#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cio s PRO 2 N 0.00 0.87 0.48 6.28 0.04 -1.26 -4.96 135.00 136.45 2cio s PRO 2 Ca 0.00 0.46 0.27 0.00 0.04 0.00 0.00 61.00 61.77 2cio s PRO 2 Cb 0.00 -1.79 0.75 0.00 0.04 0.00 0.00 34.50 33.50 2cio s PRO 2 CO 0.00 -2.42 1.76 0.93 0.04 0.00 0.00 177.00 177.31 2cio h GLU 3 N -1.66 0.00 -4.72 4.56 5.08 -1.99 -3.44 114.58 112.41 2cio h GLU 3 Ca -0.52 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.38 2cio h GLU 3 Cb 1.32 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 30.26 2cio h GLU 3 CO 0.59 0.00 -0.80 0.71 -1.00 0.00 0.00 179.01 178.51 2cio s TYR 4 N -3.39 1.14 -0.01 4.33 2.02 -1.26 -3.61 117.35 116.56 2cio s TYR 4 Ca 0.05 -0.31 0.00 0.00 -0.37 0.00 0.00 57.07 56.44 2cio s TYR 4 Cb 0.07 -0.80 0.02 0.00 -0.40 0.00 0.00 41.96 40.84 2cio s TYR 4 CO 0.62 -0.13 0.00 0.08 -1.57 0.00 0.00 175.55 174.55 2cio s VAL 5 N 0.21 0.08 -0.28 0.71 1.01 -0.61 -4.98 120.40 116.55 2cio s VAL 5 Ca -0.04 0.06 -0.00 0.00 0.00 0.00 0.00 61.98 61.99 2cio s VAL 5 Cb -0.10 -0.14 0.14 0.00 0.00 0.00 0.00 36.38 36.28 2cio s VAL 5 CO 0.01 0.08 0.32 -0.62 0.00 0.00 0.00 175.10 174.89 2cio s ASP 6 N 0.56 1.26 0.53 3.32 -1.08 -1.26 -0.97 116.67 119.04 2cio s ASP 6 Ca -0.05 -0.55 0.36 0.00 -0.52 0.00 0.00 52.55 51.79 2cio s ASP 6 Cb -0.08 0.67 1.76 0.00 -1.46 0.00 0.00 42.92 43.82 2cio s ASP 6 CO -0.01 -0.37 2.07 -0.50 0.52 0.00 0.00 175.17 176.88 2cio h TRP 7 N 8.24 0.00 -0.47 -5.34 4.06 -1.30 -1.63 115.95 119.51 2cio h TRP 7 Ca -0.13 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.75 2cio h TRP 7 Cb 1.10 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.24 2cio h TRP 7 CO 0.25 0.00 0.01 0.00 -3.56 0.00 0.00 178.44 175.14 2cio h ARG 8 N 0.00 0.76 0.00 0.49 3.08 -1.92 -1.86 114.38 114.94 2cio h ARG 8 Ca 0.00 -0.20 -0.04 0.00 0.07 0.00 0.00 59.98 59.82 2cio h ARG 8 Cb 0.19 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2cio h ARG 8 CO 0.00 0.77 -0.17 1.96 -1.07 0.00 0.00 179.97 181.45 2cio h GLN 9 N 0.72 0.00 -0.61 0.04 1.08 -1.69 -2.44 115.11 112.20 2cio h GLN 9 Ca 0.14 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 2cio h GLN 9 Cb 0.42 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.85 2cio h GLN 9 CO 0.02 0.17 0.00 1.63 -0.95 0.00 0.00 178.83 179.70 2cio n LYS 10 N -3.39 2.75 -2.30 1.46 5.02 -0.95 -4.94 118.16 115.81 2cio n LYS 10 Ca -0.00 -2.23 -0.16 0.00 -2.02 0.00 0.00 58.31 53.90 2cio n LYS 10 Cb 0.37 -1.60 -0.01 0.00 -0.02 0.00 0.00 35.03 33.77 2cio n LYS 10 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2cio n GLY 11 N 1.25 -0.28 0.79 0.72 0.00 -0.92 -4.92 105.19 101.83 2cio n GLY 11 Ca 0.20 -0.20 0.07 0.00 0.00 0.00 0.00 46.02 46.09 2cio n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cio n ALA 12 N -1.76 2.25 -3.24 4.61 0.00 -0.74 -4.69 120.51 116.95 2cio n ALA 12 Ca -0.19 -1.13 -0.22 0.00 0.00 0.00 0.00 53.44 51.90 2cio n ALA 12 Cb 0.65 -0.55 -0.16 0.00 0.00 0.00 0.00 19.45 19.39 2cio n ALA 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2cio s VAL 13 N -1.02 0.91 0.68 0.00 0.11 -1.25 -3.64 120.40 116.19 2cio s VAL 13 Ca 0.28 -0.39 -0.03 0.00 -2.93 0.00 0.00 61.98 58.91 2cio s VAL 13 Cb 0.15 -0.82 0.08 0.00 -1.53 0.00 0.00 36.38 34.26 2cio s VAL 13 CO 0.20 0.29 0.96 0.42 -3.33 0.00 0.00 175.10 173.64 2cio s THR 14 N 0.42 2.33 0.85 5.04 -4.23 -1.26 -4.94 115.64 113.86 2cio s THR 14 Ca -0.08 -0.46 -0.13 0.00 -1.18 0.00 0.00 61.69 59.85 2cio s THR 14 Cb -0.12 -2.87 0.07 0.00 1.34 0.00 0.00 72.50 70.92 2cio s THR 14 CO 0.02 0.00 0.94 -2.65 -0.54 0.00 0.00 174.62 172.39 2cio n PRO 15 N -2.79 -0.05 -2.15 3.99 -0.02 -1.26 -4.93 135.00 127.79 2cio n PRO 15 Ca 0.11 0.05 -0.41 0.00 -2.02 0.00 0.00 63.50 61.23 2cio n PRO 15 Cb 0.60 -2.23 -0.03 0.00 -0.02 0.00 0.00 33.50 31.83 2cio n PRO 15 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2cio s VAL 16 N -2.27 2.90 0.42 -1.45 1.01 -1.26 -5.03 120.40 114.72 2cio s VAL 16 Ca 0.67 0.83 0.07 0.00 0.00 0.00 0.00 61.98 63.55 2cio s VAL 16 Cb -0.27 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 2cio s VAL 16 CO 0.57 0.17 0.31 -0.54 0.00 0.00 0.00 175.10 175.61 2cio s LYS 17 N -1.06 2.41 -0.18 2.72 -0.14 -1.26 -4.75 119.74 117.47 2cio s LYS 17 Ca 0.52 -1.68 -0.02 0.00 -1.36 0.00 0.00 55.97 53.44 2cio s LYS 17 Cb -0.39 -2.22 0.05 0.00 -1.68 0.00 0.00 37.83 33.60 2cio s LYS 17 CO 0.46 -0.20 -0.00 1.21 -0.76 0.00 0.00 175.35 176.06 2cio s ASN 18 N -4.06 2.94 0.42 2.83 2.47 -1.26 -1.35 114.94 116.94 2cio s ASN 18 Ca 0.45 -0.78 0.29 0.00 0.42 0.00 0.00 52.86 53.24 2cio s ASN 18 Cb -0.01 -0.76 1.17 0.00 -1.45 0.00 0.00 41.25 40.21 2cio s ASN 18 CO 0.26 -0.26 1.86 0.06 -3.72 0.00 0.00 177.10 175.30 2cio h GLN 19 N 8.17 0.00 0.00 0.43 3.07 -0.92 -3.47 115.11 122.39 2cio h GLN 19 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.55 2cio h GLN 19 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.67 2cio h GLN 19 CO 0.36 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.69 2cio n GLY 20 N 0.09 0.57 2.41 0.06 0.00 -1.26 -3.76 105.19 103.30 2cio n GLY 20 Ca 0.01 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 2cio n GLY 20 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cio n SER 21 N -1.75 7.45 -3.72 1.61 7.64 -1.26 -4.79 113.62 118.80 2cio n SER 21 Ca 0.00 -3.01 -0.11 0.00 1.01 0.00 0.00 58.87 56.75 2cio n SER 21 Cb 0.00 -1.36 -0.12 0.00 -1.01 0.00 0.00 64.21 61.72 2cio n SER 21 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2cio n GLY 23 N 4.05 4.44 3.25 0.00 0.00 0.64 -4.89 105.19 112.67 2cio n GLY 23 Ca -0.23 -1.61 -0.43 0.00 0.00 0.00 0.00 46.02 43.75 2cio n GLY 23 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cio s SER 24 N 1.90 6.04 0.00 1.61 1.04 -1.26 -2.07 113.70 120.96 2cio s SER 24 Ca 0.65 -2.25 0.00 0.00 0.48 0.00 0.00 55.95 54.84 2cio s SER 24 Cb 0.18 -2.09 0.00 0.00 0.10 0.00 0.00 66.02 64.21 2cio s SER 24 CO -0.07 -0.65 0.00 -2.67 0.98 0.00 0.00 173.24 170.83 2cio n TRP 26 N 4.51 0.00 -0.05 5.02 4.27 -1.26 -2.11 117.44 127.82 2cio n TRP 26 Ca -0.01 0.00 -0.15 0.00 -3.89 0.00 0.00 57.50 53.45 2cio n TRP 26 Cb 0.42 0.00 -0.05 0.00 -1.36 0.00 0.00 31.31 30.32 2cio n TRP 26 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2cio h ALA 27 N 0.00 0.42 -0.18 -1.67 0.00 -1.91 -2.11 119.26 113.80 2cio h ALA 27 Ca 0.00 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 2cio h ALA 27 Cb 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2cio h ALA 27 CO 0.00 0.69 0.10 0.74 0.00 0.00 0.00 179.25 180.78 2cio h PHE 28 N 0.60 0.23 -0.20 0.00 -1.00 -1.76 -0.85 116.94 113.96 2cio h PHE 28 Ca -0.02 -0.00 0.05 0.00 2.81 0.00 0.00 57.97 60.81 2cio h PHE 28 Cb 1.27 -0.08 -0.05 0.00 3.61 0.00 0.00 35.95 40.70 2cio h PHE 28 CO 0.08 0.20 -0.11 1.03 -1.61 0.00 0.00 178.31 177.90 2cio h SER 29 N 0.20 -0.36 -0.46 2.17 0.87 -1.80 -1.17 113.55 113.00 2cio h SER 29 Ca 0.06 0.08 0.02 0.00 -1.23 0.00 0.00 61.79 60.72 2cio h SER 29 Cb 0.04 0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 2cio h SER 29 CO -0.01 -0.14 0.28 0.00 -0.53 0.00 0.00 176.83 176.43 2cio h ALA 30 N 1.07 0.59 -0.73 6.23 0.00 -1.29 -2.57 119.26 122.57 2cio h ALA 30 Ca 0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2cio h ALA 30 Cb 0.26 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2cio h ALA 30 CO -0.26 -0.02 0.42 0.28 0.00 0.00 0.00 179.25 179.67 2cio h VAL 31 N 0.56 1.21 -0.88 0.00 2.07 -0.57 -1.61 116.25 117.03 2cio h VAL 31 Ca 0.18 -0.48 0.04 0.00 0.82 0.00 0.00 66.70 67.26 2cio h VAL 31 Cb -0.00 0.20 -0.06 0.00 -1.52 0.00 0.00 31.29 29.91 2cio h VAL 31 CO -0.08 0.22 0.56 0.58 0.02 0.00 0.00 177.57 178.88 2cio h VAL 32 N 1.00 1.11 -0.23 2.57 2.07 -0.82 0.45 116.25 122.40 2cio h VAL 32 Ca 0.26 -0.37 -0.12 0.00 0.82 0.00 0.00 66.70 67.30 2cio h VAL 32 Cb -0.02 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.69 2cio h VAL 32 CO -0.05 0.20 -0.35 0.71 0.02 0.00 0.00 177.57 178.10 2cio h THR 33 N 1.07 1.29 -0.20 2.57 1.35 -1.17 -1.49 112.91 116.33 2cio h THR 33 Ca 0.36 -1.46 -0.06 0.00 -0.55 0.00 0.00 66.41 64.71 2cio h THR 33 Cb 0.07 1.49 -0.00 0.00 -1.73 0.00 0.00 68.15 67.98 2cio h THR 33 CO -0.14 0.46 -0.11 0.40 -0.25 0.00 0.00 175.52 175.88 2cio h ILE 34 N 0.42 1.31 -0.69 6.82 1.08 -0.54 -0.41 117.51 125.50 2cio h ILE 34 Ca 0.05 -1.19 0.07 0.00 -0.39 0.00 0.00 64.86 63.39 2cio h ILE 34 Cb 0.81 1.66 -0.06 0.00 -3.07 0.00 0.00 36.82 36.15 2cio h ILE 34 CO 0.07 0.36 0.38 -0.33 -0.69 0.00 0.00 178.15 177.94 2cio h GLU 35 N 0.13 0.67 0.10 2.37 5.08 -0.85 -1.15 114.58 120.94 2cio h GLU 35 Ca 0.04 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2cio h GLU 35 Cb 0.61 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2cio h GLU 35 CO 0.03 0.44 -0.05 0.78 -1.00 0.00 0.00 179.01 179.22 2cio h GLY 36 N 0.69 -0.14 1.62 -3.84 0.00 -1.16 -2.60 103.07 97.63 2cio h GLY 36 Ca 0.32 0.05 -0.10 0.00 0.00 0.00 0.00 47.33 47.60 2cio h GLY 36 CO -0.20 -0.05 -0.32 1.19 0.00 0.00 0.00 176.54 177.16 2cio h ILE 37 N -0.29 1.28 -0.45 2.60 6.09 -0.87 -1.65 117.51 124.22 2cio h ILE 37 Ca -0.01 -1.38 -0.02 0.00 -1.37 0.00 0.00 64.86 62.08 2cio h ILE 37 Cb 0.24 1.47 -0.02 0.00 0.47 0.00 0.00 36.82 38.98 2cio h ILE 37 CO 0.02 0.43 0.21 0.40 -3.07 0.00 0.00 178.15 176.14 2cio h ILE 38 N 0.38 1.19 -0.55 2.19 1.08 -1.24 -0.70 117.51 119.86 2cio h ILE 38 Ca 0.05 -0.54 0.02 0.00 -0.39 0.00 0.00 64.86 64.00 2cio h ILE 38 Cb 0.74 0.72 -0.03 0.00 -3.07 0.00 0.00 36.82 35.18 2cio h ILE 38 CO 0.06 0.21 0.34 0.50 -0.69 0.00 0.00 178.15 178.57 2cio h LYS 39 N 0.58 0.67 -0.51 2.37 1.63 -1.14 0.38 116.57 120.55 2cio h LYS 39 Ca 0.15 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.86 2cio h LYS 39 Cb 0.13 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.59 2cio h LYS 39 CO -0.02 0.44 0.12 0.82 -3.45 0.00 0.00 179.45 177.36 2cio h ILE 40 N 0.69 1.24 0.00 2.00 2.04 -1.10 0.19 117.51 122.57 2cio h ILE 40 Ca 0.21 -0.86 -0.21 0.00 1.00 0.00 0.00 64.86 65.01 2cio h ILE 40 Cb -0.02 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 2cio h ILE 40 CO -0.08 0.31 -1.19 0.03 0.00 0.00 0.00 178.15 177.23 2cio h ARG 41 N 0.70 0.00 0.00 2.37 2.47 -1.01 -3.39 114.38 115.52 2cio h ARG 41 Ca 0.16 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.88 2cio h ARG 41 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.66 2cio h ARG 41 CO 0.00 0.64 -0.77 0.25 0.56 0.00 0.00 179.97 180.65 2cio n THR 42 N -3.16 0.00 -0.97 2.04 -2.24 0.11 -5.02 114.28 105.04 2cio n THR 42 Ca -0.06 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2cio n THR 42 Cb 0.92 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.79 2cio n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cio n GLY 43 N 1.88 0.72 3.41 3.38 0.00 0.67 -5.02 105.19 110.23 2cio n GLY 43 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2cio n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cio s ASN 44 N -2.43 4.31 -0.28 1.61 0.02 -1.25 -4.97 114.94 111.94 2cio s ASN 44 Ca 0.00 -0.26 -0.14 0.00 -1.02 0.00 0.00 52.86 51.44 2cio s ASN 44 Cb 0.00 -1.68 -0.04 0.00 0.02 0.00 0.00 41.25 39.55 2cio s ASN 44 CO 0.00 0.16 0.33 -0.22 0.02 0.00 0.00 177.10 177.39 2cio s LEU 45 N 0.40 4.08 0.17 0.60 2.96 -1.26 -2.83 118.68 122.79 2cio s LEU 45 Ca -0.08 0.15 0.06 0.00 -0.22 0.00 0.00 54.13 54.03 2cio s LEU 45 Cb -0.15 -2.34 -0.04 0.00 0.50 0.00 0.00 46.19 44.16 2cio s LEU 45 CO 0.04 -0.17 -0.12 0.20 -1.32 0.00 0.00 176.35 174.98 2cio s ASN 46 N 1.68 2.08 -0.09 3.68 0.01 -1.26 -5.08 114.94 115.97 2cio s ASN 46 Ca 0.13 -1.00 -0.14 0.00 -0.71 0.00 0.00 52.86 51.14 2cio s ASN 46 Cb -0.16 -0.06 -0.05 0.00 0.41 0.00 0.00 41.25 41.39 2cio s ASN 46 CO 0.10 -0.26 0.34 -1.10 -1.51 0.00 0.00 177.10 174.67 2cio s GLN 47 N -3.64 4.03 0.37 -0.60 -0.21 -1.26 -4.72 119.66 113.63 2cio s GLN 47 Ca 0.18 0.23 0.08 0.00 0.02 0.00 0.00 55.36 55.87 2cio s GLN 47 Cb 0.01 -3.32 -0.05 0.00 1.00 0.00 0.00 33.01 30.65 2cio s GLN 47 CO 0.03 0.47 0.09 0.71 -2.12 0.00 0.00 175.29 174.47 2cio s TYR 48 N -0.30 2.59 -0.54 0.91 1.51 -1.26 -0.90 117.35 119.37 2cio s TYR 48 Ca 0.20 -0.49 -0.23 0.00 -1.01 0.00 0.00 57.07 55.54 2cio s TYR 48 Cb -0.14 -1.68 0.04 0.00 -0.11 0.00 0.00 41.96 40.07 2cio s TYR 48 CO 0.08 0.36 0.88 0.45 -1.11 0.00 0.00 175.55 176.21 2cio s SER 49 N -3.80 6.32 0.27 2.29 0.15 -0.62 -4.14 113.70 114.17 2cio s SER 49 Ca 0.37 -0.46 -0.03 0.00 0.70 0.00 0.00 55.95 56.53 2cio s SER 49 Cb 0.01 -2.41 0.35 0.00 -1.71 0.00 0.00 66.02 62.27 2cio s SER 49 CO 0.21 -1.15 1.88 -0.33 1.20 0.00 0.00 173.24 175.05 2cio h GLU 50 N 9.24 1.05 -0.60 5.44 3.07 -1.85 -3.10 114.58 127.83 2cio h GLU 50 Ca -0.26 -0.13 0.01 0.00 -0.50 0.00 0.00 59.36 58.48 2cio h GLU 50 Cb 1.08 -0.20 -0.03 0.00 -0.84 0.00 0.00 28.75 28.76 2cio h GLU 50 CO 1.06 0.80 0.40 0.37 -1.40 0.00 0.00 179.01 180.24 2cio h GLN 51 N 1.05 0.76 -0.50 2.33 5.75 -1.83 -0.30 115.11 122.37 2cio h GLN 51 Ca 0.26 -0.05 -0.05 0.00 -0.15 0.00 0.00 58.65 58.67 2cio h GLN 51 Cb 0.07 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.43 2cio h GLN 51 CO -0.04 0.50 0.13 1.49 -2.65 0.00 0.00 178.83 178.27 2cio h GLU 52 N 0.78 0.80 -0.56 1.69 4.81 -1.78 0.87 114.58 121.20 2cio h GLU 52 Ca 0.23 -0.19 -0.08 0.00 -0.13 0.00 0.00 59.36 59.19 2cio h GLU 52 Cb -0.04 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 2cio h GLU 52 CO -0.05 0.76 0.03 -0.07 -0.73 0.00 0.00 179.01 178.95 2cio h LEU 53 N 0.69 0.93 -0.69 1.64 3.38 -1.40 0.20 115.31 120.08 2cio h LEU 53 Ca 0.16 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.86 2cio h LEU 53 Cb 0.31 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 2cio h LEU 53 CO -0.00 1.00 0.44 0.25 0.09 0.00 0.00 178.44 180.21 2cio h LEU 54 N 0.84 0.72 0.00 1.67 5.85 -0.55 -0.42 115.31 123.43 2cio h LEU 54 Ca 0.16 -0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.69 2cio h LEU 54 Cb 0.50 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2cio h LEU 54 CO 0.02 0.51 -1.04 0.44 -0.34 0.00 0.00 178.44 178.03 2cio h ASP 55 N 0.86 0.00 0.00 1.25 3.32 -0.63 -3.41 116.42 117.81 2cio h ASP 55 Ca 0.27 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.17 2cio h ASP 55 Cb -0.01 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 2cio h ASP 55 CO -0.10 0.79 -1.72 0.00 -1.72 0.00 0.00 179.24 176.50 2cio s ASP 57 N -4.13 6.51 0.00 0.00 2.15 -0.19 -4.82 116.67 116.20 2cio s ASP 57 Ca -0.05 -1.56 0.18 0.00 0.43 0.00 0.00 52.55 51.55 2cio s ASP 57 Cb 0.05 -2.52 0.84 0.00 -0.30 0.00 0.00 42.92 40.98 2cio s ASP 57 CO 0.47 -1.40 1.57 0.54 -0.17 0.00 0.00 175.17 176.18 2cio n ARG 58 N 8.26 1.40 0.11 4.34 5.12 -1.26 -2.17 116.66 132.46 2cio n ARG 58 Ca 0.29 -0.60 -0.03 0.00 -1.93 0.00 0.00 57.85 55.57 2cio n ARG 58 Cb 0.50 -1.33 0.04 0.00 -1.16 0.00 0.00 32.46 30.52 2cio n ARG 58 CO 0.00 0.00 0.00 -0.09 -1.93 0.00 0.00 177.63 175.61 2cio h ARG 59 N 1.19 0.00 -7.52 5.56 2.43 -1.98 -3.45 114.38 110.61 2cio h ARG 59 Ca 0.00 0.00 -0.46 0.00 -0.81 0.00 0.00 59.98 58.71 2cio h ARG 59 Cb 0.26 0.00 0.13 0.00 -0.42 0.00 0.00 29.97 29.94 2cio h ARG 59 CO 0.00 0.77 0.29 -1.12 -1.51 0.00 0.00 179.97 178.40 2cio s SER 60 N -6.75 3.66 -0.25 -3.80 0.01 -0.92 -4.92 113.70 100.74 2cio s SER 60 Ca 0.00 0.01 0.09 0.00 1.31 0.00 0.00 55.95 57.36 2cio s SER 60 Cb 0.11 -0.20 0.44 0.00 0.21 0.00 0.00 66.02 66.58 2cio s SER 60 CO 0.78 -2.35 1.22 -1.22 0.41 0.00 0.00 173.24 172.08 2cio n TYR 61 N -3.36 1.23 -0.12 2.43 4.01 0.46 -4.99 117.16 116.81 2cio n TYR 61 Ca 0.15 -1.82 0.00 0.00 -0.16 0.00 0.00 57.90 56.07 2cio n TYR 61 Cb 0.60 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 39.32 2cio n TYR 61 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2cio n GLY 62 N -0.94 3.51 0.00 2.72 0.00 -1.22 -0.83 105.19 108.43 2cio n GLY 62 Ca 0.30 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2cio n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cio n ASN 64 N -1.06 4.58 0.00 0.00 3.02 -0.01 -0.26 115.26 121.53 2cio n ASN 64 Ca 0.15 -2.48 0.00 0.00 -0.03 0.00 0.00 54.58 52.22 2cio n ASN 64 Cb 0.09 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 38.69 2cio n ASN 64 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cio n GLY 65 N 1.01 1.17 0.00 7.41 0.00 -0.88 -4.87 105.19 109.04 2cio n GLY 65 Ca 0.24 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2cio n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cio n GLY 66 N 0.57 -1.01 2.93 -0.02 0.00 -1.26 -0.40 105.19 105.99 2cio n GLY 66 Ca 0.00 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 44.87 2cio n GLY 66 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cio s TYR 67 N -3.00 2.15 0.36 1.61 1.51 -1.26 -4.80 117.35 113.92 2cio s TYR 67 Ca 0.00 -1.51 0.11 0.00 -1.01 0.00 0.00 57.07 54.66 2cio s TYR 67 Cb 0.00 -1.50 0.87 0.00 -0.11 0.00 0.00 41.96 41.23 2cio s TYR 67 CO 0.00 -0.72 1.84 -1.35 -1.11 0.00 0.00 175.55 174.21 2cio h PRO 68 N 8.02 0.61 -0.09 -1.71 0.11 -2.00 -1.68 132.00 135.25 2cio h PRO 68 Ca -0.21 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.74 2cio h PRO 68 Cb 1.09 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 2cio h PRO 68 CO 0.42 0.41 -0.49 0.11 -0.21 0.00 0.00 178.00 178.23 2cio h TRP 69 N 0.63 0.29 -0.38 0.65 5.08 -1.95 -0.81 115.95 119.47 2cio h TRP 69 Ca 0.49 -0.09 -0.09 0.00 1.08 0.00 0.00 58.89 60.28 2cio h TRP 69 Cb 0.91 -0.06 -0.01 0.00 -3.00 0.00 0.00 29.16 27.00 2cio h TRP 69 CO -0.00 0.69 -0.12 0.66 -1.28 0.00 0.00 178.44 178.39 2cio h SER 70 N 0.19 0.75 -0.73 0.11 4.64 -1.82 -1.27 113.55 115.42 2cio h SER 70 Ca 0.01 -0.38 0.03 0.00 -0.47 0.00 0.00 61.79 60.98 2cio h SER 70 Cb 0.94 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 62.78 2cio h SER 70 CO 0.08 0.96 0.47 0.00 -0.87 0.00 0.00 176.83 177.46 2cio h ALA 71 N 0.82 0.95 -0.22 5.18 0.00 -1.10 -2.58 119.26 122.32 2cio h ALA 71 Ca 0.09 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2cio h ALA 71 Cb 0.64 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2cio h ALA 71 CO 0.04 0.27 -0.23 -0.07 0.00 0.00 0.00 179.25 179.26 2cio h LEU 72 N 0.92 0.40 -0.97 0.00 3.38 -0.91 -2.53 115.31 115.60 2cio h LEU 72 Ca 0.29 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 58.03 2cio h LEU 72 Cb -0.01 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2cio h LEU 72 CO -0.10 0.64 -0.51 0.06 0.09 0.00 0.00 178.44 178.62 2cio h GLN 73 N 0.36 0.00 -0.58 1.13 3.07 -1.02 -2.85 115.11 115.23 2cio h GLN 73 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.80 2cio h GLN 73 Cb 0.61 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.14 2cio h GLN 73 CO 0.04 0.51 0.36 1.25 0.09 0.00 0.00 178.83 181.08 2cio h LEU 74 N 0.00 0.68 -1.19 0.06 6.46 -1.06 -1.04 115.31 119.22 2cio h LEU 74 Ca -0.01 -0.04 -0.08 0.00 -0.12 0.00 0.00 57.88 57.64 2cio h LEU 74 Cb 0.91 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.66 2cio h LEU 74 CO 0.07 0.51 -0.30 0.58 -0.62 0.00 0.00 178.44 178.68 2cio h VAL 75 N 0.78 1.25 0.19 1.05 2.07 -1.36 0.69 116.25 120.91 2cio h VAL 75 Ca 0.21 -1.19 -0.32 0.00 0.82 0.00 0.00 66.70 66.22 2cio h VAL 75 Cb -0.05 1.52 0.02 0.00 -1.52 0.00 0.00 31.29 31.26 2cio h VAL 75 CO -0.04 0.35 -1.45 0.00 0.02 0.00 0.00 177.57 176.45 2cio h ALA 76 N 1.54 0.02 0.00 1.67 0.00 -1.25 -2.80 119.26 118.44 2cio h ALA 76 Ca 0.02 -0.94 0.00 0.00 0.00 0.00 0.00 54.91 53.99 2cio h ALA 76 Cb 0.62 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2cio h ALA 76 CO 0.04 0.89 -1.64 0.00 0.00 0.00 0.00 179.25 178.54 2cio n GLN 77 N -3.60 0.45 0.00 0.00 10.64 -0.42 -4.56 117.38 119.88 2cio n GLN 77 Ca -0.15 -0.13 0.00 0.00 -1.83 0.00 0.00 57.00 54.89 2cio n GLN 77 Cb 1.07 -1.51 0.00 0.00 -0.86 0.00 0.00 30.24 28.94 2cio n GLN 77 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 2cio n TYR 78 N -1.99 0.00 -3.84 2.61 4.02 0.23 -5.04 117.16 113.15 2cio n TYR 78 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 2cio n TYR 78 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.80 2cio n TYR 78 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2cio n GLY 79 N 4.77 -1.33 3.30 2.72 0.00 -0.36 -4.88 105.19 109.41 2cio n GLY 79 Ca 0.00 -1.16 -0.14 0.00 0.00 0.00 0.00 46.02 44.73 2cio n GLY 79 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2cio s ILE 80 N -3.00 0.03 0.43 -0.61 2.07 -0.62 -4.15 121.20 115.35 2cio s ILE 80 Ca 0.00 -0.24 -0.01 0.00 -1.41 0.00 0.00 60.65 58.99 2cio s ILE 80 Cb 0.00 -0.65 -0.02 0.00 0.13 0.00 0.00 42.46 41.92 2cio s ILE 80 CO 0.00 -0.13 0.66 -1.00 -1.91 0.00 0.00 174.94 172.56 2cio s HIS 81 N -0.74 3.36 0.62 3.50 3.76 -1.26 -0.61 115.29 123.92 2cio s HIS 81 Ca -0.08 0.37 -0.19 0.00 -0.15 0.00 0.00 55.06 55.01 2cio s HIS 81 Cb -0.04 -2.20 -0.02 0.00 1.11 0.00 0.00 32.58 31.44 2cio s HIS 81 CO 0.04 -0.22 1.31 0.71 -0.85 0.00 0.00 174.74 175.73 2cio s TYR 82 N -2.53 2.12 0.29 1.40 2.02 -1.26 -1.59 117.35 117.80 2cio s TYR 82 Ca 0.46 1.46 -0.01 0.00 -0.37 0.00 0.00 57.07 58.60 2cio s TYR 82 Cb -0.10 -3.72 0.46 0.00 -0.40 0.00 0.00 41.96 38.20 2cio s TYR 82 CO 0.39 -2.92 1.91 -0.09 -1.57 0.00 0.00 175.55 173.27 2cio h ARG 83 N 0.75 1.09 0.00 -0.62 2.43 -1.17 -2.04 114.38 114.82 2cio h ARG 83 Ca -0.51 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.60 2cio h ARG 83 Cb 1.33 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2cio h ARG 83 CO 0.54 0.72 0.00 -2.95 -1.51 0.00 0.00 179.97 176.77 2cio h ASN 84 N 1.12 0.00 0.64 -3.80 -1.07 -1.92 -0.33 115.58 110.21 2cio h ASN 84 Ca 0.39 0.00 -0.27 0.00 0.07 0.00 0.00 56.30 56.49 2cio h ASN 84 Cb 0.12 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.32 2cio h ASN 84 CO -0.14 0.00 -1.49 0.74 0.07 0.00 0.00 177.43 176.61 2cio h THR 85 N 0.00 1.12 -1.92 6.14 2.02 -1.79 -3.42 112.91 115.06 2cio h THR 85 Ca 0.00 -2.92 -0.54 0.00 0.77 0.00 0.00 66.41 63.72 2cio h THR 85 Cb 0.45 2.56 -0.37 0.00 -1.74 0.00 0.00 68.15 69.05 2cio h THR 85 CO 0.00 0.65 -1.05 0.00 0.37 0.00 0.00 175.52 175.49 2cio n TYR 86 N -3.16 -0.68 -1.54 3.16 -0.00 -0.79 -5.03 117.16 109.13 2cio n TYR 86 Ca -0.12 -3.39 -0.29 0.00 -0.00 0.00 0.00 57.90 54.10 2cio n TYR 86 Cb 1.02 -0.12 0.11 0.00 -0.00 0.00 0.00 39.34 40.35 2cio n TYR 86 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 2cio s PRO 87 N -0.86 1.71 0.05 2.98 0.04 -0.20 -4.38 135.00 134.34 2cio s PRO 87 Ca 0.34 0.51 -0.29 0.00 0.04 0.00 0.00 61.00 61.61 2cio s PRO 87 Cb 0.15 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.76 2cio s PRO 87 CO -0.13 -1.85 0.94 -0.47 0.04 0.00 0.00 177.00 175.52 2cio s TYR 88 N -3.20 3.73 -0.02 0.56 5.04 -1.26 -4.66 117.35 117.54 2cio s TYR 88 Ca 0.62 1.70 0.04 0.00 -2.44 0.00 0.00 57.07 56.98 2cio s TYR 88 Cb -0.15 -3.05 -0.05 0.00 0.35 0.00 0.00 41.96 39.07 2cio s TYR 88 CO 0.54 0.12 0.08 0.39 -1.34 0.00 0.00 175.55 175.34 2cio n GLU 89 N 3.31 0.66 -0.99 4.97 1.02 -1.26 -5.03 120.64 123.32 2cio n GLU 89 Ca 0.03 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2cio n GLU 89 Cb 0.50 -1.04 0.00 0.00 -0.02 0.00 0.00 31.44 30.88 2cio n GLU 89 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2cio n GLY 90 N 2.18 0.47 3.09 0.62 0.00 -1.26 -5.01 105.19 105.27 2cio n GLY 90 Ca -0.01 -0.33 -0.12 0.00 0.00 0.00 0.00 46.02 45.56 2cio n GLY 90 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2cio s VAL 91 N -2.00 0.01 0.11 1.61 -7.23 -1.26 -4.61 120.40 107.04 2cio s VAL 91 Ca 0.00 -0.12 -0.30 0.00 -1.81 0.00 0.00 61.98 59.75 2cio s VAL 91 Cb 0.00 -0.31 -0.06 0.00 0.56 0.00 0.00 36.38 36.57 2cio s VAL 91 CO 0.00 -0.06 1.07 -1.58 -0.31 0.00 0.00 175.10 174.22 2cio s GLN 92 N -0.16 4.58 0.10 4.82 0.74 -1.26 -4.98 119.66 123.50 2cio s GLN 92 Ca -0.03 1.63 0.01 0.00 0.05 0.00 0.00 55.36 57.02 2cio s GLN 92 Cb -0.02 -3.34 -0.00 0.00 1.10 0.00 0.00 33.01 30.74 2cio s GLN 92 CO 0.01 0.01 0.03 0.54 -0.55 0.00 0.00 175.29 175.33 2cio n ARG 93 N 3.03 0.96 -1.78 1.67 1.74 -1.26 -5.07 116.66 115.95 2cio n ARG 93 Ca 0.04 -0.81 -0.33 0.00 -0.77 0.00 0.00 57.85 55.98 2cio n ARG 93 Cb 0.48 0.41 0.04 0.00 -1.02 0.00 0.00 32.46 32.37 2cio n ARG 93 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 2cio s TYR 94 N -1.83 2.74 -0.08 -1.55 -0.85 -1.26 -4.58 117.35 109.93 2cio s TYR 94 Ca 0.04 1.53 -0.30 0.00 -0.52 0.00 0.00 57.07 57.83 2cio s TYR 94 Cb 0.00 -3.10 -0.04 0.00 0.38 0.00 0.00 41.96 39.20 2cio s TYR 94 CO 0.03 -1.52 1.46 0.00 -1.52 0.00 0.00 175.55 174.00 2cio n ARG 96 N 6.56 2.91 -0.26 0.00 1.74 -1.26 -4.74 116.66 121.60 2cio n ARG 96 Ca 0.15 -2.56 0.02 0.00 -0.77 0.00 0.00 57.85 54.69 2cio n ARG 96 Cb 0.44 -1.64 0.15 0.00 -1.02 0.00 0.00 32.46 30.39 2cio n ARG 96 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 2cio h SER 97 N 1.86 0.53 -0.43 0.55 0.02 -1.95 -2.04 113.55 112.08 2cio h SER 97 Ca 0.00 0.06 -0.11 0.00 -0.84 0.00 0.00 61.79 60.89 2cio h SER 97 Cb 1.19 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.68 2cio h SER 97 CO 0.14 0.30 -0.16 0.03 -1.14 0.00 0.00 176.83 176.00 2cio h ARG 98 N 0.66 0.91 0.00 3.45 -0.00 -1.85 -2.92 114.38 114.62 2cio h ARG 98 Ca 0.37 -0.35 0.00 0.00 -0.50 0.00 0.00 59.98 59.50 2cio h ARG 98 Cb 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 29.97 30.30 2cio h ARG 98 CO -0.27 1.00 0.00 0.39 0.00 0.00 0.00 179.97 181.09 2cio n GLU 99 N -4.13 0.18 -0.67 0.04 1.02 -0.82 -3.10 120.64 113.16 2cio n GLU 99 Ca 0.01 0.29 0.08 0.00 -0.02 0.00 0.00 57.16 57.52 2cio n GLU 99 Cb 0.41 -1.77 0.34 0.00 -0.02 0.00 0.00 31.44 30.41 2cio n GLU 99 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2cio n LYS 100 N -2.09 3.98 0.00 3.49 5.02 -0.89 -5.08 118.16 122.59 2cio n LYS 100 Ca 0.04 -2.95 0.00 0.00 -2.02 0.00 0.00 58.31 53.37 2cio n LYS 100 Cb 0.30 -2.01 0.00 0.00 -0.02 0.00 0.00 35.03 33.31 2cio n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2cio n GLY 101 N 0.42 -2.18 3.75 0.72 0.00 -1.18 -4.91 105.19 101.82 2cio n GLY 101 Ca 0.25 -1.49 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 2cio n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cio s PRO 102 N -0.34 2.74 0.84 1.61 0.04 -1.26 -4.76 135.00 133.87 2cio s PRO 102 Ca 0.00 1.70 -0.14 0.00 0.04 0.00 0.00 61.00 62.59 2cio s PRO 102 Cb 0.00 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2cio s PRO 102 CO 0.00 -1.35 0.50 0.66 0.04 0.00 0.00 177.00 176.85 2cio n TYR 103 N -2.05 -1.03 -0.08 0.56 0.53 -1.26 -4.94 117.16 108.90 2cio n TYR 103 Ca 0.13 0.29 -0.11 0.00 -1.02 0.00 0.00 57.90 57.19 2cio n TYR 103 Cb 0.50 -1.86 -0.15 0.00 -1.03 0.00 0.00 39.34 36.80 2cio n TYR 103 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2cio n ALA 104 N -3.03 1.46 -3.23 -0.72 0.00 0.21 -4.96 120.51 110.25 2cio n ALA 104 Ca 0.08 -1.13 -0.13 0.00 0.00 0.00 0.00 53.44 52.26 2cio n ALA 104 Cb 0.52 -0.37 -0.09 0.00 0.00 0.00 0.00 19.45 19.51 2cio n ALA 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cio s ALA 105 N -2.52 -0.75 0.02 0.00 0.00 -0.80 -5.00 121.76 112.70 2cio s ALA 105 Ca -0.12 0.31 0.01 0.00 0.00 0.00 0.00 51.96 52.16 2cio s ALA 105 Cb 0.07 0.06 -0.02 0.00 0.00 0.00 0.00 23.12 23.23 2cio s ALA 105 CO 0.80 -0.25 -0.04 0.21 0.00 0.00 0.00 175.76 176.48 2cio s LYS 106 N -1.29 0.32 0.36 0.00 2.20 -1.26 -1.59 119.74 118.49 2cio s LYS 106 Ca -0.13 -0.51 0.08 0.00 -0.36 0.00 0.00 55.97 55.04 2cio s LYS 106 Cb -0.05 -0.05 -0.02 0.00 -1.51 0.00 0.00 37.83 36.19 2cio s LYS 106 CO 0.04 -0.00 0.33 0.95 -0.36 0.00 0.00 175.35 176.31 2cio s THR 107 N -1.09 3.24 -2.18 3.43 -4.23 -1.10 -5.00 115.64 108.71 2cio s THR 107 Ca -0.10 -1.35 0.21 0.00 -1.18 0.00 0.00 61.69 59.27 2cio s THR 107 Cb -0.08 -3.12 0.41 0.00 1.34 0.00 0.00 72.50 71.06 2cio s THR 107 CO -0.00 -0.11 1.36 0.47 -0.54 0.00 0.00 174.62 175.80 2cio n ASP 108 N -1.45 3.38 0.00 3.99 8.00 0.14 -4.32 116.55 126.29 2cio n ASP 108 Ca 0.00 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.54 2cio n ASP 108 Cb 0.60 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 2cio n ASP 108 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2cio n GLY 109 N 1.36 -1.50 3.03 0.44 0.00 -0.94 -4.89 105.19 102.69 2cio n GLY 109 Ca 0.18 -1.46 -0.19 0.00 0.00 0.00 0.00 46.02 44.55 2cio n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cio s VAL 110 N -2.12 0.76 0.07 1.61 0.11 -1.26 -0.05 120.40 119.52 2cio s VAL 110 Ca 0.00 -0.40 0.07 0.00 -2.93 0.00 0.00 61.98 58.72 2cio s VAL 110 Cb 0.00 -0.65 -0.03 0.00 -1.53 0.00 0.00 36.38 34.17 2cio s VAL 110 CO 0.00 0.22 -0.19 -0.13 -3.33 0.00 0.00 175.10 171.67 2cio s ARG 111 N -0.16 1.19 0.00 1.54 0.52 0.17 -4.89 118.95 117.32 2cio s ARG 111 Ca 0.03 -1.00 -0.16 0.00 -0.52 0.00 0.00 55.73 54.08 2cio s ARG 111 Cb -0.04 -1.34 -0.06 0.00 0.52 0.00 0.00 34.95 34.03 2cio s ARG 111 CO -0.00 0.33 0.44 -1.14 0.02 0.00 0.00 175.30 174.94 2cio s GLN 112 N -1.47 3.99 0.32 3.54 0.74 -1.26 -1.35 119.66 124.17 2cio s GLN 112 Ca 0.06 0.47 -0.28 0.00 0.05 0.00 0.00 55.36 55.65 2cio s GLN 112 Cb -0.09 -3.24 -0.10 0.00 1.10 0.00 0.00 33.01 30.68 2cio s GLN 112 CO 0.03 0.65 1.18 0.08 -0.55 0.00 0.00 175.29 176.68 2cio s VAL 113 N -0.98 3.17 -0.06 1.34 1.01 -0.05 -4.98 120.40 119.85 2cio s VAL 113 Ca 0.25 1.14 -0.34 0.00 0.00 0.00 0.00 61.98 63.02 2cio s VAL 113 Cb -0.17 -3.71 -0.12 0.00 0.00 0.00 0.00 36.38 32.37 2cio s VAL 113 CO 0.14 0.25 1.83 0.00 0.00 0.00 0.00 175.10 177.32 2cio n GLN 114 N 0.86 2.12 -1.28 2.72 6.02 -1.26 -4.68 117.38 121.88 2cio n GLN 114 Ca 0.00 0.77 -0.31 0.00 -0.01 0.00 0.00 57.00 57.46 2cio n GLN 114 Cb 0.44 -2.60 0.10 0.00 1.02 0.00 0.00 30.24 29.20 2cio n GLN 114 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2cio s PRO 115 N 3.61 2.13 -1.50 -1.09 0.04 -1.26 -4.12 135.00 132.82 2cio s PRO 115 Ca 0.91 1.07 -0.12 0.00 0.04 0.00 0.00 61.00 62.91 2cio s PRO 115 Cb -0.71 -1.89 0.07 0.00 0.04 0.00 0.00 34.50 32.01 2cio s PRO 115 CO 0.51 -1.71 0.94 0.66 0.04 0.00 0.00 177.00 177.44 2cio n TYR 116 N -3.56 -2.26 -3.38 0.56 4.01 -0.29 -4.94 117.16 107.31 2cio n TYR 116 Ca 0.09 0.90 -0.17 0.00 -0.16 0.00 0.00 57.90 58.56 2cio n TYR 116 Cb 0.54 -4.07 -0.09 0.00 -0.31 0.00 0.00 39.34 35.41 2cio n TYR 116 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2cio s ASN 117 N -3.48 1.46 0.14 7.72 3.84 -1.26 -4.79 114.94 118.57 2cio s ASN 117 Ca 0.56 -1.04 -0.19 0.00 0.21 0.00 0.00 52.86 52.40 2cio s ASN 117 Cb -0.28 0.54 -0.00 0.00 -0.55 0.00 0.00 41.25 40.96 2cio s ASN 117 CO 0.83 -0.34 1.72 -0.08 -2.79 0.00 0.00 177.10 176.44 2cio h GLU 118 N 7.83 0.10 -1.01 0.43 4.81 -1.91 -2.20 114.58 122.63 2cio h GLU 118 Ca -0.07 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.18 2cio h GLU 118 Cb 1.07 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.37 2cio h GLU 118 CO 0.29 0.06 0.66 0.78 -0.73 0.00 0.00 179.01 180.07 2cio h GLY 119 N 0.10 1.44 1.00 1.92 0.00 -1.98 0.69 103.07 106.25 2cio h GLY 119 Ca 0.11 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 46.93 2cio h GLY 119 CO -0.18 0.47 0.37 0.00 0.00 0.00 0.00 176.54 177.21 2cio h ALA 120 N 1.39 0.73 -0.10 3.60 0.00 -1.81 0.27 119.26 123.34 2cio h ALA 120 Ca 0.38 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 2cio h ALA 120 Cb -0.08 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 2cio h ALA 120 CO -0.10 0.18 0.02 1.25 0.00 0.00 0.00 179.25 180.60 2cio h LEU 121 N 0.78 0.15 -1.01 0.00 5.85 -0.92 -1.70 115.31 118.46 2cio h LEU 121 Ca 0.21 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.72 2cio h LEU 121 Cb -0.07 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 40.87 2cio h LEU 121 CO -0.04 0.35 0.66 -0.07 -0.34 0.00 0.00 178.44 179.00 2cio h LEU 122 N -0.05 1.13 -0.90 2.25 3.38 -0.68 -0.06 115.31 120.38 2cio h LEU 122 Ca 0.03 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 2cio h LEU 122 Cb 0.25 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2cio h LEU 122 CO 0.00 0.79 0.24 0.22 0.09 0.00 0.00 178.44 179.79 2cio h TYR 123 N 1.32 1.07 -0.16 1.13 3.20 -0.30 -0.15 116.97 123.08 2cio h TYR 123 Ca 0.39 -0.09 -0.03 0.00 3.14 0.00 0.00 58.73 62.14 2cio h TYR 123 Cb -0.07 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 37.87 2cio h TYR 123 CO -0.00 0.84 0.00 0.77 -1.64 0.00 0.00 178.16 178.13 2cio h SER 124 N 1.02 0.28 -0.76 -2.11 0.02 -0.76 -2.86 113.55 108.38 2cio h SER 124 Ca 0.23 -0.30 0.05 0.00 -0.84 0.00 0.00 61.79 60.92 2cio h SER 124 Cb 0.25 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.67 2cio h SER 124 CO -0.01 0.51 0.50 0.40 -1.14 0.00 0.00 176.83 177.09 2cio h ILE 125 N 0.03 1.07 0.00 3.27 2.04 -0.70 0.75 117.51 123.97 2cio h ILE 125 Ca 0.05 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 2cio h ILE 125 Cb 0.37 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2cio h ILE 125 CO 0.01 0.16 -0.01 0.00 0.00 0.00 0.00 178.15 178.31 2cio h ALA 126 N 1.57 1.02 0.01 1.87 0.00 -0.80 -2.85 119.26 120.09 2cio h ALA 126 Ca 0.31 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.90 2cio h ALA 126 Cb 0.15 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 2cio h ALA 126 CO -0.10 0.01 -1.89 0.09 0.00 0.00 0.00 179.25 177.35 2cio n ASN 127 N -3.12 0.88 -3.64 0.00 3.02 0.14 -5.06 115.26 107.48 2cio n ASN 127 Ca -0.02 0.30 -0.03 0.00 -0.03 0.00 0.00 54.58 54.81 2cio n ASN 127 Cb 0.17 0.04 -0.02 0.00 -0.61 0.00 0.00 39.78 39.36 2cio n ASN 127 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2cio s GLN 128 N -2.57 0.09 0.57 3.52 -2.07 -0.51 -5.07 119.66 113.62 2cio s GLN 128 Ca -0.09 -0.02 -0.20 0.00 -1.82 0.00 0.00 55.36 53.23 2cio s GLN 128 Cb 0.07 0.04 -0.05 0.00 -1.09 0.00 0.00 33.01 31.99 2cio s GLN 128 CO 0.81 -0.04 1.13 -2.30 -1.32 0.00 0.00 175.29 173.58 2cio n PRO 129 N 0.09 1.21 -4.49 9.60 -0.02 -1.26 -3.85 135.00 136.27 2cio n PRO 129 Ca 0.03 0.45 -0.22 0.00 -2.02 0.00 0.00 63.50 61.75 2cio n PRO 129 Cb 0.57 -2.32 -0.16 0.00 -0.02 0.00 0.00 33.50 31.57 2cio n PRO 129 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2cio s VAL 130 N -1.40 0.92 0.03 -1.45 1.01 -0.55 -4.73 120.40 114.23 2cio s VAL 130 Ca 0.74 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 61.98 2cio s VAL 130 Cb -0.43 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 2cio s VAL 130 CO 0.48 0.28 1.07 -0.55 0.00 0.00 0.00 175.10 176.38 2cio s SER 131 N 0.15 7.25 0.10 3.32 0.15 0.59 0.35 113.70 125.62 2cio s SER 131 Ca -0.03 1.82 0.02 0.00 0.70 0.00 0.00 55.95 58.46 2cio s SER 131 Cb -0.09 -2.58 -0.04 0.00 -1.71 0.00 0.00 66.02 61.60 2cio s SER 131 CO 0.01 -0.34 -0.05 0.68 1.20 0.00 0.00 173.24 174.74 2cio s VAL 132 N 0.95 0.66 0.21 4.45 -7.23 -0.63 -0.86 120.40 117.96 2cio s VAL 132 Ca 0.54 -1.94 0.10 0.00 -1.81 0.00 0.00 61.98 58.88 2cio s VAL 132 Cb -0.25 -1.73 -0.05 0.00 0.56 0.00 0.00 36.38 34.92 2cio s VAL 132 CO 0.29 -0.83 -0.20 0.54 -0.31 0.00 0.00 175.10 174.59 2cio s VAL 133 N -3.65 2.14 0.21 1.32 0.11 -1.24 -0.90 120.40 118.39 2cio s VAL 133 Ca 0.13 -2.12 -0.19 0.00 -2.93 0.00 0.00 61.98 56.87 2cio s VAL 133 Cb 0.05 -2.07 0.03 0.00 -1.53 0.00 0.00 36.38 32.87 2cio s VAL 133 CO -0.04 -0.32 0.58 -1.48 -3.33 0.00 0.00 175.10 170.52 2cio s LEU 134 N -2.97 -0.12 -0.35 2.54 0.05 -0.18 -3.87 118.68 113.77 2cio s LEU 134 Ca 0.22 -0.43 -0.25 0.00 0.05 0.00 0.00 54.13 53.71 2cio s LEU 134 Cb -0.06 2.36 0.01 0.00 -2.05 0.00 0.00 46.19 46.46 2cio s LEU 134 CO 0.10 -1.11 0.88 -0.70 -0.55 0.00 0.00 176.35 174.96 2cio s GLU 135 N -3.87 3.86 0.00 1.48 2.12 0.67 -0.67 118.70 122.30 2cio s GLU 135 Ca 0.08 0.56 0.11 0.00 0.36 0.00 0.00 54.97 56.08 2cio s GLU 135 Cb -0.02 -3.78 0.05 0.00 0.26 0.00 0.00 34.13 30.63 2cio s GLU 135 CO -0.02 -0.87 0.77 0.00 -0.54 0.00 0.00 175.26 174.60 2cio n ALA 136 N 6.58 2.65 0.24 6.30 0.00 -1.26 -4.68 120.51 130.34 2cio n ALA 136 Ca 0.06 -0.52 0.12 0.00 0.00 0.00 0.00 53.44 53.09 2cio n ALA 136 Cb 0.48 -0.38 0.55 0.00 0.00 0.00 0.00 19.45 20.10 2cio n ALA 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cio h ALA 137 N 2.04 1.04 -2.73 0.00 0.00 -1.93 -3.38 119.26 114.32 2cio h ALA 137 Ca 0.00 -0.14 -0.51 0.00 0.00 0.00 0.00 54.91 54.26 2cio h ALA 137 Cb 0.42 -0.02 0.08 0.00 0.00 0.00 0.00 17.79 18.26 2cio h ALA 137 CO 0.00 0.20 0.49 0.20 0.00 0.00 0.00 179.25 180.14 2cio s GLY 138 N -4.25 2.77 0.49 0.00 0.00 -1.26 -4.90 107.32 100.17 2cio s GLY 138 Ca 0.00 0.97 0.16 0.00 0.00 0.00 0.00 44.72 45.86 2cio s GLY 138 CO 0.61 1.42 2.07 0.07 0.00 0.00 0.00 173.10 177.27 2cio h LYS 139 N 1.79 0.15 -0.41 2.90 2.10 -1.94 -2.18 116.57 118.99 2cio h LYS 139 Ca -0.50 -0.01 -0.03 0.00 -2.00 0.00 0.00 60.65 58.12 2cio h LYS 139 Cb 1.26 -0.03 -0.02 0.00 -0.90 0.00 0.00 32.23 32.54 2cio h LYS 139 CO 0.59 0.10 0.15 -0.44 -2.00 0.00 0.00 179.45 177.85 2cio h ASP 140 N 0.16 0.58 -0.28 7.07 3.32 -1.91 -0.04 116.42 125.32 2cio h ASP 140 Ca 0.13 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 56.92 2cio h ASP 140 Cb 0.32 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2cio h ASP 140 CO -0.02 0.61 -0.09 0.15 -1.72 0.00 0.00 179.24 178.17 2cio h PHE 141 N 0.52 0.64 -0.46 4.55 3.57 -1.78 -2.40 116.94 121.57 2cio h PHE 141 Ca 0.13 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2cio h PHE 141 Cb 0.23 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 2cio h PHE 141 CO 0.01 0.77 0.29 1.96 -2.23 0.00 0.00 178.31 179.11 2cio h GLN 142 N 0.31 0.61 -0.24 1.11 1.08 -1.16 -2.79 115.11 114.04 2cio h GLN 142 Ca 0.07 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 2cio h GLN 142 Cb 0.58 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.88 2cio h GLN 142 CO 0.03 0.42 0.00 1.28 -0.95 0.00 0.00 178.83 179.62 2cio n LEU 143 N -4.45 3.08 -4.68 1.46 4.77 -0.05 -4.96 117.00 112.17 2cio n LEU 143 Ca 0.04 -1.22 -0.45 0.00 -0.03 0.00 0.00 56.01 54.35 2cio n LEU 143 Cb 0.07 -0.15 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 2cio n LEU 143 CO 0.36 0.61 1.24 0.00 -1.33 0.00 0.00 177.39 178.27 2cio n TYR 144 N 1.30 2.41 -0.42 -1.77 9.36 -0.91 -4.89 117.16 122.24 2cio n TYR 144 Ca 0.17 0.21 0.00 0.00 3.32 0.00 0.00 57.90 61.60 2cio n TYR 144 Cb 0.57 -2.58 0.00 0.00 -0.63 0.00 0.00 39.34 36.70 2cio n TYR 144 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2cio n ARG 145 N 3.53 1.06 0.00 2.98 5.12 -1.26 -2.12 116.66 125.97 2cio n ARG 145 Ca 0.17 -0.85 0.00 0.00 -1.93 0.00 0.00 57.85 55.24 2cio n ARG 145 Cb 0.30 -0.79 0.00 0.00 -1.16 0.00 0.00 32.46 30.82 2cio n ARG 145 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2cio n GLY 146 N -0.21 3.77 0.14 -0.13 0.00 -1.26 -4.30 105.19 103.19 2cio n GLY 146 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2cio n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cio n GLY 147 N -1.80 -3.75 3.60 -0.02 0.00 -1.26 -4.86 105.19 97.10 2cio n GLY 147 Ca 0.00 -2.04 -0.43 0.00 0.00 0.00 0.00 46.02 43.55 2cio n GLY 147 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cio s ILE 148 N -0.83 4.49 -0.19 -0.61 1.01 -1.26 -4.20 121.20 119.60 2cio s ILE 148 Ca 0.00 1.17 -0.29 0.00 0.00 0.00 0.00 60.65 61.53 2cio s ILE 148 Cb 0.00 -4.41 0.00 0.00 0.01 0.00 0.00 42.46 38.06 2cio s ILE 148 CO 0.00 -0.67 1.07 0.12 0.00 0.00 0.00 174.94 175.46 2cio s PHE 149 N 3.72 3.30 -1.54 3.97 5.36 0.28 -4.81 117.98 128.26 2cio s PHE 149 Ca 0.40 1.42 0.13 0.00 -0.96 0.00 0.00 56.93 57.92 2cio s PHE 149 Cb -0.11 -3.29 0.12 0.00 -0.34 0.00 0.00 43.02 39.39 2cio s PHE 149 CO 0.22 -0.63 0.92 1.33 -1.46 0.00 0.00 175.22 175.60 2cio n VAL 150 N 5.17 0.07 0.00 3.12 0.24 -1.26 -0.74 118.33 124.93 2cio n VAL 150 Ca 0.12 -0.53 0.00 0.00 -2.04 0.00 0.00 64.34 61.88 2cio n VAL 150 Cb 0.46 1.21 0.00 0.00 -1.47 0.00 0.00 33.84 34.04 2cio n VAL 150 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2cio n GLY 151 N 0.70 0.12 3.75 7.63 0.00 -1.26 -4.71 105.19 111.42 2cio n GLY 151 Ca 0.08 -1.85 -0.37 0.00 0.00 0.00 0.00 46.02 43.87 2cio n GLY 151 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2cio s PRO 152 N 0.00 3.11 0.06 1.61 0.02 -1.26 -4.93 135.00 133.61 2cio s PRO 152 Ca 0.00 2.04 -0.26 0.00 0.02 0.00 0.00 61.00 62.80 2cio s PRO 152 Cb 0.00 -2.14 0.09 0.00 0.02 0.00 0.00 34.50 32.46 2cio s PRO 152 CO 0.00 -1.15 0.76 0.00 -0.33 0.00 0.00 177.00 176.28 2cio n GLY 154 N -0.28 1.02 0.25 0.00 0.00 -1.26 -4.61 105.19 100.31 2cio n GLY 154 Ca -0.12 -1.91 0.06 0.00 0.00 0.00 0.00 46.02 44.04 2cio n GLY 154 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2cio n ASN 155 N -0.33 2.54 -4.49 1.61 3.02 -1.26 -3.27 115.26 113.09 2cio n ASN 155 Ca 0.00 -2.57 -0.44 0.00 -0.03 0.00 0.00 54.58 51.54 2cio n ASN 155 Cb 0.00 -0.28 -0.00 0.00 -0.61 0.00 0.00 39.78 38.89 2cio n ASN 155 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2cio s LYS 156 N -2.00 4.00 0.51 3.52 0.00 -1.26 -4.64 119.74 119.86 2cio s LYS 156 Ca 0.22 -2.35 -0.23 0.00 0.00 0.00 0.00 55.97 53.61 2cio s LYS 156 Cb 0.18 -5.14 -0.07 0.00 0.00 0.00 0.00 37.83 32.80 2cio s LYS 156 CO 0.05 -1.87 1.28 1.33 0.00 0.00 0.00 175.35 176.14 2cio n VAL 157 N 5.09 3.32 -1.92 1.79 0.24 -1.26 -4.41 118.33 121.18 2cio n VAL 157 Ca 0.37 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 62.17 2cio n VAL 157 Cb 0.44 -1.57 0.00 0.00 -1.47 0.00 0.00 33.84 31.24 2cio n VAL 157 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2cio n ASP 158 N -0.51 0.00 -3.67 -1.34 5.68 0.15 -4.85 116.55 112.00 2cio n ASP 158 Ca 0.09 -1.06 -0.09 0.00 -0.50 0.00 0.00 54.79 53.23 2cio n ASP 158 Cb 0.43 -0.01 -0.10 0.00 -1.14 0.00 0.00 41.12 40.30 2cio n ASP 158 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 2cio s HIS 159 N 0.00 -0.76 -0.18 2.11 5.04 -0.76 -4.82 115.29 115.92 2cio s HIS 159 Ca 0.00 1.52 -0.07 0.00 -1.54 0.00 0.00 55.06 54.97 2cio s HIS 159 Cb 0.00 0.36 -0.04 0.00 0.04 0.00 0.00 32.58 32.94 2cio s HIS 159 CO 0.00 -0.42 0.05 0.00 -2.34 0.00 0.00 174.74 172.03 2cio s ALA 160 N 1.85 3.36 0.00 1.58 0.00 -1.26 -1.01 121.76 126.27 2cio s ALA 160 Ca -0.07 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.12 2cio s ALA 160 Cb -0.09 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 21.14 2cio s ALA 160 CO -0.14 0.16 0.00 1.33 0.00 0.00 0.00 175.76 177.11 2cio n VAL 161 N 3.58 0.00 -4.20 0.00 0.24 -0.08 -4.47 118.33 113.40 2cio n VAL 161 Ca -0.17 0.00 -0.18 0.00 -2.04 0.00 0.00 64.34 61.96 2cio n VAL 161 Cb 0.52 0.00 -0.15 0.00 -1.47 0.00 0.00 33.84 32.74 2cio n VAL 161 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2cio s ALA 162 N -2.00 0.58 -0.17 2.33 0.00 -1.06 -1.60 121.76 119.85 2cio s ALA 162 Ca 0.00 -0.18 -0.18 0.00 0.00 0.00 0.00 51.96 51.60 2cio s ALA 162 Cb 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 2cio s ALA 162 CO 0.00 0.08 0.50 0.00 0.00 0.00 0.00 175.76 176.34 2cio s ALA 163 N 0.28 3.51 0.00 0.00 0.00 0.16 -0.27 121.76 125.43 2cio s ALA 163 Ca -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.62 2cio s ALA 163 Cb -0.07 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.30 2cio s ALA 163 CO -0.00 -0.26 0.94 1.33 0.00 0.00 0.00 175.76 177.76 2cio n VAL 164 N 4.20 0.87 -1.41 0.00 0.24 0.10 -1.49 118.33 120.85 2cio n VAL 164 Ca -0.06 -0.89 0.00 0.00 -2.04 0.00 0.00 64.34 61.36 2cio n VAL 164 Cb 0.51 0.57 0.00 0.00 -1.47 0.00 0.00 33.84 33.44 2cio n VAL 164 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2cio n GLY 165 N -0.44 -1.63 3.65 7.63 0.00 -1.16 -0.69 105.19 112.56 2cio n GLY 165 Ca 0.00 -1.07 -0.06 0.00 0.00 0.00 0.00 46.02 44.89 2cio n GLY 165 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2cio s TYR 166 N -2.41 -0.24 0.04 1.61 -0.85 -0.14 -0.69 117.35 114.67 2cio s TYR 166 Ca 0.00 -0.01 -0.00 0.00 -0.52 0.00 0.00 57.07 56.54 2cio s TYR 166 Cb 0.00 0.60 0.00 0.00 0.38 0.00 0.00 41.96 42.94 2cio s TYR 166 CO 0.00 -0.75 0.07 0.41 -1.52 0.00 0.00 175.55 173.75 2cio n GLY 167 N -0.38 2.88 0.32 5.49 0.00 -0.37 -1.58 105.19 111.54 2cio n GLY 167 Ca -0.08 -1.36 0.14 0.00 0.00 0.00 0.00 46.02 44.72 2cio n GLY 167 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2cio h PRO 168 N 0.00 0.39 -0.12 1.61 0.11 -1.98 -2.77 132.00 129.24 2cio h PRO 168 Ca -0.03 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2cio h PRO 168 Cb 0.15 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.17 2cio h PRO 168 CO 0.05 0.26 0.00 0.09 -0.21 0.00 0.00 178.00 178.18 2cio n ASN 169 N -5.04 2.26 -3.79 -2.05 3.02 -1.26 -4.87 115.26 103.52 2cio n ASN 169 Ca 0.23 -1.92 -0.10 0.00 -0.03 0.00 0.00 54.58 52.77 2cio n ASN 169 Cb 0.69 -0.08 -0.05 0.00 -0.61 0.00 0.00 39.78 39.73 2cio n ASN 169 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 2cio s TYR 170 N -0.94 0.03 -0.11 3.10 1.13 -1.05 -1.84 117.35 117.69 2cio s TYR 170 Ca 0.09 -0.39 -0.01 0.00 -1.41 0.00 0.00 57.07 55.35 2cio s TYR 170 Cb 0.05 0.17 -0.03 0.00 -1.10 0.00 0.00 41.96 41.05 2cio s TYR 170 CO 0.06 -0.75 -0.07 0.42 -2.51 0.00 0.00 175.55 172.70 2cio s ILE 171 N -3.88 3.66 -0.23 -3.49 1.01 -0.05 -1.24 121.20 116.98 2cio s ILE 171 Ca 0.09 -0.47 -0.15 0.00 0.00 0.00 0.00 60.65 60.13 2cio s ILE 171 Cb 0.02 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 2cio s ILE 171 CO -0.06 0.55 0.35 -0.22 0.00 0.00 0.00 174.94 175.56 2cio s LEU 172 N -0.25 4.11 -0.03 2.97 2.96 0.13 -0.79 118.68 127.79 2cio s LEU 172 Ca 0.03 0.38 0.06 0.00 -0.22 0.00 0.00 54.13 54.38 2cio s LEU 172 Cb -0.13 -2.41 -0.01 0.00 0.50 0.00 0.00 46.19 44.14 2cio s LEU 172 CO 0.03 -0.08 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.15 2cio s ILE 173 N 1.47 1.58 -0.37 6.68 1.01 0.21 -0.72 121.20 131.07 2cio s ILE 173 Ca 0.16 -0.83 -0.19 0.00 0.00 0.00 0.00 60.65 59.78 2cio s ILE 173 Cb -0.15 -1.33 0.00 0.00 0.01 0.00 0.00 42.46 41.00 2cio s ILE 173 CO 0.08 0.45 0.57 -0.75 0.00 0.00 0.00 174.94 175.28 2cio s LYS 174 N -0.28 3.55 0.56 2.79 2.20 0.63 -0.82 119.74 128.36 2cio s LYS 174 Ca 0.03 -0.17 0.00 0.00 -0.36 0.00 0.00 55.97 55.47 2cio s LYS 174 Cb -0.09 -3.84 0.03 0.00 -1.51 0.00 0.00 37.83 32.42 2cio s LYS 174 CO 0.01 -0.75 0.79 1.21 -0.36 0.00 0.00 175.35 176.25 2cio s ASN 175 N 1.82 5.26 -0.33 1.43 2.47 -0.88 -2.55 114.94 122.16 2cio s ASN 175 Ca 0.21 0.05 0.07 0.00 0.42 0.00 0.00 52.86 53.60 2cio s ASN 175 Cb -0.15 -0.92 0.45 0.00 -1.45 0.00 0.00 41.25 39.18 2cio s ASN 175 CO 0.15 -1.17 1.16 -1.54 -3.72 0.00 0.00 177.10 171.98 2cio n SER 176 N -2.39 4.68 -0.71 -4.21 3.41 -1.26 -4.47 113.62 108.68 2cio n SER 176 Ca 0.08 -3.66 0.09 0.00 -0.26 0.00 0.00 58.87 55.12 2cio n SER 176 Cb 0.60 -0.38 0.23 0.00 -0.26 0.00 0.00 64.21 64.40 2cio n SER 176 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2cio n TRP 177 N -0.64 0.73 0.00 7.33 8.01 -1.17 -0.19 117.44 131.51 2cio n TRP 177 Ca 0.41 -0.91 0.00 0.00 -1.31 0.00 0.00 57.50 55.68 2cio n TRP 177 Cb 0.88 -0.28 0.00 0.00 -2.01 0.00 0.00 31.31 29.90 2cio n TRP 177 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2cio n GLY 178 N -0.73 -0.55 0.04 6.99 0.00 -0.46 -4.46 105.19 106.01 2cio n GLY 178 Ca 0.20 -1.71 0.13 0.00 0.00 0.00 0.00 46.02 44.65 2cio n GLY 178 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cio n THR 179 N -0.59 0.00 0.16 2.61 -2.24 -1.26 -3.47 114.28 109.49 2cio n THR 179 Ca 0.00 -0.02 0.04 0.00 -2.27 0.00 0.00 64.05 61.80 2cio n THR 179 Cb 0.00 -0.12 0.12 0.00 -2.10 0.00 0.00 70.33 68.23 2cio n THR 179 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2cio h GLY 180 N 4.99 0.00 -3.26 3.38 0.00 -1.89 -3.17 103.07 103.12 2cio h GLY 180 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.85 2cio h GLY 180 CO 0.00 0.00 0.34 0.86 0.00 0.00 0.00 176.54 177.74 2cio s TRP 181 N -3.13 3.78 0.00 5.60 -0.00 -1.23 -4.84 118.94 119.12 2cio s TRP 181 Ca 0.03 1.81 0.00 0.00 -0.00 0.00 0.00 56.10 57.94 2cio s TRP 181 Cb 0.08 -2.93 0.00 0.00 -0.00 0.00 0.00 33.47 30.62 2cio s TRP 181 CO 0.72 0.29 0.00 0.41 -0.00 0.00 0.00 176.95 178.37 2cio n GLY 182 N 0.85 2.00 3.38 5.86 0.00 -0.90 -0.39 105.19 116.00 2cio n GLY 182 Ca 0.01 -0.52 -0.45 0.00 0.00 0.00 0.00 46.02 45.05 2cio n GLY 182 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cio s GLU 183 N 0.00 3.78 -1.44 1.61 2.02 0.50 -4.31 118.70 120.87 2cio s GLU 183 Ca 0.00 -2.42 -0.02 0.00 0.02 0.00 0.00 54.97 52.54 2cio s GLU 183 Cb 0.00 -4.68 0.01 0.00 0.10 0.00 0.00 34.13 29.56 2cio s GLU 183 CO 0.00 -1.48 0.22 0.09 0.02 0.00 0.00 175.26 174.11 2cio n ASN 184 N 4.69 -5.04 0.00 -0.19 4.13 -1.25 -1.64 115.26 115.96 2cio n ASN 184 Ca 0.22 -0.07 0.00 0.00 1.68 0.00 0.00 54.58 56.41 2cio n ASN 184 Cb 0.46 -4.18 0.00 0.00 -1.54 0.00 0.00 39.78 34.52 2cio n ASN 184 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2cio n GLY 185 N -1.10 0.14 3.95 7.41 0.00 0.48 -4.69 105.19 111.39 2cio n GLY 185 Ca -0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.67 2cio n GLY 185 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cio s TYR 186 N -2.00 3.24 -0.01 1.61 2.02 -0.65 -2.06 117.35 119.50 2cio s TYR 186 Ca 0.00 -0.13 0.02 0.00 -0.37 0.00 0.00 57.07 56.59 2cio s TYR 186 Cb 0.00 -1.71 -0.00 0.00 -0.40 0.00 0.00 41.96 39.84 2cio s TYR 186 CO 0.00 0.27 -0.06 -1.50 -1.57 0.00 0.00 175.55 172.69 2cio s ILE 187 N -2.10 0.48 -0.38 2.71 2.07 -0.00 -0.37 121.20 123.61 2cio s ILE 187 Ca 0.38 -0.25 -0.12 0.00 -1.41 0.00 0.00 60.65 59.25 2cio s ILE 187 Cb -0.09 -0.41 0.02 0.00 0.13 0.00 0.00 42.46 42.11 2cio s ILE 187 CO 0.29 0.14 0.24 -0.13 -1.91 0.00 0.00 174.94 173.57 2cio s ARG 188 N -0.09 2.97 -0.15 3.50 0.52 -1.26 -0.62 118.95 123.83 2cio s ARG 188 Ca 0.02 -1.00 -0.12 0.00 -0.52 0.00 0.00 55.73 54.11 2cio s ARG 188 Cb -0.03 -3.81 -0.05 0.00 0.52 0.00 0.00 34.95 31.58 2cio s ARG 188 CO -0.00 -0.68 0.25 0.42 0.02 0.00 0.00 175.30 175.31 2cio s ILE 189 N 1.62 5.33 0.29 1.52 1.01 0.03 -0.56 121.20 130.44 2cio s ILE 189 Ca 0.04 0.46 -0.29 0.00 0.00 0.00 0.00 60.65 60.86 2cio s ILE 189 Cb -0.19 -3.58 -0.13 0.00 0.01 0.00 0.00 42.46 38.57 2cio s ILE 189 CO 0.08 0.44 1.27 1.17 0.00 0.00 0.00 174.94 177.90 2cio n LYS 190 N 3.24 1.91 -4.50 2.79 3.00 0.08 -0.87 118.16 123.82 2cio n LYS 190 Ca -0.14 0.67 -0.24 0.00 -0.00 0.00 0.00 58.31 58.60 2cio n LYS 190 Cb 0.52 -2.23 -0.09 0.00 0.00 0.00 0.00 35.03 33.23 2cio n LYS 190 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 2cio s ARG 191 N -1.31 1.83 0.00 1.64 1.70 -0.76 -4.54 118.95 117.51 2cio s ARG 191 Ca 0.61 -2.09 0.00 0.00 -0.47 0.00 0.00 55.73 53.78 2cio s ARG 191 Cb -0.63 -0.70 0.00 0.00 -0.57 0.00 0.00 34.95 33.05 2cio s ARG 191 CO 0.58 -0.38 0.00 0.41 -1.08 0.00 0.00 175.30 174.83 2cio n GLY 192 N -0.84 2.72 0.00 3.88 0.00 -1.26 -4.66 105.19 105.03 2cio n GLY 192 Ca -0.05 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2cio n GLY 192 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cio n THR 193 N 0.00 0.00 -1.94 2.61 -2.24 -1.26 -4.85 114.28 106.59 2cio n THR 193 Ca 0.00 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.42 2cio n THR 193 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2cio n THR 193 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cio n GLY 194 N 0.00 5.25 2.75 3.38 0.00 -1.26 -4.91 105.19 110.39 2cio n GLY 194 Ca 0.00 -2.26 -0.30 0.00 0.00 0.00 0.00 46.02 43.46 2cio n GLY 194 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2cio s ASN 195 N -0.48 3.98 0.41 1.61 3.04 -1.26 -5.00 114.94 117.23 2cio s ASN 195 Ca 0.52 -1.59 0.18 0.00 0.04 0.00 0.00 52.86 52.01 2cio s ASN 195 Cb 0.34 -0.88 0.87 0.00 -1.54 0.00 0.00 41.25 40.04 2cio s ASN 195 CO -0.26 -0.40 1.85 0.28 -3.04 0.00 0.00 177.10 175.53 2cio h SER 196 N 8.08 0.00 0.33 -4.21 0.02 -1.91 -1.90 113.55 113.96 2cio h SER 196 Ca -0.14 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.70 2cio h SER 196 Cb 1.02 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.55 2cio h SER 196 CO 0.46 0.32 -0.47 1.88 -1.14 0.00 0.00 176.83 177.88 2cio h TYR 197 N 0.00 0.21 0.00 3.45 0.05 -1.95 -3.36 116.97 115.38 2cio h TYR 197 Ca -0.00 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.71 2cio h TYR 197 Cb 0.66 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.36 2cio h TYR 197 CO 0.00 0.62 0.00 0.41 -1.05 0.00 0.00 178.16 178.14 2cio n GLY 198 N -0.07 -1.51 3.72 3.88 0.00 -0.72 -0.15 105.19 110.34 2cio n GLY 198 Ca -0.02 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 2cio n GLY 198 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2cio n VAL 199 N -1.06 0.00 -2.10 1.61 0.31 -1.26 -1.40 118.33 114.43 2cio n VAL 199 Ca 0.00 -0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.15 2cio n VAL 199 Cb 0.00 -1.97 -0.03 0.00 -0.91 0.00 0.00 33.84 30.93 2cio n VAL 199 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2cio n GLY 201 N -0.74 0.64 0.35 0.00 0.00 -0.49 -0.24 105.19 104.72 2cio n GLY 201 Ca -0.21 -0.59 0.18 0.00 0.00 0.00 0.00 46.02 45.41 2cio n GLY 201 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2cio h LEU 202 N 0.00 0.00 -2.44 0.99 5.85 -1.05 -1.99 115.31 116.66 2cio h LEU 202 Ca -0.19 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.53 2cio h LEU 202 Cb 0.81 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.84 2cio h LEU 202 CO 0.26 0.00 0.00 -1.22 -0.34 0.00 0.00 178.44 177.14 2cio n TYR 203 N -3.35 0.92 -0.10 1.25 0.53 0.79 -4.44 117.16 112.76 2cio n TYR 203 Ca 0.01 -0.45 -0.11 0.00 -1.02 0.00 0.00 57.90 56.34 2cio n TYR 203 Cb 0.40 -0.02 -0.03 0.00 -1.03 0.00 0.00 39.34 38.65 2cio n TYR 203 CO 0.00 0.00 0.00 1.15 -1.02 0.00 0.00 176.86 176.99 2cio h THR 204 N 3.79 1.25 -0.98 -0.72 2.02 -1.49 -0.75 112.91 116.03 2cio h THR 204 Ca 0.00 -0.89 0.06 0.00 0.77 0.00 0.00 66.41 66.34 2cio h THR 204 Cb 0.92 1.28 -0.21 0.00 -1.74 0.00 0.00 68.15 68.40 2cio h THR 204 CO 0.02 0.29 -0.33 -0.55 0.37 0.00 0.00 175.52 175.32 2cio s SER 205 N -5.98 -1.51 -0.06 4.18 0.15 -1.26 -4.73 113.70 104.49 2cio s SER 205 Ca -0.13 0.47 0.02 0.00 0.70 0.00 0.00 55.95 57.00 2cio s SER 205 Cb 0.08 2.08 0.01 0.00 -1.71 0.00 0.00 66.02 66.48 2cio s SER 205 CO 0.75 -0.28 -0.10 -0.44 1.20 0.00 0.00 173.24 174.37 2cio s SER 206 N 2.84 1.55 0.13 5.45 0.01 -1.26 -3.58 113.70 118.84 2cio s SER 206 Ca 0.15 -0.25 0.04 0.00 1.31 0.00 0.00 55.95 57.19 2cio s SER 206 Cb -0.12 -0.69 -0.04 0.00 0.21 0.00 0.00 66.02 65.37 2cio s SER 206 CO -0.24 0.02 -0.10 -0.36 0.41 0.00 0.00 173.24 172.98 2cio s PHE 207 N 0.65 1.15 -0.02 2.43 0.40 -0.04 -0.87 117.98 121.68 2cio s PHE 207 Ca -0.13 -0.76 -0.09 0.00 -0.60 0.00 0.00 56.93 55.35 2cio s PHE 207 Cb -0.15 -0.61 0.01 0.00 0.51 0.00 0.00 43.02 42.78 2cio s PHE 207 CO 0.03 0.02 0.19 1.52 0.70 0.00 0.00 175.22 177.68 2cio s TYR 208 N -3.15 -0.07 0.52 0.36 1.13 -0.45 -0.30 117.35 115.39 2cio s TYR 208 Ca 0.13 0.11 -0.19 0.00 -1.41 0.00 0.00 57.07 55.71 2cio s TYR 208 Cb 0.02 0.01 -0.07 0.00 -1.10 0.00 0.00 41.96 40.82 2cio s TYR 208 CO -0.01 -0.27 1.07 -1.25 -2.51 0.00 0.00 175.55 172.58 2cio s PRO 209 N -1.04 3.57 -0.10 -3.49 0.04 -1.26 -0.66 135.00 132.06 2cio s PRO 209 Ca -0.11 1.40 -0.01 0.00 0.04 0.00 0.00 61.00 62.32 2cio s PRO 209 Cb -0.06 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 2cio s PRO 209 CO 0.02 -0.63 -0.05 0.08 0.04 0.00 0.00 177.00 176.46 2cio s VAL 210 N -2.02 3.80 0.04 -0.36 1.01 0.93 -4.82 120.40 118.98 2cio s VAL 210 Ca 0.68 -0.42 -0.27 0.00 0.00 0.00 0.00 61.98 61.97 2cio s VAL 210 Cb -0.18 -2.60 0.08 0.00 0.00 0.00 0.00 36.38 33.68 2cio s VAL 210 CO 0.25 0.56 0.72 -0.75 0.00 0.00 0.00 175.10 175.89 2cio s LYS 211 N -0.37 1.05 0.00 2.72 2.20 -1.26 0.26 119.74 124.34 2cio s LYS 211 Ca 0.06 -0.18 0.00 0.00 -0.36 0.00 0.00 55.97 55.49 2cio s LYS 211 Cb -0.12 0.49 0.00 0.00 -1.51 0.00 0.00 37.83 36.69 2cio s LYS 211 CO 0.02 -0.42 0.27 0.27 -0.36 0.00 0.00 175.35 175.14