0.02 -0.19 0.01 0.00 -0.22 0.00 0.00 54.13 53.71 2icy s LEU 422 Cb -0.03 -0.59 0.02 0.00 0.50 0.00 0.00 46.19 46.09 2icy s LEU 422 CO 0.02 -0.02 -0.09 -0.54 -1.32 0.00 0.00 176.35 174.39 2icy s LYS 423 N 0.82 1.52 -0.08 1.98 1.02 -0.63 -0.76 119.74 123.62 2icy s LYS 423 Ca -0.12 -0.31 0.03 0.00 0.02 0.00 0.00 55.97 55.58 2icy s LYS 423 Cb -0.15 -1.41 0.01 0.00 -0.52 0.00 0.00 37.83 35.76 2icy s LYS 423 CO 0.01 -0.10 -0.16 0.08 -0.92 0.00 0.00 175.35 174.26 2icy s VAL 424 N 1.11 1.45 0.05 3.17 1.01 0.13 -0.05 120.40 127.26 2icy s VAL 424 Ca -0.07 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.26 2icy s VAL 424 Cb -0.14 -1.29 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 2icy s VAL 424 CO -0.01 0.42 -0.05 -0.94 0.00 0.00 0.00 175.10 174.52 2icy s SER 425 N 0.53 0.69 0.00 3.32 1.04 0.09 -1.64 113.70 117.74 2icy s SER 425 Ca -0.16 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.56 2icy s SER 425 Cb -0.16 0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.05 2icy s SER 425 CO 0.05 -0.35 0.00 0.61 0.98 0.00 0.00 173.24 174.53 2icy n GLY 426 N 0.94 -2.84 3.32 7.32 0.00 -1.26 -1.13 105.19 111.54 2icy n GLY 426 Ca -0.19 -1.78 -0.43 0.00 0.00 0.00 0.00 46.02 43.61 2icy n GLY 426 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2icy n ASP 427 N -0.19 4.91 -4.69 1.61 2.03 -1.26 -4.83 116.55 114.13 2icy n ASP 427 Ca 0.00 -2.96 -0.35 0.00 0.52 0.00 0.00 54.79 52.00 2icy n ASP 427 Cb 0.00 -1.64 -0.09 0.00 -0.72 0.00 0.00 41.12 38.68 2icy n ASP 427 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2icy s VAL 428 N 2.59 4.84 -0.03 5.18 1.01 -1.26 -1.37 120.40 131.35 2icy s VAL 428 Ca 0.47 -0.03 0.06 0.00 0.00 0.00 0.00 61.98 62.48 2icy s VAL 428 Cb 0.04 -3.14 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 2icy s VAL 428 CO 0.02 0.52 -0.21 0.26 0.00 0.00 0.00 175.10 175.69 2icy s TRP 429 N -0.14 2.00 -0.16 5.22 0.52 0.35 -4.88 118.94 121.84 2icy s TRP 429 Ca 0.07 -0.49 -0.03 0.00 0.02 0.00 0.00 56.10 55.67 2icy s TRP 429 Cb -0.12 -1.31 -0.02 0.00 -1.15 0.00 0.00 33.47 30.87 2icy s TRP 429 CO 0.01 -0.12 -0.05 -0.06 0.02 0.00 0.00 176.95 176.75 2icy s PHE 430 N -0.26 2.98 0.00 -1.98 0.40 0.28 -0.14 117.98 119.26 2icy s PHE 430 Ca 0.02 -0.43 0.00 0.00 -0.60 0.00 0.00 56.93 55.91 2icy s PHE 430 Cb -0.11 -1.96 0.00 0.00 0.51 0.00 0.00 43.02 41.46 2icy s PHE 430 CO 0.01 -0.13 0.00 0.41 0.70 0.00 0.00 175.22 176.21 2icy n GLY 431 N 3.71 -0.71 3.93 4.36 0.00 -0.12 -1.06 105.19 115.30 2icy n GLY 431 Ca -0.18 -1.52 -0.20 0.00 0.00 0.00 0.00 46.02 44.12 2icy n GLY 431 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2icy s SER 432 N -1.14 5.90 -1.35 1.61 1.04 -1.26 -3.70 113.70 114.79 2icy s SER 432 Ca 0.00 -0.17 -0.11 0.00 0.48 0.00 0.00 55.95 56.16 2icy s SER 432 Cb 0.00 -1.41 0.08 0.00 0.10 0.00 0.00 66.02 64.79 2icy s SER 432 CO 0.00 -0.24 0.56 -1.54 0.98 0.00 0.00 173.24 173.00 2icy n SER 433 N -1.45 -3.82 -4.80 7.02 3.41 -1.26 0.19 113.62 112.92 2icy n SER 433 Ca -0.04 -0.48 -0.35 0.00 -0.26 0.00 0.00 58.87 57.73 2icy n SER 433 Cb 0.58 -3.14 -0.05 0.00 -0.26 0.00 0.00 64.21 61.33 2icy n SER 433 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2icy s ILE 434 N -3.00 4.05 -0.14 -1.33 1.01 -1.26 -3.78 121.20 116.75 2icy s ILE 434 Ca 0.45 1.43 0.02 0.00 0.00 0.00 0.00 60.65 62.55 2icy s ILE 434 Cb -0.24 -3.67 0.01 0.00 0.01 0.00 0.00 42.46 38.58 2icy s ILE 434 CO 0.56 -0.13 -0.19 -0.69 0.00 0.00 0.00 174.94 174.50 2icy s VAL 435 N -1.89 1.82 -0.12 2.92 1.01 -0.34 -0.77 120.40 123.03 2icy s VAL 435 Ca 0.60 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.76 2icy s VAL 435 Cb -0.16 -1.64 -0.02 0.00 0.00 0.00 0.00 36.38 34.57 2icy s VAL 435 CO 0.20 0.50 -0.12 -0.76 0.00 0.00 0.00 175.10 174.92 2icy s LEU 436 N 1.03 2.78 0.03 3.92 1.43 -0.50 0.57 118.68 127.95 2icy s LEU 436 Ca -0.04 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 2icy s LEU 436 Cb -0.15 -1.62 -0.02 0.00 0.03 0.00 0.00 46.19 44.43 2icy s LEU 436 CO -0.05 0.20 -0.07 -0.54 0.23 0.00 0.00 176.35 176.12 2icy s LYS 437 N 0.14 0.50 7.49 1.70 1.02 0.12 -3.62 119.74 127.09 2icy s LYS 437 Ca -0.06 -0.67 0.00 0.00 0.02 0.00 0.00 55.97 55.26 2icy s LYS 437 Cb -0.15 -0.29 0.00 0.00 -0.52 0.00 0.00 37.83 36.87 2icy s LYS 437 CO 0.05 0.05 0.00 0.41 -0.92 0.00 0.00 175.35 174.94 2icy n GLY 438 N 1.69 2.80 3.44 -3.33 0.00 -0.71 -0.49 105.19 108.59 2icy n GLY 438 Ca -0.21 -0.24 -0.38 0.00 0.00 0.00 0.00 46.02 45.19 2icy n GLY 438 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2icy s LYS 439 N 0.00 3.43 -0.04 1.61 3.01 -1.26 -0.39 119.74 126.10 2icy s LYS 439 Ca 0.00 -0.64 0.06 0.00 -1.01 0.00 0.00 55.97 54.37 2icy s LYS 439 Cb 0.00 -3.50 -0.01 0.00 -1.01 0.00 0.00 37.83 33.31 2icy s LYS 439 CO 0.00 -0.35 -0.22 0.08 0.51 0.00 0.00 175.35 175.37 2icy s VAL 440 N 1.61 1.80 -0.01 3.17 1.01 -0.19 -2.31 120.40 125.49 2icy s VAL 440 Ca 0.05 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.09 2icy s VAL 440 Cb -0.16 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.71 2icy s VAL 440 CO 0.06 0.51 0.01 0.42 0.00 0.00 0.00 175.10 176.09 2icy s THR 441 N -0.22 0.04 -0.25 3.92 -4.23 -0.76 -1.60 115.64 112.55 2icy s THR 441 Ca 0.00 0.07 0.01 0.00 -1.18 0.00 0.00 61.69 60.59 2icy s THR 441 Cb -0.12 -0.11 0.07 0.00 1.34 0.00 0.00 72.50 73.68 2icy s THR 441 CO 0.02 0.06 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.44 2icy s VAL 442 N 0.53 1.48 -0.31 2.29 1.01 0.93 0.18 120.40 126.51 2icy s VAL 442 Ca -0.05 -1.28 -0.00 0.00 0.00 0.00 0.00 61.98 60.65 2icy s VAL 442 Cb -0.07 -1.81 0.07 0.00 0.00 0.00 0.00 36.38 34.57 2icy s VAL 442 CO -0.01 -0.18 0.01 0.00 0.00 0.00 0.00 175.10 174.91 2icy s ALA 443 N 1.40 2.82 -0.23 5.51 0.00 0.11 -0.73 121.76 130.63 2icy s ALA 443 Ca -0.03 -1.95 -0.25 0.00 0.00 0.00 0.00 51.96 49.72 2icy s ALA 443 Cb -0.19 -1.93 -0.00 0.00 0.00 0.00 0.00 23.12 21.00 2icy s ALA 443 CO -0.08 -1.37 0.87 0.00 0.00 0.00 0.00 175.76 175.18 2icy s ALA 444 N 1.17 3.64 0.91 0.00 0.00 -0.28 -4.30 121.76 122.89 2icy s ALA 444 Ca -0.02 -0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.76 2icy s ALA 444 Cb -0.20 -3.33 0.14 0.00 0.00 0.00 0.00 23.12 19.73 2icy s ALA 444 CO -0.03 -0.92 1.09 0.15 0.00 0.00 0.00 175.76 176.05 2icy s LYS 445 N 2.84 1.12 0.19 0.00 1.02 -1.26 -4.36 119.74 119.29 2icy s LYS 445 Ca 0.37 1.05 -0.33 0.00 0.02 0.00 0.00 55.97 57.08 2icy s LYS 445 Cb -0.15 -1.78 -0.14 0.00 -0.52 0.00 0.00 37.83 35.25 2icy s LYS 445 CO 0.08 -2.40 1.54 0.45 -0.92 0.00 0.00 175.35 174.09 2icy n SER 446 N -4.02 3.07 0.00 2.83 2.88 -1.26 -0.64 113.62 116.48 2icy n SER 446 Ca 0.08 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.72 2icy n SER 446 Cb 0.54 -1.44 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 2icy n SER 446 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2icy n GLY 447 N 3.03 2.21 3.85 0.46 0.00 -1.26 -5.02 105.19 108.46 2icy n GLY 447 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 2icy n GLY 447 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2icy s VAL 448 N -2.36 5.20 -0.33 1.61 1.01 0.19 -5.05 120.40 120.67 2icy s VAL 448 Ca 0.00 0.62 0.01 0.00 0.00 0.00 0.00 61.98 62.61 2icy s VAL 448 Cb 0.00 -3.60 0.09 0.00 0.00 0.00 0.00 36.38 32.86 2icy s VAL 448 CO 0.00 0.59 0.05 -1.59 0.00 0.00 0.00 175.10 174.15 2icy s LYS 449 N -1.03 1.90 -0.18 2.72 -2.85 -1.26 -4.00 119.74 115.04 2icy s LYS 449 Ca 0.21 -1.66 -0.19 0.00 -1.00 0.00 0.00 55.97 53.32 2icy s LYS 449 Cb -0.15 -3.23 -0.03 0.00 -2.06 0.00 0.00 37.83 32.36 2icy s LYS 449 CO 0.10 -0.85 0.53 -0.51 0.10 0.00 0.00 175.35 174.72 2icy s LEU 450 N 1.05 4.17 -0.19 2.77 1.43 -0.47 -5.00 118.68 122.44 2icy s LEU 450 Ca 0.04 0.72 -0.01 0.00 -1.03 0.00 0.00 54.13 53.85 2icy s LEU 450 Cb -0.20 -2.73 0.00 0.00 0.03 0.00 0.00 46.19 43.29 2icy s LEU 450 CO -0.05 -0.16 -0.12 -1.61 0.23 0.00 0.00 176.35 174.64 2icy s GLU 451 N 1.49 3.23 -0.08 1.70 2.02 -1.26 -0.50 118.70 125.30 2icy s GLU 451 Ca 0.25 -0.72 -0.25 0.00 0.02 0.00 0.00 54.97 54.27 2icy s GLU 451 Cb -0.15 -2.76 -0.03 0.00 0.10 0.00 0.00 34.13 31.28 2icy s GLU 451 CO 0.10 -0.12 0.79 0.42 0.02 0.00 0.00 175.26 176.47 2icy s ILE 452 N 1.18 4.97 0.53 -1.63 1.09 0.81 -4.96 121.20 123.19 2icy s ILE 452 Ca 0.02 1.62 -0.20 0.00 -1.10 0.00 0.00 60.65 60.99 2icy s ILE 452 Cb -0.14 -4.12 -0.07 0.00 -1.06 0.00 0.00 42.46 37.07 2icy s ILE 452 CO -0.05 0.17 1.11 -2.16 -0.10 0.00 0.00 174.94 173.92 2icy s PRO 453 N 1.19 3.47 0.43 2.79 0.04 -1.26 -0.94 135.00 140.72 2icy s PRO 453 Ca 0.41 1.55 -0.25 0.00 0.04 0.00 0.00 61.00 62.75 2icy s PRO 453 Cb -0.18 -2.03 -0.10 0.00 0.04 0.00 0.00 34.50 32.23 2icy s PRO 453 CO 0.19 -0.74 1.17 -0.25 0.04 0.00 0.00 177.00 177.40 2icy n ASP 454 N -1.21 2.01 0.00 6.66 8.00 -1.26 -1.86 116.55 128.88 2icy n ASP 454 Ca 0.11 1.07 0.00 0.00 0.71 0.00 0.00 54.79 56.68 2icy n ASP 454 Cb 0.51 -1.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.17 2icy n ASP 454 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2icy n ARG 455 N 0.01 -0.06 -1.82 -1.24 1.74 0.13 -4.94 116.66 110.48 2icy n ARG 455 Ca 0.08 0.02 -0.42 0.00 -0.77 0.00 0.00 57.85 56.76 2icy n ARG 455 Cb 0.40 -3.38 -0.02 0.00 -1.02 0.00 0.00 32.46 28.44 2icy n ARG 455 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2icy s ALA 456 N -2.65 3.76 -0.28 7.54 0.00 -0.78 -4.75 121.76 124.61 2icy s ALA 456 Ca 0.00 1.52 -0.06 0.00 0.00 0.00 0.00 51.96 53.42 2icy s ALA 456 Cb 0.00 -3.64 0.01 0.00 0.00 0.00 0.00 23.12 19.49 2icy s ALA 456 CO 0.00 -0.92 0.05 0.08 0.00 0.00 0.00 175.76 174.97 2icy s VAL 457 N 0.25 3.76 -0.35 0.00 1.01 -1.26 -1.19 120.40 122.62 2icy s VAL 457 Ca 0.65 -0.71 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 2icy s VAL 457 Cb -0.47 -2.92 0.07 0.00 0.00 0.00 0.00 36.38 33.07 2icy s VAL 457 CO 0.44 0.13 0.10 -0.69 0.00 0.00 0.00 175.10 175.08 2icy s VAL 458 N 1.47 3.23 -0.18 2.92 1.01 0.19 -4.96 120.40 124.08 2icy s VAL 458 Ca 0.02 -1.63 0.00 0.00 0.00 0.00 0.00 61.98 60.38 2icy s VAL 458 Cb -0.17 -3.00 0.01 0.00 0.00 0.00 0.00 36.38 33.22 2icy s VAL 458 CO 0.01 -0.36 -0.16 -0.70 0.00 0.00 0.00 175.10 173.89 2icy s GLU 459 N 1.23 3.12 -1.54 2.72 2.12 -1.26 0.10 118.70 125.19 2icy s GLU 459 Ca 0.01 -0.77 -0.09 0.00 0.36 0.00 0.00 54.97 54.47 2icy s GLU 459 Cb -0.21 -2.66 0.07 0.00 0.26 0.00 0.00 34.13 31.60 2icy s GLU 459 CO -0.02 -0.14 0.66 0.09 -0.54 0.00 0.00 175.26 175.31 2icy n ASN 460 N 4.48 -2.20 -4.50 -1.70 3.02 0.36 -4.97 115.26 109.75 2icy n ASN 460 Ca -0.20 -0.97 -0.26 0.00 -0.03 0.00 0.00 54.58 53.13 2icy n ASN 460 Cb 0.51 -3.11 -0.10 0.00 -0.61 0.00 0.00 39.78 36.46 2icy n ASN 460 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2icy s LYS 461 N -6.69 1.80 -0.38 3.52 1.02 -0.98 -4.88 119.74 113.15 2icy s LYS 461 Ca 0.39 -1.50 -0.03 0.00 0.02 0.00 0.00 55.97 54.86 2icy s LYS 461 Cb -0.21 -1.95 0.09 0.00 -0.52 0.00 0.00 37.83 35.24 2icy s LYS 461 CO 0.89 0.39 0.15 -0.80 -0.92 0.00 0.00 175.35 175.06 2icy s ASN 462 N -3.02 5.17 -0.33 2.83 0.01 -1.26 -1.83 114.94 116.51 2icy s ASN 462 Ca 0.25 -1.82 -0.21 0.00 -0.71 0.00 0.00 52.86 50.37 2icy s ASN 462 Cb -0.07 -1.80 -0.00 0.00 0.41 0.00 0.00 41.25 39.78 2icy s ASN 462 CO 0.14 -0.47 0.66 -0.63 -1.51 0.00 0.00 177.10 175.29 2icy s ILE 463 N 1.17 4.90 -1.02 0.60 -1.09 0.13 -4.91 121.20 120.98 2icy s ILE 463 Ca 0.05 0.80 0.10 0.00 -2.23 0.00 0.00 60.65 59.37 2icy s ILE 463 Cb -0.22 -4.05 0.18 0.00 -1.58 0.00 0.00 42.46 36.79 2icy s ILE 463 CO -0.03 -0.23 1.02 0.59 -1.23 0.00 0.00 174.94 175.07 2icy n ASN 464 N 6.00 2.33 0.00 3.58 3.02 -1.26 0.07 115.26 129.00 2icy n ASN 464 Ca -0.00 -1.71 0.00 0.00 -0.03 0.00 0.00 54.58 52.83 2icy n ASN 464 Cb 0.49 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.55 2icy n ASN 464 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2icy n GLY 465 N 0.47 -0.52 0.00 7.41 0.00 -1.26 -4.56 105.19 106.74 2icy n GLY 465 Ca 0.08 -1.57 0.10 0.00 0.00 0.00 0.00 46.02 44.63 2icy n GLY 465 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77