#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1chk n GLY 2 N 0.00 0.88 0.17 0.00 0.00 -1.26 -4.95 105.19 100.03 1chk n GLY 2 Ca 0.00 -0.42 0.13 0.00 0.00 0.00 0.00 46.02 45.73 1chk n GLY 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1chk h ALA 3 N -1.31 1.00 -0.82 4.61 0.00 -2.02 -3.48 119.26 117.25 1chk h ALA 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1chk h ALA 3 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1chk h ALA 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1chk n GLY 4 N 0.72 3.50 0.25 0.00 0.00 -1.26 -1.07 105.19 107.33 1chk n GLY 4 Ca 0.03 -0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.15 1chk n GLY 4 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1chk h LEU 5 N 0.00 0.00 -0.59 0.99 5.85 -1.92 -2.50 115.31 117.13 1chk h LEU 5 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1chk h LEU 5 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1chk h LEU 5 CO 0.00 0.08 0.00 0.47 -0.34 0.00 0.00 178.44 178.65 1chk n ASP 6 N -3.19 0.34 -4.72 1.25 8.00 -0.23 -2.47 116.55 115.53 1chk n ASP 6 Ca 0.01 0.62 -0.42 0.00 0.71 0.00 0.00 54.79 55.71 1chk n ASP 6 Cb 0.39 -0.68 -0.03 0.00 -0.02 0.00 0.00 41.12 40.78 1chk n ASP 6 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1chk s ASP 7 N -3.63 6.39 0.30 -2.24 2.15 -0.94 -4.80 116.67 113.90 1chk s ASP 7 Ca 0.02 2.85 0.02 0.00 0.43 0.00 0.00 52.55 55.87 1chk s ASP 7 Cb 0.06 -2.60 0.73 0.00 -0.30 0.00 0.00 42.92 40.82 1chk s ASP 7 CO 0.22 -0.97 1.60 -0.65 -0.17 0.00 0.00 175.17 175.21 1chk h PRO 8 N 6.84 0.08 -0.01 4.34 0.11 -1.92 0.16 132.00 141.62 1chk h PRO 8 Ca -0.43 -0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.48 1chk h PRO 8 Cb 1.20 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1chk h PRO 8 CO 0.96 0.05 -0.84 1.25 -0.21 0.00 0.00 178.00 179.21 1chk h HIS 9 N 0.09 0.29 0.02 0.65 -0.00 -1.93 -2.48 115.15 111.79 1chk h HIS 9 Ca 0.57 -0.15 -0.23 0.00 -0.00 0.00 0.00 60.37 60.56 1chk h HIS 9 Cb 1.19 -0.04 -0.03 0.00 -0.00 0.00 0.00 27.41 28.54 1chk h HIS 9 CO -0.38 0.95 -1.10 -0.22 -0.00 0.00 0.00 177.93 177.17 1chk h LYS 10 N 0.12 0.05 -0.73 5.26 3.64 -1.62 -2.70 116.57 120.58 1chk h LYS 10 Ca -0.04 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.22 1chk h LYS 10 Cb 1.45 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.27 1chk h LYS 10 CO 0.13 1.00 0.29 -0.22 -2.27 0.00 0.00 179.45 178.38 1chk h LYS 11 N 0.01 1.07 -0.45 1.90 3.64 -0.38 -1.08 116.57 121.28 1chk h LYS 11 Ca -0.05 -0.18 -0.14 0.00 -1.27 0.00 0.00 60.65 59.00 1chk h LYS 11 Cb 1.82 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 33.45 1chk h LYS 11 CO 0.14 0.86 -0.27 1.49 -2.27 0.00 0.00 179.45 179.41 1chk h GLU 12 N 1.05 0.98 -0.28 1.90 4.57 -1.39 -1.73 114.58 119.68 1chk h GLU 12 Ca 0.24 -0.44 0.03 0.00 -1.18 0.00 0.00 59.36 58.01 1chk h GLU 12 Cb 0.19 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.73 1chk h GLU 12 CO -0.02 1.11 0.08 0.82 -1.18 0.00 0.00 179.01 179.82 1chk h ILE 13 N 0.83 0.90 -0.79 2.32 2.04 -1.13 -0.95 117.51 120.73 1chk h ILE 13 Ca 0.10 -0.07 0.13 0.00 1.00 0.00 0.00 64.86 66.02 1chk h ILE 13 Cb 0.85 0.69 -0.09 0.00 -0.74 0.00 0.00 36.82 37.54 1chk h ILE 13 CO 0.08 0.03 0.39 0.00 0.00 0.00 0.00 178.15 178.65 1chk h ALA 14 N 1.19 1.15 -0.19 1.87 0.00 -1.10 0.34 119.26 122.51 1chk h ALA 14 Ca 0.12 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 1chk h ALA 14 Cb 0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1chk h ALA 14 CO -0.15 -0.09 -0.29 0.52 0.00 0.00 0.00 179.25 179.25 1chk h MET 15 N 0.59 0.38 -0.17 0.00 2.86 -0.33 -1.65 114.93 116.61 1chk h MET 15 Ca 0.42 -0.15 -0.13 0.00 -2.06 0.00 0.00 59.70 57.78 1chk h MET 15 Cb 0.55 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.19 1chk h MET 15 CO -0.34 0.64 -0.40 0.93 1.06 0.00 0.00 176.91 178.80 1chk h GLU 16 N 0.33 0.58 -0.48 1.72 5.08 -0.36 -2.69 114.58 118.76 1chk h GLU 16 Ca 0.05 -0.39 0.07 0.00 -1.00 0.00 0.00 59.36 58.09 1chk h GLU 16 Cb 0.68 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.93 1chk h GLU 16 CO 0.05 1.01 0.13 -0.07 -1.00 0.00 0.00 179.01 179.13 1chk h LEU 17 N 0.24 0.08 -0.40 1.33 -0.00 -0.71 0.17 115.31 116.02 1chk h LEU 17 Ca -0.00 0.07 -0.01 0.00 -0.00 0.00 0.00 57.88 57.94 1chk h LEU 17 Cb 1.01 0.08 -0.02 0.00 -0.00 0.00 0.00 40.66 41.73 1chk h LEU 17 CO 0.09 0.07 0.19 0.58 -0.00 0.00 0.00 178.44 179.38 1chk h VAL 18 N 0.28 1.17 -0.37 1.22 2.07 -1.36 -2.88 116.25 116.38 1chk h VAL 18 Ca 0.23 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 1chk h VAL 18 Cb 0.28 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1chk h VAL 18 CO -0.28 0.18 0.11 -1.28 0.02 0.00 0.00 177.57 176.33 1chk h SER 19 N 0.51 0.49 0.09 0.57 0.87 -1.03 0.72 113.55 115.77 1chk h SER 19 Ca 0.14 -0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 1chk h SER 19 Cb 0.11 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 61.95 1chk h SER 19 CO -0.02 0.48 -0.05 0.77 -0.53 0.00 0.00 176.83 177.49 1chk h SER 20 N 0.53 0.00 0.12 6.23 4.64 -0.45 0.27 113.55 124.89 1chk h SER 20 Ca 0.13 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.08 1chk h SER 20 Cb 0.18 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.22 1chk h SER 20 CO -0.01 0.05 -2.14 0.00 -0.87 0.00 0.00 176.83 173.85 1chk n ALA 21 N -2.38 1.19 -0.04 5.18 0.00 -0.34 -2.45 120.51 121.66 1chk n ALA 21 Ca -0.03 -0.84 -0.15 0.00 0.00 0.00 0.00 53.44 52.43 1chk n ALA 21 Cb 0.13 -0.48 -0.08 0.00 0.00 0.00 0.00 19.45 19.02 1chk n ALA 21 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1chk h GLU 22 N 0.03 0.49 0.00 0.00 3.07 -0.76 -3.39 114.58 114.02 1chk h GLU 22 Ca -0.47 -0.35 0.00 0.00 -0.50 0.00 0.00 59.36 58.04 1chk h GLU 22 Cb 2.01 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 29.98 1chk h GLU 22 CO 0.03 0.97 0.00 0.09 -1.40 0.00 0.00 179.01 178.70 1chk n ASN 23 N -4.32 1.19 -3.23 1.42 4.13 0.91 -4.99 115.26 110.36 1chk n ASN 23 Ca -0.07 -1.50 -0.22 0.00 1.68 0.00 0.00 54.58 54.47 1chk n ASN 23 Cb 0.52 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.77 1chk n ASN 23 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1chk n SER 24 N -0.25 -4.14 -3.71 6.41 7.64 -1.03 -4.95 113.62 113.59 1chk n SER 24 Ca 0.00 -0.33 -0.14 0.00 1.01 0.00 0.00 58.87 59.41 1chk n SER 24 Cb 0.26 -3.41 -0.09 0.00 -1.01 0.00 0.00 64.21 59.96 1chk n SER 24 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1chk s SER 25 N -2.67 -0.33 0.00 6.43 0.15 -1.21 -4.96 113.70 111.10 1chk s SER 25 Ca 0.35 0.39 0.29 0.00 0.70 0.00 0.00 55.95 57.68 1chk s SER 25 Cb -0.18 0.50 1.19 0.00 -1.71 0.00 0.00 66.02 65.81 1chk s SER 25 CO 0.43 -0.39 1.89 0.18 1.20 0.00 0.00 173.24 176.55 1chk n LEU 26 N 1.63 0.04 -3.73 3.45 4.32 -1.26 -2.86 117.00 118.59 1chk n LEU 26 Ca -0.19 0.45 -0.42 0.00 -0.02 0.00 0.00 56.01 55.83 1chk n LEU 26 Cb 0.56 -0.47 -0.02 0.00 -1.62 0.00 0.00 43.42 41.87 1chk n LEU 26 CO 0.20 0.01 2.43 -0.67 -1.22 0.00 0.00 177.39 178.13 1chk n ASP 27 N -1.49 3.37 0.13 -1.43 2.03 -1.26 -4.58 116.55 113.32 1chk n ASP 27 Ca 0.07 -2.78 0.04 0.00 0.52 0.00 0.00 54.79 52.64 1chk n ASP 27 Cb 0.34 -1.45 0.44 0.00 -0.72 0.00 0.00 41.12 39.73 1chk n ASP 27 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 1chk h TRP 28 N 6.84 0.22 0.00 -0.67 5.08 -1.86 -2.46 115.95 123.10 1chk h TRP 28 Ca 0.50 -0.02 0.00 0.00 1.08 0.00 0.00 58.89 60.46 1chk h TRP 28 Cb 0.66 -0.07 0.00 0.00 -3.00 0.00 0.00 29.16 26.76 1chk h TRP 28 CO 1.37 0.29 0.00 1.63 -1.28 0.00 0.00 178.44 180.45 1chk n LYS 29 N -4.35 0.10 0.00 0.12 5.02 -1.26 -2.14 118.16 115.65 1chk n LYS 29 Ca -0.01 0.30 0.04 0.00 -2.02 0.00 0.00 58.31 56.63 1chk n LYS 29 Cb 0.21 -1.67 0.22 0.00 -0.02 0.00 0.00 35.03 33.77 1chk n LYS 29 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1chk n ALA 30 N -1.63 1.59 0.71 7.82 0.00 -0.93 -2.94 120.51 125.13 1chk n ALA 30 Ca 0.03 -0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.51 1chk n ALA 30 Cb 0.22 -1.14 0.05 0.00 0.00 0.00 0.00 19.45 18.59 1chk n ALA 30 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1chk n GLN 31 N -1.27 1.42 -0.20 0.00 1.13 -0.91 -4.25 117.38 113.31 1chk n GLN 31 Ca 0.04 -1.36 0.17 0.00 -1.94 0.00 0.00 57.00 53.92 1chk n GLN 31 Cb 0.07 -1.31 0.51 0.00 0.11 0.00 0.00 30.24 29.61 1chk n GLN 31 CO 0.00 0.00 0.00 1.88 -1.44 0.00 0.00 177.06 177.50 1chk h TYR 32 N 2.99 0.51 -0.39 1.08 0.05 -1.75 -2.27 116.97 117.18 1chk h TYR 32 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1chk h TYR 32 Cb 0.67 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.25 1chk h TYR 32 CO 0.00 0.17 0.00 0.36 -1.05 0.00 0.00 178.16 177.64 1chk n LYS 33 N -4.49 2.18 -2.77 4.88 2.85 -1.26 -4.21 118.16 115.35 1chk n LYS 33 Ca 0.16 -1.80 -0.39 0.00 -1.05 0.00 0.00 58.31 55.23 1chk n LYS 33 Cb 0.60 -1.44 -0.06 0.00 -0.65 0.00 0.00 35.03 33.48 1chk n LYS 33 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 177.40 176.88 1chk s TYR 34 N -1.49 3.88 -0.29 5.58 5.04 -0.85 -4.62 117.35 124.60 1chk s TYR 34 Ca 0.36 1.86 -0.16 0.00 -2.44 0.00 0.00 57.07 56.69 1chk s TYR 34 Cb 0.19 -2.95 0.15 0.00 0.35 0.00 0.00 41.96 39.70 1chk s TYR 34 CO 0.27 0.37 0.98 -1.50 -1.34 0.00 0.00 175.55 174.33 1chk s ILE 35 N -1.33 -0.06 -0.05 3.14 2.07 -1.26 -1.05 121.20 122.67 1chk s ILE 35 Ca 0.44 0.00 -0.29 0.00 -1.41 0.00 0.00 60.65 59.39 1chk s ILE 35 Cb -0.23 -1.00 0.10 0.00 0.13 0.00 0.00 42.46 41.46 1chk s ILE 35 CO 0.29 0.00 0.87 -1.83 -1.91 0.00 0.00 174.94 172.36 1chk s GLU 36 N 1.46 0.82 -0.35 3.50 -1.05 -0.33 -4.98 118.70 117.78 1chk s GLU 36 Ca -0.08 -0.09 -0.18 0.00 -0.15 0.00 0.00 54.97 54.47 1chk s GLU 36 Cb -0.04 0.38 -0.00 0.00 -0.44 0.00 0.00 34.13 34.03 1chk s GLU 36 CO -0.15 -0.32 0.52 0.34 0.95 0.00 0.00 175.26 176.60 1chk s ASP 37 N -1.87 6.32 0.00 0.83 -1.08 -1.26 -0.91 116.67 118.71 1chk s ASP 37 Ca 0.00 -0.02 0.30 0.00 -0.52 0.00 0.00 52.55 52.31 1chk s ASP 37 Cb -0.01 -2.27 1.41 0.00 -1.46 0.00 0.00 42.92 40.60 1chk s ASP 37 CO -0.03 -0.49 1.96 -0.38 0.52 0.00 0.00 175.17 176.76 1chk n ILE 38 N 5.43 0.00 -0.12 4.11 5.41 -1.26 -4.93 119.36 128.00 1chk n ILE 38 Ca -0.05 -0.06 0.00 0.00 1.00 0.00 0.00 62.75 63.64 1chk n ILE 38 Cb 0.49 -0.17 0.00 0.00 -0.71 0.00 0.00 39.64 39.25 1chk n ILE 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1chk n GLY 39 N 1.20 1.16 0.11 7.39 0.00 -1.26 -4.94 105.19 108.84 1chk n GLY 39 Ca 0.17 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.20 1chk n GLY 39 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1chk n ASP 40 N 0.00 0.33 0.00 1.61 5.75 -1.26 -4.87 116.55 118.11 1chk n ASP 40 Ca 0.00 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.78 1chk n ASP 40 Cb 0.00 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.05 1chk n ASP 40 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1chk n GLY 41 N 0.59 1.52 0.06 6.12 0.00 -1.26 -4.88 105.19 107.33 1chk n GLY 41 Ca 0.02 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.19 1chk n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1chk n ARG 42 N -2.00 0.58 0.00 1.61 1.74 -1.26 -4.16 116.66 113.17 1chk n ARG 42 Ca 0.00 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 1chk n ARG 42 Cb 0.00 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 1chk n ARG 42 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1chk n GLY 43 N 1.27 0.05 3.67 -0.13 0.00 -1.26 -0.44 105.19 108.34 1chk n GLY 43 Ca 0.15 -1.01 -0.43 0.00 0.00 0.00 0.00 46.02 44.73 1chk n GLY 43 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1chk s TYR 44 N 0.00 3.05 -0.19 1.61 2.02 -1.26 -4.11 117.35 118.47 1chk s TYR 44 Ca 0.00 1.17 -0.05 0.00 -0.37 0.00 0.00 57.07 57.82 1chk s TYR 44 Cb 0.00 -3.43 -0.03 0.00 -0.40 0.00 0.00 41.96 38.10 1chk s TYR 44 CO 0.00 -1.33 0.00 0.99 -1.57 0.00 0.00 175.55 173.65 1chk s THR 45 N 3.02 4.10 0.36 -0.71 2.01 -0.08 -0.49 115.64 123.84 1chk s THR 45 Ca 0.53 -0.27 -0.07 0.00 0.31 0.00 0.00 61.69 62.19 1chk s THR 45 Cb -0.21 -2.84 0.02 0.00 0.01 0.00 0.00 72.50 69.48 1chk s THR 45 CO 0.15 0.45 0.60 -0.83 -0.69 0.00 0.00 174.62 174.30 1chk s GLY 46 N 0.74 1.08 0.00 4.40 0.00 0.18 -1.18 107.32 112.54 1chk s GLY 46 Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.48 1chk s GLY 46 CO 0.02 -0.74 0.00 0.61 0.00 0.00 0.00 173.10 172.99 1chk n GLY 47 N -0.56 -2.22 0.19 0.20 0.00 -0.21 -0.26 105.19 102.34 1chk n GLY 47 Ca -0.03 -1.54 0.06 0.00 0.00 0.00 0.00 46.02 44.52 1chk n GLY 47 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1chk h ILE 48 N 0.00 0.85 -0.54 -0.61 3.07 -1.84 -3.21 117.51 115.23 1chk h ILE 48 Ca 0.00 -1.47 -0.39 0.00 1.55 0.00 0.00 64.86 64.54 1chk h ILE 48 Cb 0.00 1.91 -0.35 0.00 -0.27 0.00 0.00 36.82 38.11 1chk h ILE 48 CO 0.00 0.35 -0.82 2.30 -1.05 0.00 0.00 178.15 178.93 1chk n ILE 49 N -3.53 2.18 -3.25 0.16 -6.64 -1.26 -5.01 119.36 102.01 1chk n ILE 49 Ca -0.00 -3.72 -0.15 0.00 -1.77 0.00 0.00 62.75 57.11 1chk n ILE 49 Cb 0.50 -0.52 0.08 0.00 -1.44 0.00 0.00 39.64 38.26 1chk n ILE 49 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1chk n GLY 50 N -0.71 -0.36 3.76 3.28 0.00 -1.21 -5.00 105.19 104.94 1chk n GLY 50 Ca 0.32 0.09 -0.37 0.00 0.00 0.00 0.00 46.02 46.07 1chk n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1chk s PHE 51 N -3.32 2.46 0.04 1.61 0.40 0.65 -4.61 117.98 115.20 1chk s PHE 51 Ca 0.05 1.49 0.05 0.00 -0.60 0.00 0.00 56.93 57.92 1chk s PHE 51 Cb -0.01 -3.53 -0.02 0.00 0.51 0.00 0.00 43.02 39.97 1chk s PHE 51 CO 0.65 -2.23 -0.13 0.00 0.70 0.00 0.00 175.22 174.21 1chk h SER 53 N 4.89 0.00 -0.07 0.00 4.64 -0.85 -3.06 113.55 119.09 1chk h SER 53 Ca -0.38 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.73 1chk h SER 53 Cb 1.18 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1chk h SER 53 CO 0.44 0.33 -0.78 1.23 -0.87 0.00 0.00 176.83 177.18 1chk h GLY 54 N 1.17 0.72 2.00 -0.77 0.00 -0.89 -3.36 103.07 101.93 1chk h GLY 54 Ca -0.00 -1.13 -0.03 0.00 0.00 0.00 0.00 47.33 46.17 1chk h GLY 54 CO 0.04 1.00 -0.13 -0.84 0.00 0.00 0.00 176.54 176.61 1chk h THR 55 N 0.30 0.52 0.00 4.70 2.02 -1.75 0.23 112.91 118.94 1chk h THR 55 Ca -0.08 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.49 1chk h THR 55 Cb 1.43 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 69.25 1chk h THR 55 CO 0.16 0.13 0.00 0.61 0.37 0.00 0.00 175.52 176.78 1chk n GLY 56 N -0.53 3.48 0.10 2.16 0.00 -1.25 -4.92 105.19 104.24 1chk n GLY 56 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 1chk n GLY 56 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1chk h ASP 57 N 0.00 0.26 -0.95 1.61 2.03 -1.91 -2.62 116.42 114.85 1chk h ASP 57 Ca 0.00 -0.38 0.00 0.00 -0.73 0.00 0.00 57.03 55.93 1chk h ASP 57 Cb 0.00 -0.09 -0.05 0.00 -0.83 0.00 0.00 39.33 38.37 1chk h ASP 57 CO 0.00 1.31 0.61 -0.03 -1.03 0.00 0.00 179.24 180.11 1chk h MET 58 N 0.05 1.26 -0.54 4.15 4.05 -1.85 0.26 114.93 122.30 1chk h MET 58 Ca -0.22 -0.09 -0.05 0.00 -0.28 0.00 0.00 59.70 59.07 1chk h MET 58 Cb 1.98 -0.28 -0.02 0.00 -0.80 0.00 0.00 31.60 32.47 1chk h MET 58 CO 0.14 0.85 0.16 1.25 0.23 0.00 0.00 176.91 179.54 1chk h LEU 59 N 1.29 0.80 -0.79 3.39 5.85 -1.80 -1.05 115.31 122.99 1chk h LEU 59 Ca 0.35 -0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 1chk h LEU 59 Cb -0.12 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.67 1chk h LEU 59 CO -0.07 0.80 0.25 -0.33 -0.34 0.00 0.00 178.44 178.75 1chk h GLU 60 N 0.75 1.15 0.22 1.25 5.08 -1.07 -1.47 114.58 120.50 1chk h GLU 60 Ca 0.17 -0.23 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1chk h GLU 60 Cb 0.29 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1chk h GLU 60 CO -0.00 0.97 -0.35 1.25 -1.00 0.00 0.00 179.01 179.87 1chk h LEU 61 N 1.11 -0.99 0.00 1.33 5.85 -0.65 -0.31 115.31 121.65 1chk h LEU 61 Ca 0.25 0.10 0.00 0.00 0.84 0.00 0.00 57.88 59.07 1chk h LEU 61 Cb 0.28 0.36 0.00 0.00 0.37 0.00 0.00 40.66 41.67 1chk h LEU 61 CO -0.01 -0.46 -0.18 1.33 -0.34 0.00 0.00 178.44 178.78 1chk n VAL 62 N -5.45 0.38 -0.10 1.05 0.24 -0.43 -1.12 118.33 112.92 1chk n VAL 62 Ca -0.08 -0.21 -0.06 0.00 -2.04 0.00 0.00 64.34 61.95 1chk n VAL 62 Cb 0.35 -0.40 0.12 0.00 -1.47 0.00 0.00 33.84 32.44 1chk n VAL 62 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1chk h GLN 63 N 0.00 0.79 0.16 7.34 4.20 -0.98 0.13 115.11 126.75 1chk h GLN 63 Ca 0.00 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.43 1chk h GLN 63 Cb 0.68 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.40 1chk h GLN 63 CO 0.00 0.88 -0.08 1.25 -0.67 0.00 0.00 178.83 180.21 1chk h HIS 64 N 0.71 -0.20 -0.74 2.96 2.76 0.40 -1.03 115.15 120.01 1chk h HIS 64 Ca 0.12 -0.00 0.12 0.00 -2.20 0.00 0.00 60.37 58.40 1chk h HIS 64 Cb 0.61 0.07 -0.08 0.00 1.55 0.00 0.00 27.41 29.56 1chk h HIS 64 CO 0.03 0.06 0.34 -0.92 -1.30 0.00 0.00 177.93 176.14 1chk h TYR 65 N -0.44 0.60 -0.06 5.26 3.20 -0.98 -0.78 116.97 123.77 1chk h TYR 65 Ca -0.02 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.78 1chk h TYR 65 Cb 0.34 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 1chk h TYR 65 CO 0.00 0.16 -0.43 1.15 -1.64 0.00 0.00 178.16 177.41 1chk h THR 66 N 0.54 1.32 -0.06 1.81 2.02 -0.50 0.75 112.91 118.79 1chk h THR 66 Ca 0.38 -1.53 -0.10 0.00 0.77 0.00 0.00 66.41 65.94 1chk h THR 66 Cb 0.49 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 68.64 1chk h THR 66 CO -0.33 0.45 -0.41 0.44 0.37 0.00 0.00 175.52 176.04 1chk h ASP 67 N 0.11 0.14 0.25 4.18 3.32 0.19 -2.84 116.42 121.76 1chk h ASP 67 Ca 0.01 -0.06 -0.33 0.00 0.02 0.00 0.00 57.03 56.67 1chk h ASP 67 Cb 0.81 -0.04 0.04 0.00 0.22 0.00 0.00 39.33 40.36 1chk h ASP 67 CO 0.06 0.54 -1.44 -0.07 -1.72 0.00 0.00 179.24 176.61 1chk h LEU 68 N 0.11 0.85 -6.55 1.55 4.07 -0.70 -3.42 115.31 111.23 1chk h LEU 68 Ca 0.01 -0.89 -0.58 0.00 0.08 0.00 0.00 57.88 56.50 1chk h LEU 68 Cb 0.78 -0.28 -0.39 0.00 1.08 0.00 0.00 40.66 41.85 1chk h LEU 68 CO 0.06 1.69 -0.87 -0.70 -1.08 0.00 0.00 178.44 177.54 1chk s GLU 69 N -2.67 0.64 0.16 1.13 2.12 0.20 -5.06 118.70 115.22 1chk s GLU 69 Ca -0.09 -1.51 -0.16 0.00 0.36 0.00 0.00 54.97 53.57 1chk s GLU 69 Cb 0.04 -1.35 0.09 0.00 0.26 0.00 0.00 34.13 33.17 1chk s GLU 69 CO 0.95 -1.25 1.70 -1.35 -0.54 0.00 0.00 175.26 174.76 1chk h PRO 70 N 6.72 0.08 -1.35 4.30 0.11 -1.74 -2.09 132.00 138.04 1chk h PRO 70 Ca 0.10 -0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.99 1chk h PRO 70 Cb 0.96 -0.02 -0.11 0.00 0.11 0.00 0.00 31.00 31.94 1chk h PRO 70 CO 0.29 0.05 0.28 0.41 -0.21 0.00 0.00 178.00 178.82 1chk n GLY 71 N -1.27 3.35 3.76 -0.55 0.00 -1.26 -4.86 105.19 104.36 1chk n GLY 71 Ca 0.02 -0.63 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 1chk n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1chk s ASN 72 N 0.42 4.25 0.00 1.61 2.20 -0.79 -4.92 114.94 117.71 1chk s ASN 72 Ca 0.22 1.56 0.15 0.00 -0.94 0.00 0.00 52.86 53.85 1chk s ASN 72 Cb 0.18 -2.28 0.89 0.00 -2.00 0.00 0.00 41.25 38.04 1chk s ASN 72 CO 0.02 -2.16 1.51 2.30 -2.94 0.00 0.00 177.10 175.82 1chk n ILE 73 N -3.58 0.00 0.59 0.54 -5.35 -1.26 -3.12 119.36 107.18 1chk n ILE 73 Ca 0.08 0.00 0.08 0.00 -0.27 0.00 0.00 62.75 62.64 1chk n ILE 73 Cb 0.55 -0.30 -0.10 0.00 -1.74 0.00 0.00 39.64 38.04 1chk n ILE 73 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1chk n LEU 74 N -0.76 0.59 0.23 7.28 4.77 -1.26 -4.60 117.00 123.26 1chk n LEU 74 Ca 0.11 -0.38 0.09 0.00 -0.03 0.00 0.00 56.01 55.81 1chk n LEU 74 Cb 0.05 0.00 0.57 0.00 -2.33 0.00 0.00 43.42 41.71 1chk n LEU 74 CO 0.08 0.15 0.87 0.00 -1.33 0.00 0.00 177.39 177.16 1chk h ALA 75 N 2.16 1.23 -0.33 -1.18 0.00 -1.88 -1.49 119.26 117.78 1chk h ALA 75 Ca 0.00 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.80 1chk h ALA 75 Cb 0.49 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1chk h ALA 75 CO 0.00 0.26 0.23 1.57 0.00 0.00 0.00 179.25 181.31 1chk h LYS 76 N 0.00 0.08 -0.01 0.00 2.10 -1.82 -0.95 116.57 115.96 1chk h LYS 76 Ca -0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1chk h LYS 76 Cb 0.53 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.84 1chk h LYS 76 CO 0.03 0.06 0.00 0.66 -2.00 0.00 0.00 179.45 178.19 1chk n TYR 77 N -4.46 0.02 -0.29 0.07 4.01 -0.56 -4.21 117.16 111.75 1chk n TYR 77 Ca 0.04 -0.01 -0.05 0.00 -0.16 0.00 0.00 57.90 57.72 1chk n TYR 77 Cb 0.34 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.44 1chk n TYR 77 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1chk h LEU 78 N 0.21 0.97 -0.90 7.72 -0.00 -1.30 -0.37 115.31 121.64 1chk h LEU 78 Ca 0.00 -0.10 0.06 0.00 -0.00 0.00 0.00 57.88 57.84 1chk h LEU 78 Cb 0.05 -0.25 -0.06 0.00 -0.00 0.00 0.00 40.66 40.40 1chk h LEU 78 CO 0.00 0.79 0.57 -0.65 -0.00 0.00 0.00 178.44 179.15 1chk h PRO 79 N 1.08 1.02 -0.15 1.13 0.11 -1.84 -0.88 132.00 132.47 1chk h PRO 79 Ca 0.27 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.28 1chk h PRO 79 Cb 0.03 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 30.91 1chk h PRO 79 CO -0.04 0.68 -0.07 0.00 -0.21 0.00 0.00 178.00 178.35 1chk h ALA 80 N 1.41 0.21 -0.90 -0.75 0.00 -1.71 0.14 119.26 117.66 1chk h ALA 80 Ca 0.39 -0.27 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1chk h ALA 80 Cb 0.14 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 1chk h ALA 80 CO -0.16 0.01 0.55 -0.07 0.00 0.00 0.00 179.25 179.58 1chk h LEU 81 N -0.02 0.84 -0.37 0.00 4.07 -0.78 -1.47 115.31 117.58 1chk h LEU 81 Ca 0.03 0.03 -0.05 0.00 0.08 0.00 0.00 57.88 57.97 1chk h LEU 81 Cb 0.54 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.13 1chk h LEU 81 CO 0.02 0.51 0.03 0.11 -1.08 0.00 0.00 178.44 178.03 1chk h LYS 82 N 0.96 0.62 -0.10 1.13 1.57 -0.73 -2.77 116.57 117.25 1chk h LYS 82 Ca 0.41 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1chk h LYS 82 Cb 0.28 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.52 1chk h LYS 82 CO -0.21 0.71 0.05 -0.22 -0.57 0.00 0.00 179.45 179.21 1chk h LYS 83 N 0.45 0.13 0.00 3.15 3.64 -0.62 -3.14 116.57 120.19 1chk h LYS 83 Ca 0.11 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1chk h LYS 83 Cb 0.41 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1chk h LYS 83 CO 0.01 0.17 0.00 0.28 -2.27 0.00 0.00 179.45 177.64 1chk h VAL 84 N 0.07 0.00 -2.88 2.00 2.07 -1.26 -3.46 116.25 112.79 1chk h VAL 84 Ca 0.03 -0.22 -0.53 0.00 0.82 0.00 0.00 66.70 66.80 1chk h VAL 84 Cb 0.07 0.95 0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1chk h VAL 84 CO -0.01 0.00 0.83 0.21 0.02 0.00 0.00 177.57 178.63 1chk s ASN 85 N -4.43 6.68 0.00 0.57 3.04 -1.05 -0.71 114.94 119.04 1chk s ASN 85 Ca 0.02 2.49 0.00 0.00 0.04 0.00 0.00 52.86 55.41 1chk s ASN 85 Cb 0.09 -2.59 0.00 0.00 -1.54 0.00 0.00 41.25 37.21 1chk s ASN 85 CO 0.38 -0.77 0.00 0.61 -3.04 0.00 0.00 177.10 174.28 1chk n GLY 86 N 3.68 0.75 3.33 1.21 0.00 0.81 -5.02 105.19 109.95 1chk n GLY 86 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 1chk n GLY 86 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1chk s SER 87 N -2.49 0.21 -0.13 1.61 1.04 0.11 -5.04 113.70 109.02 1chk s SER 87 Ca 0.00 -1.29 0.12 0.00 0.48 0.00 0.00 55.95 55.26 1chk s SER 87 Cb 0.00 0.46 0.57 0.00 0.10 0.00 0.00 66.02 67.15 1chk s SER 87 CO 0.00 -0.96 1.41 0.00 0.98 0.00 0.00 173.24 174.67 1chk n ALA 88 N -0.34 3.22 -1.65 5.32 0.00 -1.26 -4.02 120.51 121.79 1chk n ALA 88 Ca 0.01 -1.28 -0.41 0.00 0.00 0.00 0.00 53.44 51.76 1chk n ALA 88 Cb 0.64 -1.06 0.02 0.00 0.00 0.00 0.00 19.45 19.05 1chk n ALA 88 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1chk n SER 89 N 0.63 1.72 -1.08 0.00 2.88 -1.26 -4.59 113.62 111.93 1chk n SER 89 Ca 0.20 1.04 0.10 0.00 -1.33 0.00 0.00 58.87 58.88 1chk n SER 89 Cb 0.81 -1.41 0.24 0.00 -0.75 0.00 0.00 64.21 63.10 1chk n SER 89 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1chk n HIS 90 N -0.50 0.68 -1.53 0.66 -0.00 -1.26 -4.91 115.22 108.36 1chk n HIS 90 Ca 0.09 -0.41 -0.50 0.00 -0.00 0.00 0.00 57.72 56.89 1chk n HIS 90 Cb 0.40 -0.01 -0.06 0.00 -0.00 0.00 0.00 29.99 30.32 1chk n HIS 90 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1chk n SER 91 N 1.27 2.50 0.00 0.41 2.88 -1.26 -0.59 113.62 118.83 1chk n SER 91 Ca 0.19 0.57 0.00 0.00 -1.33 0.00 0.00 58.87 58.30 1chk n SER 91 Cb 0.55 -1.29 0.00 0.00 -0.75 0.00 0.00 64.21 62.72 1chk n SER 91 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1chk n GLY 92 N 5.83 0.50 0.00 0.46 0.00 -1.26 -4.84 105.19 105.88 1chk n GLY 92 Ca 0.35 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1chk n GLY 92 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1chk n LEU 93 N 0.00 0.00 0.00 0.99 4.32 0.25 -4.86 117.00 117.69 1chk n LEU 93 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1chk n LEU 93 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1chk n LEU 93 CO 0.00 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.78 1chk n GLY 94 N 2.03 2.21 0.28 -0.72 0.00 -1.16 -3.54 105.19 104.30 1chk n GLY 94 Ca 0.00 -0.46 -0.06 0.00 0.00 0.00 0.00 46.02 45.50 1chk n GLY 94 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1chk h THR 95 N 0.00 1.22 -0.67 2.61 1.35 -1.99 -2.25 112.91 113.17 1chk h THR 95 Ca 0.00 -0.57 0.05 0.00 -0.55 0.00 0.00 66.41 65.34 1chk h THR 95 Cb 0.00 0.34 -0.05 0.00 -1.73 0.00 0.00 68.15 66.71 1chk h THR 95 CO 0.00 0.25 0.39 -0.65 -0.25 0.00 0.00 175.52 175.25 1chk h PRO 96 N 0.94 0.71 -0.26 4.72 0.11 -1.99 -1.83 132.00 134.40 1chk h PRO 96 Ca 0.24 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 66.35 1chk h PRO 96 Cb 0.07 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 30.97 1chk h PRO 96 CO -0.04 0.47 -0.03 0.35 -0.21 0.00 0.00 178.00 178.54 1chk h PHE 97 N 0.73 -0.08 0.00 0.65 3.57 -1.52 0.14 116.94 120.43 1chk h PHE 97 Ca 0.29 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.75 1chk h PHE 97 Cb 0.14 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1chk h PHE 97 CO -0.07 -0.08 -0.33 1.15 -2.23 0.00 0.00 178.31 176.75 1chk h THR 98 N 0.04 0.93 0.01 4.41 2.02 -1.19 0.25 112.91 119.38 1chk h THR 98 Ca 0.12 -1.29 -0.20 0.00 0.77 0.00 0.00 66.41 65.81 1chk h THR 98 Cb 0.18 1.77 0.02 0.00 -1.74 0.00 0.00 68.15 68.37 1chk h THR 98 CO -0.24 0.33 -0.79 0.11 0.37 0.00 0.00 175.52 175.29 1chk h LYS 99 N 0.00 0.52 -0.88 6.66 1.57 -0.79 -3.16 116.57 120.48 1chk h LYS 99 Ca -0.00 -0.57 -0.03 0.00 -1.87 0.00 0.00 60.65 58.18 1chk h LYS 99 Cb 0.74 0.17 -0.04 0.00 0.08 0.00 0.00 32.23 33.18 1chk h LYS 99 CO 0.04 1.20 0.45 -0.44 -0.57 0.00 0.00 179.45 180.14 1chk h ASP 100 N 0.08 1.13 -0.02 0.86 5.19 -0.36 -1.73 116.42 121.55 1chk h ASP 100 Ca -0.10 -0.12 0.00 0.00 -0.62 0.00 0.00 57.03 56.19 1chk h ASP 100 Cb 1.49 -0.29 -0.00 0.00 0.18 0.00 0.00 39.33 40.71 1chk h ASP 100 CO 0.16 0.92 0.02 -0.25 -3.12 0.00 0.00 179.24 176.97 1chk h TRP 101 N 1.24 0.03 0.00 4.55 2.91 -0.61 -0.02 115.95 124.04 1chk h TRP 101 Ca 0.31 0.00 -0.07 0.00 1.13 0.00 0.00 58.89 60.26 1chk h TRP 101 Cb 0.08 -0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 28.71 1chk h TRP 101 CO 0.01 0.04 -0.32 0.00 -1.03 0.00 0.00 178.44 177.14 1chk h ALA 102 N 0.99 1.31 -0.18 2.65 0.00 -1.45 -1.34 119.26 121.23 1chk h ALA 102 Ca 0.01 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.48 1chk h ALA 102 Cb 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1chk h ALA 102 CO -0.00 0.40 -0.46 1.15 0.00 0.00 0.00 179.25 180.34 1chk h THR 103 N 0.00 1.33 -0.03 0.00 2.02 -0.83 -3.21 112.91 112.19 1chk h THR 103 Ca -0.00 -1.70 0.01 0.00 0.77 0.00 0.00 66.41 65.48 1chk h THR 103 Cb 0.63 1.93 -0.00 0.00 -1.74 0.00 0.00 68.15 68.97 1chk h THR 103 CO 0.04 0.53 0.02 0.00 0.37 0.00 0.00 175.52 176.48 1chk h ALA 104 N 0.57 1.93 0.00 6.16 0.00 0.05 -1.64 119.26 126.33 1chk h ALA 104 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1chk h ALA 104 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1chk h ALA 104 CO 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.32 1chk n ALA 105 N -2.50 1.40 0.88 0.00 0.00 -0.68 -0.45 120.51 119.16 1chk n ALA 105 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.54 1chk n ALA 105 Cb 0.11 -1.18 0.21 0.00 0.00 0.00 0.00 19.45 18.60 1chk n ALA 105 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1chk n LYS 106 N -1.64 0.08 -3.00 0.00 5.02 -0.61 -4.79 118.16 113.21 1chk n LYS 106 Ca 0.02 0.02 -0.40 0.00 -2.02 0.00 0.00 58.31 55.92 1chk n LYS 106 Cb 0.11 -1.54 -0.05 0.00 -0.02 0.00 0.00 35.03 33.53 1chk n LYS 106 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1chk s ASP 107 N -3.31 6.97 0.40 4.39 2.15 0.41 -4.93 116.67 122.74 1chk s ASP 107 Ca 0.09 1.17 0.18 0.00 0.43 0.00 0.00 52.55 54.43 1chk s ASP 107 Cb 0.16 -2.42 0.86 0.00 -0.30 0.00 0.00 42.92 41.22 1chk s ASP 107 CO 0.71 -0.20 1.85 0.71 -0.17 0.00 0.00 175.17 178.07 1chk h THR 108 N 4.89 0.99 0.00 1.71 1.35 -1.87 -1.53 112.91 118.45 1chk h THR 108 Ca -0.38 -1.21 -0.04 0.00 -0.55 0.00 0.00 66.41 64.23 1chk h THR 108 Cb 1.18 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 69.29 1chk h THR 108 CO 0.77 0.32 -0.21 0.58 -0.25 0.00 0.00 175.52 176.73 1chk h VAL 109 N 0.00 0.51 -0.01 6.82 2.07 -1.92 0.11 116.25 123.83 1chk h VAL 109 Ca -0.00 -1.10 -0.23 0.00 0.82 0.00 0.00 66.70 66.19 1chk h VAL 109 Cb 0.68 1.77 0.02 0.00 -1.52 0.00 0.00 31.29 32.23 1chk h VAL 109 CO 0.04 0.21 -0.89 0.15 0.02 0.00 0.00 177.57 177.10 1chk h PHE 110 N 0.00 0.92 -0.24 1.57 3.57 -1.52 -1.08 116.94 120.15 1chk h PHE 110 Ca -0.00 -0.49 0.05 0.00 3.53 0.00 0.00 57.97 61.06 1chk h PHE 110 Cb 0.75 -0.11 -0.06 0.00 2.79 0.00 0.00 35.95 39.33 1chk h PHE 110 CO 0.00 1.32 -0.12 1.96 -2.23 0.00 0.00 178.31 179.24 1chk h GLN 111 N 0.25 -0.10 -0.88 1.11 4.20 -1.28 -0.63 115.11 117.78 1chk h GLN 111 Ca -0.11 0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.62 1chk h GLN 111 Cb 1.56 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 29.32 1chk h GLN 111 CO 0.18 -0.06 0.58 0.37 -0.67 0.00 0.00 178.83 179.23 1chk h GLN 112 N -0.10 1.15 -0.55 1.46 5.75 -0.74 -2.05 115.11 120.03 1chk h GLN 112 Ca 0.13 -0.07 -0.08 0.00 -0.15 0.00 0.00 58.65 58.48 1chk h GLN 112 Cb 0.29 -0.26 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 1chk h GLN 112 CO -0.30 0.76 0.01 0.00 -2.65 0.00 0.00 178.83 176.65 1chk h ALA 113 N 1.45 0.97 -0.46 3.38 0.00 -0.34 0.01 119.26 124.28 1chk h ALA 113 Ca 0.33 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1chk h ALA 113 Cb -0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 1chk h ALA 113 CO -0.07 0.63 -0.03 1.96 0.00 0.00 0.00 179.25 181.73 1chk h GLN 114 N 0.87 0.83 -0.61 0.00 4.20 -0.78 -1.28 115.11 118.34 1chk h GLN 114 Ca 0.16 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 1chk h GLN 114 Cb 0.50 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 1chk h GLN 114 CO 0.02 0.90 0.34 -0.91 -0.67 0.00 0.00 178.83 178.52 1chk h ASN 115 N 0.68 0.76 -0.69 1.46 2.35 -1.26 -0.02 115.58 118.86 1chk h ASN 115 Ca 0.13 -0.09 -0.04 0.00 -0.55 0.00 0.00 56.30 55.75 1chk h ASN 115 Cb 0.55 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.69 1chk h ASN 115 CO 0.03 0.63 0.29 0.44 -1.65 0.00 0.00 177.43 177.17 1chk h ASP 116 N 0.83 0.95 0.07 5.81 3.32 -0.68 -0.50 116.42 126.22 1chk h ASP 116 Ca 0.22 -0.13 -0.21 0.00 0.02 0.00 0.00 57.03 56.93 1chk h ASP 116 Cb 0.03 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.34 1chk h ASP 116 CO -0.04 0.84 -0.77 -0.33 -1.72 0.00 0.00 179.24 177.22 1chk h GLU 117 N 1.02 0.59 -0.14 3.56 4.39 -0.92 -0.88 114.58 122.20 1chk h GLU 117 Ca 0.24 -0.49 0.03 0.00 0.34 0.00 0.00 59.36 59.47 1chk h GLU 117 Cb 0.18 0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.91 1chk h GLU 117 CO -0.02 1.12 -0.03 -0.09 -1.16 0.00 0.00 179.01 178.82 1chk h ARG 118 N 0.40 0.01 -0.25 2.33 1.12 -0.72 -2.20 114.38 115.07 1chk h ARG 118 Ca -0.05 -0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.83 1chk h ARG 118 Cb 1.37 -0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 31.32 1chk h ARG 118 CO 0.15 0.00 0.16 -0.44 -3.11 0.00 0.00 179.97 176.73 1chk h ASP 119 N 0.01 0.29 -0.41 -3.80 3.32 -1.04 -0.24 116.42 114.54 1chk h ASP 119 Ca 0.07 -0.02 0.08 0.00 0.02 0.00 0.00 57.03 57.18 1chk h ASP 119 Cb 0.10 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.51 1chk h ASP 119 CO -0.14 0.22 -0.02 -0.09 -1.72 0.00 0.00 179.24 177.49 1chk h ARG 120 N 0.33 0.08 0.00 3.56 2.43 -0.98 -0.00 114.38 119.81 1chk h ARG 120 Ca 0.09 -0.01 -0.37 0.00 -0.81 0.00 0.00 59.98 58.89 1chk h ARG 120 Cb -0.03 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.44 1chk h ARG 120 CO -0.02 0.06 -2.34 0.28 -1.51 0.00 0.00 179.97 176.43 1chk n VAL 121 N -5.22 1.42 0.00 0.20 0.31 -0.84 -4.56 118.33 109.64 1chk n VAL 121 Ca 0.03 -0.83 -0.03 0.00 -0.01 0.00 0.00 64.34 63.49 1chk n VAL 121 Cb 0.22 -0.58 -0.01 0.00 -0.91 0.00 0.00 33.84 32.56 1chk n VAL 121 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1chk n TYR 122 N -2.81 0.00 0.27 3.52 4.02 -0.15 -4.64 117.16 117.37 1chk n TYR 122 Ca -0.33 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.41 1chk n TYR 122 Cb 1.14 -0.16 -0.08 0.00 -0.02 0.00 0.00 39.34 40.22 1chk n TYR 122 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 1chk h PHE 123 N -0.29 -0.63 -0.36 -0.72 3.57 -1.47 -1.92 116.94 115.12 1chk h PHE 123 Ca -0.02 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.36 1chk h PHE 123 Cb 0.38 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 1chk h PHE 123 CO -0.11 -0.33 -0.21 -0.44 -2.23 0.00 0.00 178.31 174.99 1chk h ASP 124 N -0.85 0.69 -0.44 0.41 3.32 -1.25 -1.44 116.42 116.86 1chk h ASP 124 Ca -0.07 -0.23 -0.08 0.00 0.02 0.00 0.00 57.03 56.66 1chk h ASP 124 Cb 0.59 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1chk h ASP 124 CO 0.11 0.89 -0.02 -0.65 -1.72 0.00 0.00 179.24 177.85 1chk h PRO 125 N 0.60 0.86 -0.09 3.56 0.11 -1.76 -1.78 132.00 133.50 1chk h PRO 125 Ca 0.09 -0.25 -0.05 0.00 0.11 0.00 0.00 66.00 65.89 1chk h PRO 125 Cb 0.68 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.70 1chk h PRO 125 CO 0.05 0.88 -0.15 0.00 -0.21 0.00 0.00 178.00 178.57 1chk h ALA 126 N 1.17 0.14 -0.50 -0.75 0.00 -1.22 -1.63 119.26 116.47 1chk h ALA 126 Ca 0.15 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 1chk h ALA 126 Cb 0.51 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1chk h ALA 126 CO 0.03 0.04 0.03 0.28 0.00 0.00 0.00 179.25 179.62 1chk h VAL 127 N -0.19 1.26 -0.42 0.00 2.07 -1.32 -0.77 116.25 116.88 1chk h VAL 127 Ca 0.01 -1.03 -0.13 0.00 0.82 0.00 0.00 66.70 66.36 1chk h VAL 127 Cb 0.72 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1chk h VAL 127 CO 0.03 0.36 -0.26 -1.28 0.02 0.00 0.00 177.57 176.45 1chk h SER 128 N 0.74 0.90 -0.33 0.57 0.87 -1.34 -1.54 113.55 113.41 1chk h SER 128 Ca 0.15 -0.35 -0.08 0.00 -1.23 0.00 0.00 61.79 60.28 1chk h SER 128 Cb 0.48 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.17 1chk h SER 128 CO 0.02 1.10 -0.06 -0.61 -0.53 0.00 0.00 176.83 176.75 1chk h GLN 129 N 0.75 0.74 -0.43 2.24 5.75 -1.05 -1.44 115.11 121.66 1chk h GLN 129 Ca 0.09 -0.22 -0.02 0.00 -0.15 0.00 0.00 58.65 58.36 1chk h GLN 129 Cb 0.81 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.26 1chk h GLN 129 CO 0.07 0.79 0.20 0.00 -2.65 0.00 0.00 178.83 177.23 1chk h ALA 130 N 1.25 0.55 -0.12 3.38 0.00 -0.68 -1.78 119.26 121.86 1chk h ALA 130 Ca 0.12 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1chk h ALA 130 Cb 0.51 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1chk h ALA 130 CO 0.03 0.13 -0.18 0.87 0.00 0.00 0.00 179.25 180.10 1chk h LYS 131 N 0.55 0.20 -0.13 0.00 1.57 -1.19 -1.75 116.57 115.82 1chk h LYS 131 Ca 0.15 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.84 1chk h LYS 131 Cb 0.14 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1chk h LYS 131 CO -0.02 0.38 -0.10 0.00 -0.57 0.00 0.00 179.45 179.14 1chk h ALA 132 N 1.64 1.61 -0.00 3.86 0.00 -0.55 -0.98 119.26 124.83 1chk h ALA 132 Ca 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1chk h ALA 132 Cb 0.43 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1chk h ALA 132 CO 0.03 0.29 -0.08 -0.25 0.00 0.00 0.00 179.25 179.23 1chk n ASP 133 N -4.32 0.18 0.00 0.00 9.92 -0.74 -4.74 116.55 116.84 1chk n ASP 133 Ca -0.01 -0.06 0.00 0.00 -0.53 0.00 0.00 54.79 54.19 1chk n ASP 133 Cb 0.23 -0.24 0.00 0.00 -0.64 0.00 0.00 41.12 40.47 1chk n ASP 133 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1chk n GLY 134 N 1.38 0.38 3.82 0.44 0.00 -0.37 -0.50 105.19 110.33 1chk n GLY 134 Ca 0.11 -1.01 -0.38 0.00 0.00 0.00 0.00 46.02 44.74 1chk n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1chk s LEU 135 N 0.00 4.49 0.00 0.99 1.02 -0.72 -4.64 118.68 119.82 1chk s LEU 135 Ca 0.00 1.18 -0.00 0.00 0.02 0.00 0.00 54.13 55.33 1chk s LEU 135 Cb 0.00 -2.89 0.00 0.00 0.02 0.00 0.00 46.19 43.32 1chk s LEU 135 CO 0.00 0.26 0.00 0.54 0.02 0.00 0.00 176.35 177.17 1chk n ARG 136 N 1.60 0.21 0.04 1.70 1.74 -1.26 -4.37 116.66 116.33 1chk n ARG 136 Ca -0.10 -0.01 -0.00 0.00 -0.77 0.00 0.00 57.85 56.97 1chk n ARG 136 Cb 0.51 -0.00 0.30 0.00 -1.02 0.00 0.00 32.46 32.25 1chk n ARG 136 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1chk h ALA 137 N -1.46 1.35 -0.22 7.54 0.00 -1.78 -1.15 119.26 123.55 1chk h ALA 137 Ca -0.00 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 1chk h ALA 137 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1chk h ALA 137 CO 0.00 0.44 -0.10 1.25 0.00 0.00 0.00 179.25 180.84 1chk h LEU 138 N 0.40 0.33 -0.22 0.00 7.12 -1.50 0.15 115.31 121.59 1chk h LEU 138 Ca 0.08 -0.07 -0.19 0.00 0.13 0.00 0.00 57.88 57.83 1chk h LEU 138 Cb 0.42 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 40.47 1chk h LEU 138 CO 0.02 0.46 -0.59 1.23 -0.13 0.00 0.00 178.44 179.44 1chk h GLY 139 N 0.80 0.86 1.01 3.75 0.00 -1.49 -1.44 103.07 106.56 1chk h GLY 139 Ca 0.07 -1.09 0.00 0.00 0.00 0.00 0.00 47.33 46.31 1chk h GLY 139 CO 0.02 0.97 0.57 1.46 0.00 0.00 0.00 176.54 179.57 1chk h GLN 140 N 0.52 1.19 0.09 4.80 4.20 -0.94 -0.02 115.11 124.95 1chk h GLN 140 Ca -0.01 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 1chk h GLN 140 Cb 1.21 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.73 1chk h GLN 140 CO 0.13 0.81 -0.04 0.35 -0.67 0.00 0.00 178.83 179.40 1chk h PHE 141 N 1.22 -0.11 -0.88 2.96 3.57 -0.60 -2.13 116.94 120.97 1chk h PHE 141 Ca 0.32 -0.00 0.16 0.00 3.53 0.00 0.00 57.97 61.98 1chk h PHE 141 Cb -0.11 0.04 -0.07 0.00 2.79 0.00 0.00 35.95 38.60 1chk h PHE 141 CO -0.00 0.21 0.57 0.00 -2.23 0.00 0.00 178.31 176.85 1chk h ALA 142 N 0.43 1.94 -0.09 2.41 0.00 -0.88 0.55 119.26 123.61 1chk h ALA 142 Ca -0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1chk h ALA 142 Cb 0.37 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1chk h ALA 142 CO 0.02 -0.19 0.02 1.88 0.00 0.00 0.00 179.25 180.98 1chk h TYR 143 N 0.60 0.16 0.36 0.00 -1.99 -0.81 -2.75 116.97 112.54 1chk h TYR 143 Ca 0.45 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 61.15 1chk h TYR 143 Cb 0.83 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 39.51 1chk h TYR 143 CO -0.00 0.34 -0.23 -0.92 -0.00 0.00 0.00 178.16 177.34 1chk h TYR 144 N -0.07 -0.60 -0.75 4.88 3.20 -0.45 -1.00 116.97 122.19 1chk h TYR 144 Ca 0.03 -0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.07 1chk h TYR 144 Cb 0.26 0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.70 1chk h TYR 144 CO 0.01 -0.36 0.51 0.22 -1.64 0.00 0.00 178.16 176.91 1chk h ASP 145 N -0.57 0.22 0.43 -2.11 3.58 -1.06 -0.45 116.42 116.45 1chk h ASP 145 Ca -0.04 0.02 -0.28 0.00 0.42 0.00 0.00 57.03 57.15 1chk h ASP 145 Cb 0.48 -0.03 0.02 0.00 1.72 0.00 0.00 39.33 41.51 1chk h ASP 145 CO 0.03 0.10 -1.24 0.00 -2.88 0.00 0.00 179.24 175.26 1chk h ALA 146 N 1.65 0.08 0.00 -0.78 0.00 -0.97 -2.66 119.26 116.57 1chk h ALA 146 Ca 0.37 -0.83 -0.12 0.00 0.00 0.00 0.00 54.91 54.32 1chk h ALA 146 Cb 1.10 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1chk h ALA 146 CO -0.08 0.84 -0.59 0.97 0.00 0.00 0.00 179.25 180.40 1chk h ILE 147 N 0.15 1.16 -0.00 0.00 2.10 -0.18 0.84 117.51 121.58 1chk h ILE 147 Ca -0.16 -2.22 -0.00 0.00 1.08 0.00 0.00 64.86 63.56 1chk h ILE 147 Cb 1.93 2.29 -0.00 0.00 -1.09 0.00 0.00 36.82 39.96 1chk h ILE 147 CO 0.22 0.58 -0.00 0.58 -1.08 0.00 0.00 178.15 178.44 1chk h VAL 148 N 0.00 1.26 0.08 2.19 2.07 -1.16 0.76 116.25 121.45 1chk h VAL 148 Ca -0.01 -0.75 -0.26 0.00 0.82 0.00 0.00 66.70 66.50 1chk h VAL 148 Cb 1.25 1.77 0.01 0.00 -1.52 0.00 0.00 31.29 32.79 1chk h VAL 148 CO 0.08 0.20 -1.13 -0.03 0.02 0.00 0.00 177.57 176.70 1chk h MET 149 N -0.32 0.40 0.00 1.57 1.85 -1.33 -3.38 114.93 113.72 1chk h MET 149 Ca 0.00 -0.54 0.00 0.00 -0.61 0.00 0.00 59.70 58.55 1chk h MET 149 Cb 0.32 0.18 0.00 0.00 0.43 0.00 0.00 31.60 32.53 1chk h MET 149 CO 0.00 1.21 -1.21 0.72 -0.40 0.00 0.00 176.91 177.24 1chk n HIS 150 N -3.67 0.00 0.00 1.39 8.25 0.28 -5.09 115.22 116.37 1chk n HIS 150 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 1chk n HIS 150 Cb 0.94 -0.18 0.00 0.00 1.12 0.00 0.00 29.99 31.87 1chk n HIS 150 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1chk n GLY 151 N 1.52 -2.46 3.75 -1.41 0.00 0.26 -4.27 105.19 102.58 1chk n GLY 151 Ca -0.00 -1.46 -0.31 0.00 0.00 0.00 0.00 46.02 44.25 1chk n GLY 151 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1chk s PRO 152 N -3.07 2.01 0.00 1.61 0.04 -1.26 -0.94 135.00 133.40 1chk s PRO 152 Ca 0.00 1.28 0.00 0.00 0.04 0.00 0.00 61.00 62.32 1chk s PRO 152 Cb 0.00 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.68 1chk s PRO 152 CO 0.00 -1.84 0.00 0.41 0.04 0.00 0.00 177.00 175.61 1chk n GLY 153 N -0.81 2.75 0.98 0.56 0.00 -1.26 -4.70 105.19 102.72 1chk n GLY 153 Ca 0.10 -2.07 0.10 0.00 0.00 0.00 0.00 46.02 44.15 1chk n GLY 153 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1chk n ASN 154 N 0.00 3.21 -4.73 1.61 3.02 -1.26 -0.01 115.26 117.09 1chk n ASN 154 Ca 0.00 -1.92 -0.32 0.00 -0.03 0.00 0.00 54.58 52.31 1chk n ASN 154 Cb 0.00 -0.24 0.11 0.00 -0.61 0.00 0.00 39.78 39.04 1chk n ASN 154 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1chk s ASP 155 N -1.26 4.07 0.51 6.41 1.01 -1.26 -3.73 116.67 122.42 1chk s ASP 155 Ca 0.33 2.06 0.23 0.00 0.71 0.00 0.00 52.55 55.88 1chk s ASP 155 Cb 0.19 -2.55 1.32 0.00 1.01 0.00 0.00 42.92 42.89 1chk s ASP 155 CO 0.26 -2.33 1.98 -0.65 0.21 0.00 0.00 175.17 174.64 1chk h PRO 156 N -1.01 0.09 -0.18 8.23 0.11 -1.94 -1.84 132.00 135.47 1chk h PRO 156 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1chk h PRO 156 Cb 1.26 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1chk h PRO 156 CO 0.49 0.06 0.00 0.25 -0.21 0.00 0.00 178.00 178.59 1chk n THR 157 N -4.40 0.21 -3.02 -1.15 -2.24 -1.26 -3.75 114.28 98.66 1chk n THR 157 Ca 0.11 -0.60 -0.21 0.00 -2.27 0.00 0.00 64.05 61.07 1chk n THR 157 Cb 0.58 1.29 0.01 0.00 -2.10 0.00 0.00 70.33 70.12 1chk n THR 157 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1chk s SER 158 N -1.78 5.72 0.06 3.42 0.01 -0.69 -4.72 113.70 115.71 1chk s SER 158 Ca 0.32 0.03 -0.14 0.00 1.31 0.00 0.00 55.95 57.47 1chk s SER 158 Cb 0.21 -1.21 -0.04 0.00 0.21 0.00 0.00 66.02 65.19 1chk s SER 158 CO 0.31 -0.75 1.23 0.15 0.41 0.00 0.00 173.24 174.60 1chk h PHE 159 N 0.47 -0.78 -0.77 2.43 3.57 -1.15 -0.91 116.94 119.79 1chk h PHE 159 Ca -0.44 0.05 0.15 0.00 3.53 0.00 0.00 57.97 61.25 1chk h PHE 159 Cb 1.27 0.38 -0.05 0.00 2.79 0.00 0.00 35.95 40.33 1chk h PHE 159 CO 0.42 -0.19 0.52 0.78 -2.23 0.00 0.00 178.31 177.61 1chk h GLY 160 N -0.09 0.76 1.77 2.40 0.00 -0.69 0.52 103.07 107.74 1chk h GLY 160 Ca 0.05 -0.19 -0.11 0.00 0.00 0.00 0.00 47.33 47.08 1chk h GLY 160 CO -0.33 0.06 -0.43 -1.33 0.00 0.00 0.00 176.54 174.51 1chk h GLY 161 N 0.44 0.28 1.57 4.60 0.00 -1.31 -0.21 103.07 108.43 1chk h GLY 161 Ca 0.38 -0.27 -0.20 0.00 0.00 0.00 0.00 47.33 47.24 1chk h GLY 161 CO -0.13 0.25 -0.81 -2.22 0.00 0.00 0.00 176.54 173.63 1chk h ILE 162 N 0.21 1.39 -0.34 2.60 2.04 0.36 -2.29 117.51 121.48 1chk h ILE 162 Ca 0.02 -2.26 -0.17 0.00 1.00 0.00 0.00 64.86 63.45 1chk h ILE 162 Cb 0.85 2.23 -0.00 0.00 -0.74 0.00 0.00 36.82 39.15 1chk h ILE 162 CO 0.07 0.68 -0.44 -0.09 0.00 0.00 0.00 178.15 178.37 1chk h ARG 163 N 0.26 0.89 -0.75 2.37 2.43 -0.96 -2.19 114.38 116.42 1chk h ARG 163 Ca -0.05 -0.50 -0.03 0.00 -0.81 0.00 0.00 59.98 58.60 1chk h ARG 163 Cb 1.41 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.95 1chk h ARG 163 CO 0.14 1.14 0.35 -0.22 -1.51 0.00 0.00 179.97 179.87 1chk h LYS 164 N 0.71 1.09 -0.43 0.20 3.11 -0.89 -1.34 116.57 119.02 1chk h LYS 164 Ca 0.05 -0.17 -0.01 0.00 -2.81 0.00 0.00 60.65 57.71 1chk h LYS 164 Cb 1.03 -0.19 -0.02 0.00 -1.00 0.00 0.00 32.23 32.05 1chk h LYS 164 CO 0.10 0.86 0.24 1.15 -2.81 0.00 0.00 179.45 178.99 1chk h THR 165 N 1.06 1.15 -0.70 1.00 2.02 -1.27 -2.69 112.91 113.48 1chk h THR 165 Ca 0.26 -0.38 0.06 0.00 0.77 0.00 0.00 66.41 67.12 1chk h THR 165 Cb 0.14 0.62 -0.06 0.00 -1.74 0.00 0.00 68.15 67.11 1chk h THR 165 CO -0.03 0.16 0.40 0.00 0.37 0.00 0.00 175.52 176.42 1chk h ALA 166 N 1.10 0.94 0.00 6.16 0.00 -0.75 -1.48 119.26 125.23 1chk h ALA 166 Ca 0.15 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1chk h ALA 166 Cb 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1chk h ALA 166 CO -0.03 0.09 0.00 -1.33 0.00 0.00 0.00 179.25 177.99 1chk n MET 167 N -4.75 0.15 0.06 0.00 2.00 -0.57 -0.46 117.12 113.55 1chk n MET 167 Ca 0.09 0.23 -0.08 0.00 0.00 0.00 0.00 57.70 57.93 1chk n MET 167 Cb 0.17 -1.71 -0.13 0.00 0.00 0.00 0.00 33.22 31.55 1chk n MET 167 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 1chk h LYS 168 N 0.00 0.04 0.09 0.03 1.57 -0.93 -3.35 116.57 114.02 1chk h LYS 168 Ca 0.00 -0.06 -0.30 0.00 -1.87 0.00 0.00 60.65 58.41 1chk h LYS 168 Cb 0.52 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 1chk h LYS 168 CO 0.00 0.97 -1.58 0.87 -0.57 0.00 0.00 179.45 179.14 1chk h LYS 169 N 0.01 0.19 -2.87 3.15 6.56 -1.13 -3.49 116.57 118.99 1chk h LYS 169 Ca -0.06 -0.32 -0.11 0.00 -1.06 0.00 0.00 60.65 59.10 1chk h LYS 169 Cb 1.83 0.12 -0.20 0.00 -0.57 0.00 0.00 32.23 33.41 1chk h LYS 169 CO 0.13 1.01 -0.20 0.00 -2.06 0.00 0.00 179.45 178.33 1chk s ALA 170 N -2.61 -0.94 0.11 3.86 0.00 0.40 -5.11 121.76 117.47 1chk s ALA 170 Ca -0.09 0.48 -0.21 0.00 0.00 0.00 0.00 51.96 52.14 1chk s ALA 170 Cb 0.07 0.06 -0.07 0.00 0.00 0.00 0.00 23.12 23.18 1chk s ALA 170 CO 0.84 -0.28 0.64 1.03 0.00 0.00 0.00 175.76 177.99 1chk s ARG 171 N -1.30 4.30 0.57 0.00 1.81 -1.26 -3.98 118.95 119.09 1chk s ARG 171 Ca -0.13 0.86 -0.20 0.00 -1.72 0.00 0.00 55.73 54.53 1chk s ARG 171 Cb -0.04 -3.20 -0.04 0.00 -0.45 0.00 0.00 34.95 31.21 1chk s ARG 171 CO 0.05 0.59 1.29 0.99 -0.68 0.00 0.00 175.30 177.54 1chk s THR 172 N -1.17 2.33 0.29 0.02 2.01 -1.26 -4.15 115.64 113.71 1chk s THR 172 Ca 0.32 0.23 -0.00 0.00 0.31 0.00 0.00 61.69 62.55 1chk s THR 172 Cb -0.20 -3.10 0.36 0.00 0.01 0.00 0.00 72.50 69.57 1chk s THR 172 CO 0.21 -0.02 1.60 -0.65 -0.69 0.00 0.00 174.62 175.07 1chk h PRO 173 N 1.21 0.06 -0.08 4.92 0.11 -1.60 0.34 132.00 136.95 1chk h PRO 173 Ca -0.51 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.62 1chk h PRO 173 Cb 1.30 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.39 1chk h PRO 173 CO 0.56 0.04 0.06 0.00 -0.21 0.00 0.00 178.00 178.46 1chk h ALA 174 N 1.88 2.03 0.00 -0.75 0.00 -1.06 -0.71 119.26 120.66 1chk h ALA 174 Ca 0.55 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1chk h ALA 174 Cb 1.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1chk h ALA 174 CO -0.82 -0.11 -0.37 1.04 0.00 0.00 0.00 179.25 179.00 1chk n GLN 175 N -4.44 0.04 0.00 0.00 6.02 -0.17 -4.94 117.38 113.89 1chk n GLN 175 Ca -0.01 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 1chk n GLN 175 Cb 0.17 -1.53 0.00 0.00 1.02 0.00 0.00 30.24 29.91 1chk n GLN 175 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1chk n GLY 176 N 1.48 0.88 3.94 1.08 0.00 -0.27 -4.92 105.19 107.38 1chk n GLY 176 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 1chk n GLY 176 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1chk s GLY 177 N -0.62 1.73 -0.13 -0.02 0.00 -0.07 -4.93 107.32 103.28 1chk s GLY 177 Ca 0.00 -1.11 -0.23 0.00 0.00 0.00 0.00 44.72 43.38 1chk s GLY 177 CO 0.00 -0.68 0.71 -0.35 0.00 0.00 0.00 173.10 172.78 1chk s ASP 178 N -4.56 6.90 0.19 1.64 2.15 -1.26 -3.34 116.67 118.39 1chk s ASP 178 Ca 0.61 1.09 -0.13 0.00 0.43 0.00 0.00 52.55 54.56 1chk s ASP 178 Cb -0.09 -2.40 0.12 0.00 -0.30 0.00 0.00 42.92 40.24 1chk s ASP 178 CO 0.44 -0.22 1.83 -0.08 -0.17 0.00 0.00 175.17 176.97 1chk h GLU 179 N 7.08 0.71 0.00 4.34 4.81 -1.93 0.22 114.58 129.81 1chk h GLU 179 Ca -0.36 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 58.72 1chk h GLU 179 Cb 1.17 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 1chk h GLU 179 CO 0.78 0.47 -0.53 1.79 -0.73 0.00 0.00 179.01 180.79 1chk h THR 180 N 0.73 0.97 0.07 0.32 1.35 -1.97 0.13 112.91 114.52 1chk h THR 180 Ca 0.23 -2.17 -0.00 0.00 -0.55 0.00 0.00 66.41 63.92 1chk h THR 180 Cb -0.02 2.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 1chk h THR 180 CO -0.08 0.52 -0.03 0.74 -0.25 0.00 0.00 175.52 176.41 1chk h THR 181 N 0.00 1.11 -0.86 6.82 2.02 -1.82 0.16 112.91 120.33 1chk h THR 181 Ca -0.01 -0.63 0.02 0.00 0.77 0.00 0.00 66.41 66.56 1chk h THR 181 Cb 1.29 1.52 -0.04 0.00 -1.74 0.00 0.00 68.15 69.18 1chk h THR 181 CO 0.07 0.16 0.57 0.22 0.37 0.00 0.00 175.52 176.91 1chk h TYR 182 N -0.37 1.07 -0.00 3.16 3.20 -0.17 -2.38 116.97 121.48 1chk h TYR 182 Ca -0.01 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.72 1chk h TYR 182 Cb 0.33 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 38.21 1chk h TYR 182 CO 0.02 0.66 -0.76 -0.07 -1.64 0.00 0.00 178.16 176.37 1chk h LEU 183 N 1.15 0.04 -1.42 2.82 3.38 -0.68 -0.19 115.31 120.41 1chk h LEU 183 Ca 0.32 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.21 1chk h LEU 183 Cb -0.09 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1chk h LEU 183 CO -0.08 0.78 -0.19 0.78 0.09 0.00 0.00 178.44 179.83 1chk h ASN 184 N 0.02 0.14 -0.29 -0.43 2.35 -0.53 -0.07 115.58 116.78 1chk h ASN 184 Ca -0.01 -0.03 -0.11 0.00 -0.55 0.00 0.00 56.30 55.60 1chk h ASN 184 Cb 1.34 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.67 1chk h ASN 184 CO 0.10 0.34 -0.24 1.23 -1.65 0.00 0.00 177.43 177.21 1chk h GLY 185 N 0.76 0.73 0.87 2.83 0.00 -0.93 -0.38 103.07 106.95 1chk h GLY 185 Ca 0.03 -0.72 -0.00 0.00 0.00 0.00 0.00 47.33 46.63 1chk h GLY 185 CO 0.03 0.65 0.03 -2.75 0.00 0.00 0.00 176.54 174.50 1chk h PHE 186 N 0.41 0.10 -0.79 5.60 3.57 -0.82 -1.61 116.94 123.39 1chk h PHE 186 Ca 0.05 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 1chk h PHE 186 Cb 0.80 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.48 1chk h PHE 186 CO 0.07 0.21 0.33 -0.07 -2.23 0.00 0.00 178.31 176.61 1chk h LEU 187 N -0.04 1.08 -0.58 0.59 4.07 -0.85 0.32 115.31 119.90 1chk h LEU 187 Ca 0.02 -0.17 0.04 0.00 0.08 0.00 0.00 57.88 57.86 1chk h LEU 187 Cb 0.15 -0.28 -0.05 0.00 1.08 0.00 0.00 40.66 41.56 1chk h LEU 187 CO -0.00 0.95 0.32 0.44 -1.08 0.00 0.00 178.44 179.07 1chk h ASP 188 N 1.14 0.48 -0.48 -0.43 3.32 -0.95 0.27 116.42 119.78 1chk h ASP 188 Ca 0.26 0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.24 1chk h ASP 188 Cb 0.20 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1chk h ASP 188 CO -0.02 0.33 -0.06 0.00 -1.72 0.00 0.00 179.24 177.76 1chk h ALA 189 N 1.29 0.90 -0.13 3.45 0.00 -0.24 -1.39 119.26 123.15 1chk h ALA 189 Ca 0.25 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1chk h ALA 189 Cb 0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1chk h ALA 189 CO -0.15 0.64 0.04 -0.09 0.00 0.00 0.00 179.25 179.69 1chk h ARG 190 N 0.85 0.20 -0.69 0.00 1.12 0.52 -1.43 114.38 114.95 1chk h ARG 190 Ca 0.14 -0.04 -0.00 0.00 -1.11 0.00 0.00 59.98 58.97 1chk h ARG 190 Cb 0.59 -0.03 -0.03 0.00 -0.01 0.00 0.00 29.97 30.49 1chk h ARG 190 CO 0.04 0.33 0.43 -0.22 -3.11 0.00 0.00 179.97 177.43 1chk h LYS 191 N 0.02 0.92 -0.06 0.20 3.64 -0.94 -0.36 116.57 120.00 1chk h LYS 191 Ca 0.04 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1chk h LYS 191 Cb 0.22 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1chk h LYS 191 CO -0.00 0.64 0.01 0.00 -2.27 0.00 0.00 179.45 177.83 1chk h ALA 192 N 1.23 0.06 -0.78 5.00 0.00 -1.05 -2.12 119.26 121.60 1chk h ALA 192 Ca 0.25 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.30 1chk h ALA 192 Cb -0.05 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.67 1chk h ALA 192 CO -0.05 -0.47 0.38 0.00 0.00 0.00 0.00 179.25 179.11 1chk h ALA 193 N 1.05 1.12 0.46 0.00 0.00 -0.43 -2.15 119.26 119.31 1chk h ALA 193 Ca 0.03 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1chk h ALA 193 Cb 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1chk h ALA 193 CO -0.04 -0.09 -0.22 0.52 0.00 0.00 0.00 179.25 179.42 1chk h MET 194 N 0.59 -0.60 0.00 0.00 2.07 -0.84 -2.83 114.93 113.31 1chk h MET 194 Ca 0.41 0.04 0.00 0.00 -2.07 0.00 0.00 59.70 58.08 1chk h MET 194 Cb 0.53 0.14 0.00 0.00 -1.87 0.00 0.00 31.60 30.40 1chk h MET 194 CO -0.33 -0.38 0.00 -0.07 1.07 0.00 0.00 176.91 177.20 1chk h LEU 195 N -0.66 0.00 -0.52 1.22 4.07 -0.81 -0.34 115.31 118.26 1chk h LEU 195 Ca -0.06 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 57.73 1chk h LEU 195 Cb 0.50 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.23 1chk h LEU 195 CO 0.10 0.00 -0.63 0.74 -1.08 0.00 0.00 178.44 177.58 1chk h THR 196 N 0.00 1.36 -2.85 0.22 2.02 -1.20 -3.45 112.91 109.02 1chk h THR 196 Ca 0.00 -1.97 -0.53 0.00 0.77 0.00 0.00 66.41 64.68 1chk h THR 196 Cb 0.19 1.96 0.03 0.00 -1.74 0.00 0.00 68.15 68.58 1chk h THR 196 CO 0.00 0.59 0.86 -1.61 0.37 0.00 0.00 175.52 175.74 1chk s GLU 197 N -3.79 4.25 0.44 6.66 8.01 -0.14 -4.97 118.70 129.15 1chk s GLU 197 Ca -0.06 2.24 -0.25 0.00 0.01 0.00 0.00 54.97 56.90 1chk s GLU 197 Cb 0.11 -3.33 -0.09 0.00 -4.31 0.00 0.00 34.13 26.51 1chk s GLU 197 CO 0.83 -0.59 1.40 0.00 0.01 0.00 0.00 175.26 176.90 1chk n ALA 198 N 4.51 1.87 -2.64 5.21 0.00 -1.26 -2.75 120.51 125.46 1chk n ALA 198 Ca 0.14 0.26 -0.21 0.00 0.00 0.00 0.00 53.44 53.62 1chk n ALA 198 Cb 0.41 -2.36 0.01 0.00 0.00 0.00 0.00 19.45 17.50 1chk n ALA 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1chk n ALA 199 N -0.18 -0.75 -1.43 0.00 0.00 -1.26 -4.96 120.51 111.94 1chk n ALA 199 Ca 0.05 0.22 -0.35 0.00 0.00 0.00 0.00 53.44 53.35 1chk n ALA 199 Cb 0.41 -2.86 0.09 0.00 0.00 0.00 0.00 19.45 17.10 1chk n ALA 199 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1chk n HIS 200 N -4.22 1.41 -0.39 0.00 -0.00 -1.11 -5.07 115.22 105.84 1chk n HIS 200 Ca -0.20 0.41 0.00 0.00 -0.00 0.00 0.00 57.72 57.93 1chk n HIS 200 Cb 0.66 -2.17 0.00 0.00 -0.00 0.00 0.00 29.99 28.48 1chk n HIS 200 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 1chk n ASP 201 N -2.32 -0.42 -1.79 4.39 5.75 -1.26 -5.09 116.55 115.82 1chk n ASP 201 Ca 0.14 -0.39 0.00 0.00 -0.01 0.00 0.00 54.79 54.53 1chk n ASP 201 Cb 0.49 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 1chk n ASP 201 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1chk n ASP 202 N -1.81 0.00 -0.52 -1.12 5.68 -1.26 -5.02 116.55 112.51 1chk n ASP 202 Ca 0.00 -0.66 0.06 0.00 -0.50 0.00 0.00 54.79 53.70 1chk n ASP 202 Cb 0.00 0.00 0.13 0.00 -1.14 0.00 0.00 41.12 40.11 1chk n ASP 202 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1chk n THR 203 N -0.96 1.48 -0.25 2.12 -2.24 -1.26 -4.81 114.28 108.37 1chk n THR 203 Ca 0.00 -2.14 0.14 0.00 -2.27 0.00 0.00 64.05 59.78 1chk n THR 203 Cb 0.00 0.03 0.42 0.00 -2.10 0.00 0.00 70.33 68.68 1chk n THR 203 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1chk h SER 204 N 0.50 0.57 -0.29 3.42 4.64 -1.95 -0.01 113.55 120.44 1chk h SER 204 Ca -0.03 0.04 0.08 0.00 -0.47 0.00 0.00 61.79 61.41 1chk h SER 204 Cb 1.18 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1chk h SER 204 CO 0.01 0.28 0.31 0.08 -0.87 0.00 0.00 176.83 176.64 1chk h ARG 205 N 0.60 0.00 0.00 4.77 0.11 -1.87 0.51 114.38 118.50 1chk h ARG 205 Ca 0.44 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 60.41 1chk h ARG 205 Cb 0.81 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.87 1chk h ARG 205 CO -0.19 0.00 -0.99 0.28 0.10 0.00 0.00 179.97 179.17 1chk n VAL 206 N -3.81 1.47 -0.25 0.08 0.31 -0.40 -1.52 118.33 114.21 1chk n VAL 206 Ca 0.04 0.08 -0.06 0.00 -0.01 0.00 0.00 64.34 64.40 1chk n VAL 206 Cb 0.46 -2.24 0.05 0.00 -0.91 0.00 0.00 33.84 31.20 1chk n VAL 206 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1chk h ASP 207 N -1.00 0.84 -0.05 4.52 3.32 0.16 -1.38 116.42 122.84 1chk h ASP 207 Ca -0.17 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 1chk h ASP 207 Cb 0.91 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 40.25 1chk h ASP 207 CO -0.10 0.67 -0.05 0.35 -1.72 0.00 0.00 179.24 178.38 1chk n THR 208 N -4.54 1.99 0.00 0.35 -2.24 0.12 -4.44 114.28 105.53 1chk n THR 208 Ca 0.06 -2.32 0.00 0.00 -2.27 0.00 0.00 64.05 59.52 1chk n THR 208 Cb 0.06 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 1chk n THR 208 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1chk n GLU 209 N -1.27 0.00 -0.07 -0.78 2.13 -1.15 -1.89 120.64 117.61 1chk n GLU 209 Ca 0.17 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.90 1chk n GLU 209 Cb 0.69 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.38 1chk n GLU 209 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1chk h GLN 210 N 0.00 0.35 -0.42 5.31 4.20 -1.13 -1.39 115.11 122.03 1chk h GLN 210 Ca 0.00 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.57 1chk h GLN 210 Cb 0.00 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 1chk h GLN 210 CO 0.00 0.27 -0.17 -0.09 -0.67 0.00 0.00 178.83 178.16 1chk h ARG 211 N 0.33 0.80 -0.34 1.46 9.65 -1.51 -1.36 114.38 123.41 1chk h ARG 211 Ca 0.09 -0.30 0.03 0.00 -1.10 0.00 0.00 59.98 58.71 1chk h ARG 211 Cb 0.00 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 28.50 1chk h ARG 211 CO -0.02 0.92 0.13 0.28 2.80 0.00 0.00 179.97 184.08 1chk h VAL 212 N 0.71 0.93 -0.26 0.20 2.07 -1.68 0.19 116.25 118.41 1chk h VAL 212 Ca 0.11 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.46 1chk h VAL 212 Cb 0.68 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1chk h VAL 212 CO 0.05 0.05 -0.14 -0.26 0.02 0.00 0.00 177.57 177.29 1chk h PHE 213 N 0.29 0.47 -0.37 1.57 0.04 -0.22 -2.45 116.94 116.28 1chk h PHE 213 Ca 0.15 -0.07 -0.07 0.00 2.80 0.00 0.00 57.97 60.78 1chk h PHE 213 Cb 0.10 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.11 1chk h PHE 213 CO -0.13 0.57 -0.04 1.25 -0.60 0.00 0.00 178.31 179.36 1chk h LEU 214 N 0.41 0.67 -0.88 1.54 5.85 -0.87 -1.08 115.31 120.96 1chk h LEU 214 Ca 0.08 -0.33 -0.06 0.00 0.84 0.00 0.00 57.88 58.40 1chk h LEU 214 Cb 0.49 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1chk h LEU 214 CO 0.03 0.85 -0.28 0.11 -0.34 0.00 0.00 178.44 178.81 1chk h LYS 215 N 0.49 0.00 0.00 1.25 1.57 -0.71 -1.19 116.57 117.98 1chk h LYS 215 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1chk h LYS 215 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1chk h LYS 215 CO 0.03 0.28 0.00 0.00 -0.57 0.00 0.00 179.45 179.19 1chk n ALA 216 N -2.23 2.10 -1.18 3.86 0.00 -0.94 -4.91 120.51 117.21 1chk n ALA 216 Ca 0.00 -0.10 -0.06 0.00 0.00 0.00 0.00 53.44 53.29 1chk n ALA 216 Cb 0.49 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 1chk n ALA 216 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1chk n GLY 217 N 0.67 0.85 2.46 0.00 0.00 -0.45 -4.93 105.19 103.80 1chk n GLY 217 Ca 0.09 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 45.19 1chk n GLY 217 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1chk n ASN 218 N 0.44 7.15 0.11 1.61 2.85 -0.42 -4.71 115.26 122.30 1chk n ASN 218 Ca -0.06 -2.69 0.13 0.00 -0.11 0.00 0.00 54.58 51.84 1chk n ASN 218 Cb 0.25 -1.58 0.44 0.00 1.24 0.00 0.00 39.78 40.13 1chk n ASN 218 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1chk n LEU 219 N 4.27 0.76 -0.88 1.20 4.77 -1.26 -2.11 117.00 123.74 1chk n LEU 219 Ca 0.69 0.61 0.12 0.00 -0.03 0.00 0.00 56.01 57.40 1chk n LEU 219 Cb 0.28 -0.41 0.24 0.00 -2.33 0.00 0.00 43.42 41.21 1chk n LEU 219 CO 0.86 -0.31 0.71 0.47 -1.33 0.00 0.00 177.39 177.80 1chk n ASP 220 N -2.25 2.71 -3.68 -1.43 8.00 -1.26 -1.43 116.55 117.20 1chk n ASP 220 Ca 0.04 -1.88 -0.29 0.00 0.71 0.00 0.00 54.79 53.38 1chk n ASP 220 Cb 0.36 -0.09 0.04 0.00 -0.02 0.00 0.00 41.12 41.41 1chk n ASP 220 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1chk n LEU 221 N 1.06 -3.00 -4.73 0.64 7.94 -0.90 -4.61 117.00 113.40 1chk n LEU 221 Ca 0.17 -0.98 -0.35 0.00 -1.11 0.00 0.00 56.01 53.74 1chk n LEU 221 Cb 0.52 -2.45 -0.08 0.00 0.53 0.00 0.00 43.42 41.94 1chk n LEU 221 CO 0.15 0.44 -0.20 0.20 -1.11 0.00 0.00 177.39 176.87 1chk s ASN 222 N -3.63 6.08 0.58 1.96 0.01 -1.26 -5.02 114.94 113.67 1chk s ASN 222 Ca 0.39 0.23 -0.16 0.00 -0.71 0.00 0.00 52.86 52.61 1chk s ASN 222 Cb -0.13 -2.04 -0.04 0.00 0.41 0.00 0.00 41.25 39.44 1chk s ASN 222 CO 0.85 0.22 1.04 -2.84 -1.51 0.00 0.00 177.10 174.86 1chk s PRO 223 N 0.12 3.43 0.30 -0.60 0.02 -1.26 -4.63 135.00 132.38 1chk s PRO 223 Ca 0.08 1.15 -0.29 0.00 0.02 0.00 0.00 61.00 61.97 1chk s PRO 223 Cb -0.11 -2.05 -0.10 0.00 0.02 0.00 0.00 34.50 32.26 1chk s PRO 223 CO -0.01 -0.72 1.15 -1.25 -0.33 0.00 0.00 177.00 175.85 1chk s PRO 224 N -4.10 4.52 -0.22 5.54 0.04 -1.25 -4.89 135.00 134.64 1chk s PRO 224 Ca 0.63 1.90 -0.04 0.00 0.04 0.00 0.00 61.00 63.52 1chk s PRO 224 Cb -0.15 -3.11 -0.01 0.00 0.04 0.00 0.00 34.50 31.28 1chk s PRO 224 CO 0.36 0.07 -0.05 -0.51 0.04 0.00 0.00 177.00 176.92 1chk s LEU 225 N -1.63 2.86 -0.05 -3.56 1.02 -0.30 -4.99 118.68 112.02 1chk s LEU 225 Ca 0.47 -0.40 0.05 0.00 0.02 0.00 0.00 54.13 54.26 1chk s LEU 225 Cb -0.33 -1.73 -0.01 0.00 0.02 0.00 0.00 46.19 44.14 1chk s LEU 225 CO 0.43 -0.02 -0.22 -0.54 0.02 0.00 0.00 176.35 176.03 1chk s LYS 226 N 1.47 2.28 0.39 1.70 1.02 -1.26 -1.34 119.74 124.00 1chk s LYS 226 Ca 0.06 -0.78 -0.15 0.00 0.02 0.00 0.00 55.97 55.11 1chk s LYS 226 Cb -0.14 -1.93 0.06 0.00 -0.52 0.00 0.00 37.83 35.30 1chk s LYS 226 CO -0.04 0.31 0.79 1.67 -0.92 0.00 0.00 175.35 177.16 1chk s TRP 227 N -0.04 0.14 -0.00 3.18 -2.14 -0.70 -4.97 118.94 114.39 1chk s TRP 227 Ca -0.05 -0.82 0.01 0.00 2.66 0.00 0.00 56.10 57.91 1chk s TRP 227 Cb -0.13 0.84 -0.00 0.00 -3.10 0.00 0.00 33.47 31.07 1chk s TRP 227 CO 0.03 -1.58 -0.04 0.15 -2.66 0.00 0.00 176.95 172.85 1chk s LYS 228 N -2.26 0.36 -0.06 3.25 1.02 -0.79 -0.93 119.74 120.33 1chk s LYS 228 Ca 0.16 -0.17 0.02 0.00 0.02 0.00 0.00 55.97 56.00 1chk s LYS 228 Cb -0.05 -0.34 0.01 0.00 -0.52 0.00 0.00 37.83 36.93 1chk s LYS 228 CO 0.12 0.09 -0.13 0.95 -0.92 0.00 0.00 175.35 175.46 1chk s THR 229 N -0.14 1.16 -1.91 2.17 -4.23 -0.82 -4.13 115.64 107.74 1chk s THR 229 Ca 0.01 -0.51 0.00 0.00 -1.18 0.00 0.00 61.69 60.02 1chk s THR 229 Cb -0.02 -1.05 0.00 0.00 1.34 0.00 0.00 72.50 72.77 1chk s THR 229 CO -0.00 0.36 0.00 -1.22 -0.54 0.00 0.00 174.62 173.22 1chk n TYR 230 N 3.71 -0.70 -0.37 3.99 4.01 -1.26 -0.89 117.16 125.65 1chk n TYR 230 Ca -0.22 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.52 1chk n TYR 230 Cb 0.52 -3.81 0.00 0.00 -0.31 0.00 0.00 39.34 35.74 1chk n TYR 230 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1chk n GLY 231 N -0.82 0.74 3.53 2.72 0.00 -1.26 -5.06 105.19 105.04 1chk n GLY 231 Ca -0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 1chk n GLY 231 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1chk s ASP 232 N -2.98 4.87 0.36 1.61 1.01 -0.07 -5.06 116.67 116.41 1chk s ASP 232 Ca 0.00 -0.09 -0.23 0.00 0.71 0.00 0.00 52.55 52.94 1chk s ASP 232 Cb 0.00 -1.74 -0.10 0.00 1.01 0.00 0.00 42.92 42.09 1chk s ASP 232 CO 0.00 0.20 0.92 -2.16 0.21 0.00 0.00 175.17 174.34 1chk s PRO 233 N 0.20 4.39 0.02 8.23 0.04 -1.26 -1.95 135.00 144.66 1chk s PRO 233 Ca -0.02 1.18 0.01 0.00 0.04 0.00 0.00 61.00 62.21 1chk s PRO 233 Cb -0.14 -2.54 -0.01 0.00 0.04 0.00 0.00 34.50 31.85 1chk s PRO 233 CO 0.03 0.16 -0.04 0.71 0.04 0.00 0.00 177.00 177.89 1chk s TYR 234 N -1.86 0.34 -0.04 0.56 1.51 -0.11 -4.98 117.35 112.78 1chk s TYR 234 Ca 0.55 -0.30 0.00 0.00 -1.01 0.00 0.00 57.07 56.31 1chk s TYR 234 Cb -0.14 -0.22 0.03 0.00 -0.11 0.00 0.00 41.96 41.52 1chk s TYR 234 CO 0.19 -0.08 -0.01 0.08 -1.11 0.00 0.00 175.55 174.62 1chk s VAL 235 N -0.79 0.27 -0.27 0.71 1.01 -1.26 -1.73 120.40 118.34 1chk s VAL 235 Ca -0.07 0.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.93 1chk s VAL 235 Cb -0.06 -0.37 0.02 0.00 0.00 0.00 0.00 36.38 35.97 1chk s VAL 235 CO -0.00 0.18 0.01 -0.63 0.00 0.00 0.00 175.10 174.66 1chk s ILE 236 N 1.18 3.44 0.06 2.22 1.01 -0.45 -4.99 121.20 123.67 1chk s ILE 236 Ca -0.07 -0.83 0.10 0.00 0.00 0.00 0.00 60.65 59.85 1chk s ILE 236 Cb -0.13 -2.75 -0.09 0.00 0.01 0.00 0.00 42.46 39.49 1chk s ILE 236 CO -0.02 0.15 1.39 0.78 0.00 0.00 0.00 174.94 177.24 1chk h ASN 237 N 8.12 0.00 0.00 3.58 4.21 -1.97 -0.79 115.58 128.74 1chk h ASN 237 Ca -0.32 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.19 1chk h ASN 237 Cb 1.12 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.32 1chk h ASN 237 CO 0.59 0.78 0.00 -1.54 -1.29 0.00 0.00 177.43 175.97