#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3guy s ILE 2 N 0.00 3.40 -0.23 1.96 -1.09 -0.03 -0.78 121.20 124.42 3guy s ILE 2 Ca 0.00 -0.73 -0.15 0.00 -2.23 0.00 0.00 60.65 57.54 3guy s ILE 2 Cb 0.00 -2.67 -0.04 0.00 -1.58 0.00 0.00 42.46 38.17 3guy s ILE 2 CO 0.00 0.24 0.34 -0.69 -1.23 0.00 0.00 174.94 173.60 3guy s VAL 3 N 1.43 5.23 -0.18 2.92 1.01 -0.43 -1.10 120.40 129.28 3guy s VAL 3 Ca 0.03 0.57 0.01 0.00 0.00 0.00 0.00 61.98 62.59 3guy s VAL 3 Cb -0.16 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.57 3guy s VAL 3 CO -0.02 0.25 -0.19 -0.63 0.00 0.00 0.00 175.10 174.51 3guy s ILE 4 N 1.44 2.03 0.30 2.22 1.01 -0.53 0.33 121.20 128.01 3guy s ILE 4 Ca 0.16 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.87 3guy s ILE 4 Cb -0.15 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 3guy s ILE 4 CO 0.08 0.52 0.49 0.42 0.00 0.00 0.00 174.94 176.45 3guy s THR 5 N 1.30 5.14 -1.04 2.92 -4.23 0.32 -1.11 115.64 118.93 3guy s THR 5 Ca 0.05 -0.46 -0.01 0.00 -1.18 0.00 0.00 61.69 60.09 3guy s THR 5 Cb -0.13 -3.82 0.00 0.00 1.34 0.00 0.00 72.50 69.89 3guy s THR 5 CO -0.13 -0.43 0.08 0.61 -0.54 0.00 0.00 174.62 174.22 3guy n GLY 6 N -1.42 -0.12 0.49 3.99 0.00 -0.78 -2.57 105.19 104.78 3guy n GLY 6 Ca -0.05 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 45.77 3guy n GLY 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3guy n ALA 7 N -1.88 2.64 0.13 4.61 0.00 0.64 -3.99 120.51 122.67 3guy n ALA 7 Ca -0.13 -0.47 0.03 0.00 0.00 0.00 0.00 53.44 52.87 3guy n ALA 7 Cb 0.60 -1.12 0.40 0.00 0.00 0.00 0.00 19.45 19.33 3guy n ALA 7 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3guy h SER 8 N 2.43 0.19 -5.03 0.00 0.02 -1.89 -3.29 113.55 105.97 3guy h SER 8 Ca 0.00 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.87 3guy h SER 8 Cb 0.55 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 63.05 3guy h SER 8 CO 0.00 0.36 0.26 -0.94 -1.14 0.00 0.00 176.83 175.37 3guy s SER 9 N -6.90 0.09 0.59 3.07 1.04 -1.26 -4.61 113.70 105.72 3guy s SER 9 Ca -0.05 -1.23 0.00 0.00 0.48 0.00 0.00 55.95 55.14 3guy s SER 9 Cb 0.15 0.86 0.00 0.00 0.10 0.00 0.00 66.02 67.13 3guy s SER 9 CO 0.73 -1.72 0.00 0.61 0.98 0.00 0.00 173.24 173.84 3guy n GLY 10 N -0.54 1.14 0.23 7.32 0.00 -1.26 -2.73 105.19 109.34 3guy n GLY 10 Ca -0.08 -0.71 -0.02 0.00 0.00 0.00 0.00 46.02 45.20 3guy n GLY 10 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3guy h LEU 11 N 0.00 0.30 -1.02 0.99 5.85 -1.88 -1.90 115.31 117.65 3guy h LEU 11 Ca 0.00 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.69 3guy h LEU 11 Cb 0.00 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 3guy h LEU 11 CO 0.00 0.20 -0.17 1.23 -0.34 0.00 0.00 178.44 179.36 3guy h GLY 12 N 0.46 0.54 0.79 3.75 0.00 -1.69 0.12 103.07 107.05 3guy h GLY 12 Ca 0.27 -0.40 -0.06 0.00 0.00 0.00 0.00 47.33 47.14 3guy h GLY 12 CO -0.24 0.37 -0.14 0.00 0.00 0.00 0.00 176.54 176.53 3guy h ALA 13 N 1.36 0.26 -0.48 3.60 0.00 -1.27 -2.22 119.26 120.51 3guy h ALA 13 Ca 0.08 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 3guy h ALA 13 Cb 0.56 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3guy h ALA 13 CO 0.04 0.14 -0.08 0.93 0.00 0.00 0.00 179.25 180.28 3guy h GLU 14 N 0.08 0.85 -0.74 0.00 4.39 -1.06 -2.18 114.58 115.92 3guy h GLU 14 Ca 0.03 -0.28 0.03 0.00 0.34 0.00 0.00 59.36 59.48 3guy h GLU 14 Cb 0.66 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.19 3guy h GLU 14 CO 0.04 0.90 0.47 -0.07 -1.16 0.00 0.00 179.01 179.19 3guy h LEU 15 N 0.77 0.79 -0.83 1.33 3.38 -0.78 -2.88 115.31 117.09 3guy h LEU 15 Ca 0.13 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.13 3guy h LEU 15 Cb 0.58 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 3guy h LEU 15 CO 0.04 0.55 0.53 0.00 0.09 0.00 0.00 178.44 179.65 3guy h ALA 16 N 1.31 1.10 -0.28 1.53 0.00 -0.77 -1.33 119.26 120.81 3guy h ALA 16 Ca 0.29 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 3guy h ALA 16 Cb -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3guy h ALA 16 CO -0.10 0.36 -0.05 0.87 0.00 0.00 0.00 179.25 180.33 3guy h LYS 17 N 1.03 0.44 -0.08 0.00 1.57 -1.41 -0.41 116.57 117.70 3guy h LYS 17 Ca 0.33 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.95 3guy h LYS 17 Cb 0.02 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.27 3guy h LYS 17 CO -0.12 0.51 -0.20 -0.07 -0.57 0.00 0.00 179.45 178.99 3guy h LEU 18 N 0.42 0.33 -0.70 2.94 3.38 -1.19 -2.40 115.31 118.09 3guy h LEU 18 Ca 0.09 -0.58 -0.00 0.00 0.09 0.00 0.00 57.88 57.47 3guy h LEU 18 Cb 0.35 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3guy h LEU 18 CO 0.02 0.85 0.42 1.88 0.09 0.00 0.00 178.44 181.69 3guy h TYR 19 N -0.18 0.92 -0.30 1.13 0.05 -1.18 -2.73 116.97 114.69 3guy h TYR 19 Ca -0.00 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3guy h TYR 19 Cb 0.81 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 38.23 3guy h TYR 19 CO 0.12 0.63 0.19 0.22 -1.05 0.00 0.00 178.16 178.26 3guy h ASP 20 N 0.95 0.33 -0.72 3.88 3.58 -1.13 -1.81 116.42 121.49 3guy h ASP 20 Ca 0.25 -0.01 0.14 0.00 0.42 0.00 0.00 57.03 57.83 3guy h ASP 20 Cb -0.02 -0.08 -0.05 0.00 1.72 0.00 0.00 39.33 40.90 3guy h ASP 20 CO -0.05 0.24 0.48 0.00 -2.88 0.00 0.00 179.24 177.03 3guy h ALA 21 N 1.11 2.08 0.00 -0.78 0.00 -1.28 0.18 119.26 120.57 3guy h ALA 21 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3guy h ALA 21 Cb -0.04 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3guy h ALA 21 CO -0.03 -0.26 0.00 0.39 0.00 0.00 0.00 179.25 179.35 3guy n GLU 22 N -4.48 0.83 -2.05 0.00 1.02 -0.75 -4.86 120.64 110.35 3guy n GLU 22 Ca 0.13 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.26 3guy n GLU 22 Cb 0.49 -1.37 -0.00 0.00 -0.02 0.00 0.00 31.44 30.54 3guy n GLU 22 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3guy n GLY 23 N 0.58 0.34 3.72 0.62 0.00 0.05 -5.05 105.19 105.44 3guy n GLY 23 Ca 0.15 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 45.00 3guy n GLY 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3guy s LYS 24 N -4.12 3.19 0.03 1.61 1.02 -0.79 -5.03 119.74 115.65 3guy s LYS 24 Ca 0.00 -0.34 -0.30 0.00 0.02 0.00 0.00 55.97 55.35 3guy s LYS 24 Cb -0.00 -2.92 -0.06 0.00 -0.52 0.00 0.00 37.83 34.33 3guy s LYS 24 CO 0.00 0.67 1.33 0.00 -0.92 0.00 0.00 175.35 176.44 3guy s ALA 25 N -0.78 3.53 0.09 5.17 0.00 -1.26 -4.03 121.76 124.49 3guy s ALA 25 Ca 0.12 0.90 0.08 0.00 0.00 0.00 0.00 51.96 53.07 3guy s ALA 25 Cb -0.12 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 3guy s ALA 25 CO 0.02 -0.73 -0.18 0.95 0.00 0.00 0.00 175.76 175.83 3guy s THR 26 N 1.81 2.83 -0.12 0.00 -4.23 -1.25 -0.85 115.64 113.82 3guy s THR 26 Ca 0.62 -1.40 0.01 0.00 -1.18 0.00 0.00 61.69 59.74 3guy s THR 26 Cb -0.31 -2.27 0.02 0.00 1.34 0.00 0.00 72.50 71.28 3guy s THR 26 CO 0.27 0.17 -0.14 -0.47 -0.54 0.00 0.00 174.62 173.91 3guy s TYR 27 N -1.08 2.01 -0.01 3.99 5.04 -0.26 -0.62 117.35 126.42 3guy s TYR 27 Ca 0.17 -1.03 0.03 0.00 -2.44 0.00 0.00 57.07 53.80 3guy s TYR 27 Cb -0.11 -1.48 -0.03 0.00 0.35 0.00 0.00 41.96 40.70 3guy s TYR 27 CO 0.09 -0.56 -0.07 -0.51 -1.34 0.00 0.00 175.55 173.16 3guy s LEU 28 N 1.24 3.14 0.06 6.97 1.43 -0.53 -1.45 118.68 129.55 3guy s LEU 28 Ca -0.01 -0.14 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 3guy s LEU 28 Cb -0.14 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 3guy s LEU 28 CO -0.06 0.29 -0.08 0.28 0.23 0.00 0.00 176.35 177.02 3guy s THR 29 N -0.96 0.62 0.02 5.49 -1.32 -0.27 -1.55 115.64 117.68 3guy s THR 29 Ca 0.16 -1.42 -0.27 0.00 -1.21 0.00 0.00 61.69 58.95 3guy s THR 29 Cb -0.11 -1.04 0.09 0.00 -1.51 0.00 0.00 72.50 69.94 3guy s THR 29 CO 0.06 -0.56 1.24 -0.83 -2.21 0.00 0.00 174.62 172.32 3guy s GLY 30 N -2.14 -0.08 0.16 6.08 0.00 -1.24 -0.26 107.32 109.84 3guy s GLY 30 Ca -0.01 -0.03 0.11 0.00 0.00 0.00 0.00 44.72 44.78 3guy s GLY 30 CO -0.01 4.92 1.27 3.21 0.00 0.00 0.00 173.10 182.49 3guy h ARG 31 N 2.00 0.00 -4.66 2.90 3.08 -1.91 -1.34 114.38 114.45 3guy h ARG 31 Ca -0.23 0.00 -0.70 0.00 0.07 0.00 0.00 59.98 59.12 3guy h ARG 31 Cb 1.19 0.00 -0.27 0.00 0.08 0.00 0.00 29.97 30.98 3guy h ARG 31 CO 0.32 0.74 -0.57 0.45 -1.07 0.00 0.00 179.97 179.85 3guy s SER 32 N -6.52 5.47 0.25 7.04 0.15 -1.26 -4.63 113.70 114.21 3guy s SER 32 Ca 0.01 -1.02 -0.02 0.00 0.70 0.00 0.00 55.95 55.62 3guy s SER 32 Cb 0.09 -1.94 0.49 0.00 -1.71 0.00 0.00 66.02 62.95 3guy s SER 32 CO 0.79 -0.33 1.76 -0.08 1.20 0.00 0.00 173.24 176.58 3guy h GLU 33 N 8.31 0.59 -0.55 5.44 4.81 -1.94 -1.64 114.58 129.60 3guy h GLU 33 Ca -0.25 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.00 3guy h GLU 33 Cb 1.10 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 30.29 3guy h GLU 33 CO 0.63 0.39 0.26 1.03 -0.73 0.00 0.00 179.01 180.58 3guy h SER 34 N 0.60 0.34 0.10 1.04 0.87 -2.00 -0.92 113.55 113.58 3guy h SER 34 Ca 0.44 0.04 -0.18 0.00 -1.23 0.00 0.00 61.79 60.86 3guy h SER 34 Cb 0.59 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.54 3guy h SER 34 CO -0.35 0.23 -0.66 0.11 -0.53 0.00 0.00 176.83 175.63 3guy h LYS 35 N 0.49 0.53 -0.46 2.24 1.57 -1.73 -2.84 116.57 116.36 3guy h LYS 35 Ca 0.25 -0.39 0.01 0.00 -1.87 0.00 0.00 60.65 58.65 3guy h LYS 35 Cb 0.21 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 3guy h LYS 35 CO -0.20 1.01 0.30 -0.07 -0.57 0.00 0.00 179.45 179.92 3guy h LEU 36 N 0.38 0.51 -0.73 2.94 3.38 -1.08 -2.14 115.31 118.57 3guy h LEU 36 Ca -0.02 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.00 3guy h LEU 36 Cb 1.23 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.81 3guy h LEU 36 CO 0.12 0.37 0.44 -1.28 0.09 0.00 0.00 178.44 178.18 3guy h SER 37 N 0.61 0.68 -0.75 -0.43 0.87 -1.07 -0.33 113.55 113.13 3guy h SER 37 Ca 0.17 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.72 3guy h SER 37 Cb -0.05 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 61.75 3guy h SER 37 CO -0.05 0.45 0.35 0.74 -0.53 0.00 0.00 176.83 177.79 3guy h THR 38 N 0.82 1.24 0.00 2.23 2.02 -1.23 -0.89 112.91 117.11 3guy h THR 38 Ca 0.32 -0.71 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 3guy h THR 38 Cb 0.14 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 3guy h THR 38 CO -0.16 0.30 -0.00 0.58 0.37 0.00 0.00 175.52 176.61 3guy h VAL 39 N 1.09 1.19 -0.39 3.16 2.07 -1.03 -3.11 116.25 119.23 3guy h VAL 39 Ca 0.26 -0.58 0.11 0.00 0.82 0.00 0.00 66.70 67.31 3guy h VAL 39 Cb 0.13 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 3guy h VAL 39 CO -0.03 0.15 0.28 0.74 0.02 0.00 0.00 177.57 178.73 3guy h THR 40 N -0.25 0.81 0.00 2.57 2.02 -0.72 -0.49 112.91 116.85 3guy h THR 40 Ca -0.00 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 3guy h THR 40 Cb 0.25 0.79 -0.00 0.00 -1.74 0.00 0.00 68.15 67.45 3guy h THR 40 CO 0.00 0.00 -0.04 0.78 0.37 0.00 0.00 175.52 176.63 3guy h ASN 41 N 0.02 0.00 1.16 4.18 2.35 -1.10 -0.78 115.58 121.43 3guy h ASN 41 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 3guy h ASN 41 Cb 0.72 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.09 3guy h ASN 41 CO -0.01 0.04 0.00 0.00 -1.65 0.00 0.00 177.43 175.82 3guy s LEU 43 N -3.85 3.60 0.00 0.00 1.43 -0.30 -5.03 118.68 114.54 3guy s LEU 43 Ca 0.11 -0.07 0.05 0.00 -1.03 0.00 0.00 54.13 53.19 3guy s LEU 43 Cb 0.14 -2.26 -0.03 0.00 0.03 0.00 0.00 46.19 44.07 3guy s LEU 43 CO 0.53 0.20 0.34 -1.54 0.23 0.00 0.00 176.35 176.11 3guy n SER 44 N 0.72 0.56 -0.06 2.29 3.41 -1.26 -4.65 113.62 114.63 3guy n SER 44 Ca -0.11 -0.78 0.04 0.00 -0.26 0.00 0.00 58.87 57.76 3guy n SER 44 Cb 0.52 0.75 0.05 0.00 -0.26 0.00 0.00 64.21 65.27 3guy n SER 44 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3guy n ASN 45 N -0.76 1.80 -4.76 4.04 3.02 -1.26 -5.06 115.26 112.27 3guy n ASN 45 Ca 0.02 -2.29 -0.41 0.00 -0.03 0.00 0.00 54.58 51.86 3guy n ASN 45 Cb 0.10 -0.17 -0.01 0.00 -0.61 0.00 0.00 39.78 39.09 3guy n ASN 45 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3guy s ASN 46 N -1.57 6.36 -0.25 6.41 3.84 -1.26 -3.85 114.94 124.62 3guy s ASN 46 Ca 0.11 3.00 0.12 0.00 0.21 0.00 0.00 52.86 56.30 3guy s ASN 46 Cb 0.10 -2.65 0.52 0.00 -0.55 0.00 0.00 41.25 38.67 3guy s ASN 46 CO 0.01 -0.89 1.47 1.33 -2.79 0.00 0.00 177.10 176.23 3guy n VAL 47 N 1.33 2.46 0.00 -5.21 0.24 0.21 -4.88 118.33 112.48 3guy n VAL 47 Ca 0.05 -2.29 0.00 0.00 -2.04 0.00 0.00 64.34 60.05 3guy n VAL 47 Cb 0.38 -0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.45 3guy n VAL 47 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3guy n GLY 48 N -0.84 3.46 3.23 7.63 0.00 -1.22 -4.88 105.19 112.57 3guy n GLY 48 Ca 0.29 -1.77 -0.10 0.00 0.00 0.00 0.00 46.02 44.44 3guy n GLY 48 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3guy s TYR 49 N -2.13 -0.01 -0.29 1.61 -0.85 -1.26 -1.45 117.35 112.97 3guy s TYR 49 Ca 0.00 -0.27 -0.15 0.00 -0.52 0.00 0.00 57.07 56.13 3guy s TYR 49 Cb 0.00 0.05 0.11 0.00 0.38 0.00 0.00 41.96 42.49 3guy s TYR 49 CO 0.00 -0.53 0.76 0.50 -1.52 0.00 0.00 175.55 174.76 3guy s ARG 50 N -3.16 0.59 0.12 -3.49 3.52 -0.59 -4.96 118.95 110.99 3guy s ARG 50 Ca -0.01 1.12 -0.30 0.00 -0.13 0.00 0.00 55.73 56.41 3guy s ARG 50 Cb 0.01 0.27 -0.07 0.00 -1.56 0.00 0.00 34.95 33.61 3guy s ARG 50 CO -0.07 -0.14 1.20 0.00 -0.81 0.00 0.00 175.30 175.48 3guy s ALA 51 N 1.84 3.42 -0.02 6.12 0.00 -1.26 -3.63 121.76 128.23 3guy s ALA 51 Ca -0.09 0.91 -0.04 0.00 0.00 0.00 0.00 51.96 52.74 3guy s ALA 51 Cb -0.06 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.63 3guy s ALA 51 CO -0.19 -0.40 0.10 1.03 0.00 0.00 0.00 175.76 176.30 3guy s ARG 52 N 0.43 0.23 -0.50 0.00 1.81 -0.50 -4.94 118.95 115.48 3guy s ARG 52 Ca 0.56 -0.08 -0.17 0.00 -1.72 0.00 0.00 55.73 54.32 3guy s ARG 52 Cb -0.31 0.10 0.07 0.00 -0.45 0.00 0.00 34.95 34.36 3guy s ARG 52 CO 0.33 -0.04 0.53 0.34 -0.68 0.00 0.00 175.30 175.78 3guy s ASP 53 N -0.47 6.19 0.23 0.23 -1.08 -1.26 -4.10 116.67 116.40 3guy s ASP 53 Ca -0.05 -1.20 0.21 0.00 -0.52 0.00 0.00 52.55 50.99 3guy s ASP 53 Cb -0.04 -2.24 0.94 0.00 -1.46 0.00 0.00 42.92 40.12 3guy s ASP 53 CO 0.00 -0.82 1.65 0.18 0.52 0.00 0.00 175.17 176.71 3guy n LEU 54 N 5.73 0.55 0.29 -1.34 4.77 -1.26 -2.09 117.00 123.65 3guy n LEU 54 Ca -0.10 0.66 0.19 0.00 -0.03 0.00 0.00 56.01 56.72 3guy n LEU 54 Cb 0.44 -0.60 0.84 0.00 -2.33 0.00 0.00 43.42 41.77 3guy n LEU 54 CO 0.52 -0.58 1.05 0.00 -1.33 0.00 0.00 177.39 177.04 3guy h ALA 55 N 2.24 1.00 -2.56 -1.18 0.00 -1.86 -3.37 119.26 113.54 3guy h ALA 55 Ca 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.26 3guy h ALA 55 Cb 0.28 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 17.92 3guy h ALA 55 CO 0.00 0.00 -0.16 0.45 0.00 0.00 0.00 179.25 179.54 3guy s SER 56 N -5.42 6.27 0.31 0.00 0.15 -0.89 -4.81 113.70 109.31 3guy s SER 56 Ca -0.01 -0.00 0.04 0.00 0.70 0.00 0.00 55.95 56.68 3guy s SER 56 Cb 0.10 -2.23 0.52 0.00 -1.71 0.00 0.00 66.02 62.70 3guy s SER 56 CO 0.49 -0.36 1.79 1.12 1.20 0.00 0.00 173.24 177.48 3guy h HIS 57 N 8.38 0.48 -0.93 3.44 2.07 -1.87 -2.48 115.15 124.23 3guy h HIS 57 Ca -0.29 -0.08 -0.01 0.00 -2.85 0.00 0.00 60.37 57.14 3guy h HIS 57 Cb 1.14 -0.12 -0.04 0.00 2.57 0.00 0.00 27.41 30.95 3guy h HIS 57 CO 0.72 0.59 0.54 1.96 -3.07 0.00 0.00 177.93 178.67 3guy h GLN 58 N 0.40 1.28 -0.48 5.12 4.20 -1.95 -0.62 115.11 123.06 3guy h GLN 58 Ca 0.07 -0.13 -0.07 0.00 0.06 0.00 0.00 58.65 58.58 3guy h GLN 58 Cb 0.54 -0.26 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 3guy h GLN 58 CO 0.03 0.91 0.02 0.93 -0.67 0.00 0.00 178.83 180.06 3guy h GLU 59 N 1.29 0.79 -0.24 1.46 5.08 -1.79 -2.07 114.58 119.10 3guy h GLU 59 Ca 0.33 -0.20 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 3guy h GLU 59 Cb -0.02 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 3guy h GLU 59 CO -0.06 0.78 -0.06 0.28 -1.00 0.00 0.00 179.01 178.95 3guy h VAL 60 N 0.74 1.29 -0.68 3.13 2.07 -1.15 0.86 116.25 122.51 3guy h VAL 60 Ca 0.15 -1.07 0.13 0.00 0.82 0.00 0.00 66.70 66.73 3guy h VAL 60 Cb 0.42 1.49 -0.09 0.00 -1.52 0.00 0.00 31.29 31.59 3guy h VAL 60 CO 0.02 0.33 0.20 -0.08 0.02 0.00 0.00 177.57 178.06 3guy h GLU 61 N 0.21 0.32 -0.12 1.57 4.22 -1.03 -2.71 114.58 117.04 3guy h GLU 61 Ca 0.06 -0.02 -0.18 0.00 0.08 0.00 0.00 59.36 59.30 3guy h GLU 61 Cb 0.53 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 3guy h GLU 61 CO 0.02 0.21 -0.67 1.96 -2.18 0.00 0.00 179.01 178.35 3guy h GLN 62 N 0.33 0.49 -0.56 1.92 1.08 -1.18 -0.18 115.11 117.02 3guy h GLN 62 Ca 0.37 -0.37 0.11 0.00 -1.45 0.00 0.00 58.65 57.31 3guy h GLN 62 Cb 0.57 0.07 -0.11 0.00 -0.05 0.00 0.00 27.48 27.96 3guy h GLN 62 CO -0.42 0.99 -0.14 1.25 -0.95 0.00 0.00 178.83 179.56 3guy h LEU 63 N 0.35 -0.52 0.02 1.46 5.85 -0.53 -2.38 115.31 119.57 3guy h LEU 63 Ca -0.02 0.17 -0.25 0.00 0.84 0.00 0.00 57.88 58.61 3guy h LEU 63 Cb 1.24 0.34 -0.03 0.00 0.37 0.00 0.00 40.66 42.58 3guy h LEU 63 CO 0.12 -0.18 -1.32 -0.26 -0.34 0.00 0.00 178.44 176.46 3guy h PHE 64 N 0.00 0.08 -0.87 1.25 0.04 -1.39 -3.30 116.94 112.75 3guy h PHE 64 Ca 0.27 -0.06 0.12 0.00 2.80 0.00 0.00 57.97 61.10 3guy h PHE 64 Cb 0.41 -0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.47 3guy h PHE 64 CO -0.46 1.07 0.49 1.49 -0.60 0.00 0.00 178.31 180.30 3guy h GLU 65 N 0.01 0.74 -0.15 1.51 4.57 -0.85 -2.60 114.58 117.82 3guy h GLU 65 Ca -0.14 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 3guy h GLU 65 Cb 1.89 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 30.31 3guy h GLU 65 CO 0.12 0.49 0.00 1.04 -1.18 0.00 0.00 179.01 179.48 3guy n GLN 66 N -4.77 1.41 -2.77 1.92 1.13 -0.91 -4.86 117.38 108.53 3guy n GLN 66 Ca 0.16 -0.63 -0.38 0.00 -1.94 0.00 0.00 57.00 54.21 3guy n GLN 66 Cb 0.35 -1.22 -0.06 0.00 0.11 0.00 0.00 30.24 29.42 3guy n GLN 66 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3guy s LEU 67 N -1.22 4.46 0.14 1.08 1.43 -0.98 -4.96 118.68 118.64 3guy s LEU 67 Ca 0.19 1.89 0.26 0.00 -1.03 0.00 0.00 54.13 55.43 3guy s LEU 67 Cb 0.10 -3.85 0.69 0.00 0.03 0.00 0.00 46.19 43.16 3guy s LEU 67 CO 0.14 0.02 1.63 0.47 0.23 0.00 0.00 176.35 178.84 3guy n ASP 68 N 0.93 0.67 -2.86 2.29 8.00 -1.26 -4.93 116.55 119.39 3guy n ASP 68 Ca 0.00 0.37 -0.12 0.00 0.71 0.00 0.00 54.79 55.76 3guy n ASP 68 Cb 0.49 -0.39 -0.00 0.00 -0.02 0.00 0.00 41.12 41.19 3guy n ASP 68 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3guy n SER 69 N -2.08 -1.80 -4.64 -2.24 3.41 -1.26 -5.13 113.62 99.88 3guy n SER 69 Ca 0.05 -2.72 -0.41 0.00 -0.26 0.00 0.00 58.87 55.52 3guy n SER 69 Cb 0.42 3.14 -0.05 0.00 -0.26 0.00 0.00 64.21 67.46 3guy n SER 69 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3guy s ILE 70 N -2.47 4.88 0.59 -1.33 1.01 -1.26 -5.03 121.20 117.60 3guy s ILE 70 Ca 0.22 1.43 -0.18 0.00 0.00 0.00 0.00 60.65 62.12 3guy s ILE 70 Cb -0.03 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 3guy s ILE 70 CO 0.16 -0.04 1.17 -2.16 0.00 0.00 0.00 174.94 174.07 3guy s PRO 71 N 2.73 3.04 -0.14 2.79 0.04 -1.26 -4.62 135.00 137.58 3guy s PRO 71 Ca 0.32 1.70 -0.01 0.00 0.04 0.00 0.00 61.00 63.04 3guy s PRO 71 Cb -0.15 -1.95 -0.24 0.00 0.04 0.00 0.00 34.50 32.19 3guy s PRO 71 CO 0.08 -1.12 0.28 -1.13 0.04 0.00 0.00 177.00 175.14 3guy n SER 72 N -1.65 1.83 -4.15 6.66 3.41 0.04 -4.65 113.62 115.10 3guy n SER 72 Ca 0.13 0.16 -0.26 0.00 -0.26 0.00 0.00 58.87 58.63 3guy n SER 72 Cb 0.50 -0.58 -0.16 0.00 -0.26 0.00 0.00 64.21 63.72 3guy n SER 72 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3guy s THR 73 N -2.55 1.48 -0.18 6.66 2.01 -1.19 -1.33 115.64 120.54 3guy s THR 73 Ca -0.22 -0.75 -0.00 0.00 0.31 0.00 0.00 61.69 61.02 3guy s THR 73 Cb 0.07 -1.26 0.00 0.00 0.01 0.00 0.00 72.50 71.32 3guy s THR 73 CO 0.75 0.42 -0.15 -0.69 -0.69 0.00 0.00 174.62 174.27 3guy s VAL 74 N -0.07 2.61 -0.39 3.82 1.01 0.23 -1.32 120.40 126.29 3guy s VAL 74 Ca -0.02 -0.77 -0.12 0.00 0.00 0.00 0.00 61.98 61.07 3guy s VAL 74 Cb -0.11 -2.12 0.03 0.00 0.00 0.00 0.00 36.38 34.18 3guy s VAL 74 CO 0.02 0.50 0.24 -0.69 0.00 0.00 0.00 175.10 175.17 3guy s VAL 75 N 1.12 4.75 -0.56 2.92 1.01 0.15 -0.24 120.40 129.55 3guy s VAL 75 Ca 0.01 -0.84 -0.20 0.00 0.00 0.00 0.00 61.98 60.95 3guy s VAL 75 Cb -0.14 -3.67 0.07 0.00 0.00 0.00 0.00 36.38 32.65 3guy s VAL 75 CO -0.05 -0.27 0.73 -2.28 0.00 0.00 0.00 175.10 173.22 3guy s HIS 76 N 1.58 2.96 -0.11 5.22 2.46 0.37 -0.53 115.29 127.24 3guy s HIS 76 Ca 0.03 -0.65 0.03 0.00 0.47 0.00 0.00 55.06 54.94 3guy s HIS 76 Cb -0.19 -3.86 0.07 0.00 -0.13 0.00 0.00 32.58 28.47 3guy s HIS 76 CO 0.07 -1.24 1.05 -1.13 -2.47 0.00 0.00 174.74 171.02 3guy n SER 77 N 6.55 2.16 -4.77 9.88 3.41 -1.06 -1.39 113.62 128.41 3guy n SER 77 Ca -0.07 -2.13 -0.39 0.00 -0.26 0.00 0.00 58.87 56.03 3guy n SER 77 Cb 0.44 -0.08 -0.00 0.00 -0.26 0.00 0.00 64.21 64.31 3guy n SER 77 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3guy s ALA 78 N -1.23 3.14 0.00 7.33 0.00 -1.25 -4.62 121.76 125.14 3guy s ALA 78 Ca 0.06 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.16 3guy s ALA 78 Cb 0.05 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.71 3guy s ALA 78 CO 0.02 -0.79 0.00 0.41 0.00 0.00 0.00 175.76 175.40 3guy n GLY 79 N 0.63 1.69 3.34 0.00 0.00 -1.25 -4.83 105.19 104.77 3guy n GLY 79 Ca 0.05 -0.99 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 3guy n GLY 79 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3guy s SER 80 N 0.00 -0.31 0.05 1.61 1.04 -1.26 -4.97 113.70 109.85 3guy s SER 80 Ca 0.00 -0.12 -0.02 0.00 0.48 0.00 0.00 55.95 56.29 3guy s SER 80 Cb 0.00 0.48 -0.04 0.00 0.10 0.00 0.00 66.02 66.55 3guy s SER 80 CO 0.00 -0.79 0.23 -0.83 0.98 0.00 0.00 173.24 172.83 3guy s GLY 81 N -2.45 2.20 -0.09 7.32 0.00 -1.26 -4.89 107.32 108.15 3guy s GLY 81 Ca -0.01 -0.75 -0.16 0.00 0.00 0.00 0.00 44.72 43.81 3guy s GLY 81 CO -0.08 -0.67 0.39 -0.47 0.00 0.00 0.00 173.10 172.27 3guy s TYR 82 N -1.46 -0.35 0.17 1.90 5.04 -1.26 -5.04 117.35 116.35 3guy s TYR 82 Ca 0.33 0.76 -0.09 0.00 -2.44 0.00 0.00 57.07 55.62 3guy s TYR 82 Cb -0.13 0.15 -0.01 0.00 0.35 0.00 0.00 41.96 42.33 3guy s TYR 82 CO 0.24 -0.32 0.30 -0.06 -1.34 0.00 0.00 175.55 174.37 3guy s PHE 83 N -0.53 0.39 0.00 4.97 0.08 -1.26 -4.46 117.98 117.18 3guy s PHE 83 Ca -0.06 -0.75 0.00 0.00 0.12 0.00 0.00 56.93 56.23 3guy s PHE 83 Cb -0.04 -0.04 0.00 0.00 -0.57 0.00 0.00 43.02 42.38 3guy s PHE 83 CO 0.03 -0.74 0.00 0.41 -0.10 0.00 0.00 175.22 174.82 3guy n GLY 84 N -0.23 3.97 3.65 4.36 0.00 0.17 -4.91 105.19 112.20 3guy n GLY 84 Ca -0.07 -1.67 -0.38 0.00 0.00 0.00 0.00 46.02 43.90 3guy n GLY 84 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3guy n LEU 85 N 0.00 4.22 -0.23 0.99 4.77 -1.26 -4.38 117.00 121.11 3guy n LEU 85 Ca 0.00 0.86 -0.06 0.00 -0.03 0.00 0.00 56.01 56.78 3guy n LEU 85 Cb 0.00 -1.44 0.05 0.00 -2.33 0.00 0.00 43.42 39.70 3guy n LEU 85 CO 0.00 -1.49 1.15 0.25 -1.33 0.00 0.00 177.39 175.97 3guy h LEU 86 N 0.76 0.75 -1.63 2.23 5.85 -1.97 -1.99 115.31 119.31 3guy h LEU 86 Ca -0.49 -0.02 0.12 0.00 0.84 0.00 0.00 57.88 58.33 3guy h LEU 86 Cb 1.35 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.15 3guy h LEU 86 CO 0.53 0.54 0.43 1.56 -0.34 0.00 0.00 178.44 181.16 3guy h GLN 87 N 0.88 0.39 0.00 1.25 7.50 -2.04 -1.38 115.11 121.71 3guy h GLN 87 Ca 0.24 -0.02 0.00 0.00 0.50 0.00 0.00 58.65 59.36 3guy h GLN 87 Cb -0.10 -0.09 0.00 0.00 0.05 0.00 0.00 27.48 27.34 3guy h GLN 87 CO -0.05 0.26 0.00 0.39 -1.50 0.00 0.00 178.83 177.93 3guy n GLU 88 N -4.47 0.14 -2.71 1.46 -0.58 -0.76 -4.90 120.64 108.81 3guy n GLU 88 Ca 0.11 0.15 -0.39 0.00 -0.42 0.00 0.00 57.16 56.61 3guy n GLU 88 Cb 0.43 -1.67 -0.06 0.00 -0.57 0.00 0.00 31.44 29.57 3guy n GLU 88 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3guy s GLN 89 N -3.07 4.75 -0.20 3.49 -0.21 -0.52 -4.96 119.66 118.94 3guy s GLN 89 Ca 0.11 1.51 -0.23 0.00 0.02 0.00 0.00 55.36 56.77 3guy s GLN 89 Cb 0.15 -3.15 -0.02 0.00 1.00 0.00 0.00 33.01 30.99 3guy s GLN 89 CO 0.53 0.41 0.75 0.34 -2.12 0.00 0.00 175.29 175.20 3guy s ASP 90 N -1.23 6.81 0.29 5.90 2.15 -1.26 -4.98 116.67 124.36 3guy s ASP 90 Ca 0.44 1.00 0.04 0.00 0.43 0.00 0.00 52.55 54.46 3guy s ASP 90 Cb -0.25 -2.41 0.67 0.00 -0.30 0.00 0.00 42.92 40.63 3guy s ASP 90 CO 0.32 -0.37 1.79 -0.65 -0.17 0.00 0.00 175.17 176.09 3guy h PRO 91 N 7.48 0.80 -0.68 4.34 0.11 -1.96 -1.31 132.00 140.78 3guy h PRO 91 Ca -0.29 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.76 3guy h PRO 91 Cb 1.13 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.03 3guy h PRO 91 CO 0.82 0.53 0.38 0.93 -0.21 0.00 0.00 178.00 180.44 3guy h GLU 92 N 0.82 0.94 -0.02 1.05 5.08 -1.99 -1.02 114.58 119.44 3guy h GLU 92 Ca 0.55 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.73 3guy h GLU 92 Cb 0.76 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 3guy h GLU 92 CO -0.35 0.69 -0.32 1.96 -1.00 0.00 0.00 179.01 179.99 3guy h GLN 93 N 0.92 0.04 -0.25 2.33 1.08 -1.72 -1.18 115.11 116.33 3guy h GLN 93 Ca 0.24 -0.01 -0.16 0.00 -1.45 0.00 0.00 58.65 57.27 3guy h GLN 93 Cb 0.02 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 3guy h GLN 93 CO -0.04 0.36 -0.45 0.82 -0.95 0.00 0.00 178.83 178.57 3guy h ILE 94 N 0.04 1.30 -0.86 2.54 2.04 -0.89 -1.38 117.51 120.29 3guy h ILE 94 Ca 0.00 -1.65 0.01 0.00 1.00 0.00 0.00 64.86 64.23 3guy h ILE 94 Cb 0.59 1.72 -0.04 0.00 -0.74 0.00 0.00 36.82 38.34 3guy h ILE 94 CO 0.04 0.53 0.57 -0.61 0.00 0.00 0.00 178.15 178.68 3guy h GLN 95 N 0.49 1.12 -0.43 2.37 5.75 -0.81 -1.06 115.11 122.53 3guy h GLN 95 Ca 0.02 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 3guy h GLN 95 Cb 1.05 -0.25 -0.02 0.00 1.07 0.00 0.00 27.48 29.33 3guy h GLN 95 CO 0.10 0.74 0.25 1.15 -2.65 0.00 0.00 178.83 178.43 3guy h THR 96 N 1.15 1.14 -0.53 2.39 2.02 -1.09 -1.63 112.91 116.36 3guy h THR 96 Ca 0.32 -0.34 0.09 0.00 0.77 0.00 0.00 66.41 67.25 3guy h THR 96 Cb -0.11 0.59 -0.07 0.00 -1.74 0.00 0.00 68.15 66.82 3guy h THR 96 CO -0.08 0.15 0.13 0.25 0.37 0.00 0.00 175.52 176.34 3guy h LEU 97 N 0.57 0.05 0.05 2.58 5.85 -0.96 0.61 115.31 124.07 3guy h LEU 97 Ca 0.15 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 3guy h LEU 97 Cb 0.02 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.16 3guy h LEU 97 CO -0.03 0.05 -0.02 0.40 -0.34 0.00 0.00 178.44 178.50 3guy h ILE 98 N 0.28 0.98 -0.17 4.05 2.04 -1.05 -2.08 117.51 121.56 3guy h ILE 98 Ca 0.27 -0.11 0.05 0.00 1.00 0.00 0.00 64.86 66.07 3guy h ILE 98 Cb 0.36 1.05 -0.06 0.00 -0.74 0.00 0.00 36.82 37.43 3guy h ILE 98 CO -0.33 0.03 -0.24 -0.33 0.00 0.00 0.00 178.15 177.28 3guy h GLU 99 N -0.12 -0.27 0.00 2.37 5.08 -1.01 0.93 114.58 121.56 3guy h GLU 99 Ca -0.01 0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 3guy h GLU 99 Cb 0.10 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 3guy h GLU 99 CO 0.01 -0.18 -0.33 -0.91 -1.00 0.00 0.00 179.01 176.60 3guy h ASN 100 N -0.28 0.00 0.00 1.42 2.35 -0.78 -2.71 115.58 115.58 3guy h ASN 100 Ca 0.11 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.70 3guy h ASN 100 Cb 0.45 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.80 3guy h ASN 100 CO -0.33 0.33 -1.37 0.59 -1.65 0.00 0.00 177.43 175.00 3guy n ASN 101 N -3.59 1.49 -0.04 5.81 3.02 -0.79 -3.82 115.26 117.35 3guy n ASN 101 Ca -0.01 0.25 -0.20 0.00 -0.03 0.00 0.00 54.58 54.60 3guy n ASN 101 Cb 0.46 -0.58 -0.13 0.00 -0.61 0.00 0.00 39.78 38.92 3guy n ASN 101 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3guy h LEU 102 N -0.67 0.20 -0.73 3.41 5.85 -1.02 -2.88 115.31 119.46 3guy h LEU 102 Ca -0.24 -0.81 -0.08 0.00 0.84 0.00 0.00 57.88 57.59 3guy h LEU 102 Cb 1.05 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 3guy h LEU 102 CO -0.15 1.42 0.05 0.28 -0.34 0.00 0.00 178.44 179.70 3guy h SER 103 N -0.65 0.98 -0.46 1.25 0.02 -1.29 -0.40 113.55 113.00 3guy h SER 103 Ca -0.23 -0.25 -0.08 0.00 -0.84 0.00 0.00 61.79 60.39 3guy h SER 103 Cb 1.45 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.72 3guy h SER 103 CO -0.02 1.01 -0.04 0.77 -1.14 0.00 0.00 176.83 177.41 3guy h SER 104 N 0.94 0.83 -0.51 3.07 4.64 -1.63 -0.43 113.55 120.46 3guy h SER 104 Ca 0.18 -0.33 -0.08 0.00 -0.47 0.00 0.00 61.79 61.09 3guy h SER 104 Cb 0.48 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.33 3guy h SER 104 CO 0.02 0.96 0.01 0.00 -0.87 0.00 0.00 176.83 176.95 3guy h ALA 105 N 0.90 0.69 -0.15 5.18 0.00 -1.25 -0.87 119.26 123.76 3guy h ALA 105 Ca 0.12 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3guy h ALA 105 Cb 0.56 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3guy h ALA 105 CO 0.03 0.50 0.04 0.82 0.00 0.00 0.00 179.25 180.64 3guy h ILE 106 N 0.77 1.19 -0.29 0.00 2.04 -0.92 -0.33 117.51 119.98 3guy h ILE 106 Ca 0.15 -0.61 -0.03 0.00 1.00 0.00 0.00 64.86 65.37 3guy h ILE 106 Cb 0.51 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 3guy h ILE 106 CO 0.02 0.18 0.07 0.78 0.00 0.00 0.00 178.15 179.20 3guy h ASN 107 N 0.04 0.45 -0.00 1.72 2.35 -0.99 0.21 115.58 119.36 3guy h ASN 107 Ca 0.05 -0.24 -0.00 0.00 -0.55 0.00 0.00 56.30 55.56 3guy h ASN 107 Cb 0.25 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 3guy h ASN 107 CO -0.00 0.57 0.00 0.58 -1.65 0.00 0.00 177.43 176.93 3guy h VAL 108 N 0.31 1.09 -0.38 2.81 2.07 -1.14 -1.93 116.25 119.08 3guy h VAL 108 Ca 0.09 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 3guy h VAL 108 Cb 0.30 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 3guy h VAL 108 CO 0.00 0.07 0.10 0.25 0.02 0.00 0.00 177.57 178.02 3guy h LEU 109 N -0.12 0.56 -0.48 2.57 5.85 -0.98 -1.23 115.31 121.49 3guy h LEU 109 Ca 0.00 -0.22 0.08 0.00 0.84 0.00 0.00 57.88 58.58 3guy h LEU 109 Cb 0.12 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 40.94 3guy h LEU 109 CO -0.00 0.64 0.11 -0.09 -0.34 0.00 0.00 178.44 178.76 3guy h ARG 110 N 0.46 0.24 -0.64 1.25 2.43 -0.60 -0.34 114.38 117.19 3guy h ARG 110 Ca 0.12 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 3guy h ARG 110 Cb 0.29 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 3guy h ARG 110 CO -0.00 0.16 0.10 1.49 -1.51 0.00 0.00 179.97 180.21 3guy h GLU 111 N 0.25 1.05 -0.14 0.20 4.57 -1.05 0.29 114.58 119.75 3guy h GLU 111 Ca 0.24 -0.27 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 3guy h GLU 111 Cb 0.30 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 3guy h GLU 111 CO -0.30 0.96 0.07 -0.07 -1.18 0.00 0.00 179.01 178.49 3guy h LEU 112 N 0.99 0.18 -0.52 1.64 3.38 -0.96 -1.74 115.31 118.27 3guy h LEU 112 Ca 0.20 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3guy h LEU 112 Cb 0.42 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 3guy h LEU 112 CO 0.01 0.26 0.32 0.58 0.09 0.00 0.00 178.44 179.70 3guy h VAL 113 N 0.09 1.15 -0.44 1.22 2.07 -0.78 0.13 116.25 119.70 3guy h VAL 113 Ca 0.05 -0.33 0.07 0.00 0.82 0.00 0.00 66.70 67.31 3guy h VAL 113 Cb 0.13 0.43 -0.06 0.00 -1.52 0.00 0.00 31.29 30.26 3guy h VAL 113 CO -0.01 0.15 0.08 0.50 0.02 0.00 0.00 177.57 178.32 3guy h LYS 114 N 0.70 0.20 0.13 1.57 3.64 -0.70 -2.68 116.57 119.43 3guy h LYS 114 Ca 0.19 -0.01 -0.34 0.00 -1.27 0.00 0.00 60.65 59.21 3guy h LYS 114 Cb -0.03 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 3guy h LYS 114 CO -0.04 0.13 -1.81 0.00 -2.27 0.00 0.00 179.45 175.46 3guy h ARG 115 N 0.21 0.27 0.00 1.90 3.08 -1.24 -3.42 114.38 115.17 3guy h ARG 115 Ca 0.22 -0.46 0.00 0.00 0.07 0.00 0.00 59.98 59.80 3guy h ARG 115 Cb 0.28 0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.50 3guy h ARG 115 CO -0.30 1.15 -0.13 0.66 -1.07 0.00 0.00 179.97 180.28 3guy n TYR 116 N -3.46 0.00 0.26 3.04 4.01 0.45 -4.76 117.16 116.69 3guy n TYR 116 Ca -0.25 -0.60 0.10 0.00 -0.16 0.00 0.00 57.90 56.99 3guy n TYR 116 Cb 1.06 -0.10 0.68 0.00 -0.31 0.00 0.00 39.34 40.66 3guy n TYR 116 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 3guy h LYS 117 N 0.00 0.00 -0.79 -0.72 2.10 -1.55 -1.92 116.57 113.69 3guy h LYS 117 Ca 0.00 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.46 3guy h LYS 117 Cb 1.04 0.00 -0.12 0.00 -0.90 0.00 0.00 32.23 32.26 3guy h LYS 117 CO 0.00 0.11 0.25 -0.25 -2.00 0.00 0.00 179.45 177.56 3guy n ASP 118 N -4.00 4.50 -4.25 7.07 8.00 -1.26 -3.21 116.55 123.40 3guy n ASP 118 Ca -0.02 -3.06 -0.19 0.00 0.71 0.00 0.00 54.79 52.22 3guy n ASP 118 Cb 0.20 -0.72 -0.11 0.00 -0.02 0.00 0.00 41.12 40.47 3guy n ASP 118 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3guy s GLN 119 N -2.68 1.06 -1.41 -1.24 -1.52 -0.72 -4.83 119.66 108.32 3guy s GLN 119 Ca 0.48 -1.25 -0.15 0.00 -1.95 0.00 0.00 55.36 52.50 3guy s GLN 119 Cb 0.39 -0.99 0.05 0.00 -0.22 0.00 0.00 33.01 32.23 3guy s GLN 119 CO 0.12 0.20 2.09 -0.35 -0.25 0.00 0.00 175.29 177.09 3guy n PRO 120 N 0.56 2.95 -3.76 2.91 -0.04 -1.26 -2.76 135.00 133.59 3guy n PRO 120 Ca -0.16 -2.80 -0.35 0.00 -0.04 0.00 0.00 63.50 60.16 3guy n PRO 120 Cb 0.57 -3.35 -0.08 0.00 -0.04 0.00 0.00 33.50 30.60 3guy n PRO 120 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3guy s VAL 121 N 3.48 5.35 -0.33 0.52 1.01 -1.26 -4.79 120.40 124.38 3guy s VAL 121 Ca 0.49 0.17 -0.21 0.00 0.00 0.00 0.00 61.98 62.42 3guy s VAL 121 Cb 0.11 -3.43 -0.00 0.00 0.00 0.00 0.00 36.38 33.05 3guy s VAL 121 CO -0.04 0.45 0.68 0.20 0.00 0.00 0.00 175.10 176.38 3guy s ASN 122 N 0.33 6.51 -0.41 3.32 0.01 -0.45 -1.80 114.94 122.45 3guy s ASN 122 Ca 0.08 0.37 -0.12 0.00 -0.71 0.00 0.00 52.86 52.48 3guy s ASN 122 Cb -0.11 -2.35 0.05 0.00 0.41 0.00 0.00 41.25 39.25 3guy s ASN 122 CO -0.02 -0.57 0.27 -0.69 -1.51 0.00 0.00 177.10 174.59 3guy s VAL 123 N 2.76 4.74 -0.46 1.60 1.01 0.17 -0.60 120.40 129.61 3guy s VAL 123 Ca 0.27 -0.99 -0.18 0.00 0.00 0.00 0.00 61.98 61.09 3guy s VAL 123 Cb -0.14 -3.74 0.05 0.00 0.00 0.00 0.00 36.38 32.54 3guy s VAL 123 CO 0.13 -0.38 0.50 -0.69 0.00 0.00 0.00 175.10 174.67 3guy s VAL 124 N 1.56 5.04 -0.39 2.92 1.01 0.67 -0.36 120.40 130.85 3guy s VAL 124 Ca 0.03 -0.55 -0.14 0.00 0.00 0.00 0.00 61.98 61.33 3guy s VAL 124 Cb -0.21 -4.15 0.01 0.00 0.00 0.00 0.00 36.38 32.03 3guy s VAL 124 CO 0.06 -0.60 0.27 -0.04 0.00 0.00 0.00 175.10 174.80 3guy s MET 125 N 2.22 3.09 -0.21 2.72 -1.94 0.12 -0.48 119.30 124.82 3guy s MET 125 Ca 0.12 -0.93 -0.15 0.00 -1.71 0.00 0.00 55.69 53.02 3guy s MET 125 Cb -0.19 -3.90 -0.04 0.00 2.01 0.00 0.00 34.83 32.70 3guy s MET 125 CO 0.12 -0.66 0.35 0.42 -0.01 0.00 0.00 175.02 175.23 3guy s ILE 126 N 1.68 5.23 0.00 2.53 1.01 -0.48 -1.37 121.20 129.79 3guy s ILE 126 Ca 0.05 0.59 0.00 0.00 0.00 0.00 0.00 60.65 61.29 3guy s ILE 126 Cb -0.19 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.60 3guy s ILE 126 CO 0.10 0.26 0.00 0.23 0.00 0.00 0.00 174.94 175.53 3guy n MET 127 N 4.51 0.00 0.00 2.79 2.81 0.38 -4.76 117.12 122.85 3guy n MET 127 Ca -0.10 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.79 3guy n MET 127 Cb 0.51 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.02 3guy n MET 127 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3guy n SER 128 N 0.00 0.00 0.18 7.83 2.88 -1.26 -4.48 113.62 118.77 3guy n SER 128 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 3guy n SER 128 Cb 0.00 0.00 0.62 0.00 -0.75 0.00 0.00 64.21 64.08 3guy n SER 128 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 3guy h THR 129 N 0.46 0.00 -0.00 2.46 1.35 -1.54 -0.36 112.91 115.28 3guy h THR 129 Ca 0.00 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 3guy h THR 129 Cb 0.00 0.73 -0.00 0.00 -1.73 0.00 0.00 68.15 67.15 3guy h THR 129 CO 0.00 0.00 0.03 0.00 -0.25 0.00 0.00 175.52 175.30 3guy h ALA 130 N 2.08 1.11 0.00 6.62 0.00 -1.85 -2.03 119.26 125.19 3guy h ALA 130 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3guy h ALA 130 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3guy h ALA 130 CO 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.22 3guy h ALA 131 N 1.95 1.00 0.00 0.00 0.00 -1.31 -3.34 119.26 117.56 3guy h ALA 131 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3guy h ALA 131 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3guy h ALA 131 CO -0.00 0.00 -1.49 1.04 0.00 0.00 0.00 179.25 178.80 3guy n GLN 132 N -3.02 0.79 -3.92 0.00 6.02 -0.77 -4.33 117.38 112.15 3guy n GLN 132 Ca 0.02 -0.11 -0.09 0.00 -0.01 0.00 0.00 57.00 56.81 3guy n GLN 132 Cb 0.38 -1.33 -0.09 0.00 1.02 0.00 0.00 30.24 30.23 3guy n GLN 132 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3guy s GLN 133 N -2.92 0.69 0.39 -1.09 -0.21 -1.17 -5.15 119.66 110.20 3guy s GLN 133 Ca -0.03 -0.87 -0.24 0.00 0.02 0.00 0.00 55.36 54.24 3guy s GLN 133 Cb 0.10 0.27 -0.10 0.00 1.00 0.00 0.00 33.01 34.29 3guy s GLN 133 CO 0.62 -0.19 0.99 -1.25 -2.12 0.00 0.00 175.29 173.35 3guy s PRO 134 N -3.20 4.29 -0.05 2.91 0.04 -1.26 -4.68 135.00 133.05 3guy s PRO 134 Ca -0.00 1.34 -0.02 0.00 0.04 0.00 0.00 61.00 62.36 3guy s PRO 134 Cb 0.02 -2.50 0.04 0.00 0.04 0.00 0.00 34.50 32.10 3guy s PRO 134 CO -0.07 -0.00 0.11 0.15 0.04 0.00 0.00 177.00 177.22 3guy s LYS 135 N -2.58 0.04 0.50 4.56 1.02 -1.26 -5.11 119.74 116.90 3guy s LYS 135 Ca 0.57 0.33 -0.23 0.00 0.02 0.00 0.00 55.97 56.66 3guy s LYS 135 Cb -0.17 -0.22 -0.06 0.00 -0.52 0.00 0.00 37.83 36.86 3guy s LYS 135 CO 0.22 -0.18 1.30 0.00 -0.92 0.00 0.00 175.35 175.77 3guy s ALA 136 N 1.26 2.95 0.00 5.17 0.00 -1.26 -1.78 121.76 128.10 3guy s ALA 136 Ca -0.08 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.09 3guy s ALA 136 Cb -0.12 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.50 3guy s ALA 136 CO -0.05 -1.08 0.00 1.04 0.00 0.00 0.00 175.76 175.67 3guy n GLN 137 N -0.67 -1.29 -1.35 0.00 6.02 -1.26 -4.82 117.38 114.01 3guy n GLN 137 Ca 0.08 0.32 0.03 0.00 -0.01 0.00 0.00 57.00 57.42 3guy n GLN 137 Cb 0.45 -4.47 0.08 0.00 1.02 0.00 0.00 30.24 27.33 3guy n GLN 137 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3guy n GLU 138 N -0.25 0.86 -0.23 -1.09 1.02 -0.73 -0.65 120.64 119.57 3guy n GLU 138 Ca 0.00 -2.67 -0.07 0.00 -0.02 0.00 0.00 57.16 54.40 3guy n GLU 138 Cb 0.32 -0.79 0.04 0.00 -0.02 0.00 0.00 31.44 30.99 3guy n GLU 138 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3guy h SER 139 N 1.20 0.84 1.08 1.62 4.64 -1.82 0.45 113.55 121.56 3guy h SER 139 Ca -0.12 -0.13 -0.13 0.00 -0.47 0.00 0.00 61.79 60.95 3guy h SER 139 Cb 1.53 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 63.39 3guy h SER 139 CO 0.11 0.73 -0.60 0.71 -0.87 0.00 0.00 176.83 176.91 3guy h THR 140 N 0.89 1.15 -0.02 2.95 1.35 -1.92 -1.18 112.91 116.12 3guy h THR 140 Ca 0.22 -2.29 -0.04 0.00 -0.55 0.00 0.00 66.41 63.75 3guy h THR 140 Cb 0.11 2.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 3guy h THR 140 CO -0.03 0.59 -0.15 0.22 -0.25 0.00 0.00 175.52 175.90 3guy h TYR 141 N 0.00 0.20 -0.71 4.73 3.20 -1.63 -1.93 116.97 120.82 3guy h TYR 141 Ca -0.01 -0.09 0.11 0.00 3.14 0.00 0.00 58.73 61.88 3guy h TYR 141 Cb 1.30 -0.03 -0.08 0.00 1.54 0.00 0.00 36.73 39.46 3guy h TYR 141 CO 0.00 0.81 0.32 0.00 -1.64 0.00 0.00 178.16 177.65 3guy h ALA 143 N 1.46 0.39 0.00 0.00 0.00 -1.07 0.33 119.26 120.38 3guy h ALA 143 Ca 0.36 0.08 -0.14 0.00 0.00 0.00 0.00 54.91 55.21 3guy h ALA 143 Cb 0.45 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3guy h ALA 143 CO -0.31 -0.34 -0.68 -0.39 0.00 0.00 0.00 179.25 177.53 3guy h VAL 144 N 0.19 1.40 0.07 0.00 -1.51 -0.92 -0.69 116.25 114.80 3guy h VAL 144 Ca 0.18 -2.39 -0.27 0.00 -1.23 0.00 0.00 66.70 62.99 3guy h VAL 144 Cb 0.21 2.32 0.01 0.00 -2.13 0.00 0.00 31.29 31.71 3guy h VAL 144 CO -0.24 0.67 -1.12 0.11 -1.23 0.00 0.00 177.57 175.75 3guy h LYS 145 N 0.00 0.49 -0.74 5.19 1.79 -0.73 -1.76 116.57 120.82 3guy h LYS 145 Ca -0.01 -0.62 0.01 0.00 -2.18 0.00 0.00 60.65 57.85 3guy h LYS 145 Cb 1.27 0.20 -0.04 0.00 -1.58 0.00 0.00 32.23 32.08 3guy h LYS 145 CO 0.09 1.25 0.49 -1.49 -1.08 0.00 0.00 179.45 178.71 3guy h TRP 146 N 0.23 0.92 -0.28 -1.35 4.06 -0.38 -1.70 115.95 117.45 3guy h TRP 146 Ca -0.14 0.02 0.04 0.00 2.06 0.00 0.00 58.89 60.87 3guy h TRP 146 Cb 1.79 -0.31 -0.04 0.00 -1.00 0.00 0.00 29.16 29.61 3guy h TRP 146 CO 0.09 0.57 0.06 0.00 -3.56 0.00 0.00 178.44 175.60 3guy h ALA 147 N 1.28 0.30 -0.64 1.49 0.00 -0.98 -1.48 119.26 119.23 3guy h ALA 147 Ca 0.28 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 3guy h ALA 147 Cb -0.09 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3guy h ALA 147 CO -0.07 -0.35 0.14 0.28 0.00 0.00 0.00 179.25 179.26 3guy h VAL 148 N 0.17 1.25 -0.51 0.00 2.07 -1.15 -1.70 116.25 116.38 3guy h VAL 148 Ca 0.13 -0.93 0.05 0.00 0.82 0.00 0.00 66.70 66.77 3guy h VAL 148 Cb 0.13 0.60 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 3guy h VAL 148 CO -0.17 0.35 0.25 0.50 0.02 0.00 0.00 177.57 178.52 3guy h LYS 149 N 0.96 0.46 -0.50 1.57 3.64 -0.98 -1.22 116.57 120.51 3guy h LYS 149 Ca 0.20 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 3guy h LYS 149 Cb 0.36 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 3guy h LYS 149 CO 0.00 0.31 0.27 0.78 -2.27 0.00 0.00 179.45 178.54 3guy h GLY 150 N 0.48 0.74 0.27 5.01 0.00 -0.96 0.42 103.07 109.03 3guy h GLY 150 Ca 0.23 -0.34 0.02 0.00 0.00 0.00 0.00 47.33 47.24 3guy h GLY 150 CO -0.18 0.33 -0.41 -2.00 0.00 0.00 0.00 176.54 174.28 3guy h LEU 151 N 0.66 -1.21 -0.71 3.11 5.85 -1.10 -1.85 115.31 120.06 3guy h LEU 151 Ca 0.17 0.14 -0.13 0.00 0.84 0.00 0.00 57.88 58.90 3guy h LEU 151 Cb 0.06 0.46 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 3guy h LEU 151 CO -0.03 -0.48 -0.41 0.16 -0.34 0.00 0.00 178.44 177.34 3guy h ILE 152 N -0.63 1.30 -0.10 4.05 -0.00 -1.03 -0.65 117.51 120.45 3guy h ILE 152 Ca 0.03 -1.58 -0.09 0.00 -0.00 0.00 0.00 64.86 63.22 3guy h ILE 152 Cb 0.67 1.59 -0.01 0.00 -0.00 0.00 0.00 36.82 39.06 3guy h ILE 152 CO -0.25 0.49 -0.33 -0.33 -0.00 0.00 0.00 178.15 177.73 3guy h GLU 153 N 0.41 0.20 -0.09 0.16 4.39 -0.86 -0.30 114.58 118.49 3guy h GLU 153 Ca 0.03 -0.08 -0.12 0.00 0.34 0.00 0.00 59.36 59.54 3guy h GLU 153 Cb 0.90 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.54 3guy h GLU 153 CO 0.08 0.51 -0.42 0.77 -1.16 0.00 0.00 179.01 178.79 3guy h SER 154 N 0.17 0.53 -0.12 1.42 0.02 -0.95 -3.04 113.55 111.58 3guy h SER 154 Ca 0.02 -0.64 -0.08 0.00 -0.84 0.00 0.00 61.79 60.25 3guy h SER 154 Cb 0.67 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 3guy h SER 154 CO 0.05 1.08 -0.18 0.58 -1.14 0.00 0.00 176.83 177.23 3guy h VAL 155 N 0.01 1.25 -0.87 2.27 2.07 -0.98 -2.37 116.25 117.62 3guy h VAL 155 Ca -0.03 -1.13 0.11 0.00 0.82 0.00 0.00 66.70 66.47 3guy h VAL 155 Cb 1.07 1.22 -0.08 0.00 -1.52 0.00 0.00 31.29 31.98 3guy h VAL 155 CO 0.09 0.37 0.50 0.03 0.02 0.00 0.00 177.57 178.57 3guy h ARG 156 N 0.46 0.77 -0.41 1.57 3.08 -1.07 0.11 114.38 118.90 3guy h ARG 156 Ca 0.08 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 3guy h ARG 156 Cb 0.57 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 3guy h ARG 156 CO 0.04 0.51 0.11 -0.07 -1.07 0.00 0.00 179.97 179.49 3guy h LEU 157 N 0.79 0.55 -0.92 3.04 3.38 -1.31 -2.36 115.31 118.49 3guy h LEU 157 Ca 0.44 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.29 3guy h LEU 157 Cb 0.46 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3guy h LEU 157 CO -0.28 0.54 -0.17 -0.33 0.09 0.00 0.00 178.44 178.30 3guy h GLU 158 N 0.59 0.00 -0.22 1.13 5.08 -0.52 -3.15 114.58 117.48 3guy h GLU 158 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3guy h GLU 158 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3guy h GLU 158 CO -0.01 0.17 0.00 1.28 -1.00 0.00 0.00 179.01 179.45 3guy n LEU 159 N -3.26 2.39 -4.70 1.33 4.77 -0.03 -4.92 117.00 112.58 3guy n LEU 159 Ca 0.01 -0.98 -0.60 0.00 -0.03 0.00 0.00 56.01 54.41 3guy n LEU 159 Cb 0.45 -0.14 -0.08 0.00 -2.33 0.00 0.00 43.42 41.32 3guy n LEU 159 CO 0.33 0.49 1.21 0.29 -1.33 0.00 0.00 177.39 178.38 3guy n LYS 160 N 0.81 0.81 0.00 3.23 5.02 -1.10 -1.19 118.16 125.74 3guy n LYS 160 Ca 0.17 0.30 0.00 0.00 -2.02 0.00 0.00 58.31 56.76 3guy n LYS 160 Cb 0.45 -1.92 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 3guy n LYS 160 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3guy n GLY 161 N 3.89 2.65 3.94 0.72 0.00 -1.26 -5.04 105.19 110.09 3guy n GLY 161 Ca 0.27 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.05 3guy n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3guy s LYS 162 N -0.83 3.49 0.29 1.61 1.02 -0.33 -5.01 119.74 119.98 3guy s LYS 162 Ca 0.00 -0.30 0.25 0.00 0.02 0.00 0.00 55.97 55.94 3guy s LYS 162 Cb 0.00 -2.65 0.75 0.00 -0.52 0.00 0.00 37.83 35.41 3guy s LYS 162 CO 0.00 0.13 1.74 -1.00 -0.92 0.00 0.00 175.35 175.31 3guy h PRO 163 N 0.76 0.00 -6.69 -1.68 0.13 -1.81 -3.44 132.00 119.26 3guy h PRO 163 Ca -0.50 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.12 3guy h PRO 163 Cb 1.22 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.36 3guy h PRO 163 CO 0.61 0.00 0.50 1.41 -0.23 0.00 0.00 178.00 180.29 3guy s MET 164 N -3.18 4.58 0.06 0.86 -2.45 -1.11 -4.36 119.30 113.70 3guy s MET 164 Ca 0.09 1.78 0.07 0.00 -1.25 0.00 0.00 55.69 56.38 3guy s MET 164 Cb 0.10 -3.25 -0.03 0.00 1.25 0.00 0.00 34.83 32.91 3guy s MET 164 CO 0.59 0.07 -0.20 0.15 1.05 0.00 0.00 175.02 176.67 3guy s LYS 165 N -0.59 1.29 -0.17 4.11 1.02 -0.74 -4.97 119.74 119.68 3guy s LYS 165 Ca 0.49 -0.98 -0.04 0.00 0.02 0.00 0.00 55.97 55.46 3guy s LYS 165 Cb -0.31 -1.43 -0.02 0.00 -0.52 0.00 0.00 37.83 35.55 3guy s LYS 165 CO 0.37 0.36 -0.03 0.42 -0.92 0.00 0.00 175.35 175.54 3guy s ILE 166 N -0.90 3.82 -0.20 2.17 1.01 -1.26 -0.65 121.20 125.19 3guy s ILE 166 Ca 0.07 -0.37 -0.05 0.00 0.00 0.00 0.00 60.65 60.30 3guy s ILE 166 Cb -0.09 -2.69 -0.02 0.00 0.01 0.00 0.00 42.46 39.67 3guy s ILE 166 CO 0.02 0.47 -0.01 -0.63 0.00 0.00 0.00 174.94 174.80 3guy s ILE 167 N 0.61 3.84 -0.17 2.92 -1.09 0.51 -4.93 121.20 122.89 3guy s ILE 167 Ca -0.02 -0.35 -0.09 0.00 -2.23 0.00 0.00 60.65 57.96 3guy s ILE 167 Cb -0.14 -2.73 -0.05 0.00 -1.58 0.00 0.00 42.46 37.96 3guy s ILE 167 CO 0.02 0.43 0.13 0.00 -1.23 0.00 0.00 174.94 174.29 3guy s ALA 168 N 1.05 3.74 -0.06 9.38 0.00 0.10 -0.70 121.76 135.27 3guy s ALA 168 Ca 0.02 -0.68 0.03 0.00 0.00 0.00 0.00 51.96 51.33 3guy s ALA 168 Cb -0.14 -2.08 0.01 0.00 0.00 0.00 0.00 23.12 20.90 3guy s ALA 168 CO 0.01 0.33 -0.14 0.08 0.00 0.00 0.00 175.76 176.04 3guy s VAL 169 N -0.15 1.27 -0.46 0.00 1.01 -0.47 -1.44 120.40 120.15 3guy s VAL 169 Ca 0.10 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.53 3guy s VAL 169 Cb -0.11 -1.13 0.13 0.00 0.00 0.00 0.00 36.38 35.27 3guy s VAL 169 CO 0.00 0.38 0.24 -0.31 0.00 0.00 0.00 175.10 175.42 3guy s TYR 170 N 0.43 2.32 0.33 5.22 2.02 0.41 -0.47 117.35 127.62 3guy s TYR 170 Ca -0.11 -2.64 -0.16 0.00 -0.37 0.00 0.00 57.07 53.79 3guy s TYR 170 Cb -0.14 -2.16 -0.09 0.00 -0.40 0.00 0.00 41.96 39.17 3guy s TYR 170 CO 0.04 -0.77 0.76 -2.14 -1.57 0.00 0.00 175.55 171.86 3guy s PRO 171 N 0.17 4.04 0.04 -1.71 0.02 -1.26 -1.99 135.00 134.32 3guy s PRO 171 Ca 0.17 0.73 -0.04 0.00 0.02 0.00 0.00 61.00 61.88 3guy s PRO 171 Cb -0.25 -2.43 -0.02 0.00 0.02 0.00 0.00 34.50 31.83 3guy s PRO 171 CO 0.00 0.15 0.05 0.20 -0.33 0.00 0.00 177.00 177.07 3guy s GLY 172 N -2.23 0.26 -0.12 0.52 0.00 0.14 -1.71 107.32 104.18 3guy s GLY 172 Ca 0.54 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 44.51 3guy s GLY 172 CO 0.17 -0.87 0.00 0.61 0.00 0.00 0.00 173.10 173.01 3guy n GLY 173 N 0.63 0.45 3.95 0.20 0.00 -1.26 -3.41 105.19 105.74 3guy n GLY 173 Ca -0.18 -1.01 -0.23 0.00 0.00 0.00 0.00 46.02 44.60 3guy n GLY 173 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3guy s MET 174 N -2.40 3.41 0.42 1.61 1.00 -1.26 -0.73 119.30 121.35 3guy s MET 174 Ca 0.00 -0.44 0.14 0.00 0.00 0.00 0.00 55.69 55.39 3guy s MET 174 Cb 0.00 -2.69 0.89 0.00 0.00 0.00 0.00 34.83 33.03 3guy s MET 174 CO 0.00 0.13 1.92 0.00 0.00 0.00 0.00 175.02 177.07 3guy h ALA 175 N 0.77 1.55 0.00 3.03 0.00 -1.95 -2.82 119.26 119.84 3guy h ALA 175 Ca -0.49 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.18 3guy h ALA 175 Cb 1.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3guy h ALA 175 CO 0.60 0.33 0.00 0.25 0.00 0.00 0.00 179.25 180.43 3guy n THR 176 N -4.21 1.24 -1.24 0.00 -2.24 -1.26 -1.22 114.28 105.34 3guy n THR 176 Ca -0.02 0.31 0.08 0.00 -2.27 0.00 0.00 64.05 62.15 3guy n THR 176 Cb 0.32 -1.17 0.17 0.00 -2.10 0.00 0.00 70.33 67.54 3guy n THR 176 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3guy n GLU 177 N -1.42 1.53 -2.84 -0.78 1.02 -1.06 -4.58 120.64 112.50 3guy n GLU 177 Ca 0.03 -2.84 -0.43 0.00 -0.02 0.00 0.00 57.16 53.90 3guy n GLU 177 Cb 0.08 -1.58 -0.04 0.00 -0.02 0.00 0.00 31.44 29.88 3guy n GLU 177 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 3guy s PHE 178 N -3.00 3.06 -0.26 -0.32 0.08 -0.36 -5.01 117.98 112.17 3guy s PHE 178 Ca 0.35 0.67 0.18 0.00 0.12 0.00 0.00 56.93 58.25 3guy s PHE 178 Cb 0.32 -3.64 0.49 0.00 -0.57 0.00 0.00 43.02 39.62 3guy s PHE 178 CO 0.00 -0.85 1.14 1.87 -0.10 0.00 0.00 175.22 177.28 3guy n TRP 179 N 6.75 1.62 0.00 0.36 -0.00 -1.26 -5.11 117.44 119.80 3guy n TRP 179 Ca 0.06 -2.09 0.00 0.00 -0.00 0.00 0.00 57.50 55.47 3guy n TRP 179 Cb 0.48 -0.26 0.00 0.00 -0.00 0.00 0.00 31.31 31.53 3guy n TRP 179 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 177.69 176.56 3guy n SER 189 N -0.60 0.00 0.14 5.87 3.41 -1.26 -5.02 113.62 116.16 3guy n SER 189 Ca 0.18 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.91 3guy n SER 189 Cb 0.86 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 65.09 3guy n SER 189 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3guy h SER 190 N 0.00 0.00 -4.18 4.04 4.64 -2.05 -3.46 113.55 112.53 3guy h SER 190 Ca 0.00 -0.03 -0.53 0.00 -0.47 0.00 0.00 61.79 60.77 3guy h SER 190 Cb 0.00 0.00 0.15 0.00 -0.31 0.00 0.00 62.40 62.24 3guy h SER 190 CO 0.00 0.01 0.39 -0.36 -0.87 0.00 0.00 176.83 176.00 3guy s PHE 191 N -3.16 2.14 0.19 4.77 0.08 -1.26 -4.85 117.98 115.89 3guy s PHE 191 Ca 0.08 1.60 -0.30 0.00 0.12 0.00 0.00 56.93 58.43 3guy s PHE 191 Cb 0.10 -3.42 -0.08 0.00 -0.57 0.00 0.00 43.02 39.05 3guy s PHE 191 CO 0.65 -2.46 1.10 1.41 -0.10 0.00 0.00 175.22 175.81 3guy s MET 192 N -3.95 4.60 0.36 0.44 -2.45 0.10 -4.99 119.30 113.40 3guy s MET 192 Ca 0.73 1.73 -0.13 0.00 -1.25 0.00 0.00 55.69 56.76 3guy s MET 192 Cb -0.28 -3.27 -0.08 0.00 1.25 0.00 0.00 34.83 32.46 3guy s MET 192 CO 0.45 0.10 0.76 -1.54 1.05 0.00 0.00 175.02 175.84 3guy s SER 193 N -0.23 6.67 0.31 1.11 1.04 -1.26 -4.32 113.70 117.01 3guy s SER 193 Ca 0.49 1.24 0.07 0.00 0.48 0.00 0.00 55.95 58.22 3guy s SER 193 Cb -0.30 -2.36 0.79 0.00 0.10 0.00 0.00 66.02 64.25 3guy s SER 193 CO 0.36 -0.29 1.74 0.00 0.98 0.00 0.00 173.24 176.03 3guy h ALA 194 N 1.83 1.66 -0.34 5.32 0.00 -1.96 0.14 119.26 125.92 3guy h ALA 194 Ca -0.48 0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 3guy h ALA 194 Cb 1.18 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3guy h ALA 194 CO 0.65 -0.19 -0.25 1.49 0.00 0.00 0.00 179.25 180.95 3guy h GLU 195 N 0.63 0.76 -0.05 0.00 4.81 -1.93 -0.80 114.58 118.00 3guy h GLU 195 Ca 0.60 -0.37 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 3guy h GLU 195 Cb 1.04 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.42 3guy h GLU 195 CO -0.44 0.99 -0.00 -0.44 -0.73 0.00 0.00 179.01 178.39 3guy h ASP 196 N 0.54 0.09 -0.57 1.04 3.32 -1.80 -1.73 116.42 117.31 3guy h ASP 196 Ca 0.06 -0.32 0.07 0.00 0.02 0.00 0.00 57.03 56.87 3guy h ASP 196 Cb 0.81 -0.02 -0.06 0.00 0.22 0.00 0.00 39.33 40.28 3guy h ASP 196 CO 0.07 0.39 0.24 0.00 -1.72 0.00 0.00 179.24 178.21 3guy h ALA 197 N 0.71 0.73 -0.73 3.45 0.00 -1.01 -1.56 119.26 120.84 3guy h ALA 197 Ca 0.01 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3guy h ALA 197 Cb 0.34 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3guy h ALA 197 CO 0.00 -0.15 0.40 0.00 0.00 0.00 0.00 179.25 179.51 3guy h ALA 198 N 1.36 0.94 -0.38 0.00 0.00 -1.08 0.23 119.26 120.33 3guy h ALA 198 Ca 0.27 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3guy h ALA 198 Cb 0.28 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3guy h ALA 198 CO -0.25 0.45 0.25 -0.07 0.00 0.00 0.00 179.25 179.63 3guy h LEU 199 N 1.01 0.42 0.02 0.00 3.38 -0.45 0.58 115.31 120.27 3guy h LEU 199 Ca 0.26 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 3guy h LEU 199 Cb 0.03 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3guy h LEU 199 CO -0.04 0.30 -0.01 0.24 0.09 0.00 0.00 178.44 179.02 3guy h MET 200 N 0.50 -0.02 -0.21 1.13 2.86 -0.98 0.42 114.93 118.63 3guy h MET 200 Ca 0.14 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 3guy h MET 200 Cb -0.04 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 3guy h MET 200 CO -0.04 0.06 0.11 0.82 1.06 0.00 0.00 176.91 178.92 3guy h ILE 201 N -0.11 1.12 -0.28 -1.22 2.04 -0.51 0.22 117.51 118.78 3guy h ILE 201 Ca -0.00 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 3guy h ILE 201 Cb 0.10 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3guy h ILE 201 CO 0.00 0.12 0.12 -0.74 0.00 0.00 0.00 178.15 177.66 3guy h HIS 202 N 0.22 0.41 -0.28 1.37 2.76 -0.77 -0.42 115.15 118.43 3guy h HIS 202 Ca 0.07 -0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.25 3guy h HIS 202 Cb 0.09 -0.13 -0.03 0.00 1.55 0.00 0.00 27.41 28.89 3guy h HIS 202 CO -0.03 0.39 0.07 0.78 -1.30 0.00 0.00 177.93 177.84 3guy h GLY 203 N 0.31 0.33 1.46 5.26 0.00 0.01 -3.07 103.07 107.36 3guy h GLY 203 Ca 0.09 -0.03 -0.07 0.00 0.00 0.00 0.00 47.33 47.32 3guy h GLY 203 CO -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 176.54 176.51 3guy h ALA 204 N 1.20 1.19 -1.88 3.60 0.00 -0.23 -3.40 119.26 119.74 3guy h ALA 204 Ca 0.13 -0.25 -0.57 0.00 0.00 0.00 0.00 54.91 54.21 3guy h ALA 204 Cb 0.12 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3guy h ALA 204 CO -0.16 0.52 1.38 -0.51 0.00 0.00 0.00 179.25 180.49 3guy s LEU 205 N -9.07 3.46 -0.00 0.00 1.43 -0.20 -4.77 118.68 109.54 3guy s LEU 205 Ca -0.08 1.48 0.01 0.00 -1.03 0.00 0.00 54.13 54.51 3guy s LEU 205 Cb 0.15 -3.42 -0.00 0.00 0.03 0.00 0.00 46.19 42.94 3guy s LEU 205 CO 0.79 -1.90 -0.03 0.00 0.23 0.00 0.00 176.35 175.45 3guy s ALA 206 N 7.82 0.22 -0.30 4.21 0.00 -1.26 -4.98 121.76 127.47 3guy s ALA 206 Ca 0.88 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.72 3guy s ALA 206 Cb -0.26 -0.05 0.09 0.00 0.00 0.00 0.00 23.12 22.90 3guy s ALA 206 CO 0.33 0.05 0.05 -0.80 0.00 0.00 0.00 175.76 175.39 3guy s ASN 207 N -0.12 4.17 -0.08 0.00 0.02 -1.26 -2.13 114.94 115.54 3guy s ASN 207 Ca 0.00 -1.66 0.05 0.00 -1.02 0.00 0.00 52.86 50.23 3guy s ASN 207 Cb -0.01 -1.15 -0.00 0.00 0.02 0.00 0.00 41.25 40.10 3guy s ASN 207 CO -0.00 -0.36 -0.24 -0.63 0.02 0.00 0.00 177.10 175.88 3guy s ILE 208 N 1.36 2.06 0.00 0.60 -1.09 -1.08 -5.00 121.20 118.05 3guy s ILE 208 Ca 0.06 -1.04 0.00 0.00 -2.23 0.00 0.00 60.65 57.44 3guy s ILE 208 Cb -0.18 -1.76 0.00 0.00 -1.58 0.00 0.00 42.46 38.94 3guy s ILE 208 CO -0.15 0.56 0.00 0.61 -1.23 0.00 0.00 174.94 174.73 3guy n GLY 209 N 3.29 2.21 1.79 6.18 0.00 -1.26 -1.95 105.19 115.45 3guy n GLY 209 Ca -0.18 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.43 3guy n GLY 209 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3guy n ASN 210 N -0.14 6.08 -3.91 1.61 5.15 -1.26 -4.90 115.26 117.89 3guy n ASN 210 Ca 0.00 -2.84 -0.09 0.00 -0.60 0.00 0.00 54.58 51.05 3guy n ASN 210 Cb 0.00 -1.10 -0.05 0.00 -0.53 0.00 0.00 39.78 38.11 3guy n ASN 210 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3guy s GLY 211 N 0.83 0.28 0.16 8.20 0.00 -0.82 -5.17 107.32 110.78 3guy s GLY 211 Ca 0.23 -0.63 -0.23 0.00 0.00 0.00 0.00 44.72 44.09 3guy s GLY 211 CO -0.01 -0.47 0.63 -2.52 0.00 0.00 0.00 173.10 170.73 3guy s TYR 212 N -3.96 -0.50 -0.46 1.90 -0.85 -1.26 -2.63 117.35 109.59 3guy s TYR 212 Ca 0.17 0.27 -0.26 0.00 -0.52 0.00 0.00 57.07 56.73 3guy s TYR 212 Cb -0.01 0.57 0.03 0.00 0.38 0.00 0.00 41.96 42.93 3guy s TYR 212 CO 0.05 -0.86 0.96 0.08 -1.52 0.00 0.00 175.55 174.26 3guy s VAL 213 N -3.72 4.43 -0.18 -3.49 1.01 -0.91 -4.90 120.40 112.65 3guy s VAL 213 Ca 0.02 0.86 0.21 0.00 0.00 0.00 0.00 61.98 63.07 3guy s VAL 213 Cb -0.01 -4.46 -0.09 0.00 0.00 0.00 0.00 36.38 31.82 3guy s VAL 213 CO -0.11 -0.85 0.89 -1.54 0.00 0.00 0.00 175.10 173.49 3guy n SER 214 N 7.26 0.73 -3.70 3.32 3.41 -1.26 -4.81 113.62 118.57 3guy n SER 214 Ca 0.07 0.29 -0.11 0.00 -0.26 0.00 0.00 58.87 58.87 3guy n SER 214 Cb 0.49 0.58 -0.10 0.00 -0.26 0.00 0.00 64.21 64.91 3guy n SER 214 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3guy s ASP 215 N -5.37 -0.55 -0.02 4.04 1.01 -1.26 -0.72 116.67 113.80 3guy s ASP 215 Ca -0.02 0.96 -0.02 0.00 0.71 0.00 0.00 52.55 54.17 3guy s ASP 215 Cb 0.10 0.87 0.01 0.00 1.01 0.00 0.00 42.92 44.90 3guy s ASP 215 CO 0.81 -0.19 0.06 -0.51 0.21 0.00 0.00 175.17 175.55 3guy s ILE 216 N 1.14 -0.00 -0.10 0.77 2.07 -0.52 -4.97 121.20 119.59 3guy s ILE 216 Ca -0.07 0.01 0.03 0.00 -1.41 0.00 0.00 60.65 59.21 3guy s ILE 216 Cb -0.07 -0.10 0.00 0.00 0.13 0.00 0.00 42.46 42.43 3guy s ILE 216 CO -0.10 0.00 -0.21 -0.89 -1.91 0.00 0.00 174.94 171.83 3guy s THR 217 N 0.08 1.86 -0.10 4.00 2.01 -1.26 -0.44 115.64 121.79 3guy s THR 217 Ca -0.00 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 61.12 3guy s THR 217 Cb -0.01 -1.63 0.01 0.00 0.01 0.00 0.00 72.50 70.88 3guy s THR 217 CO -0.00 0.52 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.58 3guy s VAL 218 N 0.50 1.59 0.17 3.82 1.01 -0.84 -4.98 120.40 121.67 3guy s VAL 218 Ca -0.16 -0.72 0.04 0.00 0.00 0.00 0.00 61.98 61.15 3guy s VAL 218 Cb -0.17 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 3guy s VAL 218 CO 0.06 0.46 -0.07 0.20 0.00 0.00 0.00 175.10 175.74 3guy s ASN 219 N 0.80 1.83 0.30 3.32 -0.87 -1.26 -0.68 114.94 118.37 3guy s ASN 219 Ca -0.10 -1.07 -0.22 0.00 -1.57 0.00 0.00 52.86 49.90 3guy s ASN 219 Cb -0.16 -0.01 -0.09 0.00 -0.02 0.00 0.00 41.25 40.97 3guy s ASN 219 CO 0.01 -0.38 0.83 0.00 -2.57 0.00 0.00 177.10 175.00 3guy s ARG 220 N -3.78 4.34 0.00 -0.60 1.70 -1.22 -4.98 118.95 114.41 3guy s ARG 220 Ca 0.20 1.04 0.00 0.00 -0.47 0.00 0.00 55.73 56.50 3guy s ARG 220 Cb 0.03 -2.70 0.00 0.00 -0.57 0.00 0.00 34.95 31.71 3guy s ARG 220 CO 0.03 0.27 0.00 0.39 -1.08 0.00 0.00 175.30 174.91