#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 5.06 -0.17 1.96 -1.09 0.46 -0.59 121.20 126.83 3guy s ILE 2 Ca 0.00 -0.12 -0.15 0.00 -2.23 0.00 0.00 60.65 58.14 3guy s ILE 2 Cb 0.00 -3.51 -0.04 0.00 -1.58 0.00 0.00 42.46 37.33 3guy s ILE 2 CO 0.00 0.13 0.37 -0.69 -1.23 0.00 0.00 174.94 173.52 3guy s VAL 3 N 1.70 5.24 -0.19 2.92 1.01 -0.35 -0.87 120.40 129.86 3guy s VAL 3 Ca 0.06 0.68 0.01 0.00 0.00 0.00 0.00 61.98 62.74 3guy s VAL 3 Cb -0.17 -3.71 0.03 0.00 0.00 0.00 0.00 36.38 32.54 3guy s VAL 3 CO 0.09 0.32 -0.15 -0.63 0.00 0.00 0.00 175.10 174.73 3guy s ILE 4 N 0.86 1.89 0.63 2.22 1.01 -0.67 0.01 121.20 127.15 3guy s ILE 4 Ca 0.19 -1.04 -0.06 0.00 0.00 0.00 0.00 60.65 59.75 3guy s ILE 4 Cb -0.14 -1.84 0.03 0.00 0.01 0.00 0.00 42.46 40.52 3guy s ILE 4 CO 0.07 0.33 0.93 0.42 0.00 0.00 0.00 174.94 176.69 3guy s THR 5 N 1.32 3.13 -1.30 2.92 -4.23 -0.28 -1.12 115.64 116.07 3guy s THR 5 Ca 0.01 -0.13 -0.02 0.00 -1.18 0.00 0.00 61.69 60.37 3guy s THR 5 Cb -0.15 -3.27 0.01 0.00 1.34 0.00 0.00 72.50 70.43 3guy s THR 5 CO -0.10 -0.28 0.12 0.61 -0.54 0.00 0.00 174.62 174.43 3guy n GLY 6 N -2.68 -0.50 0.44 3.99 0.00 -1.11 -3.51 105.19 101.81 3guy n GLY 6 Ca 0.06 0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.24 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 -2.45 2.60 0.22 4.61 0.00 -0.36 -3.76 120.51 121.38 3guy n ALA 7 Ca -0.15 -0.43 0.09 0.00 0.00 0.00 0.00 53.44 52.95 3guy n ALA 7 Cb 0.62 -1.19 0.50 0.00 0.00 0.00 0.00 19.45 19.38 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 2.14 0.00 -5.46 0.00 0.02 -1.89 -3.25 113.55 105.11 3guy h SER 8 Ca 0.00 0.00 0.18 0.00 -0.84 0.00 0.00 61.79 61.13 3guy h SER 8 Cb 0.47 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.97 3guy h SER 8 CO 0.00 0.24 0.62 -0.94 -1.14 0.00 0.00 176.83 175.62 3guy s SER 9 N -6.29 -0.00 0.40 3.07 1.04 -1.26 -4.65 113.70 106.01 3guy s SER 9 Ca -0.01 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 55.81 3guy s SER 9 Cb 0.12 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.69 3guy s SER 9 CO 0.64 -0.91 0.00 0.61 0.98 0.00 0.00 173.24 174.57 3guy n GLY 10 N -0.71 0.48 0.15 7.32 0.00 -1.26 -3.05 105.19 108.12 3guy n GLY 10 Ca -0.02 -0.86 -0.07 0.00 0.00 0.00 0.00 46.02 45.07 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 0.22 -0.66 0.99 5.85 -1.87 -1.90 115.31 117.93 3guy h LEU 11 Ca 0.00 0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.85 3guy h LEU 11 Cb 0.00 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 40.93 3guy h LEU 11 CO 0.00 0.17 0.26 1.23 -0.34 0.00 0.00 178.44 179.76 3guy h GLY 12 N 0.33 0.96 1.06 3.75 0.00 -1.65 -0.48 103.07 107.04 3guy h GLY 12 Ca 0.15 -0.13 -0.06 0.00 0.00 0.00 0.00 47.33 47.28 3guy h GLY 12 CO -0.11 -0.04 0.21 0.00 0.00 0.00 0.00 176.54 176.60 3guy h ALA 13 N 1.46 0.95 -0.03 3.60 0.00 -1.39 -2.20 119.26 121.66 3guy h ALA 13 Ca 0.34 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 3guy h ALA 13 Cb 0.45 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3guy h ALA 13 CO -0.34 0.65 -0.67 0.93 0.00 0.00 0.00 179.25 179.83 3guy h GLU 14 N 1.09 0.13 -0.29 0.00 4.39 -0.83 -2.49 114.58 116.57 3guy h GLU 14 Ca 0.23 -0.10 -0.18 0.00 0.34 0.00 0.00 59.36 59.65 3guy h GLU 14 Cb 0.33 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.00 3guy h GLU 14 CO -0.00 0.75 -0.52 -0.07 -1.16 0.00 0.00 179.01 178.01 3guy h LEU 15 N 0.09 0.93 -0.49 1.33 3.38 -1.04 -2.68 115.31 116.83 3guy h LEU 15 Ca -0.01 -0.48 0.10 0.00 0.09 0.00 0.00 57.88 57.57 3guy h LEU 15 Cb 1.20 -0.27 -0.10 0.00 0.09 0.00 0.00 40.66 41.58 3guy h LEU 15 CO 0.10 1.27 -0.24 0.00 0.09 0.00 0.00 178.44 179.66 3guy h ALA 16 N 0.75 0.09 -0.95 1.53 0.00 -1.28 -1.45 119.26 117.96 3guy h ALA 16 Ca 0.02 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3guy h ALA 16 Cb 1.12 0.58 -0.05 0.00 0.00 0.00 0.00 17.79 19.44 3guy h ALA 16 CO 0.12 -0.58 0.58 0.87 0.00 0.00 0.00 179.25 180.23 3guy h LYS 17 N -0.13 1.28 -0.21 0.00 1.57 -1.34 -2.13 116.57 115.61 3guy h LYS 17 Ca 0.22 -0.11 -0.13 0.00 -1.87 0.00 0.00 60.65 58.76 3guy h LYS 17 Cb 0.49 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3guy h LYS 17 CO -0.57 0.89 -0.39 -0.07 -0.57 0.00 0.00 179.45 178.74 3guy h LEU 18 N 1.30 0.71 -1.86 2.94 3.38 -1.11 -1.96 115.31 118.71 3guy h LEU 18 Ca 0.34 -0.54 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 3guy h LEU 18 Cb -0.06 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.48 3guy h LEU 18 CO -0.06 1.11 -0.13 1.88 0.09 0.00 0.00 178.44 181.33 3guy h TYR 19 N 0.33 0.00 -0.08 1.13 0.05 -1.26 -3.05 116.97 114.09 3guy h TYR 19 Ca 0.01 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.76 3guy h TYR 19 Cb 0.99 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.72 3guy h TYR 19 CO 0.09 0.13 -0.09 0.22 -1.05 0.00 0.00 178.16 177.46 3guy h ASP 20 N 0.00 0.21 0.47 3.88 3.58 -1.01 -1.82 116.42 121.73 3guy h ASP 20 Ca -0.00 -0.50 0.00 0.00 0.42 0.00 0.00 57.03 56.95 3guy h ASP 20 Cb 0.33 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.32 3guy h ASP 20 CO 0.02 0.67 0.00 0.00 -2.88 0.00 0.00 179.24 177.05 3guy h ALA 21 N 0.55 1.00 -0.36 -0.78 0.00 -1.28 0.24 119.26 118.63 3guy h ALA 21 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3guy h ALA 21 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3guy h ALA 21 CO 0.02 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.66 3guy n GLU 22 N -2.45 2.03 -1.95 0.00 1.02 -1.16 -4.91 120.64 113.21 3guy n GLU 22 Ca 0.00 -1.38 -0.15 0.00 -0.02 0.00 0.00 57.16 55.61 3guy n GLU 22 Cb 0.16 -1.38 -0.03 0.00 -0.02 0.00 0.00 31.44 30.18 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 0.98 0.44 3.91 0.62 0.00 0.85 -5.00 105.19 106.99 3guy n GLY 23 Ca 0.13 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 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 -4.17 3.41 0.03 1.61 1.02 -0.69 -5.03 119.74 115.91 3guy s LYS 24 Ca 0.00 -0.44 -0.26 0.00 0.02 0.00 0.00 55.97 55.30 3guy s LYS 24 Cb 0.00 -3.03 -0.05 0.00 -0.52 0.00 0.00 37.83 34.23 3guy s LYS 24 CO 0.00 0.62 0.79 0.00 -0.92 0.00 0.00 175.35 175.84 3guy s ALA 25 N -1.47 3.33 0.07 5.17 0.00 -1.26 -4.19 121.76 123.41 3guy s ALA 25 Ca 0.33 0.30 0.08 0.00 0.00 0.00 0.00 51.96 52.68 3guy s ALA 25 Cb -0.13 -3.04 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 3guy s ALA 25 CO 0.26 -0.00 -0.22 0.95 0.00 0.00 0.00 175.76 176.75 3guy s THR 26 N 0.20 1.80 -0.17 0.00 -4.23 -1.25 -0.40 115.64 111.59 3guy s THR 26 Ca 0.40 -1.40 0.01 0.00 -1.18 0.00 0.00 61.69 59.52 3guy s THR 26 Cb -0.20 -1.59 0.03 0.00 1.34 0.00 0.00 72.50 72.07 3guy s THR 26 CO 0.23 0.12 -0.15 -0.47 -0.54 0.00 0.00 174.62 173.81 3guy s TYR 27 N -0.96 2.42 -0.11 3.99 5.04 -0.05 -0.60 117.35 127.09 3guy s TYR 27 Ca 0.08 -1.44 -0.03 0.00 -2.44 0.00 0.00 57.07 53.25 3guy s TYR 27 Cb -0.09 -1.71 -0.03 0.00 0.35 0.00 0.00 41.96 40.48 3guy s TYR 27 CO 0.03 -0.73 0.01 -0.51 -1.34 0.00 0.00 175.55 173.02 3guy s LEU 28 N 1.40 3.62 0.16 6.97 1.43 -0.98 -1.68 118.68 129.61 3guy s LEU 28 Ca 0.04 0.13 0.05 0.00 -1.03 0.00 0.00 54.13 53.32 3guy s LEU 28 Cb -0.14 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 3guy s LEU 28 CO -0.11 0.34 -0.11 0.28 0.23 0.00 0.00 176.35 176.98 3guy s THR 29 N -0.62 1.28 0.00 5.49 -1.32 -0.28 -1.04 115.64 119.15 3guy s THR 29 Ca 0.10 -2.07 0.00 0.00 -1.21 0.00 0.00 61.69 58.51 3guy s THR 29 Cb -0.12 -1.87 0.00 0.00 -1.51 0.00 0.00 72.50 69.00 3guy s THR 29 CO 0.02 -0.70 0.00 0.61 -2.21 0.00 0.00 174.62 172.34 3guy n GLY 30 N -0.20 0.08 0.15 6.08 0.00 -1.25 -1.22 105.19 108.83 3guy n GLY 30 Ca -0.10 -0.93 0.03 0.00 0.00 0.00 0.00 46.02 45.02 3guy n GLY 30 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3guy h ARG 31 N 0.00 0.00 -5.01 1.61 3.08 -1.92 -0.31 114.38 111.84 3guy h ARG 31 Ca 0.00 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.38 3guy h ARG 31 Cb 0.00 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 29.72 3guy h ARG 31 CO 0.00 0.46 -0.81 0.45 -1.07 0.00 0.00 179.97 179.00 3guy s SER 32 N -6.43 3.66 0.16 7.04 0.15 -1.26 -4.48 113.70 112.53 3guy s SER 32 Ca 0.04 -0.65 -0.15 0.00 0.70 0.00 0.00 55.95 55.88 3guy s SER 32 Cb 0.08 -1.57 0.03 0.00 -1.71 0.00 0.00 66.02 62.85 3guy s SER 32 CO 0.73 -0.03 1.82 -0.08 1.20 0.00 0.00 173.24 176.88 3guy h GLU 33 N 7.98 0.60 -0.25 5.44 4.57 -1.95 -1.77 114.58 129.20 3guy h GLU 33 Ca -0.42 -0.04 0.06 0.00 -1.18 0.00 0.00 59.36 57.79 3guy h GLU 33 Cb 1.14 -0.13 -0.06 0.00 -0.16 0.00 0.00 28.75 29.53 3guy h GLU 33 CO 0.61 0.40 -0.15 1.03 -1.18 0.00 0.00 179.01 179.72 3guy h SER 34 N 0.62 -0.51 -0.38 1.04 0.87 -1.99 -0.10 113.55 113.10 3guy h SER 34 Ca 0.17 0.11 -0.08 0.00 -1.23 0.00 0.00 61.79 60.76 3guy h SER 34 Cb -0.07 0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 3guy h SER 34 CO -0.04 -0.19 -0.04 0.11 -0.53 0.00 0.00 176.83 176.15 3guy h LYS 35 N -0.14 0.78 -0.56 2.24 1.57 -1.85 -1.80 116.57 116.82 3guy h LYS 35 Ca 0.14 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 3guy h LYS 35 Cb 0.34 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 3guy h LYS 35 CO -0.33 0.82 0.28 -0.07 -0.57 0.00 0.00 179.45 179.57 3guy h LEU 36 N 0.73 0.69 -0.62 2.94 3.38 -0.99 -2.59 115.31 118.84 3guy h LEU 36 Ca 0.14 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 3guy h LEU 36 Cb 0.49 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3guy h LEU 36 CO 0.03 0.58 -0.06 -1.28 0.09 0.00 0.00 178.44 177.79 3guy h SER 37 N 0.78 1.01 -0.60 -0.43 0.87 -0.22 -1.59 113.55 113.37 3guy h SER 37 Ca 0.20 -0.31 0.08 0.00 -1.23 0.00 0.00 61.79 60.53 3guy h SER 37 Cb 0.06 -0.27 -0.07 0.00 -0.44 0.00 0.00 62.40 61.68 3guy h SER 37 CO -0.03 1.09 0.25 0.74 -0.53 0.00 0.00 176.83 178.35 3guy h THR 38 N 0.92 0.81 -0.15 2.23 2.02 -1.02 -2.90 112.91 114.82 3guy h THR 38 Ca 0.15 -0.15 -0.07 0.00 0.77 0.00 0.00 66.41 67.10 3guy h THR 38 Cb 0.62 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 67.35 3guy h THR 38 CO 0.04 0.08 -0.19 0.58 0.37 0.00 0.00 175.52 176.40 3guy h VAL 39 N 0.45 1.35 -0.14 3.16 2.07 -1.25 -3.25 116.25 118.64 3guy h VAL 39 Ca 0.30 -1.40 0.04 0.00 0.82 0.00 0.00 66.70 66.46 3guy h VAL 39 Cb 0.33 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 3guy h VAL 39 CO -0.27 0.41 0.10 0.74 0.02 0.00 0.00 177.57 178.57 3guy h THR 40 N 0.01 0.89 0.00 2.57 2.02 -1.16 -2.71 112.91 114.53 3guy h THR 40 Ca 0.02 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 3guy h THR 40 Cb 0.75 0.93 -0.00 0.00 -1.74 0.00 0.00 68.15 68.08 3guy h THR 40 CO 0.05 0.00 -0.08 0.78 0.37 0.00 0.00 175.52 176.64 3guy h ASN 41 N 0.00 0.00 1.51 4.18 2.35 -1.55 -1.29 115.58 120.78 3guy h ASN 41 Ca 0.07 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 3guy h ASN 41 Cb 0.27 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.64 3guy h ASN 41 CO -0.00 0.08 -0.07 0.00 -1.65 0.00 0.00 177.43 175.78 3guy s LEU 43 N -6.29 3.97 0.00 0.00 1.43 -0.49 -5.01 118.68 112.28 3guy s LEU 43 Ca 0.04 0.81 0.21 0.00 -1.03 0.00 0.00 54.13 54.16 3guy s LEU 43 Cb 0.07 -3.65 0.35 0.00 0.03 0.00 0.00 46.19 42.99 3guy s LEU 43 CO 0.63 -0.28 1.14 -1.54 0.23 0.00 0.00 176.35 176.53 3guy n SER 44 N -1.20 0.75 -0.20 2.29 3.41 -1.26 -4.80 113.62 112.60 3guy n SER 44 Ca -0.01 -1.99 0.00 0.00 -0.26 0.00 0.00 58.87 56.61 3guy n SER 44 Cb 0.54 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 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 0.41 0.00 -4.77 4.04 3.02 -1.26 -5.10 115.26 111.60 3guy n ASN 45 Ca 0.03 -1.25 -0.39 0.00 -0.03 0.00 0.00 54.58 52.94 3guy n ASN 45 Cb 1.07 -0.05 -0.05 0.00 -0.61 0.00 0.00 39.78 40.14 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 -0.25 7.21 -0.23 6.41 3.84 -1.26 -3.84 114.94 126.82 3guy s ASN 46 Ca 0.00 2.07 0.11 0.00 0.21 0.00 0.00 52.86 55.25 3guy s ASN 46 Cb 0.00 -2.60 0.44 0.00 -0.55 0.00 0.00 41.25 38.53 3guy s ASN 46 CO 0.00 -0.17 1.21 1.33 -2.79 0.00 0.00 177.10 176.68 3guy n VAL 47 N 0.79 2.19 0.00 -5.21 0.24 0.23 -4.90 118.33 111.67 3guy n VAL 47 Ca 0.01 -3.45 0.00 0.00 -2.04 0.00 0.00 64.34 58.86 3guy n VAL 47 Cb 0.47 -0.43 0.00 0.00 -1.47 0.00 0.00 33.84 32.41 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 -0.91 3.13 3.50 7.63 0.00 -1.25 -4.87 105.19 112.43 3guy n GLY 48 Ca 0.26 -1.83 -0.13 0.00 0.00 0.00 0.00 46.02 44.32 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 -2.02 -0.51 -0.22 1.61 -0.85 -1.26 -2.31 117.35 111.79 3guy s TYR 49 Ca 0.00 0.64 -0.08 0.00 -0.52 0.00 0.00 57.07 57.11 3guy s TYR 49 Cb 0.00 0.48 0.09 0.00 0.38 0.00 0.00 41.96 42.92 3guy s TYR 49 CO 0.00 -0.61 0.48 0.50 -1.52 0.00 0.00 175.55 174.40 3guy s ARG 50 N -2.25 0.40 0.01 -3.49 3.52 -0.21 -4.95 118.95 111.99 3guy s ARG 50 Ca -0.03 1.08 -0.36 0.00 -0.13 0.00 0.00 55.73 56.30 3guy s ARG 50 Cb -0.01 0.36 -0.14 0.00 -1.56 0.00 0.00 34.95 33.60 3guy s ARG 50 CO -0.02 -0.22 1.61 0.00 -0.81 0.00 0.00 175.30 175.86 3guy n ALA 51 N 5.15 0.34 -3.18 6.12 0.00 -1.26 -3.80 120.51 123.88 3guy n ALA 51 Ca -0.12 0.42 -0.13 0.00 0.00 0.00 0.00 53.44 53.61 3guy n ALA 51 Cb 0.51 -2.29 -0.11 0.00 0.00 0.00 0.00 19.45 17.56 3guy n ALA 51 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3guy s ARG 52 N 1.92 0.35 -0.48 0.00 1.81 -0.12 -4.94 118.95 117.48 3guy s ARG 52 Ca 0.87 0.41 -0.14 0.00 -1.72 0.00 0.00 55.73 55.15 3guy s ARG 52 Cb -0.82 0.17 0.10 0.00 -0.45 0.00 0.00 34.95 33.94 3guy s ARG 52 CO 0.48 -0.04 0.40 0.34 -0.68 0.00 0.00 175.30 175.80 3guy s ASP 53 N 0.15 6.03 0.00 0.23 -1.08 -1.26 -3.87 116.67 116.87 3guy s ASP 53 Ca -0.00 -1.56 0.17 0.00 -0.52 0.00 0.00 52.55 50.63 3guy s ASP 53 Cb -0.02 -2.14 0.75 0.00 -1.46 0.00 0.00 42.92 40.05 3guy s ASP 53 CO 0.00 -0.70 1.54 0.18 0.52 0.00 0.00 175.17 176.71 3guy n LEU 54 N 5.14 0.00 0.00 -1.34 4.77 -1.26 -1.84 117.00 122.47 3guy n LEU 54 Ca -0.12 0.46 0.09 0.00 -0.03 0.00 0.00 56.01 56.41 3guy n LEU 54 Cb 0.42 -0.46 0.38 0.00 -2.33 0.00 0.00 43.42 41.43 3guy n LEU 54 CO 0.48 -0.19 0.78 0.00 -1.33 0.00 0.00 177.39 177.13 3guy n ALA 55 N -1.46 1.83 -3.01 -1.18 0.00 -1.26 -4.00 120.51 111.42 3guy n ALA 55 Ca 0.05 -0.06 -0.39 0.00 0.00 0.00 0.00 53.44 53.04 3guy n ALA 55 Cb 0.19 -1.29 -0.12 0.00 0.00 0.00 0.00 19.45 18.23 3guy n ALA 55 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3guy s SER 56 N -3.00 5.43 0.42 0.00 0.15 -0.76 -4.89 113.70 111.05 3guy s SER 56 Ca 0.09 -0.80 0.30 0.00 0.70 0.00 0.00 55.95 56.23 3guy s SER 56 Cb 0.12 -1.95 1.34 0.00 -1.71 0.00 0.00 66.02 63.82 3guy s SER 56 CO 0.33 -0.26 1.89 1.12 1.20 0.00 0.00 173.24 177.51 3guy h HIS 57 N 8.32 0.00 -0.05 3.44 2.07 -1.87 -2.05 115.15 125.00 3guy h HIS 57 Ca -0.29 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.15 3guy h HIS 57 Cb 1.12 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.10 3guy h HIS 57 CO 0.61 0.00 -0.27 1.96 -3.07 0.00 0.00 177.93 177.16 3guy h GLN 58 N 0.00 0.27 -0.01 5.12 7.50 -1.93 -2.79 115.11 123.27 3guy h GLN 58 Ca 0.00 -0.23 -0.06 0.00 0.50 0.00 0.00 58.65 58.87 3guy h GLN 58 Cb 0.31 0.05 -0.01 0.00 0.05 0.00 0.00 27.48 27.88 3guy h GLN 58 CO 0.00 0.88 -0.26 0.93 -1.50 0.00 0.00 178.83 178.88 3guy h GLU 59 N -0.26 0.02 -0.04 1.46 5.08 -1.67 -2.56 114.58 116.61 3guy h GLU 59 Ca -0.02 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 3guy h GLU 59 Cb 0.93 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.18 3guy h GLU 59 CO 0.06 0.28 -0.04 0.28 -1.00 0.00 0.00 179.01 178.59 3guy h VAL 60 N 0.02 1.38 -0.67 3.13 2.07 -1.49 -1.95 116.25 118.73 3guy h VAL 60 Ca 0.00 -1.18 0.13 0.00 0.82 0.00 0.00 66.70 66.47 3guy h VAL 60 Cb 0.47 2.08 -0.09 0.00 -1.52 0.00 0.00 31.29 32.23 3guy h VAL 60 CO 0.03 0.32 0.18 -0.08 0.02 0.00 0.00 177.57 178.04 3guy h GLU 61 N -0.36 0.29 0.09 1.57 4.81 -1.35 -2.65 114.58 116.97 3guy h GLU 61 Ca 0.01 -0.02 -0.27 0.00 -0.13 0.00 0.00 59.36 58.95 3guy h GLU 61 Cb 0.53 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.86 3guy h GLU 61 CO 0.01 0.19 -1.15 -0.56 -0.73 0.00 0.00 179.01 176.77 3guy h GLN 62 N 0.30 0.46 -0.90 1.92 3.07 -1.46 0.20 115.11 118.69 3guy h GLN 62 Ca 0.36 -0.61 0.36 0.00 0.09 0.00 0.00 58.65 58.85 3guy h GLN 62 Cb 0.57 0.20 -0.16 0.00 0.08 0.00 0.00 27.48 28.17 3guy h GLN 62 CO -0.44 1.25 0.40 -0.11 0.09 0.00 0.00 178.83 180.02 3guy n LEU 63 N -3.71 0.24 -0.06 0.06 7.94 -0.74 -1.22 117.00 119.51 3guy n LEU 63 Ca -0.10 1.51 -0.16 0.00 -1.11 0.00 0.00 56.01 56.15 3guy n LEU 63 Cb 0.95 -0.70 -0.14 0.00 0.53 0.00 0.00 43.42 44.06 3guy n LEU 63 CO 0.55 -1.66 -1.01 0.49 -1.11 0.00 0.00 177.39 174.65 3guy n PHE 64 N -5.10 0.57 -0.09 1.96 3.72 -1.02 -4.24 117.46 113.26 3guy n PHE 64 Ca 0.32 0.15 -0.06 0.00 -0.05 0.00 0.00 57.45 57.81 3guy n PHE 64 Cb 1.08 -1.08 0.01 0.00 -0.94 0.00 0.00 39.48 38.54 3guy n PHE 64 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 3guy h GLU 65 N 0.02 0.04 -0.95 -1.08 4.57 0.15 -3.10 114.58 114.24 3guy h GLU 65 Ca -0.48 -0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 57.56 3guy h GLU 65 Cb 2.02 -0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 30.52 3guy h GLU 65 CO 0.02 0.03 0.18 1.04 -1.18 0.00 0.00 179.01 179.09 3guy n GLN 66 N -5.23 1.78 -3.71 1.92 6.02 -0.36 -4.86 117.38 112.93 3guy n GLN 66 Ca 0.01 -1.17 -0.37 0.00 -0.01 0.00 0.00 57.00 55.46 3guy n GLN 66 Cb 0.18 -1.55 -0.06 0.00 1.02 0.00 0.00 30.24 29.83 3guy n GLN 66 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3guy s LEU 67 N -1.20 4.41 0.58 1.08 1.43 -1.17 -4.99 118.68 118.81 3guy s LEU 67 Ca 0.21 0.65 0.32 0.00 -1.03 0.00 0.00 54.13 54.29 3guy s LEU 67 Cb 0.18 -2.28 1.33 0.00 0.03 0.00 0.00 46.19 45.44 3guy s LEU 67 CO 0.05 0.35 1.63 0.44 0.23 0.00 0.00 176.35 179.05 3guy h ASP 68 N 5.04 0.00 -5.29 2.29 5.19 -1.92 -3.45 116.42 118.27 3guy h ASP 68 Ca -0.52 0.00 0.11 0.00 -0.62 0.00 0.00 57.03 56.00 3guy h ASP 68 Cb 1.22 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.70 3guy h ASP 68 CO 0.61 0.00 0.49 -0.94 -3.12 0.00 0.00 179.24 176.28 3guy s SER 69 N -4.42 -0.01 -0.01 6.45 1.04 -1.26 -5.14 113.70 110.35 3guy s SER 69 Ca -0.04 -0.78 -0.30 0.00 0.48 0.00 0.00 55.95 55.31 3guy s SER 69 Cb 0.18 0.60 -0.03 0.00 0.10 0.00 0.00 66.02 66.87 3guy s SER 69 CO 0.61 -1.18 0.97 -0.63 0.98 0.00 0.00 173.24 173.99 3guy s ILE 70 N -2.32 4.87 0.42 -1.02 1.01 -1.26 -5.05 121.20 117.86 3guy s ILE 70 Ca 0.19 2.03 -0.23 0.00 0.00 0.00 0.00 60.65 62.64 3guy s ILE 70 Cb -0.03 -4.31 -0.09 0.00 0.01 0.00 0.00 42.46 38.04 3guy s ILE 70 CO 0.07 0.16 1.05 -2.84 0.00 0.00 0.00 174.94 173.37 3guy s PRO 71 N 1.05 4.08 0.08 2.79 0.02 -1.26 -4.69 135.00 137.07 3guy s PRO 71 Ca 0.51 1.48 0.16 0.00 0.02 0.00 0.00 61.00 63.17 3guy s PRO 71 Cb -0.21 -2.44 -0.12 0.00 0.02 0.00 0.00 34.50 31.75 3guy s PRO 71 CO 0.27 -0.21 0.87 0.66 -0.33 0.00 0.00 177.00 178.27 3guy h SER 72 N 2.28 0.00 -3.65 2.53 4.64 -1.18 -3.43 113.55 114.74 3guy h SER 72 Ca -0.49 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.65 3guy h SER 72 Cb 1.22 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 63.03 3guy h SER 72 CO 0.62 0.58 -0.49 -0.89 -0.87 0.00 0.00 176.83 175.78 3guy s THR 73 N -2.92 -0.02 -0.17 2.95 2.01 -1.16 -3.19 115.64 113.14 3guy s THR 73 Ca -0.02 0.06 0.01 0.00 0.31 0.00 0.00 61.69 62.04 3guy s THR 73 Cb 0.09 -0.31 0.02 0.00 0.01 0.00 0.00 72.50 72.31 3guy s THR 73 CO 0.81 0.02 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.89 3guy s VAL 74 N 0.52 1.93 -0.34 3.82 1.01 0.01 -1.21 120.40 126.15 3guy s VAL 74 Ca -0.03 -0.88 -0.10 0.00 0.00 0.00 0.00 61.98 60.97 3guy s VAL 74 Cb -0.05 -1.77 0.01 0.00 0.00 0.00 0.00 36.38 34.57 3guy s VAL 74 CO -0.03 0.50 0.17 -0.69 0.00 0.00 0.00 175.10 175.06 3guy s VAL 75 N 1.34 4.51 -0.55 2.92 1.01 0.10 -0.17 120.40 129.56 3guy s VAL 75 Ca 0.05 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 61.17 3guy s VAL 75 Cb -0.13 -3.41 0.09 0.00 0.00 0.00 0.00 36.38 32.92 3guy s VAL 75 CO -0.12 -0.08 0.64 -2.28 0.00 0.00 0.00 175.10 173.26 3guy s HIS 76 N 1.57 3.05 -0.05 5.22 2.46 0.69 -1.13 115.29 127.10 3guy s HIS 76 Ca 0.03 -0.82 0.07 0.00 0.47 0.00 0.00 55.06 54.81 3guy s HIS 76 Cb -0.18 -3.75 0.11 0.00 -0.13 0.00 0.00 32.58 28.62 3guy s HIS 76 CO 0.06 -1.14 1.05 -1.13 -2.47 0.00 0.00 174.74 171.11 3guy n SER 77 N 6.12 2.11 -4.75 9.88 3.41 -1.23 -1.13 113.62 128.04 3guy n SER 77 Ca -0.09 -2.40 -0.41 0.00 -0.26 0.00 0.00 58.87 55.71 3guy n SER 77 Cb 0.43 -0.16 -0.03 0.00 -0.26 0.00 0.00 64.21 64.19 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 -1.70 3.46 0.00 7.33 0.00 -1.26 -4.59 121.76 125.01 3guy s ALA 78 Ca 0.12 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.10 3guy s ALA 78 Cb 0.11 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.80 3guy s ALA 78 CO 0.01 -0.41 0.00 0.41 0.00 0.00 0.00 175.76 175.77 3guy n GLY 79 N 1.88 -1.84 3.63 0.00 0.00 -1.25 -4.79 105.19 102.82 3guy n GLY 79 Ca 0.03 -1.13 -0.09 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.48 -0.39 0.12 1.61 1.04 -1.26 -4.96 113.70 109.38 3guy s SER 80 Ca 0.00 -0.27 0.07 0.00 0.48 0.00 0.00 55.95 56.23 3guy s SER 80 Cb 0.00 0.62 -0.04 0.00 0.10 0.00 0.00 66.02 66.70 3guy s SER 80 CO 0.00 -1.07 -0.07 -0.83 0.98 0.00 0.00 173.24 172.25 3guy s GLY 81 N -2.81 1.79 -0.25 7.32 0.00 -1.26 -4.89 107.32 107.22 3guy s GLY 81 Ca 0.06 -1.28 -0.19 0.00 0.00 0.00 0.00 44.72 43.31 3guy s GLY 81 CO -0.04 -1.27 0.64 -0.47 0.00 0.00 0.00 173.10 171.97 3guy s TYR 82 N -1.37 -0.81 0.20 1.90 5.04 -1.26 -5.02 117.35 116.03 3guy s TYR 82 Ca 0.23 1.82 -0.01 0.00 -2.44 0.00 0.00 57.07 56.67 3guy s TYR 82 Cb -0.11 0.37 -0.04 0.00 0.35 0.00 0.00 41.96 42.53 3guy s TYR 82 CO 0.15 -0.40 0.14 -0.06 -1.34 0.00 0.00 175.55 174.04 3guy s PHE 83 N 0.83 1.11 0.00 4.97 0.08 -1.26 -4.44 117.98 119.26 3guy s PHE 83 Ca -0.04 -1.34 0.00 0.00 0.12 0.00 0.00 56.93 55.67 3guy s PHE 83 Cb -0.05 -0.52 0.00 0.00 -0.57 0.00 0.00 43.02 41.88 3guy s PHE 83 CO -0.07 -0.65 0.00 0.41 -0.10 0.00 0.00 175.22 174.82 3guy n GLY 84 N -0.26 3.50 3.76 4.36 0.00 0.80 -4.92 105.19 112.43 3guy n GLY 84 Ca 0.01 -1.82 -0.39 0.00 0.00 0.00 0.00 46.02 43.83 3guy n GLY 84 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3guy s LEU 85 N 0.00 3.96 0.17 0.99 1.43 -1.26 -4.22 118.68 119.75 3guy s LEU 85 Ca 0.00 2.73 -0.13 0.00 -1.03 0.00 0.00 54.13 55.69 3guy s LEU 85 Cb 0.00 -4.17 0.07 0.00 0.03 0.00 0.00 46.19 42.12 3guy s LEU 85 CO 0.00 -1.34 1.78 0.25 0.23 0.00 0.00 176.35 177.27 3guy h LEU 86 N 1.82 0.70 -2.01 1.79 5.85 -1.96 0.69 115.31 122.19 3guy h LEU 86 Ca -0.51 -0.09 0.13 0.00 0.84 0.00 0.00 57.88 58.26 3guy h LEU 86 Cb 1.28 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.11 3guy h LEU 86 CO 0.59 0.59 0.34 0.06 -0.34 0.00 0.00 178.44 179.68 3guy h GLN 87 N 0.76 0.00 -0.01 1.25 3.07 -2.04 -1.36 115.11 116.79 3guy h GLN 87 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.94 3guy h GLN 87 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.60 3guy h GLN 87 CO -0.03 0.00 -0.43 0.39 0.09 0.00 0.00 178.83 178.85 3guy n GLU 88 N -4.33 0.78 -2.81 0.06 -0.58 0.19 -4.96 120.64 108.99 3guy n GLU 88 Ca 0.08 -0.55 -0.36 0.00 -0.42 0.00 0.00 57.16 55.91 3guy n GLU 88 Cb 0.54 -1.49 -0.07 0.00 -0.57 0.00 0.00 31.44 29.86 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 -2.60 4.44 -0.24 3.49 -0.21 -0.51 -4.94 119.66 119.08 3guy s GLN 89 Ca 0.19 1.23 -0.21 0.00 0.02 0.00 0.00 55.36 56.59 3guy s GLN 89 Cb 0.18 -2.59 -0.02 0.00 1.00 0.00 0.00 33.01 31.59 3guy s GLN 89 CO 0.59 0.18 0.66 0.34 -2.12 0.00 0.00 175.29 174.94 3guy s ASP 90 N -1.82 6.64 0.38 5.90 2.15 -1.26 -4.97 116.67 123.69 3guy s ASP 90 Ca 0.54 0.78 0.14 0.00 0.43 0.00 0.00 52.55 54.44 3guy s ASP 90 Cb -0.15 -2.35 0.98 0.00 -0.30 0.00 0.00 42.92 41.09 3guy s ASP 90 CO 0.20 -0.38 1.81 -0.65 -0.17 0.00 0.00 175.17 175.98 3guy h PRO 91 N 7.79 0.50 -0.54 4.34 0.11 -1.96 -0.08 132.00 142.16 3guy h PRO 91 Ca -0.27 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.75 3guy h PRO 91 Cb 1.12 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 3guy h PRO 91 CO 0.79 0.33 0.09 1.49 -0.21 0.00 0.00 178.00 180.49 3guy h GLU 92 N 0.52 0.90 -0.03 1.05 4.81 -2.00 -1.60 114.58 118.23 3guy h GLU 92 Ca 0.54 -0.24 -0.13 0.00 -0.13 0.00 0.00 59.36 59.40 3guy h GLU 92 Cb 1.18 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.43 3guy h GLU 92 CO -0.27 0.87 -0.58 1.96 -0.73 0.00 0.00 179.01 180.26 3guy h GLN 93 N 0.79 0.08 -0.62 1.92 4.20 -1.50 -1.83 115.11 118.15 3guy h GLN 93 Ca 0.16 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 3guy h GLN 93 Cb 0.41 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 3guy h GLN 93 CO 0.01 0.64 0.34 0.82 -0.67 0.00 0.00 178.83 179.96 3guy h ILE 94 N 0.06 1.20 -0.30 2.54 2.04 -0.80 -1.10 117.51 121.15 3guy h ILE 94 Ca -0.00 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.36 3guy h ILE 94 Cb 1.04 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 3guy h ILE 94 CO 0.08 0.22 0.16 -0.61 0.00 0.00 0.00 178.15 178.00 3guy h GLN 95 N 0.84 0.33 -0.83 2.37 5.75 -0.98 -0.61 115.11 121.99 3guy h GLN 95 Ca 0.22 -0.02 0.08 0.00 -0.15 0.00 0.00 58.65 58.78 3guy h GLN 95 Cb 0.05 -0.07 -0.07 0.00 1.07 0.00 0.00 27.48 28.46 3guy h GLN 95 CO -0.03 0.22 0.49 1.15 -2.65 0.00 0.00 178.83 178.00 3guy h THR 96 N 0.34 0.95 -0.49 2.39 2.02 -1.16 -0.79 112.91 116.18 3guy h THR 96 Ca 0.12 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 67.01 3guy h THR 96 Cb 0.01 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.43 3guy h THR 96 CO -0.06 0.15 0.31 0.25 0.37 0.00 0.00 175.52 176.55 3guy h LEU 97 N 0.84 0.57 -0.04 2.58 5.85 -0.04 -0.53 115.31 124.55 3guy h LEU 97 Ca 0.39 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 59.08 3guy h LEU 97 Cb 0.30 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3guy h LEU 97 CO -0.22 0.43 -0.01 0.40 -0.34 0.00 0.00 178.44 178.70 3guy h ILE 98 N 0.66 0.95 -0.12 4.05 2.04 -0.39 -1.83 117.51 122.86 3guy h ILE 98 Ca 0.18 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.06 3guy h ILE 98 Cb -0.05 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 3guy h ILE 98 CO -0.04 0.00 -0.03 -0.33 0.00 0.00 0.00 178.15 177.75 3guy h GLU 99 N -0.00 0.00 0.00 2.37 5.08 -0.83 0.15 114.58 121.35 3guy h GLU 99 Ca 0.02 -0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 3guy h GLU 99 Cb 0.04 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 3guy h GLU 99 CO -0.04 0.00 -0.40 -0.91 -1.00 0.00 0.00 179.01 176.66 3guy h ASN 100 N 0.00 0.00 0.00 1.42 2.35 -0.98 -2.56 115.58 115.81 3guy h ASN 100 Ca 0.06 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.61 3guy h ASN 100 Cb 0.09 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.43 3guy h ASN 100 CO -0.13 0.40 -1.54 0.59 -1.65 0.00 0.00 177.43 175.10 3guy n ASN 101 N -3.61 1.55 -0.02 5.81 3.02 -0.70 -3.85 115.26 117.45 3guy n ASN 101 Ca -0.01 0.26 -0.21 0.00 -0.03 0.00 0.00 54.58 54.59 3guy n ASN 101 Cb 0.51 -0.61 -0.13 0.00 -0.61 0.00 0.00 39.78 38.93 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 -0.73 0.28 -0.44 3.41 5.85 -0.91 -2.88 115.31 119.90 3guy h LEU 102 Ca -0.30 -0.79 -0.04 0.00 0.84 0.00 0.00 57.88 57.59 3guy h LEU 102 Cb 1.15 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.07 3guy h LEU 102 CO -0.18 1.63 0.13 0.28 -0.34 0.00 0.00 178.44 179.96 3guy h SER 103 N -0.41 0.65 -0.58 1.25 0.02 -1.35 -0.95 113.55 112.17 3guy h SER 103 Ca -0.34 -0.21 0.04 0.00 -0.84 0.00 0.00 61.79 60.44 3guy h SER 103 Cb 1.69 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 64.01 3guy h SER 103 CO -0.01 0.69 0.33 0.77 -1.14 0.00 0.00 176.83 177.48 3guy h SER 104 N 0.58 0.51 -0.26 3.07 4.64 -1.59 -0.44 113.55 120.06 3guy h SER 104 Ca 0.14 0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 61.35 3guy h SER 104 Cb 0.28 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 3guy h SER 104 CO -0.00 0.35 -0.27 0.00 -0.87 0.00 0.00 176.83 176.04 3guy h ALA 105 N 1.28 0.84 -0.04 5.18 0.00 -1.26 -0.45 119.26 124.80 3guy h ALA 105 Ca 0.24 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3guy h ALA 105 Cb 0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3guy h ALA 105 CO -0.13 0.64 -0.03 0.82 0.00 0.00 0.00 179.25 180.55 3guy h ILE 106 N 0.65 1.35 -0.07 0.00 2.04 -0.87 -1.59 117.51 119.02 3guy h ILE 106 Ca 0.08 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 64.86 3guy h ILE 106 Cb 0.79 1.98 -0.00 0.00 -0.74 0.00 0.00 36.82 38.85 3guy h ILE 106 CO 0.07 0.29 0.05 0.78 0.00 0.00 0.00 178.15 179.34 3guy h ASN 107 N -0.32 0.08 -0.51 1.72 2.35 -1.03 0.69 115.58 118.56 3guy h ASN 107 Ca 0.01 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3guy h ASN 107 Cb 0.49 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.81 3guy h ASN 107 CO 0.01 0.06 0.30 0.58 -1.65 0.00 0.00 177.43 176.74 3guy h VAL 108 N 0.10 1.16 -0.01 2.81 2.07 -1.13 -2.46 116.25 118.79 3guy h VAL 108 Ca 0.03 -0.37 -0.21 0.00 0.82 0.00 0.00 66.70 66.97 3guy h VAL 108 Cb -0.01 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3guy h VAL 108 CO -0.01 0.17 -0.88 0.25 0.02 0.00 0.00 177.57 177.12 3guy h LEU 109 N 0.69 0.38 -0.22 2.57 5.85 -1.09 -1.50 115.31 121.99 3guy h LEU 109 Ca 0.18 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 3guy h LEU 109 Cb 0.00 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 3guy h LEU 109 CO -0.03 1.09 0.11 -0.09 -0.34 0.00 0.00 178.44 179.17 3guy h ARG 110 N 0.17 0.32 -0.17 1.25 2.43 -0.88 -0.93 114.38 116.57 3guy h ARG 110 Ca -0.06 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 3guy h ARG 110 Cb 1.50 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.99 3guy h ARG 110 CO 0.14 0.33 0.10 1.49 -1.51 0.00 0.00 179.97 180.53 3guy h GLU 111 N 0.23 0.23 -0.70 0.20 4.57 -1.42 0.14 114.58 117.83 3guy h GLU 111 Ca 0.08 -0.02 0.09 0.00 -1.18 0.00 0.00 59.36 58.32 3guy h GLU 111 Cb 0.12 -0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 28.59 3guy h GLU 111 CO -0.01 0.20 0.36 -0.07 -1.18 0.00 0.00 179.01 178.31 3guy h LEU 112 N 0.20 0.48 -0.08 1.64 3.38 -1.22 -0.97 115.31 118.74 3guy h LEU 112 Ca 0.06 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 3guy h LEU 112 Cb 0.03 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3guy h LEU 112 CO -0.01 0.28 -0.03 0.58 0.09 0.00 0.00 178.44 179.34 3guy h VAL 113 N 0.62 1.31 -0.31 1.22 2.07 -0.89 0.24 116.25 120.51 3guy h VAL 113 Ca 0.34 -1.01 0.07 0.00 0.82 0.00 0.00 66.70 66.92 3guy h VAL 113 Cb 0.34 1.82 -0.07 0.00 -1.52 0.00 0.00 31.29 31.86 3guy h VAL 113 CO -0.25 0.28 -0.14 0.50 0.02 0.00 0.00 177.57 177.98 3guy h LYS 114 N -0.19 -0.09 0.24 1.57 3.64 -0.57 -2.76 116.57 118.42 3guy h LYS 114 Ca 0.02 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3guy h LYS 114 Cb 0.46 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 3guy h LYS 114 CO 0.01 -0.06 -0.11 0.00 -2.27 0.00 0.00 179.45 177.02 3guy h ARG 115 N -0.10 -0.31 -0.29 1.90 3.08 -1.19 -3.42 114.38 114.07 3guy h ARG 115 Ca 0.16 0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.19 3guy h ARG 115 Cb 0.33 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 3guy h ARG 115 CO -0.37 -0.10 0.00 0.66 -1.07 0.00 0.00 179.97 179.09 3guy n TYR 116 N -4.98 1.00 0.30 3.04 4.01 0.84 -4.69 117.16 116.68 3guy n TYR 116 Ca -0.05 -1.00 0.18 0.00 -0.16 0.00 0.00 57.90 56.87 3guy n TYR 116 Cb 0.18 -0.35 1.00 0.00 -0.31 0.00 0.00 39.34 39.86 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 1.67 0.00 -0.42 -0.72 2.10 -1.55 -2.04 116.57 115.61 3guy h LYS 117 Ca 0.04 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.69 3guy h LYS 117 Cb 1.50 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.83 3guy h LYS 117 CO 0.26 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.46 3guy n ASP 118 N -3.54 3.53 -4.73 7.07 8.00 -1.26 -2.91 116.55 122.71 3guy n ASP 118 Ca -0.02 -2.29 -0.26 0.00 0.71 0.00 0.00 54.79 52.93 3guy n ASP 118 Cb 0.13 -0.38 -0.07 0.00 -0.02 0.00 0.00 41.12 40.79 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 -1.52 2.63 -1.17 -1.24 -1.52 -0.77 -4.80 119.66 111.28 3guy s GLN 119 Ca 0.34 -1.00 -0.18 0.00 -1.95 0.00 0.00 55.36 52.57 3guy s GLN 119 Cb 0.21 -2.49 -0.04 0.00 -0.22 0.00 0.00 33.01 30.47 3guy s GLN 119 CO 0.17 0.47 2.04 -0.35 -0.25 0.00 0.00 175.29 177.37 3guy n PRO 120 N -0.23 2.29 -4.00 2.91 -0.04 -1.26 -2.69 135.00 131.98 3guy n PRO 120 Ca -0.09 -2.39 -0.36 0.00 -0.04 0.00 0.00 63.50 60.62 3guy n PRO 120 Cb 0.55 -3.21 -0.08 0.00 -0.04 0.00 0.00 33.50 30.72 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 4.64 5.08 -0.27 0.52 1.01 -1.26 -4.86 120.40 125.26 3guy s VAL 121 Ca 0.53 0.05 -0.11 0.00 0.00 0.00 0.00 61.98 62.46 3guy s VAL 121 Cb 0.12 -3.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 3guy s VAL 121 CO 0.02 0.56 0.20 0.20 0.00 0.00 0.00 175.10 176.09 3guy s ASN 122 N -0.55 6.07 -0.37 3.32 0.01 -1.19 -1.80 114.94 120.43 3guy s ASN 122 Ca 0.11 0.06 -0.09 0.00 -0.71 0.00 0.00 52.86 52.23 3guy s ASN 122 Cb -0.12 -2.13 0.04 0.00 0.41 0.00 0.00 41.25 39.46 3guy s ASN 122 CO 0.02 -0.03 0.17 -0.69 -1.51 0.00 0.00 177.10 175.06 3guy s VAL 123 N 1.59 4.18 -0.46 1.60 1.01 -0.00 -0.81 120.40 127.52 3guy s VAL 123 Ca 0.08 -1.05 -0.22 0.00 0.00 0.00 0.00 61.98 60.78 3guy s VAL 123 Cb -0.15 -3.38 0.03 0.00 0.00 0.00 0.00 36.38 32.87 3guy s VAL 123 CO 0.09 -0.25 0.76 -0.69 0.00 0.00 0.00 175.10 175.01 3guy s VAL 124 N 1.47 4.68 -0.40 2.92 1.01 0.76 -1.13 120.40 129.71 3guy s VAL 124 Ca 0.00 0.31 -0.14 0.00 0.00 0.00 0.00 61.98 62.15 3guy s VAL 124 Cb -0.20 -4.31 0.02 0.00 0.00 0.00 0.00 36.38 31.89 3guy s VAL 124 CO 0.04 -0.72 0.28 -0.04 0.00 0.00 0.00 175.10 174.66 3guy s MET 125 N 3.20 3.01 -0.30 2.72 -1.94 -0.24 -0.22 119.30 125.53 3guy s MET 125 Ca 0.28 -0.99 -0.17 0.00 -1.71 0.00 0.00 55.69 53.10 3guy s MET 125 Cb -0.13 -3.93 -0.02 0.00 2.01 0.00 0.00 34.83 32.76 3guy s MET 125 CO 0.21 -0.71 0.46 0.42 -0.01 0.00 0.00 175.02 175.39 3guy s ILE 126 N 1.67 5.09 0.00 2.53 1.01 -0.28 -1.94 121.20 129.28 3guy s ILE 126 Ca 0.05 0.54 0.00 0.00 0.00 0.00 0.00 60.65 61.24 3guy s ILE 126 Cb -0.19 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.45 3guy s ILE 126 CO 0.10 -0.01 0.00 0.23 0.00 0.00 0.00 174.94 175.26 3guy n MET 127 N 5.54 0.00 -3.59 2.79 2.81 0.29 -4.75 117.12 120.21 3guy n MET 127 Ca -0.06 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.77 3guy n MET 127 Cb 0.50 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 32.97 3guy n MET 127 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3guy s SER 128 N 0.07 -0.21 0.38 7.83 0.15 -1.26 -4.41 113.70 116.26 3guy s SER 128 Ca 0.00 0.11 0.26 0.00 0.70 0.00 0.00 55.95 57.02 3guy s SER 128 Cb 0.00 0.20 1.37 0.00 -1.71 0.00 0.00 66.02 65.88 3guy s SER 128 CO 0.00 -0.28 1.80 0.71 1.20 0.00 0.00 173.24 176.67 3guy h THR 129 N 2.16 0.00 0.00 6.45 1.35 -1.51 -0.83 112.91 120.52 3guy h THR 129 Ca -0.13 -0.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 3guy h THR 129 Cb 1.18 0.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 3guy h THR 129 CO 0.26 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.53 3guy n ALA 130 N -1.84 1.41 0.68 6.62 0.00 -1.26 -2.29 120.51 123.84 3guy n ALA 130 Ca -0.01 0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.66 3guy n ALA 130 Cb 0.07 -1.32 0.47 0.00 0.00 0.00 0.00 19.45 18.67 3guy n ALA 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3guy n ALA 131 N -1.73 2.14 0.30 0.00 0.00 -0.32 -3.99 120.51 116.92 3guy n ALA 131 Ca 0.01 -0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.48 3guy n ALA 131 Cb 0.14 -1.44 -0.08 0.00 0.00 0.00 0.00 19.45 18.08 3guy n ALA 131 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3guy n GLN 132 N -1.98 1.87 -3.55 0.00 1.13 -0.97 -4.43 117.38 109.45 3guy n GLN 132 Ca 0.05 -0.05 -0.12 0.00 -1.94 0.00 0.00 57.00 54.94 3guy n GLN 132 Cb 0.35 -1.16 -0.04 0.00 0.11 0.00 0.00 30.24 29.50 3guy n GLN 132 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 3guy s GLN 133 N -2.44 1.11 0.45 -1.09 -2.07 -1.24 -5.15 119.66 109.23 3guy s GLN 133 Ca 0.00 -0.43 -0.13 0.00 -1.82 0.00 0.00 55.36 52.98 3guy s GLN 133 Cb 0.08 0.50 -0.07 0.00 -1.09 0.00 0.00 33.01 32.44 3guy s GLN 133 CO 0.49 -0.44 0.87 -1.25 -1.32 0.00 0.00 175.29 173.64 3guy s PRO 134 N -3.18 3.86 -0.06 9.60 0.04 -1.26 -4.74 135.00 139.26 3guy s PRO 134 Ca -0.01 0.69 -0.02 0.00 0.04 0.00 0.00 61.00 61.70 3guy s PRO 134 Cb 0.00 -2.28 0.04 0.00 0.04 0.00 0.00 34.50 32.30 3guy s PRO 134 CO -0.08 -0.14 0.12 0.15 0.04 0.00 0.00 177.00 177.10 3guy s LYS 135 N -3.92 0.06 0.43 4.56 -0.14 -1.26 -5.12 119.74 114.35 3guy s LYS 135 Ca 0.55 0.34 -0.26 0.00 -1.36 0.00 0.00 55.97 55.24 3guy s LYS 135 Cb -0.10 -0.20 -0.09 0.00 -1.68 0.00 0.00 37.83 35.76 3guy s LYS 135 CO 0.31 -0.17 1.44 0.00 -0.76 0.00 0.00 175.35 176.16 3guy s ALA 136 N 1.21 3.34 0.00 5.17 0.00 -1.26 -2.38 121.76 127.84 3guy s ALA 136 Ca -0.09 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.36 3guy s ALA 136 Cb -0.12 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.41 3guy s ALA 136 CO -0.05 -1.14 0.00 1.04 0.00 0.00 0.00 175.76 175.61 3guy n GLN 137 N 0.01 -0.49 -1.12 0.00 6.02 -1.26 -4.82 117.38 115.72 3guy n GLN 137 Ca 0.04 0.12 0.05 0.00 -0.01 0.00 0.00 57.00 57.20 3guy n GLN 137 Cb 0.41 -3.61 0.10 0.00 1.02 0.00 0.00 30.24 28.16 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 -1.63 0.77 -0.28 -1.09 1.02 -1.00 -0.14 120.64 118.30 3guy n GLU 138 Ca 0.00 -2.63 -0.04 0.00 -0.02 0.00 0.00 57.16 54.47 3guy n GLU 138 Cb 0.12 -0.77 0.08 0.00 -0.02 0.00 0.00 31.44 30.85 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 1.04 0.87 0.99 1.62 4.64 -1.82 0.25 113.55 121.12 3guy h SER 139 Ca -0.12 -0.02 -0.16 0.00 -0.47 0.00 0.00 61.79 61.02 3guy h SER 139 Cb 1.49 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 63.34 3guy h SER 139 CO 0.06 0.62 -0.76 0.71 -0.87 0.00 0.00 176.83 176.59 3guy h THR 140 N 1.02 1.42 -0.02 2.95 1.35 -1.91 -1.29 112.91 116.43 3guy h THR 140 Ca 0.29 -2.72 -0.03 0.00 -0.55 0.00 0.00 66.41 63.41 3guy h THR 140 Cb -0.08 2.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.86 3guy h THR 140 CO -0.08 0.74 -0.09 0.22 -0.25 0.00 0.00 175.52 176.07 3guy h TYR 141 N 0.00 0.13 -0.77 4.73 3.20 -1.61 -1.76 116.97 120.89 3guy h TYR 141 Ca -0.01 -0.06 0.12 0.00 3.14 0.00 0.00 58.73 61.93 3guy h TYR 141 Cb 1.46 -0.02 -0.09 0.00 1.54 0.00 0.00 36.73 39.62 3guy h TYR 141 CO 0.00 0.75 0.36 0.00 -1.64 0.00 0.00 178.16 177.63 3guy h ALA 143 N 1.51 -0.05 -0.28 0.00 0.00 -1.05 0.28 119.26 119.67 3guy h ALA 143 Ca 0.40 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 55.18 3guy h ALA 143 Cb 0.54 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3guy h ALA 143 CO -0.34 -0.56 -0.43 -0.39 0.00 0.00 0.00 179.25 177.53 3guy h VAL 144 N -0.12 1.29 -0.38 0.00 -1.51 -1.11 -0.54 116.25 113.89 3guy h VAL 144 Ca 0.05 -1.62 -0.13 0.00 -1.23 0.00 0.00 66.70 63.77 3guy h VAL 144 Cb 0.18 1.54 -0.01 0.00 -2.13 0.00 0.00 31.29 30.87 3guy h VAL 144 CO -0.11 0.52 -0.28 0.11 -1.23 0.00 0.00 177.57 176.57 3guy h LYS 145 N 0.56 0.80 -0.67 5.19 1.79 -0.64 -2.23 116.57 121.37 3guy h LYS 145 Ca 0.04 -0.36 -0.06 0.00 -2.18 0.00 0.00 60.65 58.09 3guy h LYS 145 Cb 0.98 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.58 3guy h LYS 145 CO 0.09 0.99 0.20 -1.49 -1.08 0.00 0.00 179.45 178.16 3guy h TRP 146 N 0.68 1.09 -0.33 -1.35 4.06 -0.40 -2.30 115.95 117.41 3guy h TRP 146 Ca 0.08 -0.11 0.05 0.00 2.06 0.00 0.00 58.89 60.97 3guy h TRP 146 Cb 0.82 -0.31 -0.05 0.00 -1.00 0.00 0.00 29.16 28.62 3guy h TRP 146 CO 0.04 0.88 0.06 0.00 -3.56 0.00 0.00 178.44 175.86 3guy h ALA 147 N 1.09 0.35 -0.41 1.49 0.00 -0.89 -1.11 119.26 119.77 3guy h ALA 147 Ca 0.22 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 3guy h ALA 147 Cb 0.31 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3guy h ALA 147 CO -0.01 -0.35 0.08 0.28 0.00 0.00 0.00 179.25 179.26 3guy h VAL 148 N 0.17 1.19 -0.66 0.00 2.07 -1.30 -0.73 116.25 117.00 3guy h VAL 148 Ca 0.16 -0.70 -0.07 0.00 0.82 0.00 0.00 66.70 66.91 3guy h VAL 148 Cb 0.18 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 3guy h VAL 148 CO -0.22 0.25 0.14 0.50 0.02 0.00 0.00 177.57 178.27 3guy h LYS 149 N 0.60 1.05 -0.49 1.57 3.64 -0.86 -1.04 116.57 121.04 3guy h LYS 149 Ca 0.14 -0.25 -0.04 0.00 -1.27 0.00 0.00 60.65 59.22 3guy h LYS 149 Cb 0.26 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 3guy h LYS 149 CO -0.00 0.94 0.14 0.78 -2.27 0.00 0.00 179.45 179.04 3guy h GLY 150 N 1.06 0.83 0.66 5.01 0.00 -0.59 -0.78 103.07 109.25 3guy h GLY 150 Ca 0.21 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 3guy h GLY 150 CO 0.00 0.47 -0.46 -2.00 0.00 0.00 0.00 176.54 174.55 3guy h LEU 151 N 0.67 -1.23 -0.97 3.11 5.85 -0.98 -1.99 115.31 119.76 3guy h LEU 151 Ca 0.16 0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.86 3guy h LEU 151 Cb 0.30 0.39 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 3guy h LEU 151 CO -0.00 -0.66 -0.50 0.16 -0.34 0.00 0.00 178.44 177.09 3guy h ILE 152 N -1.02 1.36 -0.02 4.05 -0.00 -1.02 -0.36 117.51 120.51 3guy h ILE 152 Ca -0.07 -1.73 -0.14 0.00 -0.00 0.00 0.00 64.86 62.91 3guy h ILE 152 Cb 0.86 1.92 -0.02 0.00 -0.00 0.00 0.00 36.82 39.58 3guy h ILE 152 CO 0.00 0.50 -0.65 -0.33 -0.00 0.00 0.00 178.15 177.66 3guy h GLU 153 N 0.02 0.08 -0.18 0.16 4.39 -1.15 -0.45 114.58 117.44 3guy h GLU 153 Ca -0.00 -0.06 -0.15 0.00 0.34 0.00 0.00 59.36 59.48 3guy h GLU 153 Cb 0.90 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.56 3guy h GLU 153 CO 0.07 0.70 -0.48 0.77 -1.16 0.00 0.00 179.01 178.91 3guy h SER 154 N 0.06 0.74 0.02 1.42 0.02 -0.68 -3.17 113.55 111.95 3guy h SER 154 Ca -0.01 -0.58 -0.10 0.00 -0.84 0.00 0.00 61.79 60.27 3guy h SER 154 Cb 1.16 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.48 3guy h SER 154 CO 0.09 1.18 -0.28 0.58 -1.14 0.00 0.00 176.83 177.26 3guy h VAL 155 N 0.33 1.27 -0.86 2.27 2.07 -0.96 -2.33 116.25 118.04 3guy h VAL 155 Ca -0.01 -1.30 0.09 0.00 0.82 0.00 0.00 66.70 66.30 3guy h VAL 155 Cb 1.10 1.42 -0.06 0.00 -1.52 0.00 0.00 31.29 32.23 3guy h VAL 155 CO 0.10 0.40 0.56 0.03 0.02 0.00 0.00 177.57 178.69 3guy h ARG 156 N 0.36 0.84 -0.10 1.57 3.08 -1.10 -0.24 114.38 118.79 3guy h ARG 156 Ca 0.05 -0.05 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 3guy h ARG 156 Cb 0.69 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 3guy h ARG 156 CO 0.05 0.56 -0.51 -0.07 -1.07 0.00 0.00 179.97 178.93 3guy h LEU 157 N 0.87 0.31 -1.14 3.04 3.38 -1.40 -2.34 115.31 118.02 3guy h LEU 157 Ca 0.39 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 3guy h LEU 157 Cb 0.36 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 3guy h LEU 157 CO -0.16 0.76 -0.20 -0.33 0.09 0.00 0.00 178.44 178.60 3guy h GLU 158 N 0.22 0.00 -0.56 1.13 5.08 -0.99 -3.11 114.58 116.35 3guy h GLU 158 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3guy h GLU 158 Cb 0.97 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.22 3guy h GLU 158 CO 0.08 0.20 0.00 1.28 -1.00 0.00 0.00 179.01 179.57 3guy n LEU 159 N -3.37 2.99 -4.77 1.33 4.77 -0.22 -4.92 117.00 112.81 3guy n LEU 159 Ca 0.00 -1.50 -0.41 0.00 -0.03 0.00 0.00 56.01 54.08 3guy n LEU 159 Cb 0.42 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 3guy n LEU 159 CO 0.33 0.75 1.09 -0.75 -1.33 0.00 0.00 177.39 177.47 3guy s LYS 160 N -1.25 4.03 0.00 3.23 2.20 -1.12 -2.26 119.74 124.57 3guy s LYS 160 Ca 0.37 2.46 0.00 0.00 -0.36 0.00 0.00 55.97 58.45 3guy s LYS 160 Cb 0.19 -2.89 0.00 0.00 -1.51 0.00 0.00 37.83 33.62 3guy s LYS 160 CO 0.25 -0.55 0.00 0.41 -0.36 0.00 0.00 175.35 175.10 3guy n GLY 161 N 0.54 2.84 3.94 5.54 0.00 -1.26 -5.00 105.19 111.79 3guy n GLY 161 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.09 3.38 0.24 1.61 1.02 -0.96 -5.02 119.74 119.92 3guy s LYS 162 Ca 0.00 -0.23 0.24 0.00 0.02 0.00 0.00 55.97 56.00 3guy s LYS 162 Cb 0.00 -2.56 0.42 0.00 -0.52 0.00 0.00 37.83 35.18 3guy s LYS 162 CO 0.00 -0.06 1.48 -1.00 -0.92 0.00 0.00 175.35 174.85 3guy h PRO 163 N 0.51 0.00 -6.75 -1.68 0.13 -1.81 -3.45 132.00 118.95 3guy h PRO 163 Ca -0.48 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.13 3guy h PRO 163 Cb 1.22 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.40 3guy h PRO 163 CO 0.60 0.00 0.65 1.41 -0.23 0.00 0.00 178.00 180.43 3guy s MET 164 N -3.19 4.39 0.06 0.86 1.75 -1.09 -4.16 119.30 117.92 3guy s MET 164 Ca 0.07 2.11 0.08 0.00 -1.25 0.00 0.00 55.69 56.69 3guy s MET 164 Cb 0.10 -3.15 -0.03 0.00 2.84 0.00 0.00 34.83 34.59 3guy s MET 164 CO 0.68 -0.22 -0.21 0.15 -0.65 0.00 0.00 175.02 174.77 3guy s LYS 165 N -0.68 1.35 -0.22 4.11 1.02 -0.75 -4.96 119.74 119.61 3guy s LYS 165 Ca 0.54 -1.03 -0.06 0.00 0.02 0.00 0.00 55.97 55.44 3guy s LYS 165 Cb -0.38 -1.53 -0.02 0.00 -0.52 0.00 0.00 37.83 35.38 3guy s LYS 165 CO 0.43 0.38 0.02 0.42 -0.92 0.00 0.00 175.35 175.68 3guy s ILE 166 N -0.91 4.00 -0.16 2.17 1.01 -1.26 -0.82 121.20 125.22 3guy s ILE 166 Ca 0.08 -0.29 -0.05 0.00 0.00 0.00 0.00 60.65 60.39 3guy s ILE 166 Cb -0.09 -2.83 -0.03 0.00 0.01 0.00 0.00 42.46 39.52 3guy s ILE 166 CO 0.03 0.40 -0.01 -0.63 0.00 0.00 0.00 174.94 174.73 3guy s ILE 167 N 1.26 4.13 -0.15 2.92 1.09 -0.28 -4.92 121.20 125.25 3guy s ILE 167 Ca 0.04 -0.27 -0.06 0.00 -1.10 0.00 0.00 60.65 59.25 3guy s ILE 167 Cb -0.15 -2.83 -0.04 0.00 -1.06 0.00 0.00 42.46 38.39 3guy s ILE 167 CO 0.02 0.48 0.07 0.00 -0.10 0.00 0.00 174.94 175.40 3guy s ALA 168 N 0.39 3.47 -0.06 9.38 0.00 -0.21 -1.07 121.76 133.66 3guy s ALA 168 Ca -0.02 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.23 3guy s ALA 168 Cb -0.14 -1.85 0.01 0.00 0.00 0.00 0.00 23.12 21.14 3guy s ALA 168 CO 0.02 0.33 -0.13 0.08 0.00 0.00 0.00 175.76 176.07 3guy s VAL 169 N -0.11 1.15 -0.44 0.00 1.01 -0.82 -1.53 120.40 119.65 3guy s VAL 169 Ca 0.07 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.57 3guy s VAL 169 Cb -0.12 -1.03 0.13 0.00 0.00 0.00 0.00 36.38 35.36 3guy s VAL 169 CO 0.01 0.35 0.23 -0.31 0.00 0.00 0.00 175.10 175.38 3guy s TYR 170 N 0.50 2.27 0.27 5.22 2.02 -0.27 -0.55 117.35 126.82 3guy s TYR 170 Ca -0.12 -2.55 -0.15 0.00 -0.37 0.00 0.00 57.07 53.88 3guy s TYR 170 Cb -0.14 -2.11 -0.08 0.00 -0.40 0.00 0.00 41.96 39.23 3guy s TYR 170 CO 0.03 -0.79 0.68 -2.14 -1.57 0.00 0.00 175.55 171.77 3guy s PRO 171 N 0.33 4.01 0.03 -1.71 0.02 -1.26 -1.75 135.00 134.67 3guy s PRO 171 Ca 0.17 0.62 0.02 0.00 0.02 0.00 0.00 61.00 61.82 3guy s PRO 171 Cb -0.24 -2.61 -0.02 0.00 0.02 0.00 0.00 34.50 31.65 3guy s PRO 171 CO -0.02 0.26 -0.06 0.20 -0.33 0.00 0.00 177.00 177.06 3guy s GLY 172 N -2.11 0.39 -0.36 0.52 0.00 0.52 -1.63 107.32 104.65 3guy s GLY 172 Ca 0.49 -0.61 0.00 0.00 0.00 0.00 0.00 44.72 44.60 3guy s GLY 172 CO 0.19 -0.65 0.00 0.61 0.00 0.00 0.00 173.10 173.25 3guy n GLY 173 N 1.79 0.50 3.84 0.20 0.00 -1.26 -2.56 105.19 107.70 3guy n GLY 173 Ca -0.21 -0.85 -0.32 0.00 0.00 0.00 0.00 46.02 44.64 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 -2.99 4.00 0.58 1.61 1.00 -1.26 -0.60 119.30 121.64 3guy s MET 174 Ca 0.00 0.82 0.28 0.00 0.00 0.00 0.00 55.69 56.79 3guy s MET 174 Cb 0.00 -2.27 1.58 0.00 0.00 0.00 0.00 34.83 34.14 3guy s MET 174 CO 0.00 -0.05 2.06 0.00 0.00 0.00 0.00 175.02 177.03 3guy h ALA 175 N 1.58 1.95 -0.82 3.03 0.00 -1.93 -3.13 119.26 119.94 3guy h ALA 175 Ca -0.48 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.45 3guy h ALA 175 Cb 1.18 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 3guy h ALA 175 CO 0.63 -0.38 0.53 0.00 0.00 0.00 0.00 179.25 180.03 3guy h THR 176 N 0.00 1.16 -0.31 0.00 1.03 -1.92 -3.21 112.91 109.66 3guy h THR 176 Ca 0.12 -0.36 -0.22 0.00 -0.01 0.00 0.00 66.41 65.93 3guy h THR 176 Cb 0.62 0.01 -0.31 0.00 -1.07 0.00 0.00 68.15 67.40 3guy h THR 176 CO -0.00 0.19 -0.83 -0.62 -0.01 0.00 0.00 175.52 174.25 3guy n GLU 177 N -4.55 1.56 -2.66 0.00 4.71 -1.23 -4.72 120.64 113.75 3guy n GLU 177 Ca 0.09 -2.72 -0.39 0.00 -0.01 0.00 0.00 57.16 54.13 3guy n GLU 177 Cb 0.06 -0.90 -0.05 0.00 -1.01 0.00 0.00 31.44 29.54 3guy n GLU 177 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 3guy s PHE 178 N -2.40 3.78 -0.09 -0.32 2.99 -1.18 -5.01 117.98 115.74 3guy s PHE 178 Ca 0.21 1.82 0.03 0.00 0.00 0.00 0.00 56.93 58.99 3guy s PHE 178 Cb 0.37 -3.07 -0.01 0.00 0.00 0.00 0.00 43.02 40.31 3guy s PHE 178 CO -0.07 0.05 -0.20 -0.46 -0.00 0.00 0.00 175.22 174.55 3guy s TRP 179 N -1.27 2.63 -0.05 0.36 -0.11 -1.26 -5.06 118.94 114.17 3guy s TRP 179 Ca 0.45 -0.73 -0.02 0.00 1.22 0.00 0.00 56.10 57.01 3guy s TRP 179 Cb -0.26 -1.72 0.03 0.00 -1.50 0.00 0.00 33.47 30.02 3guy s TRP 179 CO 0.33 -0.23 0.08 -1.21 -4.62 0.00 0.00 176.95 171.30 3guy s GLU 180 N 0.10 -0.02 0.13 5.86 2.02 -1.26 -5.04 118.70 120.48 3guy s GLU 180 Ca -0.09 0.36 0.24 0.00 0.02 0.00 0.00 54.97 55.50 3guy s GLU 180 Cb -0.15 -0.34 0.93 0.00 0.10 0.00 0.00 34.13 34.67 3guy s GLU 180 CO 0.06 -0.25 1.75 0.25 0.02 0.00 0.00 175.26 177.08 3guy n THR 181 N 4.81 0.55 -3.60 3.63 -2.24 -1.26 -4.84 114.28 111.33 3guy n THR 181 Ca -0.14 -0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.51 3guy n THR 181 Cb 0.50 -0.76 -0.05 0.00 -2.10 0.00 0.00 70.33 67.92 3guy n THR 181 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3guy s SER 182 N -3.78 -0.36 0.00 3.42 1.04 -1.26 -5.18 113.70 107.58 3guy s SER 182 Ca 0.10 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.54 3guy s SER 182 Cb 0.13 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.72 3guy s SER 182 CO 0.48 -0.74 0.00 0.61 0.98 0.00 0.00 173.24 174.56 3guy n GLY 183 N 0.26 0.74 3.72 7.32 0.00 -1.26 -5.16 105.19 110.81 3guy n GLY 183 Ca -0.18 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.81 3guy n GLY 183 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3guy s LYS 184 N -2.00 -0.72 0.20 1.61 1.02 -1.26 -4.96 119.74 113.63 3guy s LYS 184 Ca 0.00 -0.29 -0.32 0.00 0.02 0.00 0.00 55.97 55.37 3guy s LYS 184 Cb 0.00 -1.68 -0.13 0.00 -0.52 0.00 0.00 37.83 35.51 3guy s LYS 184 CO 0.00 -3.34 1.67 0.43 -0.92 0.00 0.00 175.35 173.19 3guy n SER 185 N -4.45 3.73 -4.59 2.83 7.64 -1.26 -4.90 113.62 112.63 3guy n SER 185 Ca 0.15 1.07 -0.55 0.00 1.01 0.00 0.00 58.87 60.56 3guy n SER 185 Cb 0.60 -1.54 -0.07 0.00 -1.01 0.00 0.00 64.21 62.19 3guy n SER 185 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3guy n LEU 186 N 3.65 1.34 -4.27 -3.43 4.32 -1.26 -4.98 117.00 112.37 3guy n LEU 186 Ca 0.16 1.13 -0.16 0.00 -0.02 0.00 0.00 56.01 57.11 3guy n LEU 186 Cb 0.33 -1.12 -0.09 0.00 -1.62 0.00 0.00 43.42 40.92 3guy n LEU 186 CO 0.64 -1.17 -0.20 1.51 -1.22 0.00 0.00 177.39 176.95 3guy s ASP 187 N 0.77 1.02 0.03 -1.43 1.47 -1.26 -5.03 116.67 112.25 3guy s ASP 187 Ca 0.88 -1.52 -0.02 0.00 1.18 0.00 0.00 52.55 53.07 3guy s ASP 187 Cb -1.05 0.39 0.03 0.00 -0.34 0.00 0.00 42.92 41.95 3guy s ASP 187 CO 0.52 -0.89 0.21 1.07 0.68 0.00 0.00 175.17 176.76 3guy n THR 188 N -0.46 -0.07 1.03 2.11 5.66 -1.26 -1.34 114.28 119.94 3guy n THR 188 Ca 0.02 0.31 0.12 0.00 -3.05 0.00 0.00 64.05 61.46 3guy n THR 188 Cb 0.65 -0.41 0.32 0.00 -1.55 0.00 0.00 70.33 69.33 3guy n THR 188 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 3guy n SER 189 N -4.20 2.31 0.13 1.09 7.64 -1.26 -4.44 113.62 114.89 3guy n SER 189 Ca 0.01 -1.79 0.12 0.00 1.01 0.00 0.00 58.87 58.22 3guy n SER 189 Cb 0.05 -0.10 0.62 0.00 -1.01 0.00 0.00 64.21 63.78 3guy n SER 189 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3guy h SER 190 N 3.25 0.07 -5.09 6.43 0.02 -1.60 -3.44 113.55 113.19 3guy h SER 190 Ca 0.00 -0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.80 3guy h SER 190 Cb 0.71 -0.02 -0.17 0.00 0.14 0.00 0.00 62.40 63.06 3guy h SER 190 CO 0.00 0.05 -0.69 -0.36 -1.14 0.00 0.00 176.83 174.69 3guy s PHE 191 N -5.12 0.50 0.02 3.45 2.99 -1.26 -4.99 117.98 113.57 3guy s PHE 191 Ca -0.06 -0.90 -0.30 0.00 0.00 0.00 0.00 56.93 55.67 3guy s PHE 191 Cb 0.18 -0.35 -0.05 0.00 0.00 0.00 0.00 43.02 42.79 3guy s PHE 191 CO 0.70 -0.30 1.33 1.41 -0.00 0.00 0.00 175.22 178.36 3guy s MET 192 N -3.22 4.33 0.44 0.44 -2.45 0.23 -4.95 119.30 114.12 3guy s MET 192 Ca 0.01 1.89 -0.22 0.00 -1.25 0.00 0.00 55.69 56.12 3guy s MET 192 Cb 0.03 -3.48 -0.08 0.00 1.25 0.00 0.00 34.83 32.55 3guy s MET 192 CO -0.07 -0.47 1.07 -1.54 1.05 0.00 0.00 175.02 175.06 3guy s SER 193 N 1.54 6.47 0.36 1.11 1.04 -1.26 -4.09 113.70 118.86 3guy s SER 193 Ca 0.62 2.07 0.15 0.00 0.48 0.00 0.00 55.95 59.26 3guy s SER 193 Cb -0.31 -2.58 1.04 0.00 0.10 0.00 0.00 66.02 64.28 3guy s SER 193 CO 0.27 -0.70 1.73 0.00 0.98 0.00 0.00 173.24 175.52 3guy h ALA 194 N 2.07 2.06 0.00 5.32 0.00 -1.95 -0.21 119.26 126.56 3guy h ALA 194 Ca -0.49 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 3guy h ALA 194 Cb 1.23 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3guy h ALA 194 CO 0.61 -0.54 -0.00 1.49 0.00 0.00 0.00 179.25 180.80 3guy h GLU 195 N 0.43 -0.01 -0.65 0.00 4.81 -1.92 -0.04 114.58 117.21 3guy h GLU 195 Ca 0.65 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.82 3guy h GLU 195 Cb 1.51 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.86 3guy h GLU 195 CO -0.42 0.37 0.16 -0.44 -0.73 0.00 0.00 179.01 177.95 3guy h ASP 196 N -0.38 0.96 -0.41 1.04 3.32 -1.81 -0.58 116.42 118.56 3guy h ASP 196 Ca -0.00 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.83 3guy h ASP 196 Cb 0.38 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 3guy h ASP 196 CO 0.00 0.92 0.15 0.00 -1.72 0.00 0.00 179.24 178.59 3guy h ALA 197 N 1.20 0.53 -0.39 3.45 0.00 -1.08 -1.55 119.26 121.41 3guy h ALA 197 Ca 0.21 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3guy h ALA 197 Cb 0.34 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3guy h ALA 197 CO -0.00 0.15 0.22 0.00 0.00 0.00 0.00 179.25 179.62 3guy h ALA 198 N 0.99 0.50 -0.23 0.00 0.00 -0.80 -0.50 119.26 119.21 3guy h ALA 198 Ca 0.13 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.01 3guy h ALA 198 Cb 0.22 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3guy h ALA 198 CO -0.01 0.02 -0.04 1.25 0.00 0.00 0.00 179.25 180.47 3guy h LEU 199 N 0.50 -0.19 -0.31 0.00 6.46 -0.90 0.26 115.31 121.13 3guy h LEU 199 Ca 0.14 0.07 -0.03 0.00 -0.12 0.00 0.00 57.88 57.93 3guy h LEU 199 Cb 0.05 0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.10 3guy h LEU 199 CO -0.02 -0.06 0.07 0.24 -0.62 0.00 0.00 178.44 178.04 3guy h MET 200 N 0.02 0.51 0.23 1.25 2.86 -1.15 -1.70 114.93 116.94 3guy h MET 200 Ca 0.11 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 3guy h MET 200 Cb 0.16 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.76 3guy h MET 200 CO -0.23 0.59 -0.11 0.82 1.06 0.00 0.00 176.91 179.04 3guy h ILE 201 N 0.35 0.82 -0.28 -1.22 2.04 -0.92 -2.05 117.51 116.26 3guy h ILE 201 Ca 0.10 -0.26 0.07 0.00 1.00 0.00 0.00 64.86 65.76 3guy h ILE 201 Cb 0.31 0.98 -0.08 0.00 -0.74 0.00 0.00 36.82 37.30 3guy h ILE 201 CO 0.00 0.06 -0.28 -0.74 0.00 0.00 0.00 178.15 177.20 3guy h HIS 202 N -0.43 -0.74 0.00 1.37 2.76 -0.49 -1.87 115.15 115.74 3guy h HIS 202 Ca -0.03 0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 3guy h HIS 202 Cb 0.33 0.37 -0.00 0.00 1.55 0.00 0.00 27.41 29.66 3guy h HIS 202 CO -0.03 -0.35 -0.04 0.78 -1.30 0.00 0.00 177.93 177.00 3guy h GLY 203 N -0.27 0.00 1.19 5.26 0.00 -1.31 -3.12 103.07 104.82 3guy h GLY 203 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.19 3guy h GLY 203 CO -0.43 0.00 -1.57 0.00 0.00 0.00 0.00 176.54 174.55 3guy h ALA 204 N 1.96 0.62 -1.71 3.60 0.00 -0.60 -3.44 119.26 119.69 3guy h ALA 204 Ca -0.00 -1.32 -0.54 0.00 0.00 0.00 0.00 54.91 53.05 3guy h ALA 204 Cb 0.24 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3guy h ALA 204 CO 0.00 1.46 1.36 -0.51 0.00 0.00 0.00 179.25 181.57 3guy s LEU 205 N -6.35 3.42 0.04 0.00 1.02 -0.84 -4.73 118.68 111.23 3guy s LEU 205 Ca -0.05 0.98 -0.00 0.00 0.02 0.00 0.00 54.13 55.07 3guy s LEU 205 Cb 0.08 -3.05 -0.03 0.00 0.02 0.00 0.00 46.19 43.21 3guy s LEU 205 CO 0.82 -2.10 -0.04 0.00 0.02 0.00 0.00 176.35 175.06 3guy s ALA 206 N 8.38 0.35 -0.33 4.21 0.00 -1.26 -5.01 121.76 128.10 3guy s ALA 206 Ca 0.79 -0.89 0.17 0.00 0.00 0.00 0.00 51.96 52.02 3guy s ALA 206 Cb -0.19 0.19 0.44 0.00 0.00 0.00 0.00 23.12 23.56 3guy s ALA 206 CO 0.28 -0.24 0.92 0.09 0.00 0.00 0.00 175.76 176.81 3guy n ASN 207 N 0.90 1.43 -4.76 0.00 3.02 -1.26 -2.31 115.26 112.28 3guy n ASN 207 Ca -0.19 -2.79 -0.40 0.00 -0.03 0.00 0.00 54.58 51.17 3guy n ASN 207 Cb 0.58 -0.54 -0.04 0.00 -0.61 0.00 0.00 39.78 39.16 3guy n ASN 207 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3guy s ILE 208 N -3.07 3.41 0.00 2.41 -1.09 -1.12 -4.77 121.20 116.98 3guy s ILE 208 Ca 0.30 1.40 0.00 0.00 -2.23 0.00 0.00 60.65 60.12 3guy s ILE 208 Cb 0.44 -3.88 0.00 0.00 -1.58 0.00 0.00 42.46 37.44 3guy s ILE 208 CO 0.01 0.32 0.00 0.61 -1.23 0.00 0.00 174.94 174.65 3guy n GLY 209 N 1.09 2.57 0.00 6.18 0.00 -1.26 -1.33 105.19 112.44 3guy n GLY 209 Ca -0.01 -0.09 0.14 0.00 0.00 0.00 0.00 46.02 46.06 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 1.29 0.00 -4.50 1.61 5.15 -1.26 -4.92 115.26 112.63 3guy n ASN 210 Ca 0.00 -0.27 -0.24 0.00 -0.60 0.00 0.00 54.58 53.47 3guy n ASN 210 Cb 0.00 -0.23 -0.11 0.00 -0.53 0.00 0.00 39.78 38.91 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 -2.46 2.10 0.10 8.20 0.00 -0.44 -5.16 107.32 109.66 3guy s GLY 211 Ca 0.30 -2.06 -0.11 0.00 0.00 0.00 0.00 44.72 42.84 3guy s GLY 211 CO 0.41 -1.92 0.27 -2.52 0.00 0.00 0.00 173.10 169.34 3guy s TYR 212 N -2.95 0.02 -0.48 1.90 -0.85 -1.26 -2.79 117.35 110.94 3guy s TYR 212 Ca 0.33 -0.41 -0.29 0.00 -0.52 0.00 0.00 57.07 56.18 3guy s TYR 212 Cb 0.06 0.06 0.03 0.00 0.38 0.00 0.00 41.96 42.49 3guy s TYR 212 CO 0.15 -0.61 1.18 0.08 -1.52 0.00 0.00 175.55 174.83 3guy s VAL 213 N -3.84 4.14 -0.13 -3.49 1.01 -0.98 -4.89 120.40 112.22 3guy s VAL 213 Ca 0.05 1.15 0.18 0.00 0.00 0.00 0.00 61.98 63.36 3guy s VAL 213 Cb 0.04 -4.56 -0.15 0.00 0.00 0.00 0.00 36.38 31.70 3guy s VAL 213 CO -0.11 -1.01 0.74 -1.54 0.00 0.00 0.00 175.10 173.18 3guy n SER 214 N 8.05 0.69 -3.75 3.32 3.41 -1.26 -4.79 113.62 119.29 3guy n SER 214 Ca 0.12 0.30 -0.13 0.00 -0.26 0.00 0.00 58.87 58.90 3guy n SER 214 Cb 0.49 0.47 -0.11 0.00 -0.26 0.00 0.00 64.21 64.79 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 -5.57 -0.35 -0.10 4.04 1.01 -1.26 -1.04 116.67 113.41 3guy s ASP 215 Ca -0.04 0.67 -0.07 0.00 0.71 0.00 0.00 52.55 53.81 3guy s ASP 215 Cb 0.09 0.65 0.03 0.00 1.01 0.00 0.00 42.92 44.70 3guy s ASP 215 CO 0.82 -0.13 0.25 -0.51 0.21 0.00 0.00 175.17 175.82 3guy s ILE 216 N 0.40 -0.02 -0.10 0.77 2.07 -0.58 -4.98 121.20 118.77 3guy s ILE 216 Ca -0.02 0.06 0.03 0.00 -1.41 0.00 0.00 60.65 59.32 3guy s ILE 216 Cb -0.04 -0.37 -0.01 0.00 0.13 0.00 0.00 42.46 42.18 3guy s ILE 216 CO -0.02 0.03 -0.22 -0.89 -1.91 0.00 0.00 174.94 171.93 3guy s THR 217 N 0.62 2.28 -0.12 4.00 2.01 -1.26 -1.11 115.64 122.06 3guy s THR 217 Ca -0.04 -0.95 0.01 0.00 0.31 0.00 0.00 61.69 61.02 3guy s THR 217 Cb -0.05 -1.89 0.02 0.00 0.01 0.00 0.00 72.50 70.59 3guy s THR 217 CO -0.04 0.55 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.61 3guy s VAL 218 N 0.25 1.49 0.12 3.82 1.01 -0.71 -4.97 120.40 121.40 3guy s VAL 218 Ca -0.15 -0.62 0.08 0.00 0.00 0.00 0.00 61.98 61.29 3guy s VAL 218 Cb -0.17 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 3guy s VAL 218 CO 0.07 0.44 -0.19 0.20 0.00 0.00 0.00 175.10 175.62 3guy s ASN 219 N 1.15 2.49 0.42 3.32 -0.87 -1.26 -0.35 114.94 119.83 3guy s ASN 219 Ca -0.03 -0.74 -0.23 0.00 -1.57 0.00 0.00 52.86 50.29 3guy s ASN 219 Cb -0.14 -0.13 -0.09 0.00 -0.02 0.00 0.00 41.25 40.86 3guy s ASN 219 CO -0.04 0.01 1.04 -0.60 -2.57 0.00 0.00 177.10 174.93 3guy s ARG 220 N -2.21 4.09 0.45 -0.60 3.00 -1.06 -4.98 118.95 117.63 3guy s ARG 220 Ca 0.09 1.44 -0.24 0.00 -1.00 0.00 0.00 55.73 56.02 3guy s ARG 220 Cb -0.08 -2.41 -0.08 0.00 0.00 0.00 0.00 34.95 32.38 3guy s ARG 220 CO 0.05 -0.19 1.22 -1.21 0.00 0.00 0.00 175.30 175.16 3guy s GLU 221 N -2.71 3.78 0.00 5.12 2.02 -1.26 -4.97 118.70 120.68 3guy s GLU 221 Ca 0.60 1.93 0.21 0.00 0.02 0.00 0.00 54.97 57.73 3guy s GLU 221 Cb -0.20 -2.52 0.51 0.00 0.10 0.00 0.00 34.13 32.03 3guy s GLU 221 CO 0.24 -0.57 1.44 0.41 0.02 0.00 0.00 175.26 176.80 3guy n GLY 222 N 0.57 2.14 2.91 -1.39 0.00 -1.26 -4.91 105.19 103.24 3guy n GLY 222 Ca 0.06 -0.72 -0.14 0.00 0.00 0.00 0.00 46.02 45.22 3guy n GLY 222 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3guy s HIS 223 N -1.20 -0.12 -0.14 1.61 5.65 -1.26 -5.12 115.29 114.71 3guy s HIS 223 Ca 0.42 0.37 0.02 0.00 0.25 0.00 0.00 55.06 56.12 3guy s HIS 223 Cb 0.23 -0.09 0.01 0.00 -1.18 0.00 0.00 32.58 31.55 3guy s HIS 223 CO 0.31 -0.13 -0.21 -1.01 -0.65 0.00 0.00 174.74 173.05 3guy s HIS 224 N 0.91 2.62 0.71 3.88 0.09 -1.26 -5.12 115.29 117.12 3guy s HIS 224 Ca -0.07 -1.36 -0.16 0.00 -0.00 0.00 0.00 55.06 53.47 3guy s HIS 224 Cb -0.09 -1.80 0.03 0.00 -0.00 0.00 0.00 32.58 30.71 3guy s HIS 224 CO -0.04 -0.64 1.22 -3.38 -0.00 0.00 0.00 174.74 171.90 3guy s HIS 225 N 0.92 2.07 0.74 1.40 -3.43 -1.26 -4.98 115.29 110.76 3guy s HIS 225 Ca -0.05 1.58 -0.14 0.00 -0.80 0.00 0.00 55.06 55.65 3guy s HIS 225 Cb -0.15 -3.51 0.04 0.00 -1.43 0.00 0.00 32.58 27.53 3guy s HIS 225 CO -0.04 -2.64 1.15 -1.01 -2.00 0.00 0.00 174.74 170.19 3guy s HIS 226 N -1.86 2.26 -0.04 0.38 3.76 -1.26 -5.07 115.29 113.46 3guy s HIS 226 Ca 0.76 1.61 -0.07 0.00 -0.15 0.00 0.00 55.06 57.21 3guy s HIS 226 Cb -0.31 -3.29 0.01 0.00 1.11 0.00 0.00 32.58 30.11 3guy s HIS 226 CO 0.44 -2.21 0.17 -3.38 -0.85 0.00 0.00 174.74 168.91 3guy s HIS 227 N -2.34 -0.12 -2.00 1.40 -3.43 -1.26 -5.34 115.29 102.20 3guy s HIS 227 Ca 0.69 0.27 0.32 0.00 -0.80 0.00 0.00 55.06 55.54 3guy s HIS 227 Cb -0.23 0.03 1.90 0.00 -1.43 0.00 0.00 32.58 32.85 3guy s HIS 227 CO 0.48 -0.17 2.22 0.72 -2.00 0.00 0.00 174.74 175.99