#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x3v s SER 15 N 0.00 7.14 0.42 -1.12 0.15 -1.26 -4.93 113.70 114.11 2x3v s SER 15 Ca 0.00 2.33 0.25 0.00 0.70 0.00 0.00 55.95 59.23 2x3v s SER 15 Cb 0.00 -2.63 1.29 0.00 -1.71 0.00 0.00 66.02 62.97 2x3v s SER 15 CO 0.00 -0.26 1.69 0.15 1.20 0.00 0.00 173.24 176.02 2x3v h PHE 16 N 4.09 0.57 0.00 3.44 3.57 -2.02 0.13 116.94 126.72 2x3v h PHE 16 Ca -0.47 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.06 2x3v h PHE 16 Cb 1.21 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.80 2x3v h PHE 16 CO 0.59 -0.09 0.00 0.91 -2.23 0.00 0.00 178.31 177.49 2x3v n TRP 17 N -4.66 0.55 -2.01 0.41 7.02 -1.26 -4.05 117.44 113.43 2x3v n TRP 17 Ca 0.32 0.19 -0.33 0.00 -1.02 0.00 0.00 57.50 56.66 2x3v n TRP 17 Cb 1.19 -0.81 0.02 0.00 -2.42 0.00 0.00 31.31 29.29 2x3v n TRP 17 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 2x3v s GLU 18 N -3.14 3.17 -0.18 -0.99 0.41 0.46 -4.94 118.70 113.50 2x3v s GLU 18 Ca 0.08 1.35 -0.29 0.00 -0.41 0.00 0.00 54.97 55.71 2x3v s GLU 18 Cb 0.12 -2.00 -0.04 0.00 -1.78 0.00 0.00 34.13 30.42 2x3v s GLU 18 CO 0.44 -0.95 1.84 0.08 -0.49 0.00 0.00 175.26 176.18 2x3v s VAL 19 N -2.26 3.38 0.00 2.63 1.01 -1.26 -2.89 120.40 121.02 2x3v s VAL 19 Ca 0.67 0.43 0.00 0.00 0.00 0.00 0.00 61.98 63.07 2x3v s VAL 19 Cb -0.19 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.79 2x3v s VAL 19 CO 0.36 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.89 2x3v n GLY 20 N 4.95 2.81 0.00 4.51 0.00 -1.26 -4.96 105.19 111.24 2x3v n GLY 20 Ca 0.22 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.31 2x3v n GLY 20 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2x3v n ASN 21 N 0.00 0.00 0.26 1.61 3.02 -1.14 -2.13 115.26 116.88 2x3v n ASN 21 Ca 0.00 -1.32 0.15 0.00 -0.03 0.00 0.00 54.58 53.38 2x3v n ASN 21 Cb 0.00 0.00 0.67 0.00 -0.61 0.00 0.00 39.78 39.84 2x3v n ASN 21 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 2x3v h TYR 22 N 0.00 0.00 -1.00 3.10 -0.00 -1.81 -3.31 116.97 113.95 2x3v h TYR 22 Ca 0.00 0.00 0.24 0.00 0.00 0.00 0.00 58.73 58.97 2x3v h TYR 22 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 36.73 36.64 2x3v h TYR 22 CO 0.00 0.09 0.64 1.57 -0.00 0.00 0.00 178.16 180.47 2x3v h LYS 23 N 0.00 0.45 -0.80 0.10 2.10 -1.82 -0.87 116.57 115.73 2x3v h LYS 23 Ca -0.00 -0.03 0.07 0.00 -2.00 0.00 0.00 60.65 58.69 2x3v h LYS 23 Cb 0.51 -0.10 -0.06 0.00 -0.90 0.00 0.00 32.23 31.68 2x3v h LYS 23 CO 0.01 0.30 0.47 0.00 -2.00 0.00 0.00 179.45 178.23 2x3v h ARG 24 N 0.46 0.81 -0.78 0.07 3.08 -1.84 0.37 114.38 116.55 2x3v h ARG 24 Ca 0.56 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.52 2x3v h ARG 24 Cb 1.32 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 31.15 2x3v h ARG 24 CO -0.28 0.53 0.33 1.15 -1.07 0.00 0.00 179.97 180.63 2x3v h THR 25 N 0.83 1.25 -0.26 2.04 2.02 -1.41 -2.12 112.91 115.26 2x3v h THR 25 Ca 0.36 -0.78 -0.17 0.00 0.77 0.00 0.00 66.41 66.59 2x3v h THR 25 Cb 0.24 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2x3v h THR 25 CO -0.20 0.32 -0.51 0.58 0.37 0.00 0.00 175.52 176.08 2x3v h VAL 26 N 1.13 1.29 -0.82 3.16 2.07 -1.18 -3.02 116.25 118.89 2x3v h VAL 26 Ca 0.26 -1.72 0.06 0.00 0.82 0.00 0.00 66.70 66.13 2x3v h VAL 26 Cb 0.19 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.54 2x3v h VAL 26 CO -0.03 0.55 0.54 0.50 0.02 0.00 0.00 177.57 179.15 2x3v h LYS 27 N 0.58 0.87 -0.23 1.57 1.63 -0.08 -1.68 116.57 119.22 2x3v h LYS 27 Ca 0.02 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.74 2x3v h LYS 27 Cb 1.09 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 32.51 2x3v h LYS 27 CO 0.11 0.58 0.00 -0.09 -3.45 0.00 0.00 179.45 176.59 2x3v h ARG 28 N 0.90 0.34 -0.58 1.90 2.43 -1.26 -1.45 114.38 116.66 2x3v h ARG 28 Ca 0.35 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.44 2x3v h ARG 28 Cb 0.23 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 2x3v h ARG 28 CO -0.13 0.37 0.25 0.82 -1.51 0.00 0.00 179.97 179.77 2x3v h ILE 29 N 0.33 1.22 -0.06 1.20 2.04 -1.31 -1.40 117.51 119.53 2x3v h ILE 29 Ca 0.08 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 2x3v h ILE 29 Cb 0.23 0.58 -0.00 0.00 -0.74 0.00 0.00 36.82 36.89 2x3v h ILE 29 CO 0.00 0.26 0.03 0.44 0.00 0.00 0.00 178.15 178.88 2x3v h ASP 30 N 0.79 0.08 -1.06 1.72 3.32 -1.46 -2.88 116.42 116.94 2x3v h ASP 30 Ca 0.19 -0.15 0.28 0.00 0.02 0.00 0.00 57.03 57.37 2x3v h ASP 30 Cb 0.18 -0.02 -0.09 0.00 0.22 0.00 0.00 39.33 39.61 2x3v h ASP 30 CO -0.02 0.22 0.68 0.44 -1.72 0.00 0.00 179.24 178.84 2x3v h ASP 31 N -0.05 0.42 -0.56 6.45 3.45 -0.92 -0.75 116.42 124.46 2x3v h ASP 31 Ca 0.02 0.08 0.03 0.00 0.43 0.00 0.00 57.03 57.60 2x3v h ASP 31 Cb 0.16 0.02 -0.04 0.00 -0.56 0.00 0.00 39.33 38.90 2x3v h ASP 31 CO -0.00 0.07 0.32 1.23 -1.57 0.00 0.00 179.24 179.28 2x3v h GLY 32 N 0.36 0.79 1.19 2.75 0.00 -1.03 0.18 103.07 107.31 2x3v h GLY 32 Ca 0.61 -0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.63 2x3v h GLY 32 CO -0.29 0.18 0.07 0.84 0.00 0.00 0.00 176.54 177.33 2x3v h HIS 33 N 0.62 1.05 -0.62 5.60 -0.00 -1.21 -2.77 115.15 117.82 2x3v h HIS 33 Ca 0.23 -0.14 -0.07 0.00 -0.00 0.00 0.00 60.37 60.39 2x3v h HIS 33 Cb 0.07 -0.29 -0.03 0.00 -0.00 0.00 0.00 27.41 27.17 2x3v h HIS 33 CO -0.07 0.90 0.12 -0.09 -0.00 0.00 0.00 177.93 178.79 2x3v h ARG 34 N 0.92 1.00 -0.79 5.26 1.12 -1.00 -2.87 114.38 118.02 2x3v h ARG 34 Ca 0.18 -0.24 -0.02 0.00 -1.11 0.00 0.00 59.98 58.79 2x3v h ARG 34 Cb 0.44 -0.13 -0.04 0.00 -0.01 0.00 0.00 29.97 30.24 2x3v h ARG 34 CO 0.02 0.91 0.40 -0.07 -3.11 0.00 0.00 179.97 178.11 2x3v h LEU 35 N 0.94 1.01 -0.19 3.80 -0.00 -0.42 -1.29 115.31 119.16 2x3v h LEU 35 Ca 0.19 -0.12 0.03 0.00 -0.00 0.00 0.00 57.88 57.99 2x3v h LEU 35 Cb 0.39 -0.26 -0.03 0.00 -0.00 0.00 0.00 40.66 40.75 2x3v h LEU 35 CO 0.01 0.85 -0.01 0.00 -0.00 0.00 0.00 178.44 179.28 2x3v h ASN 37 N 0.05 0.58 -0.22 0.00 2.35 -1.27 -0.40 115.58 116.67 2x3v h ASN 37 Ca 0.09 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2x3v h ASN 37 Cb 0.12 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 2x3v h ASN 37 CO -0.16 0.39 0.13 0.44 -1.65 0.00 0.00 177.43 176.58 2x3v h ASP 38 N 0.71 0.26 -0.70 5.81 3.32 -0.90 -1.65 116.42 123.27 2x3v h ASP 38 Ca 0.26 -0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.30 2x3v h ASP 38 Cb 0.09 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 2x3v h ASP 38 CO -0.13 0.22 0.44 0.25 -1.72 0.00 0.00 179.24 178.30 2x3v h LEU 39 N 0.27 0.74 -0.62 1.55 5.85 -0.49 -0.12 115.31 122.50 2x3v h LEU 39 Ca 0.08 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2x3v h LEU 39 Cb 0.01 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 2x3v h LEU 39 CO -0.02 0.52 0.39 0.24 -0.34 0.00 0.00 178.44 179.23 2x3v h MET 40 N 0.88 0.82 -0.64 1.25 2.86 -0.91 -1.48 114.93 117.70 2x3v h MET 40 Ca 0.27 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.85 2x3v h MET 40 Cb -0.02 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.43 2x3v h MET 40 CO -0.09 0.57 0.39 0.77 1.06 0.00 0.00 176.91 179.61 2x3v h SER 41 N 0.83 0.77 -0.05 1.22 0.02 -0.75 -1.61 113.55 113.99 2x3v h SER 41 Ca 0.22 -0.06 0.01 0.00 -0.84 0.00 0.00 61.79 61.13 2x3v h SER 41 Cb -0.06 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.27 2x3v h SER 41 CO -0.05 0.60 -0.04 0.00 -1.14 0.00 0.00 176.83 176.21 2x3v h VAL 43 N -0.05 1.33 -0.24 0.00 -1.51 -1.11 -1.89 116.25 112.79 2x3v h VAL 43 Ca 0.03 -1.66 -0.10 0.00 -1.23 0.00 0.00 66.70 63.74 2x3v h VAL 43 Cb 0.10 1.78 -0.00 0.00 -2.13 0.00 0.00 31.29 31.03 2x3v h VAL 43 CO -0.08 0.50 -0.25 -0.61 -1.23 0.00 0.00 177.57 175.90 2x3v h GLN 44 N 0.20 0.60 0.00 5.19 4.15 -1.13 -0.31 115.11 123.82 2x3v h GLN 44 Ca 0.01 -0.32 -0.04 0.00 0.77 0.00 0.00 58.65 59.07 2x3v h GLN 44 Cb 0.91 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.61 2x3v h GLN 44 CO 0.07 0.92 -0.18 0.93 -1.93 0.00 0.00 178.83 178.64 2x3v h GLU 45 N 0.31 0.00 0.04 1.69 5.08 -0.77 -1.20 114.58 119.73 2x3v h GLU 45 Ca 0.04 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.13 2x3v h GLU 45 Cb 0.81 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.08 2x3v h GLU 45 CO 0.06 0.18 -1.10 -0.09 -1.00 0.00 0.00 179.01 177.06 2x3v h ARG 46 N 0.00 0.63 -0.76 2.33 9.65 -1.20 -3.06 114.38 121.97 2x3v h ARG 46 Ca -0.00 -0.73 0.04 0.00 -1.10 0.00 0.00 59.98 58.19 2x3v h ARG 46 Cb 0.36 0.22 -0.04 0.00 -1.39 0.00 0.00 29.97 29.11 2x3v h ARG 46 CO 0.02 1.31 0.50 0.00 2.80 0.00 0.00 179.97 184.61 2x3v h ALA 47 N 0.42 1.58 -0.42 2.80 0.00 -0.46 -1.29 119.26 121.89 2x3v h ALA 47 Ca -0.14 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 2x3v h ALA 47 Cb 1.76 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 2x3v h ALA 47 CO 0.21 0.33 -0.20 -0.22 0.00 0.00 0.00 179.25 179.37 2x3v h LYS 48 N 0.89 0.83 -0.47 0.00 3.64 -1.29 -1.29 116.57 118.88 2x3v h LYS 48 Ca 0.31 -0.33 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 2x3v h LYS 48 Cb 0.11 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 2x3v h LYS 48 CO -0.10 0.96 -0.11 0.82 -2.27 0.00 0.00 179.45 178.76 2x3v h ILE 49 N 0.73 1.26 -0.24 2.00 2.04 -1.30 -2.24 117.51 119.76 2x3v h ILE 49 Ca 0.10 -1.20 -0.15 0.00 1.00 0.00 0.00 64.86 64.62 2x3v h ILE 49 Cb 0.72 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 2x3v h ILE 49 CO 0.06 0.42 -0.42 -0.08 0.00 0.00 0.00 178.15 178.12 2x3v h GLU 50 N 0.78 0.71 -0.57 2.37 4.57 -1.10 -2.91 114.58 118.42 2x3v h GLU 50 Ca 0.13 -0.44 -0.03 0.00 -1.18 0.00 0.00 59.36 57.84 2x3v h GLU 50 Cb 0.61 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.23 2x3v h GLU 50 CO 0.04 1.06 0.24 -0.22 -1.18 0.00 0.00 179.01 178.96 2x3v h LYS 51 N 0.43 0.81 0.31 1.92 3.64 -1.21 -2.12 116.57 120.35 2x3v h LYS 51 Ca 0.01 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 2x3v h LYS 51 Cb 1.02 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 2x3v h LYS 51 CO 0.10 0.65 -0.15 0.00 -2.27 0.00 0.00 179.45 177.78 2x3v h ALA 52 N 1.46 -0.42 -0.61 5.00 0.00 -1.32 -1.65 119.26 121.71 2x3v h ALA 52 Ca 0.20 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.05 2x3v h ALA 52 Cb 0.13 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 2x3v h ALA 52 CO -0.02 -0.66 0.28 -0.92 0.00 0.00 0.00 179.25 177.92 2x3v h TYR 53 N -0.57 0.50 -0.48 0.00 -0.00 -1.48 -0.47 116.97 114.48 2x3v h TYR 53 Ca -0.04 0.03 0.07 0.00 -0.00 0.00 0.00 58.73 58.79 2x3v h TYR 53 Cb 0.42 -0.13 -0.06 0.00 -0.00 0.00 0.00 36.73 36.95 2x3v h TYR 53 CO -0.02 0.18 0.12 0.00 -0.00 0.00 0.00 178.16 178.45 2x3v h ALA 54 N 1.38 0.55 -0.24 1.82 0.00 -1.26 -1.31 119.26 120.20 2x3v h ALA 54 Ca 0.30 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.20 2x3v h ALA 54 Cb 0.30 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2x3v h ALA 54 CO -0.25 -0.28 -0.19 0.37 0.00 0.00 0.00 179.25 178.90 2x3v h GLN 55 N 0.27 0.55 -0.78 0.00 5.75 -0.77 -2.44 115.11 117.69 2x3v h GLN 55 Ca 0.23 -0.28 0.07 0.00 -0.15 0.00 0.00 58.65 58.52 2x3v h GLN 55 Cb 0.29 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 28.79 2x3v h GLN 55 CO -0.28 0.86 0.51 1.96 -2.65 0.00 0.00 178.83 179.23 2x3v h GLN 56 N 0.26 0.81 -0.48 1.69 4.20 -0.85 -0.95 115.11 119.79 2x3v h GLN 56 Ca 0.04 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.64 2x3v h GLN 56 Cb 0.73 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 2x3v h GLN 56 CO 0.05 0.54 0.06 -0.07 -0.67 0.00 0.00 178.83 178.74 2x3v h LEU 57 N 0.84 0.78 -0.42 1.46 3.38 -1.12 -2.58 115.31 117.65 2x3v h LEU 57 Ca 0.34 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2x3v h LEU 57 Cb 0.25 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2x3v h LEU 57 CO -0.12 0.85 0.25 0.74 0.09 0.00 0.00 178.44 180.26 2x3v h THR 58 N 0.68 1.13 -0.61 0.22 2.02 -0.82 -0.32 112.91 115.21 2x3v h THR 58 Ca 0.14 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 66.98 2x3v h THR 58 Cb 0.42 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 2x3v h THR 58 CO 0.01 0.13 0.23 0.44 0.37 0.00 0.00 175.52 176.71 2x3v h ASP 59 N 0.55 0.83 -0.26 4.18 3.32 -1.20 -0.81 116.42 123.02 2x3v h ASP 59 Ca 0.15 -0.12 -0.06 0.00 0.02 0.00 0.00 57.03 57.02 2x3v h ASP 59 Cb -0.00 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 2x3v h ASP 59 CO -0.03 0.75 -0.08 -0.25 -1.72 0.00 0.00 179.24 177.91 2x3v h TRP 60 N 0.88 0.58 0.56 4.55 7.01 -1.05 -0.92 115.95 127.58 2x3v h TRP 60 Ca 0.21 -0.13 -0.03 0.00 2.11 0.00 0.00 58.89 61.05 2x3v h TRP 60 Cb 0.20 -0.14 0.01 0.00 -2.10 0.00 0.00 29.16 27.12 2x3v h TRP 60 CO 0.01 0.74 -0.27 0.00 -2.79 0.00 0.00 178.44 176.13 2x3v h ALA 61 N 0.76 -0.76 -0.40 2.65 0.00 -0.80 0.05 119.26 120.76 2x3v h ALA 61 Ca 0.06 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.89 2x3v h ALA 61 Cb 0.56 0.29 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 2x3v h ALA 61 CO 0.03 -0.92 -0.11 -0.22 0.00 0.00 0.00 179.25 178.02 2x3v h LYS 62 N -0.76 -0.01 0.22 0.00 3.64 -1.19 0.72 116.57 119.19 2x3v h LYS 62 Ca -0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2x3v h LYS 62 Cb 0.58 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 2x3v h LYS 62 CO 0.13 -0.01 -0.19 -0.09 -2.27 0.00 0.00 179.45 177.01 2x3v h ARG 63 N -0.01 -0.42 0.00 1.90 2.43 -1.00 -2.75 114.38 114.52 2x3v h ARG 63 Ca 0.19 0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.35 2x3v h ARG 63 Cb 0.31 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2x3v h ARG 63 CO -0.42 -0.28 -0.19 -1.49 -1.51 0.00 0.00 179.97 176.07 2x3v h TRP 64 N -0.44 0.00 -0.75 2.20 4.06 -0.81 -1.64 115.95 118.56 2x3v h TRP 64 Ca -0.01 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.93 2x3v h TRP 64 Cb 0.40 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.52 2x3v h TRP 64 CO -0.13 0.19 0.44 -0.09 -3.56 0.00 0.00 178.44 175.29 2x3v h ARG 65 N 0.00 1.03 0.01 0.49 2.43 -0.82 -0.70 114.38 116.82 2x3v h ARG 65 Ca -0.00 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.06 2x3v h ARG 65 Cb 1.12 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 2x3v h ARG 65 CO 0.03 0.75 -0.00 1.96 -1.51 0.00 0.00 179.97 181.19 2x3v h GLN 66 N 1.03 -0.01 -0.83 0.20 1.08 -1.20 -1.93 115.11 113.45 2x3v h GLN 66 Ca 0.27 0.00 0.04 0.00 -1.45 0.00 0.00 58.65 57.50 2x3v h GLN 66 Cb -0.01 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.37 2x3v h GLN 66 CO -0.05 0.48 0.53 -0.07 -0.95 0.00 0.00 178.83 178.77 2x3v h LEU 67 N -0.50 0.88 0.24 1.46 4.07 -1.29 -0.97 115.31 119.21 2x3v h LEU 67 Ca -0.00 -0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.94 2x3v h LEU 67 Cb 0.49 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 42.04 2x3v h LEU 67 CO 0.00 0.60 -0.12 0.40 -1.08 0.00 0.00 178.44 178.24 2x3v h ILE 68 N 1.03 0.76 0.00 1.22 2.04 -1.19 -3.32 117.51 118.05 2x3v h ILE 68 Ca 0.34 -0.82 -0.06 0.00 1.00 0.00 0.00 64.86 65.32 2x3v h ILE 68 Cb 0.02 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2x3v h ILE 68 CO -0.12 0.16 -0.27 -0.33 0.00 0.00 0.00 178.15 177.59 2x3v h GLU 69 N -0.79 0.00 -2.11 2.37 5.08 -1.29 -3.22 114.58 114.62 2x3v h GLU 69 Ca -0.03 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.01 2x3v h GLU 69 Cb 0.51 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.67 2x3v h GLU 69 CO 0.05 0.27 0.26 1.17 -1.00 0.00 0.00 179.01 179.76 2x3v n LYS 70 N -3.55 2.32 -0.88 2.33 3.00 -0.37 -4.93 118.16 116.08 2x3v n LYS 70 Ca -0.01 -1.48 0.11 0.00 -0.00 0.00 0.00 58.31 56.94 2x3v n LYS 70 Cb 0.41 -2.12 -0.05 0.00 0.00 0.00 0.00 35.03 33.27 2x3v n LYS 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2x3v n GLY 71 N 2.23 -2.60 0.14 3.14 0.00 -1.21 -4.98 105.19 101.90 2x3v n GLY 71 Ca 0.48 -1.24 0.12 0.00 0.00 0.00 0.00 46.02 45.38 2x3v n GLY 71 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2x3v n PRO 72 N -3.56 0.45 -2.11 1.61 -0.04 -1.26 -4.67 135.00 125.42 2x3v n PRO 72 Ca -0.03 -0.28 -0.41 0.00 -0.04 0.00 0.00 63.50 62.74 2x3v n PRO 72 Cb 0.41 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.36 2x3v n PRO 72 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2x3v s GLN 73 N -2.75 4.35 0.18 0.54 2.00 -1.26 -5.02 119.66 117.71 2x3v s GLN 73 Ca 0.17 2.21 -0.03 0.00 -2.00 0.00 0.00 55.36 55.71 2x3v s GLN 73 Cb 0.18 -3.09 -0.03 0.00 0.80 0.00 0.00 33.01 30.87 2x3v s GLN 73 CO 0.62 -0.22 0.16 1.52 -0.50 0.00 0.00 175.29 176.88 2x3v s TYR 74 N -0.89 0.92 0.00 1.67 -0.85 -1.26 -4.81 117.35 112.12 2x3v s TYR 74 Ca 0.51 -1.21 0.00 0.00 -0.52 0.00 0.00 57.07 55.85 2x3v s TYR 74 Cb -0.40 -0.41 0.00 0.00 0.38 0.00 0.00 41.96 41.54 2x3v s TYR 74 CO 0.50 -0.65 0.00 0.41 -1.52 0.00 0.00 175.55 174.29 2x3v n GLY 75 N -0.23 0.07 0.28 5.49 0.00 -1.26 -3.30 105.19 106.24 2x3v n GLY 75 Ca -0.01 -0.94 -0.07 0.00 0.00 0.00 0.00 46.02 45.00 2x3v n GLY 75 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2x3v h SER 76 N 7.25 0.84 0.28 1.61 4.64 -1.97 -2.59 113.55 123.61 2x3v h SER 76 Ca 0.00 -0.26 -0.05 0.00 -0.47 0.00 0.00 61.79 61.01 2x3v h SER 76 Cb 0.00 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.86 2x3v h SER 76 CO 0.00 0.96 -0.23 -0.07 -0.87 0.00 0.00 176.83 176.62 2x3v h LEU 77 N 0.76 0.00 -0.26 5.97 -0.00 -1.88 0.19 115.31 120.08 2x3v h LEU 77 Ca 0.13 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 58.02 2x3v h LEU 77 Cb 0.61 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.25 2x3v h LEU 77 CO 0.04 0.23 0.15 -0.08 -0.00 0.00 0.00 178.44 178.79 2x3v h GLU 78 N 0.00 0.31 -0.26 1.13 4.81 -1.46 -0.57 114.58 118.54 2x3v h GLU 78 Ca -0.00 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.08 2x3v h GLU 78 Cb 0.44 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 2x3v h GLU 78 CO 0.03 0.21 -0.39 0.00 -0.73 0.00 0.00 179.01 178.13 2x3v h ARG 79 N 0.32 0.61 0.02 1.92 3.08 -1.18 0.38 114.38 119.53 2x3v h ARG 79 Ca 0.10 -0.31 -0.00 0.00 0.07 0.00 0.00 59.98 59.84 2x3v h ARG 79 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2x3v h ARG 79 CO -0.05 0.90 -0.01 0.00 -1.07 0.00 0.00 179.97 179.74 2x3v h ALA 80 N 1.07 -0.03 -0.76 0.04 0.00 -0.54 0.30 119.26 119.33 2x3v h ALA 80 Ca 0.05 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2x3v h ALA 80 Cb 0.90 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 2x3v h ALA 80 CO 0.08 -0.50 0.26 2.35 0.00 0.00 0.00 179.25 181.43 2x3v h TRP 81 N -0.05 1.21 0.00 0.00 7.01 -1.02 -2.77 115.95 120.32 2x3v h TRP 81 Ca -0.00 -0.11 0.00 0.00 2.11 0.00 0.00 58.89 60.88 2x3v h TRP 81 Cb 0.04 -0.35 0.00 0.00 -2.10 0.00 0.00 29.16 26.75 2x3v h TRP 81 CO -0.07 0.94 0.00 0.78 -2.79 0.00 0.00 178.44 177.30 2x3v h GLY 82 N 1.12 0.00 1.28 2.65 0.00 0.11 -2.75 103.07 105.49 2x3v h GLY 82 Ca 0.25 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.51 2x3v h GLY 82 CO -0.01 0.00 0.04 0.00 0.00 0.00 0.00 176.54 176.57 2x3v h ALA 83 N 2.08 1.07 -1.01 3.60 0.00 -0.12 -2.88 119.26 122.00 2x3v h ALA 83 Ca 0.00 -0.26 0.24 0.00 0.00 0.00 0.00 54.91 54.89 2x3v h ALA 83 Cb 0.40 -0.21 -0.10 0.00 0.00 0.00 0.00 17.79 17.88 2x3v h ALA 83 CO 0.00 0.59 0.64 1.98 0.00 0.00 0.00 179.25 182.46 2x3v h MET 84 N 0.82 0.47 -0.15 0.00 -1.53 -1.57 0.21 114.93 113.18 2x3v h MET 84 Ca 0.16 -0.03 -0.09 0.00 -3.44 0.00 0.00 59.70 56.30 2x3v h MET 84 Cb 0.43 -0.11 -0.01 0.00 -0.55 0.00 0.00 31.60 31.36 2x3v h MET 84 CO 0.02 0.31 -0.32 0.52 0.14 0.00 0.00 176.91 177.57 2x3v h MET 85 N 0.49 0.30 0.00 0.39 2.86 -1.66 -2.65 114.93 114.66 2x3v h MET 85 Ca 0.58 -0.12 -0.19 0.00 -2.06 0.00 0.00 59.70 57.92 2x3v h MET 85 Cb 1.32 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.95 2x3v h MET 85 CO -0.32 0.60 -0.86 1.79 1.06 0.00 0.00 176.91 179.17 2x3v h THR 86 N 0.26 1.57 -0.15 2.22 1.35 -1.02 -1.65 112.91 115.49 2x3v h THR 86 Ca 0.03 -2.82 -0.12 0.00 -0.55 0.00 0.00 66.41 62.96 2x3v h THR 86 Cb 0.71 2.54 -0.01 0.00 -1.73 0.00 0.00 68.15 69.66 2x3v h THR 86 CO 0.05 0.81 -0.42 1.05 -0.25 0.00 0.00 175.52 176.76 2x3v h GLU 87 N 0.03 0.34 -0.61 4.72 -0.00 -1.37 -0.14 114.58 117.56 2x3v h GLU 87 Ca -0.02 -0.17 -0.02 0.00 -0.00 0.00 0.00 59.36 59.14 2x3v h GLU 87 Cb 1.51 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 30.23 2x3v h GLU 87 CO 0.12 0.71 0.30 0.00 -0.00 0.00 0.00 179.01 180.14 2x3v h ALA 88 N 1.27 0.78 -0.46 1.06 0.00 -1.33 -0.16 119.26 120.41 2x3v h ALA 88 Ca 0.02 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2x3v h ALA 88 Cb 0.87 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2x3v h ALA 88 CO 0.07 0.34 0.18 -0.44 0.00 0.00 0.00 179.25 179.40 2x3v h ASP 89 N 0.83 0.65 0.26 0.00 3.45 -1.10 -2.03 116.42 118.48 2x3v h ASP 89 Ca 0.21 -0.18 -0.14 0.00 0.43 0.00 0.00 57.03 57.36 2x3v h ASP 89 Cb 0.11 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.70 2x3v h ASP 89 CO -0.03 0.65 -0.54 0.11 -1.57 0.00 0.00 179.24 177.85 2x3v h LYS 90 N 0.61 0.30 -0.34 3.56 1.79 -0.77 -1.76 116.57 119.96 2x3v h LYS 90 Ca 0.15 -0.19 -0.14 0.00 -2.18 0.00 0.00 60.65 58.30 2x3v h LYS 90 Cb 0.21 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.87 2x3v h LYS 90 CO -0.01 0.77 -0.33 0.28 -1.08 0.00 0.00 179.45 179.08 2x3v h VAL 91 N 0.23 1.29 -0.03 0.50 2.07 -1.06 -2.77 116.25 116.48 2x3v h VAL 91 Ca 0.00 -1.51 0.03 0.00 0.82 0.00 0.00 66.70 66.05 2x3v h VAL 91 Cb 1.03 1.48 -0.05 0.00 -1.52 0.00 0.00 31.29 32.24 2x3v h VAL 91 CO 0.09 0.49 -0.23 -1.28 0.02 0.00 0.00 177.57 176.66 2x3v h SER 92 N 0.60 -0.69 -0.72 0.57 0.87 -1.08 -0.99 113.55 112.11 2x3v h SER 92 Ca 0.05 0.10 0.16 0.00 -1.23 0.00 0.00 61.79 60.87 2x3v h SER 92 Cb 0.92 0.29 -0.13 0.00 -0.44 0.00 0.00 62.40 63.04 2x3v h SER 92 CO 0.08 -0.30 -0.05 -0.08 -0.53 0.00 0.00 176.83 175.96 2x3v h GLU 93 N -0.35 0.07 -0.58 2.24 4.81 -1.38 0.18 114.58 119.58 2x3v h GLU 93 Ca 0.07 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 2x3v h GLU 93 Cb 0.44 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 2x3v h GLU 93 CO -0.23 0.05 0.09 -0.07 -0.73 0.00 0.00 179.01 178.11 2x3v h LEU 94 N 0.07 0.89 -0.17 1.64 3.38 -1.05 -1.10 115.31 118.97 2x3v h LEU 94 Ca 0.38 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 58.09 2x3v h LEU 94 Cb 0.64 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2x3v h LEU 94 CO -0.66 0.90 -0.28 0.45 0.09 0.00 0.00 178.44 178.93 2x3v h HIS 95 N 0.88 0.00 -0.09 1.13 3.86 -0.56 -2.46 115.15 117.90 2x3v h HIS 95 Ca 0.18 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.27 2x3v h HIS 95 Cb 0.39 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.85 2x3v h HIS 95 CO 0.02 0.28 -0.48 1.96 0.86 0.00 0.00 177.93 180.58 2x3v h GLN 96 N 0.00 0.24 0.04 2.45 1.08 -0.10 -2.20 115.11 116.62 2x3v h GLN 96 Ca -0.00 -0.13 -0.22 0.00 -1.45 0.00 0.00 58.65 56.85 2x3v h GLN 96 Cb 1.16 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.58 2x3v h GLN 96 CO 0.04 0.67 -1.00 1.05 -0.95 0.00 0.00 178.83 178.63 2x3v h GLU 97 N 0.19 0.18 -0.08 1.46 4.11 -1.12 -1.46 114.58 117.85 2x3v h GLU 97 Ca 0.01 -0.24 0.03 0.00 0.07 0.00 0.00 59.36 59.23 2x3v h GLU 97 Cb 0.92 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.22 2x3v h GLU 97 CO 0.07 1.04 -0.09 0.28 0.07 0.00 0.00 179.01 180.38 2x3v h VAL 98 N 0.08 0.75 0.11 -1.06 2.07 -1.42 0.12 116.25 116.89 2x3v h VAL 98 Ca -0.06 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.48 2x3v h VAL 98 Cb 1.69 0.75 -0.05 0.00 -1.52 0.00 0.00 31.29 32.16 2x3v h VAL 98 CO 0.15 0.00 -0.44 0.50 0.02 0.00 0.00 177.57 177.81 2x3v h LYS 99 N -0.11 -0.64 -0.58 1.57 3.64 -1.39 -0.60 116.57 118.46 2x3v h LYS 99 Ca 0.06 0.04 0.11 0.00 -1.27 0.00 0.00 60.65 59.60 2x3v h LYS 99 Cb 0.21 0.14 -0.09 0.00 -0.41 0.00 0.00 32.23 32.08 2x3v h LYS 99 CO -0.15 -0.42 0.09 -0.91 -2.27 0.00 0.00 179.45 175.79 2x3v h ASN 100 N -0.66 -0.06 0.20 4.20 2.35 -1.06 -1.93 115.58 118.62 2x3v h ASN 100 Ca 0.02 0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 2x3v h ASN 100 Cb 0.69 0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.24 2x3v h ASN 100 CO -0.26 -0.02 -0.10 0.28 -1.65 0.00 0.00 177.43 175.69 2x3v h SER 101 N 0.22 -0.23 -0.79 5.81 0.02 -0.49 0.44 113.55 118.53 2x3v h SER 101 Ca 0.30 -0.05 0.18 0.00 -0.84 0.00 0.00 61.79 61.38 2x3v h SER 101 Cb 0.45 0.06 -0.12 0.00 0.14 0.00 0.00 62.40 62.94 2x3v h SER 101 CO -0.41 -0.10 0.23 -0.07 -1.14 0.00 0.00 176.83 175.34 2x3v h LEU 102 N -0.34 0.08 0.02 5.07 4.07 -0.63 -0.74 115.31 122.84 2x3v h LEU 102 Ca -0.03 0.15 -0.14 0.00 0.08 0.00 0.00 57.88 57.95 2x3v h LEU 102 Cb 0.26 0.19 -0.01 0.00 1.08 0.00 0.00 40.66 42.18 2x3v h LEU 102 CO 0.04 -0.04 -0.72 -0.07 -1.08 0.00 0.00 178.44 176.57 2x3v h LEU 103 N 0.30 0.06 -0.16 1.67 3.38 -1.13 0.21 115.31 119.64 2x3v h LEU 103 Ca 0.46 -0.77 -0.10 0.00 0.09 0.00 0.00 57.88 57.56 2x3v h LEU 103 Cb 0.83 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2x3v h LEU 103 CO -0.53 1.29 -0.47 0.78 0.09 0.00 0.00 178.44 179.60 2x3v h ASN 104 N -0.90 0.00 0.00 -0.43 2.35 -0.11 -3.16 115.58 113.33 2x3v h ASN 104 Ca -0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 2x3v h ASN 104 Cb 1.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.61 2x3v h ASN 104 CO -0.08 0.47 -0.33 -0.62 -1.65 0.00 0.00 177.43 175.22 2x3v n GLU 105 N -3.26 0.18 0.00 0.81 1.02 -0.34 -4.56 120.64 114.49 2x3v n GLU 105 Ca 0.02 0.07 -0.13 0.00 -0.02 0.00 0.00 57.16 57.10 2x3v n GLU 105 Cb 0.69 -0.73 -0.09 0.00 -0.02 0.00 0.00 31.44 31.30 2x3v n GLU 105 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2x3v h ASP 106 N -0.33 -0.01 -0.34 1.62 3.32 -1.40 0.21 116.42 119.50 2x3v h ASP 106 Ca 0.00 -0.37 0.02 0.00 0.02 0.00 0.00 57.03 56.70 2x3v h ASP 106 Cb 0.33 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 2x3v h ASP 106 CO 0.00 0.37 0.18 0.25 -1.72 0.00 0.00 179.24 178.32 2x3v h LEU 107 N -0.39 0.27 -0.61 1.55 5.85 -0.67 -2.26 115.31 119.05 2x3v h LEU 107 Ca -0.00 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2x3v h LEU 107 Cb 0.38 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2x3v h LEU 107 CO 0.00 0.20 0.40 -0.33 -0.34 0.00 0.00 178.44 178.37 2x3v h GLU 108 N 0.37 0.79 -0.21 1.25 4.39 -1.50 -0.82 114.58 118.84 2x3v h GLU 108 Ca 0.14 -0.05 0.04 0.00 0.34 0.00 0.00 59.36 59.84 2x3v h GLU 108 Cb 0.04 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.47 2x3v h GLU 108 CO -0.09 0.52 -0.05 -0.22 -1.16 0.00 0.00 179.01 178.01 2x3v h LYS 109 N 0.81 -0.00 -0.31 2.33 3.64 -0.11 0.44 116.57 123.38 2x3v h LYS 109 Ca 0.23 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 2x3v h LYS 109 Cb -0.08 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 2x3v h LYS 109 CO -0.05 -0.00 0.19 0.28 -2.27 0.00 0.00 179.45 177.60 2x3v h VAL 110 N -0.00 1.10 -0.76 2.00 2.07 -1.31 -1.32 116.25 118.03 2x3v h VAL 110 Ca 0.10 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 67.45 2x3v h VAL 110 Cb 0.16 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.57 2x3v h VAL 110 CO -0.22 0.09 0.48 0.50 0.02 0.00 0.00 177.57 178.44 2x3v h LYS 111 N 0.40 0.90 -0.00 1.57 3.64 -0.05 0.41 116.57 123.44 2x3v h LYS 111 Ca 0.11 -0.05 -0.18 0.00 -1.27 0.00 0.00 60.65 59.25 2x3v h LYS 111 Cb -0.01 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.59 2x3v h LYS 111 CO -0.02 0.59 -0.83 -0.91 -2.27 0.00 0.00 179.45 176.01 2x3v h ASN 112 N 0.92 0.17 -0.42 4.20 2.35 -0.06 -2.88 115.58 119.86 2x3v h ASN 112 Ca 0.31 -0.13 -0.12 0.00 -0.55 0.00 0.00 56.30 55.81 2x3v h ASN 112 Cb 0.04 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 2x3v h ASN 112 CO -0.12 0.92 -0.19 -0.25 -1.65 0.00 0.00 177.43 176.14 2x3v h TRP 113 N 0.07 1.04 -0.65 1.19 7.01 -0.85 -3.12 115.95 120.64 2x3v h TRP 113 Ca -0.03 -0.24 -0.01 0.00 2.11 0.00 0.00 58.89 60.72 2x3v h TRP 113 Cb 1.44 -0.25 -0.03 0.00 -2.10 0.00 0.00 29.16 28.22 2x3v h TRP 113 CO 0.02 1.02 0.37 0.37 -2.79 0.00 0.00 178.44 177.43 2x3v h GLN 114 N 0.80 0.90 -0.97 2.65 4.15 -0.91 -0.57 115.11 121.17 2x3v h GLN 114 Ca 0.11 -0.10 0.08 0.00 0.77 0.00 0.00 58.65 59.51 2x3v h GLN 114 Cb 0.74 -0.18 -0.07 0.00 0.21 0.00 0.00 27.48 28.18 2x3v h GLN 114 CO 0.06 0.67 0.62 0.87 -1.93 0.00 0.00 178.83 179.11 2x3v h LYS 115 N 0.89 1.06 0.14 1.69 1.57 -1.48 -1.72 116.57 118.72 2x3v h LYS 115 Ca 0.23 -0.06 -0.29 0.00 -1.87 0.00 0.00 60.65 58.66 2x3v h LYS 115 Cb 0.02 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.10 2x3v h LYS 115 CO -0.04 0.70 -1.36 -0.44 -0.57 0.00 0.00 179.45 177.74 2x3v h ASP 116 N 1.09 0.46 -0.24 0.86 3.45 -1.43 -3.35 116.42 117.26 2x3v h ASP 116 Ca 0.43 -0.53 -0.05 0.00 0.43 0.00 0.00 57.03 57.31 2x3v h ASP 116 Cb 0.23 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 38.84 2x3v h ASP 116 CO -0.19 1.42 -0.06 0.00 -1.57 0.00 0.00 179.24 178.84 2x3v h ALA 117 N 0.51 0.33 -4.16 3.45 0.00 -0.97 -3.45 119.26 114.97 2x3v h ALA 117 Ca -0.18 -0.26 -0.69 0.00 0.00 0.00 0.00 54.91 53.77 2x3v h ALA 117 Cb 2.01 -0.08 -0.28 0.00 0.00 0.00 0.00 17.79 19.44 2x3v h ALA 117 CO 0.20 0.12 -0.84 0.71 0.00 0.00 0.00 179.25 179.44 2x3v s TYR 118 N -4.76 2.52 -0.22 0.00 2.02 -0.66 -4.94 117.35 111.32 2x3v s TYR 118 Ca -0.14 -0.43 -0.01 0.00 -0.37 0.00 0.00 57.07 56.12 2x3v s TYR 118 Cb 0.07 -1.60 0.06 0.00 -0.40 0.00 0.00 41.96 40.10 2x3v s TYR 118 CO 0.76 -0.02 0.01 -1.01 -1.57 0.00 0.00 175.55 173.72 2x3v s HIS 119 N -0.47 1.53 0.25 2.71 3.76 -1.26 -4.60 115.29 117.22 2x3v s HIS 119 Ca 0.06 -1.23 -0.30 0.00 -0.15 0.00 0.00 55.06 53.44 2x3v s HIS 119 Cb -0.12 -1.27 -0.09 0.00 1.11 0.00 0.00 32.58 32.21 2x3v s HIS 119 CO 0.01 -0.69 1.21 0.15 -0.85 0.00 0.00 174.74 174.57 2x3v s LYS 120 N 1.69 4.49 -0.18 1.40 -0.14 -1.26 -0.81 119.74 124.93 2x3v s LYS 120 Ca -0.01 1.96 -0.11 0.00 -1.36 0.00 0.00 55.97 56.44 2x3v s LYS 120 Cb -0.18 -3.18 -0.05 0.00 -1.68 0.00 0.00 37.83 32.75 2x3v s LYS 120 CO -0.09 -0.04 0.19 -0.65 -0.76 0.00 0.00 175.35 173.99 2x3v s GLN 121 N -0.95 4.16 0.55 1.68 -0.21 -0.21 -4.88 119.66 119.80 2x3v s GLN 121 Ca 0.50 -0.11 0.22 0.00 0.02 0.00 0.00 55.36 55.99 2x3v s GLN 121 Cb -0.35 -3.41 1.49 0.00 1.00 0.00 0.00 33.01 31.75 2x3v s GLN 121 CO 0.42 0.31 2.19 -0.84 -2.12 0.00 0.00 175.29 175.25 2x3v h ILE 122 N 4.62 0.81 -0.69 1.08 3.07 -1.96 -2.25 117.51 122.19 2x3v h ILE 122 Ca -0.42 0.00 -0.21 0.00 1.55 0.00 0.00 64.86 65.78 2x3v h ILE 122 Cb 1.16 1.00 -0.12 0.00 -0.27 0.00 0.00 36.82 38.58 2x3v h ILE 122 CO 0.75 0.00 0.26 0.23 -1.05 0.00 0.00 178.15 178.34 2x3v n MET 123 N -4.26 3.47 0.00 0.16 2.81 -1.26 -4.98 117.12 113.05 2x3v n MET 123 Ca -0.03 -2.78 0.00 0.00 -1.81 0.00 0.00 57.70 53.08 2x3v n MET 123 Cb 0.09 -2.14 0.00 0.00 -0.71 0.00 0.00 33.22 30.47 2x3v n MET 123 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2x3v n GLY 124 N -0.12 1.26 0.00 3.03 0.00 -0.85 -5.17 105.19 103.34 2x3v n GLY 124 Ca 0.38 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.42 2x3v n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x3v n GLY 125 N 0.00 2.17 3.79 -0.02 0.00 -1.26 -4.62 105.19 105.25 2x3v n GLY 125 Ca 0.00 -1.82 -0.37 0.00 0.00 0.00 0.00 46.02 43.83 2x3v n GLY 125 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2x3v s PHE 126 N 3.88 3.70 0.18 1.61 0.40 -1.26 -1.05 117.98 125.44 2x3v s PHE 126 Ca 0.00 1.70 -0.21 0.00 -0.60 0.00 0.00 56.93 57.82 2x3v s PHE 126 Cb 0.00 -2.86 0.10 0.00 0.51 0.00 0.00 43.02 40.77 2x3v s PHE 126 CO 0.00 0.25 1.60 0.87 0.70 0.00 0.00 175.22 178.65 2x3v h LYS 127 N 3.29 -0.18 -0.66 0.44 1.57 -1.31 -2.42 116.57 117.29 2x3v h LYS 127 Ca -0.47 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.36 2x3v h LYS 127 Cb 1.19 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.51 2x3v h LYS 127 CO 0.65 -0.12 0.44 0.93 -0.57 0.00 0.00 179.45 180.78 2x3v h GLU 128 N -0.19 0.74 -0.31 3.15 3.07 -1.92 0.29 114.58 119.40 2x3v h GLU 128 Ca 0.20 -0.04 -0.12 0.00 -0.50 0.00 0.00 59.36 58.90 2x3v h GLU 128 Cb 0.52 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 2x3v h GLU 128 CO -0.57 0.49 -0.30 1.15 -1.40 0.00 0.00 179.01 178.38 2x3v h THR 129 N 0.76 1.28 -0.18 1.13 2.02 -1.86 -2.32 112.91 113.75 2x3v h THR 129 Ca 0.27 -1.42 -0.19 0.00 0.77 0.00 0.00 66.41 65.83 2x3v h THR 129 Cb 0.12 1.37 0.01 0.00 -1.74 0.00 0.00 68.15 67.90 2x3v h THR 129 CO -0.08 0.46 -0.64 0.50 0.37 0.00 0.00 175.52 176.13 2x3v h LYS 130 N 0.56 0.75 -0.45 6.66 1.63 -0.11 -0.52 116.57 125.09 2x3v h LYS 130 Ca 0.07 -0.57 -0.06 0.00 -0.85 0.00 0.00 60.65 59.24 2x3v h LYS 130 Cb 0.80 0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.51 2x3v h LYS 130 CO 0.07 1.19 0.03 0.93 -3.45 0.00 0.00 179.45 178.21 2x3v h GLU 131 N 0.47 0.71 0.55 1.90 5.08 -0.71 -1.04 114.58 121.54 2x3v h GLU 131 Ca -0.03 -0.17 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 2x3v h GLU 131 Cb 1.27 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 30.43 2x3v h GLU 131 CO 0.14 0.71 -0.26 0.00 -1.00 0.00 0.00 179.01 178.59 2x3v h ALA 132 N 1.36 -0.74 -0.28 3.43 0.00 -1.30 -1.56 119.26 120.18 2x3v h ALA 132 Ca 0.14 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.92 2x3v h ALA 132 Cb 0.37 0.28 -0.08 0.00 0.00 0.00 0.00 17.79 18.37 2x3v h ALA 132 CO 0.01 -0.84 -0.35 0.93 0.00 0.00 0.00 179.25 179.00 2x3v h GLU 133 N -0.89 -0.33 -0.89 0.00 4.39 -0.99 -1.54 114.58 114.34 2x3v h GLU 133 Ca -0.08 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.65 2x3v h GLU 133 Cb 0.62 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.30 2x3v h GLU 133 CO 0.12 -0.22 0.56 -0.44 -1.16 0.00 0.00 179.01 177.87 2x3v h ASP 134 N -0.34 1.05 0.39 1.42 3.45 -1.24 0.14 116.42 121.29 2x3v h ASP 134 Ca 0.13 -0.05 -0.02 0.00 0.43 0.00 0.00 57.03 57.52 2x3v h ASP 134 Cb 0.56 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 39.07 2x3v h ASP 134 CO -0.46 0.79 -0.19 1.23 -1.57 0.00 0.00 179.24 179.04 2x3v h GLY 135 N 1.23 -0.54 0.93 2.75 0.00 -0.76 -0.19 103.07 106.48 2x3v h GLY 135 Ca 0.32 0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.85 2x3v h GLY 135 CO -0.06 -0.20 0.12 0.74 0.00 0.00 0.00 176.54 177.14 2x3v h PHE 136 N -0.53 0.34 -0.26 5.60 -1.00 -1.06 -0.61 116.94 119.42 2x3v h PHE 136 Ca -0.05 -0.01 0.05 0.00 2.81 0.00 0.00 57.97 60.76 2x3v h PHE 136 Cb 0.40 -0.11 -0.04 0.00 3.61 0.00 0.00 35.95 39.81 2x3v h PHE 136 CO -0.05 0.32 -0.01 -0.09 -1.61 0.00 0.00 178.31 176.87 2x3v h ARG 137 N 0.27 0.06 -0.35 1.51 2.43 -0.67 0.38 114.38 118.02 2x3v h ARG 137 Ca 0.08 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 2x3v h ARG 137 Cb 0.10 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2x3v h ARG 137 CO -0.01 0.04 0.08 -0.22 -1.51 0.00 0.00 179.97 178.36 2x3v h LYS 138 N 0.07 0.56 0.00 0.20 3.64 -0.95 -1.13 116.57 118.95 2x3v h LYS 138 Ca 0.13 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2x3v h LYS 138 Cb 0.17 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2x3v h LYS 138 CO -0.22 0.61 0.00 0.00 -2.27 0.00 0.00 179.45 177.57 2x3v n ALA 139 N -2.33 1.68 0.35 5.00 0.00 -0.24 -3.00 120.51 121.97 2x3v n ALA 139 Ca -0.01 0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.52 2x3v n ALA 139 Cb 0.20 -1.34 -0.08 0.00 0.00 0.00 0.00 19.45 18.23 2x3v n ALA 139 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2x3v n GLN 140 N -1.96 1.85 0.01 0.00 7.27 0.08 -4.68 117.38 119.94 2x3v n GLN 140 Ca 0.03 -0.05 -0.11 0.00 0.07 0.00 0.00 57.00 56.94 2x3v n GLN 140 Cb 0.21 -1.18 -0.06 0.00 2.41 0.00 0.00 30.24 31.62 2x3v n GLN 140 CO 0.00 0.00 0.00 -0.22 0.07 0.00 0.00 177.06 176.91 2x3v h LYS 141 N 0.00 0.10 -0.80 3.69 3.64 -1.11 0.15 116.57 122.23 2x3v h LYS 141 Ca 0.00 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2x3v h LYS 141 Cb 0.42 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.18 2x3v h LYS 141 CO 0.00 0.10 0.43 -1.35 -2.27 0.00 0.00 179.45 176.36 2x3v h PRO 142 N 0.07 1.12 -0.72 1.90 0.11 -1.86 -1.09 132.00 131.53 2x3v h PRO 142 Ca 0.03 -0.13 -0.04 0.00 0.11 0.00 0.00 66.00 65.97 2x3v h PRO 142 Cb 0.02 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 30.88 2x3v h PRO 142 CO -0.01 0.83 0.30 2.35 -0.21 0.00 0.00 178.00 181.26 2x3v h TRP 143 N 1.13 1.09 0.35 0.65 2.91 -1.74 -2.43 115.95 117.90 2x3v h TRP 143 Ca 0.28 -0.08 -0.02 0.00 1.13 0.00 0.00 58.89 60.21 2x3v h TRP 143 Cb 0.04 -0.33 0.00 0.00 -0.51 0.00 0.00 29.16 28.36 2x3v h TRP 143 CO 0.01 0.83 -0.17 0.00 -1.03 0.00 0.00 178.44 178.08 2x3v h ALA 144 N 1.15 -0.48 -0.68 2.65 0.00 -0.17 -1.80 119.26 119.93 2x3v h ALA 144 Ca 0.24 -0.12 0.13 0.00 0.00 0.00 0.00 54.91 55.17 2x3v h ALA 144 Cb 0.19 0.18 -0.13 0.00 0.00 0.00 0.00 17.79 18.04 2x3v h ALA 144 CO -0.02 -0.74 -0.18 0.87 0.00 0.00 0.00 179.25 179.17 2x3v h LYS 145 N -0.53 -0.01 -0.52 0.00 1.57 -1.18 -1.11 116.57 114.78 2x3v h LYS 145 Ca -0.05 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2x3v h LYS 145 Cb 0.40 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.69 2x3v h LYS 145 CO 0.08 -0.01 0.31 -0.22 -0.57 0.00 0.00 179.45 179.04 2x3v h LYS 146 N -0.01 0.70 0.00 3.15 1.63 -1.20 -2.69 116.57 118.15 2x3v h LYS 146 Ca 0.32 -0.06 -0.10 0.00 -0.85 0.00 0.00 60.65 59.97 2x3v h LYS 146 Cb 0.51 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.97 2x3v h LYS 146 CO -0.70 0.49 -0.47 0.52 -3.45 0.00 0.00 179.45 175.83 2x3v h MET 147 N 0.71 0.00 -0.23 1.90 2.86 -0.32 0.63 114.93 120.48 2x3v h MET 147 Ca 0.19 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.68 2x3v h MET 147 Cb -0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.63 2x3v h MET 147 CO -0.04 0.47 -0.45 0.87 1.06 0.00 0.00 176.91 178.83 2x3v h LYS 148 N 0.00 0.71 -0.81 1.72 1.57 -1.21 -2.71 116.57 115.84 2x3v h LYS 148 Ca -0.00 -0.46 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2x3v h LYS 148 Cb 1.17 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 33.49 2x3v h LYS 148 CO 0.06 1.08 0.52 0.93 -0.57 0.00 0.00 179.45 181.47 2x3v h GLU 149 N 0.43 1.09 -0.83 3.15 5.08 -1.23 0.11 114.58 122.37 2x3v h GLU 149 Ca 0.01 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2x3v h GLU 149 Cb 1.06 -0.24 -0.04 0.00 0.50 0.00 0.00 28.75 30.03 2x3v h GLU 149 CO 0.10 0.74 0.55 1.25 -1.00 0.00 0.00 179.01 180.65 2x3v h LEU 150 N 1.11 0.96 -0.08 1.33 7.12 -0.88 -0.39 115.31 124.48 2x3v h LEU 150 Ca 0.30 -0.03 -0.07 0.00 0.13 0.00 0.00 57.88 58.21 2x3v h LEU 150 Cb -0.09 -0.24 0.00 0.00 -0.53 0.00 0.00 40.66 39.80 2x3v h LEU 150 CO -0.06 0.70 -0.21 -0.08 -0.13 0.00 0.00 178.44 178.66 2x3v h GLU 151 N 1.13 0.29 -0.74 1.25 4.57 -1.13 -2.00 114.58 117.95 2x3v h GLU 151 Ca 0.30 -0.20 0.13 0.00 -1.18 0.00 0.00 59.36 58.42 2x3v h GLU 151 Cb -0.12 0.03 -0.09 0.00 -0.16 0.00 0.00 28.75 28.41 2x3v h GLU 151 CO -0.06 0.81 0.30 0.00 -1.18 0.00 0.00 179.01 178.87 2x3v h ALA 152 N 0.48 1.02 -0.41 2.92 0.00 -0.67 -1.37 119.26 121.23 2x3v h ALA 152 Ca -0.00 0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 2x3v h ALA 152 Cb 0.82 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2x3v h ALA 152 CO 0.05 -0.19 -0.21 0.00 0.00 0.00 0.00 179.25 178.90 2x3v h ALA 153 N 1.52 0.86 -0.34 0.00 0.00 -1.05 -2.49 119.26 117.76 2x3v h ALA 153 Ca 0.40 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2x3v h ALA 153 Cb 0.58 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2x3v h ALA 153 CO -0.38 0.64 0.01 -0.22 0.00 0.00 0.00 179.25 179.29 2x3v h LYS 154 N 0.71 0.60 -0.41 0.00 3.64 -0.59 -1.94 116.57 118.58 2x3v h LYS 154 Ca 0.10 -0.19 -0.10 0.00 -1.27 0.00 0.00 60.65 59.19 2x3v h LYS 154 Cb 0.73 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.48 2x3v h LYS 154 CO 0.06 0.72 -0.17 0.87 -2.27 0.00 0.00 179.45 178.66 2x3v h LYS 155 N 0.41 0.77 -0.06 1.90 1.57 -1.30 -2.07 116.57 117.78 2x3v h LYS 155 Ca 0.10 -0.28 -0.07 0.00 -1.87 0.00 0.00 60.65 58.53 2x3v h LYS 155 Cb 0.44 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2x3v h LYS 155 CO 0.02 0.88 -0.27 0.00 -0.57 0.00 0.00 179.45 179.51 2x3v h ALA 156 N 1.13 1.43 -0.05 3.86 0.00 -1.40 -1.90 119.26 122.33 2x3v h ALA 156 Ca 0.11 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 2x3v h ALA 156 Cb 0.66 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2x3v h ALA 156 CO 0.05 0.41 -0.07 -0.92 0.00 0.00 0.00 179.25 178.71 2x3v h TYR 157 N 0.10 0.17 0.00 0.00 5.03 -1.03 -3.17 116.97 118.06 2x3v h TYR 157 Ca 0.01 -0.06 -0.09 0.00 2.58 0.00 0.00 58.73 61.18 2x3v h TYR 157 Cb 0.54 -0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.77 2x3v h TYR 157 CO 0.00 0.63 -0.43 0.45 -1.32 0.00 0.00 178.16 177.50 2x3v h HIS 158 N -0.34 0.00 -0.27 -3.82 3.86 -1.30 -0.92 115.15 112.36 2x3v h HIS 158 Ca 0.01 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.15 2x3v h HIS 158 Cb 0.62 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.08 2x3v h HIS 158 CO 0.11 0.43 -0.10 1.37 0.86 0.00 0.00 177.93 180.60 2x3v h LEU 159 N 0.00 0.55 -1.11 2.43 8.10 -1.44 0.45 115.31 124.29 2x3v h LEU 159 Ca -0.00 -0.39 -0.08 0.00 0.11 0.00 0.00 57.88 57.52 2x3v h LEU 159 Cb 0.88 -0.15 -0.01 0.00 -0.44 0.00 0.00 40.66 40.93 2x3v h LEU 159 CO 0.06 0.81 -0.36 0.00 -4.11 0.00 0.00 178.44 174.84 2x3v h ALA 160 N 0.75 1.11 -0.06 0.17 0.00 -1.50 -1.83 119.26 117.90 2x3v h ALA 160 Ca 0.06 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 2x3v h ALA 160 Cb 0.59 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2x3v h ALA 160 CO 0.03 0.45 -0.19 0.00 0.00 0.00 0.00 179.25 179.54 2x3v h LYS 162 N -0.28 1.14 -0.85 0.00 3.64 -0.93 -2.78 116.57 116.51 2x3v h LYS 162 Ca -0.01 -0.19 0.13 0.00 -1.27 0.00 0.00 60.65 59.31 2x3v h LYS 162 Cb 0.82 -0.20 -0.09 0.00 -0.41 0.00 0.00 32.23 32.36 2x3v h LYS 162 CO 0.04 0.91 0.46 0.93 -2.27 0.00 0.00 179.45 179.52 2x3v h GLU 163 N 1.12 0.68 -0.79 1.90 5.08 -1.28 -2.43 114.58 118.85 2x3v h GLU 163 Ca 0.26 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 2x3v h GLU 163 Cb 0.17 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 2x3v h GLU 163 CO -0.03 0.45 0.40 1.49 -1.00 0.00 0.00 179.01 180.32 2x3v h GLU 164 N 0.70 1.12 -0.61 2.33 4.81 -1.14 -1.46 114.58 120.34 2x3v h GLU 164 Ca 0.44 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.50 2x3v h GLU 164 Cb 0.55 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 2x3v h GLU 164 CO -0.32 0.85 0.29 0.00 -0.73 0.00 0.00 179.01 179.11 2x3v h ARG 165 N 1.11 0.87 -0.15 1.92 2.47 -1.48 -2.23 114.38 116.88 2x3v h ARG 165 Ca 0.27 -0.13 -0.04 0.00 -1.26 0.00 0.00 59.98 58.82 2x3v h ARG 165 Cb 0.09 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.24 2x3v h ARG 165 CO -0.04 0.70 -0.08 1.25 0.56 0.00 0.00 179.97 182.36 2x3v h LEU 166 N 0.83 0.22 0.07 3.04 6.46 -0.94 -1.70 115.31 123.29 2x3v h LEU 166 Ca 0.21 -0.04 -0.25 0.00 -0.12 0.00 0.00 57.88 57.68 2x3v h LEU 166 Cb 0.12 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 2x3v h LEU 166 CO -0.03 0.33 -1.20 0.00 -0.62 0.00 0.00 178.44 176.93 2x3v h ALA 167 N 1.70 0.25 0.05 1.25 0.00 -1.16 -3.31 119.26 118.04 2x3v h ALA 167 Ca 0.05 -0.95 -0.24 0.00 0.00 0.00 0.00 54.91 53.77 2x3v h ALA 167 Cb 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2x3v h ALA 167 CO 0.01 1.13 -1.05 0.52 0.00 0.00 0.00 179.25 179.87 2x3v h MET 168 N 0.04 0.35 -0.40 0.00 2.86 -1.15 -3.11 114.93 113.52 2x3v h MET 168 Ca -0.10 -0.44 -0.14 0.00 -2.06 0.00 0.00 59.70 56.96 2x3v h MET 168 Cb 1.90 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 33.69 2x3v h MET 168 CO 0.16 1.14 -0.31 1.15 1.06 0.00 0.00 176.91 180.12 2x3v h THR 169 N 0.16 1.27 0.00 2.22 2.02 -1.46 -2.11 112.91 115.02 2x3v h THR 169 Ca -0.10 -1.47 -0.09 0.00 0.77 0.00 0.00 66.41 65.52 2x3v h THR 169 Cb 1.72 1.29 -0.01 0.00 -1.74 0.00 0.00 68.15 69.41 2x3v h THR 169 CO 0.18 0.49 -0.42 0.08 0.37 0.00 0.00 175.52 176.22 2x3v h ARG 170 N 0.74 0.00 -0.01 6.66 0.11 -1.65 -2.30 114.38 117.92 2x3v h ARG 170 Ca 0.08 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 60.05 2x3v h ARG 170 Cb 0.87 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.96 2x3v h ARG 170 CO 0.08 0.42 -0.43 1.49 0.10 0.00 0.00 179.97 181.63 2x3v h GLU 171 N 0.00 0.31 -0.45 0.08 4.22 -1.45 -2.62 114.58 114.66 2x3v h GLU 171 Ca -0.00 -0.32 -0.09 0.00 0.08 0.00 0.00 59.36 59.02 2x3v h GLU 171 Cb 0.84 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 2x3v h GLU 171 CO 0.05 1.01 -0.09 0.52 -2.18 0.00 0.00 179.01 178.32 2x3v h MET 172 N -0.26 0.85 0.00 1.92 2.86 -1.39 -0.84 114.93 118.07 2x3v h MET 172 Ca -0.05 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.27 2x3v h MET 172 Cb 1.15 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.76 2x3v h MET 172 CO 0.08 0.95 0.00 0.09 1.06 0.00 0.00 176.91 179.09 2x3v n ASN 173 N -4.29 0.54 0.06 1.22 3.02 -0.87 -2.25 115.26 112.69 2x3v n ASN 173 Ca -0.00 0.59 0.12 0.00 -0.03 0.00 0.00 54.58 55.25 2x3v n ASN 173 Cb 0.37 -0.72 0.06 0.00 -0.61 0.00 0.00 39.78 38.88 2x3v n ASN 173 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2x3v n SER 174 N -2.04 0.70 0.41 6.41 2.88 -0.99 -4.51 113.62 116.48 2x3v n SER 174 Ca 0.04 0.10 -0.16 0.00 -1.33 0.00 0.00 58.87 57.52 2x3v n SER 174 Cb 0.31 0.50 -0.08 0.00 -0.75 0.00 0.00 64.21 64.19 2x3v n SER 174 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2x3v h LYS 175 N 0.00 -1.01 -5.50 -1.46 3.64 -0.70 -3.27 116.57 108.26 2x3v h LYS 175 Ca 0.00 0.07 -0.70 0.00 -1.27 0.00 0.00 60.65 58.75 2x3v h LYS 175 Cb 0.84 0.23 -0.11 0.00 -0.41 0.00 0.00 32.23 32.77 2x3v h LYS 175 CO 0.00 -0.68 1.94 0.95 -2.27 0.00 0.00 179.45 179.39 2x3v s THR 176 N -5.17 4.42 0.05 1.00 -4.23 -1.25 -4.91 115.64 105.54 2x3v s THR 176 Ca -0.15 -2.16 0.02 0.00 -1.18 0.00 0.00 61.69 58.21 2x3v s THR 176 Cb 0.02 -5.11 -0.03 0.00 1.34 0.00 0.00 72.50 68.72 2x3v s THR 176 CO 0.46 -1.90 -0.06 -0.70 -0.54 0.00 0.00 174.62 171.88 2x3v s GLU 177 N 3.36 0.58 0.00 3.99 2.56 -1.24 -5.02 118.70 122.94 2x3v s GLU 177 Ca 0.50 -0.92 0.00 0.00 0.00 0.00 0.00 54.97 54.56 2x3v s GLU 177 Cb 0.02 -0.18 0.00 0.00 2.00 0.00 0.00 34.13 35.97 2x3v s GLU 177 CO 0.05 0.01 0.92 0.94 -0.56 0.00 0.00 175.26 176.62 2x3v n GLN 178 N 1.00 0.00 -4.02 4.30 -0.06 -1.26 -4.67 117.38 112.67 2x3v n GLN 178 Ca -0.20 0.44 -0.34 0.00 -2.00 0.00 0.00 57.00 54.90 2x3v n GLN 178 Cb 0.57 -1.43 -0.15 0.00 -4.06 0.00 0.00 30.24 25.17 2x3v n GLN 178 CO 0.00 0.00 0.00 -1.12 -0.20 0.00 0.00 177.06 175.74 2x3v s SER 179 N -2.02 3.90 -0.25 1.69 0.01 -1.26 -5.07 113.70 110.71 2x3v s SER 179 Ca 0.00 -0.79 -0.01 0.00 1.31 0.00 0.00 55.95 56.46 2x3v s SER 179 Cb 0.00 -1.59 0.08 0.00 0.21 0.00 0.00 66.02 64.71 2x3v s SER 179 CO 0.00 -0.07 0.05 -0.69 0.41 0.00 0.00 173.24 172.93 2x3v s VAL 180 N 1.31 0.84 0.97 3.43 1.01 -1.26 -5.14 120.40 121.56 2x3v s VAL 180 Ca 0.02 -1.02 -0.11 0.00 0.00 0.00 0.00 61.98 60.86 2x3v s VAL 180 Cb -0.15 -1.43 0.17 0.00 0.00 0.00 0.00 36.38 34.97 2x3v s VAL 180 CO -0.07 -0.39 1.09 0.42 0.00 0.00 0.00 175.10 176.15 2x3v s THR 181 N 1.68 2.38 0.26 3.92 -4.23 -1.26 -4.71 115.64 113.67 2x3v s THR 181 Ca 0.03 0.12 -0.02 0.00 -1.18 0.00 0.00 61.69 60.63 2x3v s THR 181 Cb -0.17 -2.39 0.24 0.00 1.34 0.00 0.00 72.50 71.51 2x3v s THR 181 CO -0.15 -0.16 1.72 -0.65 -0.54 0.00 0.00 174.62 174.84 2x3v h PRO 182 N -1.89 0.40 0.00 3.99 0.11 -2.01 -1.11 132.00 131.49 2x3v h PRO 182 Ca -0.51 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.53 2x3v h PRO 182 Cb 1.29 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2x3v h PRO 182 CO 0.50 0.26 -0.23 1.05 -0.21 0.00 0.00 178.00 179.38 2x3v h GLU 183 N 0.41 0.00 0.06 1.05 4.11 -1.98 -0.88 114.58 117.35 2x3v h GLU 183 Ca 0.45 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.87 2x3v h GLU 183 Cb 0.73 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.98 2x3v h GLU 183 CO -0.45 0.23 -0.03 1.96 0.07 0.00 0.00 179.01 180.79 2x3v h GLN 184 N 0.00 -0.08 0.00 1.06 1.08 -1.54 -3.07 115.11 112.55 2x3v h GLN 184 Ca -0.00 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2x3v h GLN 184 Cb 0.72 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.17 2x3v h GLN 184 CO 0.03 0.33 0.00 0.37 -0.95 0.00 0.00 178.83 178.61 2x3v h GLN 185 N -0.52 0.00 0.11 1.46 5.75 -1.43 -3.11 115.11 117.38 2x3v h GLN 185 Ca -0.01 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 2x3v h GLN 185 Cb 0.45 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.00 2x3v h GLN 185 CO 0.01 0.00 -0.05 -0.22 -2.65 0.00 0.00 178.83 175.92 2x3v h LYS 186 N 0.00 -0.15 -0.14 1.69 1.63 -1.21 -2.96 116.57 115.44 2x3v h LYS 186 Ca 0.00 0.01 -0.10 0.00 -0.85 0.00 0.00 60.65 59.71 2x3v h LYS 186 Cb 0.77 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.43 2x3v h LYS 186 CO 0.00 0.27 -0.34 -0.22 -3.45 0.00 0.00 179.45 175.71 2x3v h LYS 187 N -0.62 0.28 0.24 1.90 1.63 -1.61 -0.96 116.57 117.43 2x3v h LYS 187 Ca -0.02 -0.12 -0.01 0.00 -0.85 0.00 0.00 60.65 59.66 2x3v h LYS 187 Cb 0.48 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.11 2x3v h LYS 187 CO 0.03 0.59 -0.11 -0.07 -3.45 0.00 0.00 179.45 176.44 2x3v h LEU 188 N 0.24 -0.27 -0.51 5.20 3.38 -1.61 -0.38 115.31 121.37 2x3v h LEU 188 Ca 0.03 -0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 2x3v h LEU 188 Cb 0.72 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 2x3v h LEU 188 CO 0.06 -0.13 -0.69 1.62 0.09 0.00 0.00 178.44 179.38 2x3v h VAL 189 N -0.38 1.41 -0.58 1.22 3.04 -1.51 -3.02 116.25 116.42 2x3v h VAL 189 Ca -0.03 -2.16 -0.03 0.00 -1.01 0.00 0.00 66.70 63.47 2x3v h VAL 189 Cb 0.29 2.13 -0.03 0.00 -2.01 0.00 0.00 31.29 31.67 2x3v h VAL 189 CO 0.05 0.64 0.24 0.44 -1.01 0.00 0.00 177.57 177.94 2x3v h ASP 190 N 0.19 0.76 -0.41 3.17 3.45 -1.11 -2.68 116.42 119.79 2x3v h ASP 190 Ca -0.02 -0.09 -0.07 0.00 0.43 0.00 0.00 57.03 57.28 2x3v h ASP 190 Cb 1.24 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 39.80 2x3v h ASP 190 CO 0.11 0.68 -0.00 0.50 -1.57 0.00 0.00 179.24 178.95 2x3v h LYS 191 N 0.83 0.72 0.00 3.56 1.63 -0.96 -2.42 116.57 119.92 2x3v h LYS 191 Ca 0.20 -0.23 -0.06 0.00 -0.85 0.00 0.00 60.65 59.71 2x3v h LYS 191 Cb 0.14 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.70 2x3v h LYS 191 CO -0.02 0.81 -0.30 -0.39 -3.45 0.00 0.00 179.45 176.09 2x3v h VAL 192 N 0.55 0.99 -0.02 2.00 -1.51 -1.41 -2.37 116.25 114.48 2x3v h VAL 192 Ca 0.11 -1.13 -0.18 0.00 -1.23 0.00 0.00 66.70 64.27 2x3v h VAL 192 Cb 0.48 1.65 -0.01 0.00 -2.13 0.00 0.00 31.29 31.28 2x3v h VAL 192 CO 0.02 0.30 -0.79 0.44 -1.23 0.00 0.00 177.57 176.32 2x3v h ASP 193 N 0.00 0.23 -0.25 4.19 3.32 -1.34 -2.70 116.42 119.88 2x3v h ASP 193 Ca -0.00 -0.17 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 2x3v h ASP 193 Cb 0.63 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 2x3v h ASP 193 CO 0.04 0.92 -0.05 0.11 -1.72 0.00 0.00 179.24 178.55 2x3v h LYS 194 N 0.12 0.47 -0.06 3.56 1.79 -1.12 -2.98 116.57 118.34 2x3v h LYS 194 Ca -0.03 -0.17 -0.08 0.00 -2.18 0.00 0.00 60.65 58.19 2x3v h LYS 194 Cb 1.37 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.98 2x3v h LYS 194 CO 0.12 0.68 -0.32 0.00 -1.08 0.00 0.00 179.45 178.85 2x3v h ARG 196 N 0.11 0.87 -0.58 0.00 2.47 -1.53 -0.95 114.38 114.77 2x3v h ARG 196 Ca 0.01 -0.26 -0.05 0.00 -1.26 0.00 0.00 59.98 58.43 2x3v h ARG 196 Cb 0.63 -0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.83 2x3v h ARG 196 CO 0.05 0.88 0.16 1.96 0.56 0.00 0.00 179.97 183.58 2x3v h GLN 197 N 0.74 0.89 -0.16 0.04 4.20 -1.22 -1.93 115.11 117.67 2x3v h GLN 197 Ca 0.15 -0.18 -0.06 0.00 0.06 0.00 0.00 58.65 58.63 2x3v h GLN 197 Cb 0.46 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 2x3v h GLN 197 CO 0.02 0.78 -0.12 -0.44 -0.67 0.00 0.00 178.83 178.40 2x3v h ASP 198 N 0.86 0.39 0.61 1.46 5.19 -1.16 -2.94 116.42 120.82 2x3v h ASP 198 Ca 0.19 -0.45 -0.02 0.00 -0.62 0.00 0.00 57.03 56.13 2x3v h ASP 198 Cb 0.28 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 2x3v h ASP 198 CO -0.00 0.75 -0.48 0.58 -3.12 0.00 0.00 179.24 176.97 2x3v h VAL 199 N 0.02 0.06 0.00 -1.35 2.07 -1.02 0.79 116.25 116.82 2x3v h VAL 199 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 2x3v h VAL 199 Cb 0.62 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2x3v h VAL 199 CO 0.03 0.00 0.00 0.06 0.02 0.00 0.00 177.57 177.68 2x3v h GLN 200 N -1.05 0.00 0.14 1.57 -0.00 -1.47 0.21 115.11 114.52 2x3v h GLN 200 Ca -0.08 0.00 -0.36 0.00 -0.00 0.00 0.00 58.65 58.22 2x3v h GLN 200 Cb 0.88 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.35 2x3v h GLN 200 CO 0.01 0.00 -1.90 -0.22 -0.00 0.00 0.00 178.83 176.72 2x3v h LYS 201 N 0.00 0.31 0.00 0.06 3.64 -1.37 -3.09 116.57 116.11 2x3v h LYS 201 Ca 0.00 -0.52 -0.11 0.00 -1.27 0.00 0.00 60.65 58.75 2x3v h LYS 201 Cb 0.41 0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.41 2x3v h LYS 201 CO 0.00 1.23 -0.51 0.00 -2.27 0.00 0.00 179.45 177.91 2x3v h THR 202 N 0.08 1.16 -0.41 1.00 1.03 -0.47 -2.74 112.91 112.56 2x3v h THR 202 Ca -0.39 -1.86 -0.14 0.00 -0.01 0.00 0.00 66.41 64.01 2x3v h THR 202 Cb 2.06 2.06 -0.01 0.00 -1.07 0.00 0.00 68.15 71.19 2x3v h THR 202 CO 0.12 0.50 -0.29 -0.61 -0.01 0.00 0.00 175.52 175.23 2x3v h GLN 203 N 0.00 0.92 0.22 0.00 4.15 -0.74 -2.85 115.11 116.82 2x3v h GLN 203 Ca -0.01 -0.44 -0.00 0.00 0.77 0.00 0.00 58.65 58.97 2x3v h GLN 203 Cb 1.02 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.70 2x3v h GLN 203 CO 0.07 1.10 -0.16 1.49 -1.93 0.00 0.00 178.83 179.40 2x3v h GLU 204 N 0.74 -0.36 -0.13 1.69 4.81 -1.43 0.23 114.58 120.13 2x3v h GLU 204 Ca 0.08 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.30 2x3v h GLU 204 Cb 0.88 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.33 2x3v h GLU 204 CO 0.08 -0.24 -0.07 -0.22 -0.73 0.00 0.00 179.01 177.82 2x3v h LYS 205 N -0.38 0.19 -0.09 1.92 1.63 -1.57 -0.64 116.57 117.64 2x3v h LYS 205 Ca -0.02 -0.03 -0.24 0.00 -0.85 0.00 0.00 60.65 59.51 2x3v h LYS 205 Cb 0.33 -0.03 0.01 0.00 -0.60 0.00 0.00 32.23 31.94 2x3v h LYS 205 CO 0.00 0.28 -0.89 -0.92 -3.45 0.00 0.00 179.45 174.48 2x3v h TYR 206 N 0.19 1.04 -0.03 1.91 -0.00 -1.26 -2.43 116.97 116.40 2x3v h TYR 206 Ca 0.04 -0.51 -0.09 0.00 -0.00 0.00 0.00 58.73 58.18 2x3v h TYR 206 Cb 0.26 -0.14 -0.01 0.00 -0.00 0.00 0.00 36.73 36.83 2x3v h TYR 206 CO 0.00 1.34 -0.42 0.93 -0.00 0.00 0.00 178.16 180.02 2x3v h GLU 207 N 0.47 0.06 -0.13 1.82 5.08 -0.58 -2.00 114.58 119.31 2x3v h GLU 207 Ca -0.08 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.09 2x3v h GLU 207 Cb 1.52 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.78 2x3v h GLU 207 CO 0.18 0.47 -0.55 -0.22 -1.00 0.00 0.00 179.01 177.89 2x3v h LYS 208 N 0.05 0.59 -0.44 2.33 3.64 -1.09 -1.83 116.57 119.83 2x3v h LYS 208 Ca 0.00 -0.47 -0.08 0.00 -1.27 0.00 0.00 60.65 58.83 2x3v h LYS 208 Cb 0.76 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.65 2x3v h LYS 208 CO 0.06 1.09 -0.06 0.28 -2.27 0.00 0.00 179.45 178.55 2x3v h VAL 209 N 0.23 1.25 -0.32 2.00 2.07 -1.44 -2.33 116.25 117.72 2x3v h VAL 209 Ca -0.03 -1.08 -0.06 0.00 0.82 0.00 0.00 66.70 66.34 2x3v h VAL 209 Cb 1.18 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 2x3v h VAL 209 CO 0.11 0.37 -0.07 0.25 0.02 0.00 0.00 177.57 178.26 2x3v h LEU 210 N 0.70 0.49 -0.31 2.57 5.85 -1.27 -0.18 115.31 123.16 2x3v h LEU 210 Ca 0.13 -0.11 -0.08 0.00 0.84 0.00 0.00 57.88 58.66 2x3v h LEU 210 Cb 0.52 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 2x3v h LEU 210 CO 0.03 0.60 -0.13 -0.08 -0.34 0.00 0.00 178.44 178.53 2x3v h GLU 211 N 0.48 0.64 0.00 1.25 4.81 -1.09 -2.72 114.58 117.94 2x3v h GLU 211 Ca 0.10 -0.27 -0.10 0.00 -0.13 0.00 0.00 59.36 58.96 2x3v h GLU 211 Cb 0.42 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 2x3v h GLU 211 CO 0.02 0.85 -0.46 0.22 -0.73 0.00 0.00 179.01 178.91 2x3v h ASP 212 N 0.40 0.00 -0.12 1.04 -0.00 -1.02 -1.20 116.42 115.52 2x3v h ASP 212 Ca 0.07 0.00 -0.02 0.00 -0.00 0.00 0.00 57.03 57.08 2x3v h ASP 212 Cb 0.65 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.97 2x3v h ASP 212 CO 0.04 0.46 -0.01 0.58 -0.00 0.00 0.00 179.24 180.31 2x3v h VAL 213 N 0.00 1.26 -0.50 2.25 2.07 -1.03 -2.02 116.25 118.27 2x3v h VAL 213 Ca -0.00 -0.85 -0.02 0.00 0.82 0.00 0.00 66.70 66.65 2x3v h VAL 213 Cb 0.98 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 2x3v h VAL 213 CO 0.06 0.24 0.25 1.23 0.02 0.00 0.00 177.57 179.37 2x3v h GLY 214 N -0.07 0.77 1.15 2.17 0.00 -1.39 -2.26 103.07 103.44 2x3v h GLY 214 Ca 0.03 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 2x3v h GLY 214 CO 0.01 0.36 0.47 0.50 0.00 0.00 0.00 176.54 177.88 2x3v h LYS 215 N 0.67 1.12 -0.01 4.80 1.57 -1.22 -2.90 116.57 120.59 2x3v h LYS 215 Ca 0.17 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2x3v h LYS 215 Cb 0.11 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.18 2x3v h LYS 215 CO -0.02 0.80 -0.18 0.25 -0.57 0.00 0.00 179.45 179.73 2x3v n THR 216 N -4.36 0.00 0.08 -0.16 -2.24 -0.76 -4.40 114.28 102.44 2x3v n THR 216 Ca 0.09 -0.18 -0.12 0.00 -2.27 0.00 0.00 64.05 61.57 2x3v n THR 216 Cb 0.08 0.48 -0.06 0.00 -2.10 0.00 0.00 70.33 68.74 2x3v n THR 216 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2x3v h THR 217 N 1.70 0.69 -0.73 4.28 2.02 -1.19 -2.55 112.91 117.13 2x3v h THR 217 Ca 0.00 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.32 2x3v h THR 217 Cb 0.52 0.69 -0.09 0.00 -1.74 0.00 0.00 68.15 67.53 2x3v h THR 217 CO 0.00 0.00 0.28 -0.65 0.37 0.00 0.00 175.52 175.52 2x3v h PRO 218 N -0.25 0.41 -0.96 6.66 0.11 -1.78 -0.21 132.00 135.98 2x3v h PRO 218 Ca 0.03 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.14 2x3v h PRO 218 Cb 0.27 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 31.24 2x3v h PRO 218 CO -0.08 0.27 0.63 1.96 -0.21 0.00 0.00 178.00 180.56 2x3v h GLN 219 N 0.42 1.19 -0.33 1.05 1.08 -1.80 0.12 115.11 116.85 2x3v h GLN 219 Ca 0.40 -0.07 -0.09 0.00 -1.45 0.00 0.00 58.65 57.44 2x3v h GLN 219 Cb 0.61 -0.27 -0.01 0.00 -0.05 0.00 0.00 27.48 27.76 2x3v h GLN 219 CO -0.40 0.79 -0.15 -0.92 -0.95 0.00 0.00 178.83 177.20 2x3v h TYR 220 N 1.23 0.78 -0.06 2.96 3.20 -0.87 -1.59 116.97 122.63 2x3v h TYR 220 Ca 0.37 -0.19 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 2x3v h TYR 220 Cb -0.03 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.05 2x3v h TYR 220 CO -0.01 0.89 0.02 0.52 -1.64 0.00 0.00 178.16 177.94 2x3v h MET 221 N 0.45 0.09 -0.95 1.82 2.86 -0.79 -1.66 114.93 116.74 2x3v h MET 221 Ca 0.07 -0.02 0.13 0.00 -2.06 0.00 0.00 59.70 57.82 2x3v h MET 221 Cb 0.68 -0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.23 2x3v h MET 221 CO 0.05 0.22 0.58 0.93 1.06 0.00 0.00 176.91 179.74 2x3v h GLU 222 N -0.06 0.86 -0.33 1.72 5.08 -0.96 -0.81 114.58 120.09 2x3v h GLU 222 Ca 0.02 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 2x3v h GLU 222 Cb 0.16 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2x3v h GLU 222 CO -0.00 0.57 -0.07 0.78 -1.00 0.00 0.00 179.01 179.29 2x3v h GLY 223 N 0.89 0.68 1.66 -3.84 0.00 -0.99 -2.61 103.07 98.86 2x3v h GLY 223 Ca 0.48 -0.55 -0.17 0.00 0.00 0.00 0.00 47.33 47.09 2x3v h GLY 223 CO -0.29 0.51 -0.69 -0.33 0.00 0.00 0.00 176.54 175.74 2x3v h MET 224 N 0.41 0.34 -0.61 4.80 2.86 -0.96 -3.13 114.93 118.65 2x3v h MET 224 Ca 0.08 -0.27 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 2x3v h MET 224 Cb 0.56 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.24 2x3v h MET 224 CO 0.03 0.90 0.31 0.93 1.06 0.00 0.00 176.91 180.15 2x3v h GLU 225 N 0.24 0.86 -0.79 1.72 4.39 -1.14 -1.87 114.58 117.99 2x3v h GLU 225 Ca -0.02 -0.11 -0.02 0.00 0.34 0.00 0.00 59.36 59.55 2x3v h GLU 225 Cb 1.25 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 29.70 2x3v h GLU 225 CO 0.11 0.67 0.43 1.96 -1.16 0.00 0.00 179.01 181.03 2x3v h GLN 226 N 0.83 1.11 -0.27 2.33 4.20 -1.41 0.77 115.11 122.66 2x3v h GLN 226 Ca 0.21 -0.13 -0.16 0.00 0.06 0.00 0.00 58.65 58.63 2x3v h GLN 226 Cb 0.08 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.65 2x3v h GLN 226 CO -0.03 0.82 -0.46 0.28 -0.67 0.00 0.00 178.83 178.77 2x3v h VAL 227 N 1.10 1.29 -0.62 -0.54 2.07 -1.52 -3.07 116.25 114.96 2x3v h VAL 227 Ca 0.28 -1.65 -0.06 0.00 0.82 0.00 0.00 66.70 66.08 2x3v h VAL 227 Cb 0.04 1.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2x3v h VAL 227 CO -0.04 0.53 0.13 0.15 0.02 0.00 0.00 177.57 178.36 2x3v h PHE 228 N 0.55 1.02 -0.07 1.57 3.04 -0.97 -2.08 116.94 120.00 2x3v h PHE 228 Ca 0.02 -0.11 -0.10 0.00 3.98 0.00 0.00 57.97 61.76 2x3v h PHE 228 Cb 1.06 -0.29 -0.01 0.00 2.56 0.00 0.00 35.95 39.27 2x3v h PHE 228 CO 0.08 0.85 -0.40 1.49 -2.02 0.00 0.00 178.31 178.30 2x3v h GLU 229 N 0.93 0.14 -0.21 1.11 4.57 -0.89 0.69 114.58 120.91 2x3v h GLU 229 Ca 0.20 -0.06 -0.10 0.00 -1.18 0.00 0.00 59.36 58.21 2x3v h GLU 229 Cb 0.35 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 2x3v h GLU 229 CO 0.00 0.52 -0.31 1.96 -1.18 0.00 0.00 179.01 180.01 2x3v h GLN 230 N 0.12 0.43 -0.10 1.92 4.20 -1.38 -0.83 115.11 119.47 2x3v h GLN 230 Ca 0.01 -0.18 -0.10 0.00 0.06 0.00 0.00 58.65 58.44 2x3v h GLN 230 Cb 0.77 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 2x3v h GLN 230 CO 0.06 0.70 -0.41 0.00 -0.67 0.00 0.00 178.83 178.51 2x3v h GLN 232 N 0.19 0.44 -0.64 0.00 1.08 -0.62 -2.52 115.11 113.03 2x3v h GLN 232 Ca 0.02 -0.24 -0.04 0.00 -1.45 0.00 0.00 58.65 56.94 2x3v h GLN 232 Cb 0.80 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.22 2x3v h GLN 232 CO 0.06 0.81 0.24 1.96 -0.95 0.00 0.00 178.83 180.95 2x3v h GLN 233 N 0.08 0.95 0.16 1.46 4.20 -1.12 0.29 115.11 121.13 2x3v h GLN 233 Ca 0.02 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 2x3v h GLN 233 Cb 0.74 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.36 2x3v h GLN 233 CO 0.05 0.79 -0.07 0.35 -0.67 0.00 0.00 178.83 179.27 2x3v h PHE 234 N 0.93 -0.19 -0.96 2.96 3.04 -1.49 -2.61 116.94 118.61 2x3v h PHE 234 Ca 0.22 -0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.21 2x3v h PHE 234 Cb 0.20 0.06 -0.06 0.00 2.56 0.00 0.00 35.95 38.72 2x3v h PHE 234 CO 0.02 0.12 0.62 1.49 -2.02 0.00 0.00 178.31 178.53 2x3v h GLU 235 N -0.51 1.13 -0.77 1.11 4.57 -1.25 -2.36 114.58 116.50 2x3v h GLU 235 Ca -0.02 -0.07 0.04 0.00 -1.18 0.00 0.00 59.36 58.13 2x3v h GLU 235 Cb 0.40 -0.26 -0.05 0.00 -0.16 0.00 0.00 28.75 28.68 2x3v h GLU 235 CO 0.04 0.75 0.48 1.49 -1.18 0.00 0.00 179.01 180.58 2x3v h GLU 236 N 1.17 0.88 -0.48 1.92 4.81 -0.38 0.15 114.58 122.65 2x3v h GLU 236 Ca 0.40 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.61 2x3v h GLU 236 Cb 0.09 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.23 2x3v h GLU 236 CO -0.15 0.58 0.26 -0.22 -0.73 0.00 0.00 179.01 178.75 2x3v h LYS 237 N 0.91 0.50 -0.02 1.92 3.64 -1.03 0.27 116.57 122.75 2x3v h LYS 237 Ca 0.32 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.67 2x3v h LYS 237 Cb 0.07 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.78 2x3v h LYS 237 CO -0.13 0.33 0.01 -0.09 -2.27 0.00 0.00 179.45 177.29 2x3v h ARG 238 N 0.51 0.03 -0.89 1.90 2.43 -1.21 -1.65 114.38 115.50 2x3v h ARG 238 Ca 0.20 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.40 2x3v h ARG 238 Cb 0.08 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.57 2x3v h ARG 238 CO -0.12 0.18 0.58 -0.07 -1.51 0.00 0.00 179.97 179.02 2x3v h LEU 239 N -0.12 0.96 -0.51 3.80 3.38 -0.69 0.13 115.31 122.25 2x3v h LEU 239 Ca 0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2x3v h LEU 239 Cb 0.16 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2x3v h LEU 239 CO -0.00 0.66 0.28 0.58 0.09 0.00 0.00 178.44 180.05 2x3v h VAL 240 N 1.12 1.17 -0.67 1.22 2.07 -0.89 -2.47 116.25 117.80 2x3v h VAL 240 Ca 0.35 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 67.37 2x3v h VAL 240 Cb -0.00 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 2x3v h VAL 240 CO -0.12 0.18 0.17 0.15 0.02 0.00 0.00 177.57 177.98 2x3v h PHE 241 N 0.68 1.10 0.16 1.57 3.04 -0.47 -2.51 116.94 120.50 2x3v h PHE 241 Ca 0.18 -0.12 0.01 0.00 3.98 0.00 0.00 57.97 62.02 2x3v h PHE 241 Cb 0.05 -0.31 -0.02 0.00 2.56 0.00 0.00 35.95 38.22 2x3v h PHE 241 CO -0.02 0.89 -0.21 1.25 -2.02 0.00 0.00 178.31 178.20 2x3v h LEU 242 N 1.01 -0.58 -0.55 0.59 6.46 -0.63 -0.59 115.31 121.01 2x3v h LEU 242 Ca 0.21 0.06 0.11 0.00 -0.12 0.00 0.00 57.88 58.15 2x3v h LEU 242 Cb 0.34 0.21 -0.09 0.00 -0.73 0.00 0.00 40.66 40.39 2x3v h LEU 242 CO -0.00 -0.31 0.03 0.50 -0.62 0.00 0.00 178.44 178.04 2x3v h LYS 243 N -0.43 0.14 -0.23 1.25 3.64 -1.28 0.15 116.57 119.81 2x3v h LYS 243 Ca 0.01 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 2x3v h LYS 243 Cb 0.43 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 2x3v h LYS 243 CO -0.09 0.09 0.11 1.49 -2.27 0.00 0.00 179.45 178.79 2x3v h GLU 244 N 0.15 0.33 -0.40 1.90 4.81 -1.10 -2.18 114.58 118.09 2x3v h GLU 244 Ca 0.28 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.35 2x3v h GLU 244 Cb 0.44 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 2x3v h GLU 244 CO -0.44 0.33 -0.23 0.28 -0.73 0.00 0.00 179.01 178.21 2x3v h VAL 245 N 0.25 1.28 -1.00 0.32 2.07 -0.46 -1.05 116.25 117.65 2x3v h VAL 245 Ca 0.08 -1.39 0.16 0.00 0.82 0.00 0.00 66.70 66.37 2x3v h VAL 245 Cb 0.10 1.31 -0.10 0.00 -1.52 0.00 0.00 31.29 31.08 2x3v h VAL 245 CO -0.01 0.46 0.62 -0.07 0.02 0.00 0.00 177.57 178.60 2x3v h LEU 246 N 0.67 0.85 -0.35 2.57 4.07 -0.69 0.10 115.31 122.52 2x3v h LEU 246 Ca 0.08 0.07 -0.14 0.00 0.08 0.00 0.00 57.88 57.98 2x3v h LEU 246 Cb 0.80 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 42.45 2x3v h LEU 246 CO 0.07 0.37 -0.33 0.25 -1.08 0.00 0.00 178.44 177.72 2x3v h LEU 247 N 0.87 0.90 -1.33 1.67 5.85 -0.81 -1.26 115.31 121.20 2x3v h LEU 247 Ca 0.54 -0.46 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 2x3v h LEU 247 Cb 0.72 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 2x3v h LEU 247 CO -0.33 1.18 0.28 0.44 -0.34 0.00 0.00 178.44 179.68 2x3v h ASP 248 N 0.64 0.66 -0.26 1.25 3.45 -0.47 -2.59 116.42 119.11 2x3v h ASP 248 Ca 0.06 -0.05 -0.14 0.00 0.43 0.00 0.00 57.03 57.33 2x3v h ASP 248 Cb 0.91 -0.17 -0.00 0.00 -0.56 0.00 0.00 39.33 39.51 2x3v h ASP 248 CO 0.08 0.54 -0.37 0.40 -1.57 0.00 0.00 179.24 178.33 2x3v h ILE 249 N 0.75 1.31 -0.75 0.35 2.04 -0.76 -2.86 117.51 117.59 2x3v h ILE 249 Ca 0.19 -1.56 0.10 0.00 1.00 0.00 0.00 64.86 64.59 2x3v h ILE 249 Cb 0.04 1.68 -0.07 0.00 -0.74 0.00 0.00 36.82 37.73 2x3v h ILE 249 CO -0.03 0.50 0.39 0.50 0.00 0.00 0.00 178.15 179.50 2x3v h LYS 250 N 0.44 0.63 0.00 2.37 3.11 -0.94 -0.56 116.57 121.62 2x3v h LYS 250 Ca 0.03 -0.04 -0.08 0.00 -2.81 0.00 0.00 60.65 57.75 2x3v h LYS 250 Cb 0.96 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 32.03 2x3v h LYS 250 CO 0.09 0.42 -0.37 0.00 -2.81 0.00 0.00 179.45 176.77 2x3v h ARG 251 N 0.65 0.00 0.08 1.90 3.08 -1.47 -2.46 114.38 116.16 2x3v h ARG 251 Ca 0.37 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 60.13 2x3v h ARG 251 Cb 0.38 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.46 2x3v h ARG 251 CO -0.27 0.37 -1.18 0.45 -1.07 0.00 0.00 179.97 178.28 2x3v h HIS 252 N 0.00 1.00 -0.26 3.04 3.86 -1.10 -3.31 115.15 118.37 2x3v h HIS 252 Ca -0.00 -0.60 -0.10 0.00 -1.16 0.00 0.00 60.37 58.51 2x3v h HIS 252 Cb 0.95 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 29.32 2x3v h HIS 252 CO 0.00 1.44 -0.25 -0.07 0.86 0.00 0.00 177.93 179.91 2x3v h LEU 253 N 0.31 0.52 -8.67 2.43 3.38 -1.05 -3.43 115.31 108.79 2x3v h LEU 253 Ca -0.17 -0.18 -0.56 0.00 0.09 0.00 0.00 57.88 57.07 2x3v h LEU 253 Cb 1.84 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 42.39 2x3v h LEU 253 CO 0.23 0.76 1.02 0.21 0.09 0.00 0.00 178.44 180.75 2x3v s ASN 254 N -6.80 6.39 0.36 -0.43 3.84 -0.93 -4.88 114.94 112.48 2x3v s ASN 254 Ca -0.07 0.43 0.27 0.00 0.21 0.00 0.00 52.86 53.70 2x3v s ASN 254 Cb 0.14 -2.55 0.96 0.00 -0.55 0.00 0.00 41.25 39.25 2x3v s ASN 254 CO 0.80 -1.47 1.79 -0.07 -2.79 0.00 0.00 177.10 175.36 2x3v h LEU 255 N 12.11 0.00 0.00 3.21 3.38 -1.88 -2.99 115.31 129.14 2x3v h LEU 255 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2x3v h LEU 255 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2x3v h LEU 255 CO 1.14 0.00 -0.16 0.00 0.09 0.00 0.00 178.44 179.52 2x3v n ALA 256 N -1.92 2.51 -0.31 1.53 0.00 -1.26 -4.12 120.51 116.93 2x3v n ALA 256 Ca 0.03 -0.11 0.10 0.00 0.00 0.00 0.00 53.44 53.46 2x3v n ALA 256 Cb 0.34 -1.39 0.27 0.00 0.00 0.00 0.00 19.45 18.68 2x3v n ALA 256 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2x3v h GLU 257 N 0.00 0.58 -6.72 0.00 4.39 -1.86 -3.41 114.58 107.56 2x3v h GLU 257 Ca 0.00 -0.03 -0.67 0.00 0.34 0.00 0.00 59.36 58.99 2x3v h GLU 257 Cb 0.67 -0.13 -0.19 0.00 -0.10 0.00 0.00 28.75 29.00 2x3v h GLU 257 CO 0.00 0.38 -0.81 1.21 -1.16 0.00 0.00 179.01 178.63 2x3v s ASN 258 N -5.35 3.71 0.56 1.42 2.47 -1.26 -5.04 114.94 111.45 2x3v s ASN 258 Ca -0.12 -0.66 0.34 0.00 0.42 0.00 0.00 52.86 52.84 2x3v s ASN 258 Cb 0.24 -0.44 1.54 0.00 -1.45 0.00 0.00 41.25 41.14 2x3v s ASN 258 CO 0.79 0.16 2.06 0.77 -3.72 0.00 0.00 177.10 177.15 2x3v h SER 259 N 3.59 0.00 -0.58 -4.21 4.64 -1.86 -3.30 113.55 111.84 2x3v h SER 259 Ca -0.49 0.00 0.20 0.00 -0.47 0.00 0.00 61.79 61.03 2x3v h SER 259 Cb 1.18 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.16 2x3v h SER 259 CO 0.45 0.05 0.16 -1.54 -0.87 0.00 0.00 176.83 175.08 2x3v n SER 260 N -3.21 0.07 -0.04 4.97 3.41 -1.26 -0.71 113.62 116.85 2x3v n SER 260 Ca -0.01 0.97 -0.14 0.00 -0.26 0.00 0.00 58.87 59.44 2x3v n SER 260 Cb 0.26 -0.41 -0.09 0.00 -0.26 0.00 0.00 64.21 63.71 2x3v n SER 260 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2x3v h TYR 261 N 0.00 0.26 -0.36 7.33 5.03 -1.74 -3.17 116.97 124.32 2x3v h TYR 261 Ca 0.42 -0.09 -0.01 0.00 2.58 0.00 0.00 58.73 61.63 2x3v h TYR 261 Cb 1.01 -0.05 -0.02 0.00 1.55 0.00 0.00 36.73 39.23 2x3v h TYR 261 CO -0.15 0.73 0.18 1.98 -1.32 0.00 0.00 178.16 179.58 2x3v h MET 262 N -0.29 0.49 -0.25 1.82 4.05 -1.18 -2.83 114.93 116.74 2x3v h MET 262 Ca 0.00 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.37 2x3v h MET 262 Cb 0.71 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.40 2x3v h MET 262 CO 0.03 0.37 0.14 0.45 0.23 0.00 0.00 176.91 178.13 2x3v h HIS 263 N 0.49 0.34 -0.90 1.39 3.86 -1.45 -1.32 115.15 117.55 2x3v h HIS 263 Ca 0.13 -0.01 0.25 0.00 -1.16 0.00 0.00 60.37 59.58 2x3v h HIS 263 Cb 0.04 -0.11 -0.14 0.00 1.06 0.00 0.00 27.41 28.26 2x3v h HIS 263 CO 0.00 0.29 0.30 0.28 0.86 0.00 0.00 177.93 179.66 2x3v h VAL 264 N 0.29 0.32 0.00 2.45 2.07 -1.47 0.38 116.25 120.29 2x3v h VAL 264 Ca 0.09 -0.08 -0.16 0.00 0.82 0.00 0.00 66.70 67.36 2x3v h VAL 264 Cb 0.06 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 29.86 2x3v h VAL 264 CO -0.01 0.04 -1.17 1.88 0.02 0.00 0.00 177.57 178.33 2x3v h TYR 265 N 0.24 0.00 -0.52 1.57 0.05 -1.60 -1.47 116.97 115.25 2x3v h TYR 265 Ca 0.58 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 59.26 2x3v h TYR 265 Cb 1.21 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.93 2x3v h TYR 265 CO -0.21 0.63 -0.08 -0.09 -1.05 0.00 0.00 178.16 177.35 2x3v h ARG 266 N 0.00 0.94 -0.14 4.88 2.43 0.09 -1.71 114.38 120.87 2x3v h ARG 266 Ca -0.12 -0.32 -0.06 0.00 -0.81 0.00 0.00 59.98 58.67 2x3v h ARG 266 Cb 1.58 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 31.06 2x3v h ARG 266 CO 0.06 0.97 -0.16 0.93 -1.51 0.00 0.00 179.97 180.26 2x3v h GLU 267 N 0.85 0.35 -0.80 0.20 5.08 -0.35 -2.47 114.58 117.44 2x3v h GLU 267 Ca 0.14 -0.19 0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2x3v h GLU 267 Cb 0.61 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 2x3v h GLU 267 CO 0.04 0.76 0.51 1.25 -1.00 0.00 0.00 179.01 180.57 2x3v h LEU 268 N -0.04 0.86 -0.85 1.33 7.12 -1.24 0.49 115.31 122.98 2x3v h LEU 268 Ca 0.02 -0.01 -0.10 0.00 0.13 0.00 0.00 57.88 57.92 2x3v h LEU 268 Cb 0.70 -0.19 -0.02 0.00 -0.53 0.00 0.00 40.66 40.62 2x3v h LEU 268 CO 0.04 0.60 -0.18 -0.08 -0.13 0.00 0.00 178.44 178.68 2x3v h GLU 269 N 1.01 0.65 -0.16 1.25 4.81 -1.36 -2.44 114.58 118.34 2x3v h GLU 269 Ca 0.31 -0.23 -0.10 0.00 -0.13 0.00 0.00 59.36 59.21 2x3v h GLU 269 Cb -0.01 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2x3v h GLU 269 CO -0.10 0.80 -0.35 1.96 -0.73 0.00 0.00 179.01 180.58 2x3v h GLN 270 N 0.58 0.34 -0.77 1.92 7.50 -0.77 0.24 115.11 124.15 2x3v h GLN 270 Ca 0.09 -0.15 -0.04 0.00 0.50 0.00 0.00 58.65 59.06 2x3v h GLN 270 Cb 0.64 -0.01 -0.03 0.00 0.05 0.00 0.00 27.48 28.12 2x3v h GLN 270 CO 0.05 0.65 0.32 0.00 -1.50 0.00 0.00 178.83 178.35 2x3v h ALA 271 N 1.35 1.00 -0.09 3.87 0.00 -0.77 -2.02 119.26 122.60 2x3v h ALA 271 Ca 0.03 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 2x3v h ALA 271 Cb 0.76 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2x3v h ALA 271 CO 0.06 0.61 -0.38 0.82 0.00 0.00 0.00 179.25 180.36 2x3v h ILE 272 N 1.11 1.40 -0.80 0.00 2.04 -0.95 -3.20 117.51 117.11 2x3v h ILE 272 Ca 0.26 -1.75 0.11 0.00 1.00 0.00 0.00 64.86 64.48 2x3v h ILE 272 Cb 0.19 2.26 -0.08 0.00 -0.74 0.00 0.00 36.82 38.45 2x3v h ILE 272 CO -0.02 0.51 0.43 0.03 0.00 0.00 0.00 178.15 179.09 2x3v h ARG 273 N -0.04 0.66 0.00 2.37 2.47 -0.53 -2.47 114.38 116.84 2x3v h ARG 273 Ca -0.02 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 2x3v h ARG 273 Cb 1.02 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.19 2x3v h ARG 273 CO 0.08 0.44 0.00 0.41 0.56 0.00 0.00 179.97 181.46 2x3v n GLY 274 N -1.32 -0.86 3.75 0.04 0.00 -0.76 -4.80 105.19 101.24 2x3v n GLY 274 Ca 0.14 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 2x3v n GLY 274 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x3v s ALA 275 N -2.13 2.65 -0.23 4.61 0.00 -0.93 -5.03 121.76 120.71 2x3v s ALA 275 Ca 0.35 1.14 -0.03 0.00 0.00 0.00 0.00 51.96 53.42 2x3v s ALA 275 Cb 0.17 -3.50 0.10 0.00 0.00 0.00 0.00 23.12 19.89 2x3v s ALA 275 CO 0.31 -1.25 0.23 0.34 0.00 0.00 0.00 175.76 175.39 2x3v s ASP 276 N -1.33 1.60 0.17 0.00 3.68 -1.26 -5.03 116.67 114.51 2x3v s ASP 276 Ca 0.75 -0.41 -0.14 0.00 2.13 0.00 0.00 52.55 54.88 2x3v s ASP 276 Cb -0.35 0.35 0.06 0.00 -1.45 0.00 0.00 42.92 41.53 2x3v s ASP 276 CO 0.39 -0.35 1.81 0.00 0.13 0.00 0.00 175.17 177.15 2x3v h ALA 277 N 8.31 0.66 -0.30 3.66 0.00 -2.00 -2.98 119.26 126.60 2x3v h ALA 277 Ca -0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 2x3v h ALA 277 Cb 1.13 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2x3v h ALA 277 CO 0.30 0.13 0.18 1.96 0.00 0.00 0.00 179.25 181.83 2x3v h GLN 278 N 0.69 0.41 -0.57 0.00 1.08 -1.99 -0.83 115.11 113.91 2x3v h GLN 278 Ca 0.19 -0.04 0.09 0.00 -1.45 0.00 0.00 58.65 57.44 2x3v h GLN 278 Cb -0.03 -0.09 -0.07 0.00 -0.05 0.00 0.00 27.48 27.24 2x3v h GLN 278 CO -0.04 0.31 0.18 1.49 -0.95 0.00 0.00 178.83 179.83 2x3v h GLU 279 N 0.39 0.33 -0.42 1.46 4.81 -1.98 0.35 114.58 119.51 2x3v h GLU 279 Ca 0.11 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.21 2x3v h GLU 279 Cb 0.01 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 2x3v h GLU 279 CO -0.02 0.22 -0.16 -0.44 -0.73 0.00 0.00 179.01 177.88 2x3v h ASP 280 N 0.34 0.87 -0.57 1.04 3.45 -1.26 -1.04 116.42 119.26 2x3v h ASP 280 Ca 0.29 -0.39 0.05 0.00 0.43 0.00 0.00 57.03 57.41 2x3v h ASP 280 Cb 0.36 -0.24 -0.05 0.00 -0.56 0.00 0.00 39.33 38.84 2x3v h ASP 280 CO -0.31 1.06 0.29 -0.07 -1.57 0.00 0.00 179.24 178.64 2x3v h LEU 281 N 0.68 0.42 -0.88 1.55 4.07 -0.71 -1.58 115.31 118.85 2x3v h LEU 281 Ca 0.10 0.03 -0.06 0.00 0.08 0.00 0.00 57.88 58.03 2x3v h LEU 281 Cb 0.71 -0.04 -0.03 0.00 1.08 0.00 0.00 40.66 42.38 2x3v h LEU 281 CO 0.05 0.28 0.15 0.03 -1.08 0.00 0.00 178.44 177.87 2x3v h ARG 282 N 0.55 0.98 -0.34 1.13 3.08 -0.63 -1.83 114.38 117.32 2x3v h ARG 282 Ca 0.26 -0.22 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 2x3v h ARG 282 Cb 0.17 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 2x3v h ARG 282 CO -0.18 0.87 0.11 2.35 -1.07 0.00 0.00 179.97 182.05 2x3v h TRP 283 N 0.94 0.55 -0.31 3.04 7.01 -0.87 -1.91 115.95 124.39 2x3v h TRP 283 Ca 0.20 -0.05 -0.05 0.00 2.11 0.00 0.00 58.89 61.09 2x3v h TRP 283 Cb 0.33 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 27.22 2x3v h TRP 283 CO 0.02 0.54 -0.03 0.35 -2.79 0.00 0.00 178.44 176.53 2x3v h PHE 284 N 0.40 0.51 0.17 2.65 3.04 -1.18 -2.03 116.94 120.50 2x3v h PHE 284 Ca 0.11 -0.06 -0.01 0.00 3.98 0.00 0.00 57.97 62.00 2x3v h PHE 284 Cb 0.24 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 38.61 2x3v h PHE 284 CO 0.01 0.53 -0.08 -0.09 -2.02 0.00 0.00 178.31 176.65 2x3v h ARG 285 N 0.47 -0.22 0.00 1.11 2.43 -1.04 0.20 114.38 117.33 2x3v h ARG 285 Ca 0.10 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 2x3v h ARG 285 Cb 0.36 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2x3v h ARG 285 CO 0.01 -0.06 -0.23 0.66 -1.51 0.00 0.00 179.97 178.84 2x3v h SER 286 N -0.34 0.00 0.00 -3.80 4.64 -1.15 -1.14 113.55 111.76 2x3v h SER 286 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2x3v h SER 286 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2x3v h SER 286 CO 0.04 0.23 -1.14 0.35 -0.87 0.00 0.00 176.83 175.44 2x3v n THR 287 N -3.33 0.00 0.00 2.95 -2.24 -0.78 -3.45 114.28 107.42 2x3v n THR 287 Ca 0.01 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 2x3v n THR 287 Cb 0.47 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.21 2x3v n THR 287 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2x3v n SER 288 N -1.65 1.02 0.00 3.42 2.88 0.62 -4.97 113.62 114.94 2x3v n SER 288 Ca -0.01 -0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 2x3v n SER 288 Cb 0.24 0.31 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 2x3v n SER 288 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2x3v n GLY 289 N 0.61 5.45 0.29 0.46 0.00 -0.53 -4.96 105.19 106.52 2x3v n GLY 289 Ca 0.00 -1.87 0.19 0.00 0.00 0.00 0.00 46.02 44.34 2x3v n GLY 289 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2x3v h PRO 290 N 0.00 0.00 0.00 1.61 0.11 -1.89 -1.09 132.00 130.74 2x3v h PRO 290 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2x3v h PRO 290 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2x3v h PRO 290 CO 0.00 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.20 2x3v n GLY 291 N -1.15 -1.37 3.75 -0.55 0.00 -0.65 -4.82 105.19 100.41 2x3v n GLY 291 Ca -0.02 0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 2x3v n GLY 291 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2x3v s MET 292 N -3.27 3.24 0.99 1.61 -1.94 -0.41 -4.72 119.30 114.79 2x3v s MET 292 Ca 0.05 2.19 -0.12 0.00 -1.71 0.00 0.00 55.69 56.10 2x3v s MET 292 Cb 0.10 -2.29 0.18 0.00 2.01 0.00 0.00 34.83 34.83 2x3v s MET 292 CO 0.43 -1.10 1.09 -2.14 -0.01 0.00 0.00 175.02 173.30 2x3v s PRO 293 N -2.86 0.53 -0.16 2.03 0.02 -1.26 -5.05 135.00 128.25 2x3v s PRO 293 Ca 0.70 0.55 -0.11 0.00 0.02 0.00 0.00 61.00 62.16 2x3v s PRO 293 Cb -0.39 -1.75 0.05 0.00 0.02 0.00 0.00 34.50 32.43 2x3v s PRO 293 CO 0.47 -2.67 0.41 1.41 -0.33 0.00 0.00 177.00 176.29 2x3v s MET 294 N -4.96 0.42 -0.76 5.54 1.75 -1.26 -5.09 119.30 114.95 2x3v s MET 294 Ca 0.65 0.71 -0.21 0.00 -1.25 0.00 0.00 55.69 55.59 2x3v s MET 294 Cb -0.18 0.07 0.10 0.00 2.84 0.00 0.00 34.83 37.65 2x3v s MET 294 CO 0.57 -0.12 1.00 -0.80 -0.65 0.00 0.00 175.02 175.03 2x3v s ASN 295 N 0.96 6.34 0.65 1.11 0.01 -1.26 -5.04 114.94 117.71 2x3v s ASN 295 Ca -0.06 -1.43 -0.14 0.00 -0.71 0.00 0.00 52.86 50.52 2x3v s ASN 295 Cb -0.06 -2.40 -0.01 0.00 0.41 0.00 0.00 41.25 39.19 2x3v s ASN 295 CO -0.08 -1.27 1.08 0.26 -1.51 0.00 0.00 177.10 175.58 2x3v s TRP 296 N 3.43 2.87 0.22 2.20 0.52 -1.26 -4.95 118.94 121.96 2x3v s TRP 296 Ca 0.25 1.51 -0.32 0.00 0.02 0.00 0.00 56.10 57.56 2x3v s TRP 296 Cb -0.13 -3.03 -0.13 0.00 -1.15 0.00 0.00 33.47 29.03 2x3v s TRP 296 CO 0.02 -1.36 1.56 -2.30 0.02 0.00 0.00 176.95 174.89 2x3v n PRO 297 N -2.49 2.35 -4.44 4.98 -0.02 -1.26 -5.03 135.00 129.09 2x3v n PRO 297 Ca 0.09 0.84 -0.22 0.00 -2.02 0.00 0.00 63.50 62.19 2x3v n PRO 297 Cb 0.53 -2.59 -0.10 0.00 -0.02 0.00 0.00 33.50 31.32 2x3v n PRO 297 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2x3v s GLN 298 N 0.26 1.68 0.25 -0.52 -2.07 -1.26 -5.13 119.66 112.86 2x3v s GLN 298 Ca 0.72 -1.96 -0.30 0.00 -1.82 0.00 0.00 55.36 52.00 2x3v s GLN 298 Cb -0.60 -0.66 -0.09 0.00 -1.09 0.00 0.00 33.01 30.57 2x3v s GLN 298 CO 0.43 -0.30 1.29 0.12 -1.32 0.00 0.00 175.29 175.51 2x3v s PHE 299 N -3.37 3.23 -0.21 9.60 5.36 -1.26 -5.01 117.98 126.31 2x3v s PHE 299 Ca 0.33 1.33 -0.02 0.00 -0.96 0.00 0.00 56.93 57.61 2x3v s PHE 299 Cb 0.07 -3.59 0.00 0.00 -0.34 0.00 0.00 43.02 39.16 2x3v s PHE 299 CO 0.15 -1.74 -0.09 -1.21 -1.46 0.00 0.00 175.22 170.88 2x3v s GLU 300 N -0.76 3.24 0.97 10.12 0.41 -1.26 -5.11 118.70 126.31 2x3v s GLU 300 Ca 0.53 -0.70 -0.13 0.00 -0.41 0.00 0.00 54.97 54.27 2x3v s GLU 300 Cb -0.37 -2.88 0.17 0.00 -1.78 0.00 0.00 34.13 29.27 2x3v s GLU 300 CO 0.43 -0.21 1.12 -1.21 -0.49 0.00 0.00 175.26 174.90 2x3v s GLU 301 N 1.42 0.67 -0.06 1.61 0.41 -1.26 -5.06 118.70 116.43 2x3v s GLU 301 Ca 0.05 0.35 -0.07 0.00 -0.41 0.00 0.00 54.97 54.89 2x3v s GLU 301 Cb -0.14 -1.78 -0.04 0.00 -1.78 0.00 0.00 34.13 30.39 2x3v s GLU 301 CO -0.06 -2.53 0.21 -0.46 -0.49 0.00 0.00 175.26 171.93 2x3v s TRP 302 N -3.14 3.61 0.05 1.61 -0.00 -1.26 -5.11 118.94 114.70 2x3v s TRP 302 Ca 0.65 0.58 -0.27 0.00 -0.00 0.00 0.00 56.10 57.06 2x3v s TRP 302 Cb -0.16 -1.98 0.08 0.00 -0.00 0.00 0.00 33.47 31.40 2x3v s TRP 302 CO 0.55 0.69 0.68 0.54 -0.00 0.00 0.00 176.95 179.41 2x3v s ASN 303 N -1.31 -0.57 0.00 5.86 2.20 -1.26 -5.37 114.94 114.48 2x3v s ASN 303 Ca 0.21 0.29 0.30 0.00 -0.94 0.00 0.00 52.86 52.71 2x3v s ASN 303 Cb -0.13 0.54 1.40 0.00 -2.00 0.00 0.00 41.25 41.06 2x3v s ASN 303 CO 0.10 -0.77 1.94 -0.81 -2.94 0.00 0.00 177.10 174.62