#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fai h GLY 42 N 0.00 0.04 -5.26 0.00 0.00 -1.97 -3.43 103.07 92.45 3fai h GLY 42 Ca 0.00 -0.02 -0.12 0.00 0.00 0.00 0.00 47.33 47.19 3fai h GLY 42 CO 0.00 0.02 -0.22 -0.29 0.00 0.00 0.00 176.54 176.05 3fai s MET 43 N -4.65 0.49 0.15 4.80 0.00 -1.26 -0.81 119.30 118.01 3fai s MET 43 Ca -0.04 0.62 0.09 0.00 0.00 0.00 0.00 55.69 56.36 3fai s MET 43 Cb 0.16 0.22 -0.04 0.00 0.00 0.00 0.00 34.83 35.17 3fai s MET 43 CO 0.70 -0.07 -0.21 -1.54 0.00 0.00 0.00 175.02 173.91 3fai s SER 44 N 0.34 2.81 -0.16 1.11 1.04 -0.44 -4.99 113.70 113.41 3fai s SER 44 Ca -0.01 -0.80 -0.01 0.00 0.48 0.00 0.00 55.95 55.61 3fai s SER 44 Cb -0.03 -0.17 0.05 0.00 0.10 0.00 0.00 66.02 65.96 3fai s SER 44 CO -0.01 0.04 -0.01 -0.22 0.98 0.00 0.00 173.24 174.02 3fai s LEU 45 N -2.39 1.31 -0.02 2.42 2.96 -1.26 -1.58 118.68 120.12 3fai s LEU 45 Ca 0.14 -0.63 0.01 0.00 -0.22 0.00 0.00 54.13 53.43 3fai s LEU 45 Cb -0.08 -0.72 0.01 0.00 0.50 0.00 0.00 46.19 45.90 3fai s LEU 45 CO 0.06 -0.23 -0.04 -0.89 -1.32 0.00 0.00 176.35 173.93 3fai s THR 46 N 1.77 0.41 0.18 3.68 2.01 -0.43 -4.95 115.64 118.30 3fai s THR 46 Ca 0.01 -0.16 -0.32 0.00 0.31 0.00 0.00 61.69 61.53 3fai s THR 46 Cb -0.15 -0.39 -0.11 0.00 0.01 0.00 0.00 72.50 71.86 3fai s THR 46 CO -0.07 0.15 1.64 -1.58 -0.69 0.00 0.00 174.62 174.06 3fai s GLN 47 N 0.29 4.18 -0.24 4.92 0.74 -1.26 -0.34 119.66 127.95 3fai s GLN 47 Ca -0.03 2.46 -0.12 0.00 0.05 0.00 0.00 55.36 57.72 3fai s GLN 47 Cb -0.07 -3.15 -0.17 0.00 1.10 0.00 0.00 33.01 30.73 3fai s GLN 47 CO -0.00 -0.67 -0.09 0.28 -0.55 0.00 0.00 175.29 174.26 3fai n VAL 48 N 4.02 1.56 -3.59 1.34 0.31 0.26 -4.86 118.33 117.36 3fai n VAL 48 Ca 0.15 -0.36 -0.01 0.00 -0.01 0.00 0.00 64.34 64.11 3fai n VAL 48 Cb 0.37 -1.82 -0.04 0.00 -0.91 0.00 0.00 33.84 31.44 3fai n VAL 48 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3fai s SER 49 N -7.09 -1.00 1.97 4.52 0.15 -0.90 -5.04 113.70 106.31 3fai s SER 49 Ca -0.33 1.38 0.00 0.00 0.70 0.00 0.00 55.95 57.69 3fai s SER 49 Cb 0.10 2.10 0.00 0.00 -1.71 0.00 0.00 66.02 66.51 3fai s SER 49 CO 0.57 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.43 3fai n GLY 50 N 5.26 3.99 0.19 9.45 0.00 -1.26 -0.94 105.19 121.89 3fai n GLY 50 Ca -0.12 0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.07 3fai n GLY 50 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3fai n PRO 51 N 14.00 1.26 -3.56 1.61 -0.04 -1.26 -4.80 135.00 142.20 3fai n PRO 51 Ca 0.00 -0.38 -0.38 0.00 -0.04 0.00 0.00 63.50 62.71 3fai n PRO 51 Cb 0.00 -1.43 -0.10 0.00 -0.04 0.00 0.00 33.50 31.93 3fai n PRO 51 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3fai s VAL 52 N -1.97 5.29 0.10 0.52 1.01 -0.11 -1.15 120.40 124.08 3fai s VAL 52 Ca 0.39 0.27 0.08 0.00 0.00 0.00 0.00 61.98 62.72 3fai s VAL 52 Cb 0.19 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 3fai s VAL 52 CO 0.31 0.26 -0.20 -0.31 0.00 0.00 0.00 175.10 175.16 3fai s TYR 53 N 1.59 1.73 -0.10 5.22 2.02 0.33 -0.57 117.35 127.57 3fai s TYR 53 Ca 0.09 -0.42 -0.01 0.00 -0.37 0.00 0.00 57.07 56.36 3fai s TYR 53 Cb -0.15 -0.95 -0.03 0.00 -0.40 0.00 0.00 41.96 40.43 3fai s TYR 53 CO 0.09 0.19 -0.05 0.54 -1.57 0.00 0.00 175.55 174.74 3fai s VAL 54 N -1.17 3.81 -0.26 0.71 0.11 0.54 -1.10 120.40 123.04 3fai s VAL 54 Ca 0.06 -0.42 -0.09 0.00 -2.93 0.00 0.00 61.98 58.59 3fai s VAL 54 Cb -0.10 -2.60 -0.04 0.00 -1.53 0.00 0.00 36.38 32.11 3fai s VAL 54 CO 0.04 0.56 0.14 -0.69 -3.33 0.00 0.00 175.10 171.82 3fai s VAL 55 N -0.40 4.94 -0.45 2.04 1.01 0.12 -1.31 120.40 126.36 3fai s VAL 55 Ca 0.06 0.04 -0.16 0.00 0.00 0.00 0.00 61.98 61.92 3fai s VAL 55 Cb -0.12 -3.33 0.04 0.00 0.00 0.00 0.00 36.38 32.97 3fai s VAL 55 CO 0.02 0.30 0.41 -0.70 0.00 0.00 0.00 175.10 175.14 3fai s GLU 56 N 1.58 3.03 -0.49 2.72 2.12 -0.61 -0.99 118.70 126.06 3fai s GLU 56 Ca 0.07 -1.03 -0.14 0.00 0.36 0.00 0.00 54.97 54.22 3fai s GLU 56 Cb -0.15 -4.04 0.10 0.00 0.26 0.00 0.00 34.13 30.29 3fai s GLU 56 CO 0.07 -0.93 0.41 0.34 -0.54 0.00 0.00 175.26 174.61 3fai s ASP 57 N 2.14 6.06 0.00 -1.70 2.15 0.02 -1.33 116.67 124.02 3fai s ASP 57 Ca 0.08 -1.57 0.21 0.00 0.43 0.00 0.00 52.55 51.70 3fai s ASP 57 Cb -0.20 -2.15 0.75 0.00 -0.30 0.00 0.00 42.92 41.01 3fai s ASP 57 CO 0.10 -0.71 1.55 0.59 -0.17 0.00 0.00 175.17 176.53 3fai n ASN 58 N 5.16 1.68 -4.77 -0.34 3.02 0.01 -1.35 115.26 118.67 3fai n ASN 58 Ca -0.12 -1.71 -0.38 0.00 -0.03 0.00 0.00 54.58 52.34 3fai n ASN 58 Cb 0.42 -0.10 -0.01 0.00 -0.61 0.00 0.00 39.78 39.48 3fai n ASN 58 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3fai s TYR 59 N -1.79 2.90 0.00 3.10 2.02 -1.25 -4.55 117.35 117.77 3fai s TYR 59 Ca 0.32 1.50 0.00 0.00 -0.37 0.00 0.00 57.07 58.52 3fai s TYR 59 Cb 0.18 -3.50 0.00 0.00 -0.40 0.00 0.00 41.96 38.23 3fai s TYR 59 CO 0.26 -1.69 0.00 0.66 -1.57 0.00 0.00 175.55 173.21 3fai n TYR 60 N -0.09 0.00 -2.94 2.71 4.01 -1.26 -3.94 117.16 115.64 3fai n TYR 60 Ca 0.05 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.38 3fai n TYR 60 Cb 0.46 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.45 3fai n TYR 60 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3fai s VAL 67 N 0.00 4.91 0.01 -0.72 1.01 -1.26 -4.98 120.40 119.37 3fai s VAL 67 Ca 0.00 1.54 -0.38 0.00 0.00 0.00 0.00 61.98 63.14 3fai s VAL 67 Cb 0.00 -4.10 -0.17 0.00 0.00 0.00 0.00 36.38 32.11 3fai s VAL 67 CO 0.00 0.05 1.33 1.67 0.00 0.00 0.00 175.10 178.15 3fai n GLN 68 N 5.16 0.86 -4.42 2.72 7.27 -1.25 -4.95 117.38 122.76 3fai n GLN 68 Ca 0.03 0.31 -0.21 0.00 0.07 0.00 0.00 57.00 57.20 3fai n GLN 68 Cb 0.49 -1.92 -0.14 0.00 2.41 0.00 0.00 30.24 31.08 3fai n GLN 68 CO 0.00 0.00 0.00 -1.83 0.07 0.00 0.00 177.06 175.30 3fai s GLU 69 N 0.79 0.99 -0.10 3.69 4.04 -0.46 -4.30 118.70 123.35 3fai s GLU 69 Ca 0.88 -0.72 -0.00 0.00 0.04 0.00 0.00 54.97 55.17 3fai s GLU 69 Cb -1.05 -1.00 -0.02 0.00 0.02 0.00 0.00 34.13 32.07 3fai s GLU 69 CO 0.52 0.25 -0.09 -0.80 -1.84 0.00 0.00 175.26 173.31 3fai s ASN 70 N -0.99 4.43 0.34 0.83 0.01 -0.20 -0.80 114.94 118.56 3fai s ASN 70 Ca 0.03 -0.15 0.03 0.00 -0.71 0.00 0.00 52.86 52.06 3fai s ASN 70 Cb -0.07 -1.39 -0.01 0.00 0.41 0.00 0.00 41.25 40.18 3fai s ASN 70 CO 0.01 0.26 0.12 -1.20 -1.51 0.00 0.00 177.10 174.79 3fai n SER 71 N 2.89 1.13 -4.26 -1.22 7.64 -0.16 -4.59 113.62 115.05 3fai n SER 71 Ca -0.18 -2.80 -0.14 0.00 1.01 0.00 0.00 58.87 56.76 3fai n SER 71 Cb 0.53 0.87 -0.10 0.00 -1.01 0.00 0.00 64.21 64.50 3fai n SER 71 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 3fai s MET 72 N -3.29 1.18 -0.01 1.43 1.00 -0.32 0.13 119.30 119.42 3fai s MET 72 Ca 0.18 -1.58 0.01 0.00 0.00 0.00 0.00 55.69 54.30 3fai s MET 72 Cb 0.01 -0.30 -0.00 0.00 0.00 0.00 0.00 34.83 34.54 3fai s MET 72 CO 0.12 -0.15 -0.05 0.08 0.00 0.00 0.00 175.02 175.02 3fai s VAL 73 N -3.65 0.39 -0.19 -6.03 1.01 -0.26 -0.28 120.40 111.39 3fai s VAL 73 Ca 0.27 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.06 3fai s VAL 73 Cb 0.06 -0.34 0.02 0.00 0.00 0.00 0.00 36.38 36.12 3fai s VAL 73 CO 0.06 0.12 -0.18 -0.47 0.00 0.00 0.00 175.10 174.63 3fai s TYR 74 N 0.00 2.84 -0.69 5.22 5.04 0.09 -0.51 117.35 129.33 3fai s TYR 74 Ca 0.00 -1.68 -0.20 0.00 -2.44 0.00 0.00 57.07 52.76 3fai s TYR 74 Cb -0.03 -1.93 0.11 0.00 0.35 0.00 0.00 41.96 40.45 3fai s TYR 74 CO -0.00 -0.80 0.87 -0.06 -1.34 0.00 0.00 175.55 174.21 3fai s PHE 75 N 1.28 2.97 0.69 4.97 0.08 -0.30 -1.18 117.98 126.48 3fai s PHE 75 Ca 0.04 -0.98 0.04 0.00 0.12 0.00 0.00 56.93 56.15 3fai s PHE 75 Cb -0.14 -4.14 0.13 0.00 -0.57 0.00 0.00 43.02 38.30 3fai s PHE 75 CO -0.12 -1.42 0.94 0.20 -0.10 0.00 0.00 175.22 174.72 3fai s GLY 76 N 3.56 1.73 0.14 4.36 0.00 -0.30 -4.77 107.32 112.03 3fai s GLY 76 Ca 0.19 -2.01 -0.16 0.00 0.00 0.00 0.00 44.72 42.74 3fai s GLY 76 CO 0.04 -1.44 1.71 0.00 0.00 0.00 0.00 173.10 173.41 3fai h ALA 77 N -0.32 0.51 0.00 3.20 0.00 -1.97 -3.16 119.26 117.53 3fai h ALA 77 Ca -0.32 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3fai h ALA 77 Cb 1.27 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3fai h ALA 77 CO 0.38 0.08 -1.25 1.63 0.00 0.00 0.00 179.25 180.09 3fai n LYS 78 N -4.69 0.48 -3.85 0.00 5.02 -1.26 -5.06 118.16 108.80 3fai n LYS 78 Ca -0.00 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 3fai n LYS 78 Cb 0.12 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.47 3fai n LYS 78 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fai n GLY 79 N 1.28 -0.93 3.61 0.72 0.00 -1.19 -4.41 105.19 104.27 3fai n GLY 79 Ca -0.00 -1.10 -0.34 0.00 0.00 0.00 0.00 46.02 44.57 3fai n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fai s VAL 80 N -3.00 4.26 -0.16 1.61 1.01 0.38 -1.15 120.40 123.36 3fai s VAL 80 Ca 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 61.71 3fai s VAL 80 Cb 0.00 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 3fai s VAL 80 CO 0.00 0.54 -0.07 -0.89 0.00 0.00 0.00 175.10 174.68 3fai s THR 81 N -0.24 3.51 -0.11 3.92 2.01 -0.33 -0.57 115.64 123.83 3fai s THR 81 Ca 0.06 -0.49 -0.04 0.00 0.31 0.00 0.00 61.69 61.53 3fai s THR 81 Cb -0.12 -2.53 -0.04 0.00 0.01 0.00 0.00 72.50 69.82 3fai s THR 81 CO 0.02 0.49 0.05 -0.69 -0.69 0.00 0.00 174.62 173.80 3fai s VAL 82 N 0.56 4.73 -0.31 3.82 1.01 -0.13 -0.74 120.40 129.35 3fai s VAL 82 Ca -0.05 -0.08 -0.01 0.00 0.00 0.00 0.00 61.98 61.85 3fai s VAL 82 Cb -0.15 -3.04 0.06 0.00 0.00 0.00 0.00 36.38 33.26 3fai s VAL 82 CO 0.03 0.58 0.01 -0.69 0.00 0.00 0.00 175.10 175.04 3fai s VAL 83 N -0.68 2.82 0.00 2.92 1.01 0.62 -0.53 120.40 126.56 3fai s VAL 83 Ca 0.12 -1.62 0.00 0.00 0.00 0.00 0.00 61.98 60.48 3fai s VAL 83 Cb -0.12 -2.72 0.00 0.00 0.00 0.00 0.00 36.38 33.55 3fai s VAL 83 CO 0.02 -0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.51 3fai n GLY 84 N 4.55 0.23 0.05 4.51 0.00 0.55 -1.17 105.19 113.91 3fai n GLY 84 Ca -0.10 -1.14 0.15 0.00 0.00 0.00 0.00 46.02 44.93 3fai n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fai n ALA 85 N 2.28 2.61 -0.60 4.61 0.00 -0.15 -4.77 120.51 124.49 3fai n ALA 85 Ca 0.00 -0.20 0.08 0.00 0.00 0.00 0.00 53.44 53.32 3fai n ALA 85 Cb 0.00 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 17.99 3fai n ALA 85 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3fai n THR 86 N -1.12 0.00 -0.19 0.00 -2.24 -1.25 -3.51 114.28 105.98 3fai n THR 86 Ca 0.16 0.16 -0.07 0.00 -2.27 0.00 0.00 64.05 62.03 3fai n THR 86 Cb 0.24 -0.37 0.02 0.00 -2.10 0.00 0.00 70.33 68.12 3fai n THR 86 CO 0.00 0.00 0.00 -0.50 -0.57 0.00 0.00 175.07 174.00 3fai h TRP 87 N -0.57 0.76 -4.27 4.78 4.06 -1.75 -0.75 115.95 118.20 3fai h TRP 87 Ca -0.03 -0.03 -0.20 0.00 2.06 0.00 0.00 58.89 60.69 3fai h TRP 87 Cb 0.56 -0.24 -0.12 0.00 -1.00 0.00 0.00 29.16 28.36 3fai h TRP 87 CO -0.26 0.58 -0.42 0.95 -3.56 0.00 0.00 178.44 175.73 3fai s THR 88 N -5.75 0.00 0.48 1.49 -4.23 -1.26 -4.03 115.64 102.34 3fai s THR 88 Ca -0.13 -1.78 0.13 0.00 -1.18 0.00 0.00 61.69 58.73 3fai s THR 88 Cb 0.12 -2.42 0.27 0.00 1.34 0.00 0.00 72.50 71.81 3fai s THR 88 CO 0.77 0.00 2.12 -0.65 -0.54 0.00 0.00 174.62 176.32 3fai h PRO 89 N 2.43 0.19 -0.19 3.99 0.11 -1.77 -0.55 132.00 136.20 3fai h PRO 89 Ca -0.31 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.75 3fai h PRO 89 Cb 1.25 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3fai h PRO 89 CO 0.45 0.12 -0.03 -0.44 -0.21 0.00 0.00 178.00 177.90 3fai h ASP 90 N 0.19 0.36 -0.25 -2.05 3.32 -1.93 -1.02 116.42 115.03 3fai h ASP 90 Ca 0.05 -0.35 -0.04 0.00 0.02 0.00 0.00 57.03 56.72 3fai h ASP 90 Cb -0.02 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 3fai h ASP 90 CO -0.01 0.62 0.04 0.71 -1.72 0.00 0.00 179.24 178.88 3fai h THR 91 N 0.09 1.18 -0.48 0.35 1.35 -1.83 -1.37 112.91 112.21 3fai h THR 91 Ca 0.05 -0.69 -0.03 0.00 -0.55 0.00 0.00 66.41 65.20 3fai h THR 91 Cb 0.46 0.88 -0.02 0.00 -1.73 0.00 0.00 68.15 67.73 3fai h THR 91 CO 0.02 0.24 0.19 0.00 -0.25 0.00 0.00 175.52 175.72 3fai h ALA 92 N 1.55 0.62 -0.72 6.62 0.00 -0.93 -0.14 119.26 126.26 3fai h ALA 92 Ca 0.11 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.90 3fai h ALA 92 Cb 0.27 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 3fai h ALA 92 CO 0.00 0.23 0.46 -0.09 0.00 0.00 0.00 179.25 179.85 3fai h ARG 93 N 0.63 0.88 -0.84 0.00 2.43 -0.84 0.56 114.38 117.20 3fai h ARG 93 Ca 0.16 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.28 3fai h ARG 93 Cb 0.20 -0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 29.51 3fai h ARG 93 CO -0.01 0.58 0.55 0.93 -1.51 0.00 0.00 179.97 180.52 3fai h GLU 94 N 0.91 1.10 -0.66 0.20 4.39 -0.63 -0.59 114.58 119.29 3fai h GLU 94 Ca 0.28 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.90 3fai h GLU 94 Cb -0.01 -0.25 -0.03 0.00 -0.10 0.00 0.00 28.75 28.36 3fai h GLU 94 CO -0.10 0.72 0.33 1.25 -1.16 0.00 0.00 179.01 180.06 3fai h LEU 95 N 1.13 0.85 -0.98 1.33 5.85 -0.59 -2.66 115.31 120.24 3fai h LEU 95 Ca 0.31 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 3fai h LEU 95 Cb -0.12 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.64 3fai h LEU 95 CO -0.07 0.73 0.50 -0.74 -0.34 0.00 0.00 178.44 178.53 3fai h HIS 96 N 0.91 1.18 -0.67 1.25 2.76 -0.23 0.30 115.15 120.65 3fai h HIS 96 Ca 0.23 -0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.44 3fai h HIS 96 Cb 0.10 -0.38 -0.05 0.00 1.55 0.00 0.00 27.41 28.62 3fai h HIS 96 CO 0.00 0.80 0.38 0.87 -1.30 0.00 0.00 177.93 178.69 3fai h LYS 97 N 1.22 0.69 -0.46 5.26 1.57 -0.91 -0.78 116.57 123.16 3fai h LYS 97 Ca 0.31 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.93 3fai h LYS 97 Cb -0.01 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 3fai h LYS 97 CO -0.05 0.46 -0.18 -0.07 -0.57 0.00 0.00 179.45 179.04 3fai h LEU 98 N 0.71 0.90 -0.74 2.94 3.38 -0.90 -3.04 115.31 118.56 3fai h LEU 98 Ca 0.30 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3fai h LEU 98 Cb 0.16 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 3fai h LEU 98 CO -0.17 1.06 0.44 0.40 0.09 0.00 0.00 178.44 180.26 3fai h ILE 99 N 0.78 1.21 0.00 1.22 2.04 -0.21 -2.35 117.51 120.20 3fai h ILE 99 Ca 0.11 -0.47 0.00 0.00 1.00 0.00 0.00 64.86 65.50 3fai h ILE 99 Cb 0.71 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3fai h ILE 99 CO 0.05 0.22 0.00 0.11 0.00 0.00 0.00 178.15 178.54 3fai h LYS 100 N 1.01 0.00 0.00 2.37 1.57 -1.06 0.71 116.57 121.16 3fai h LYS 100 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3fai h LYS 100 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 3fai h LYS 100 CO -0.05 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.37 3fai n ARG 102 N -2.48 0.24 -0.09 3.15 1.74 -0.89 -4.07 116.66 114.26 3fai n ARG 102 Ca 0.01 0.22 -0.12 0.00 -0.77 0.00 0.00 57.85 57.19 3fai n ARG 102 Cb 0.22 -1.79 -0.09 0.00 -1.02 0.00 0.00 32.46 29.79 3fai n ARG 102 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3fai n VAL 103 N -2.21 1.05 -3.87 1.55 0.31 0.06 -5.04 118.33 110.18 3fai n VAL 103 Ca 0.05 -0.42 -0.11 0.00 -0.01 0.00 0.00 64.34 63.85 3fai n VAL 103 Cb 0.41 -1.10 -0.10 0.00 -0.91 0.00 0.00 33.84 32.13 3fai n VAL 103 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3fai s SER 104 N -5.68 0.00 0.00 4.52 0.15 -0.16 -5.02 113.70 107.51 3fai s SER 104 Ca -0.23 -0.12 0.26 0.00 0.70 0.00 0.00 55.95 56.56 3fai s SER 104 Cb 0.06 0.22 0.62 0.00 -1.71 0.00 0.00 66.02 65.21 3fai s SER 104 CO 0.44 -0.30 1.48 -2.11 1.20 0.00 0.00 173.24 173.95 3fai n ARG 105 N 1.79 0.93 -2.08 5.44 1.85 -1.26 -4.22 116.66 119.11 3fai n ARG 105 Ca -0.21 -0.60 -0.34 0.00 -1.00 0.00 0.00 57.85 55.71 3fai n ARG 105 Cb 0.56 -1.49 0.01 0.00 -1.05 0.00 0.00 32.46 30.50 3fai n ARG 105 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3fai s LYS 106 N -2.49 3.21 0.65 2.89 1.02 -1.26 -4.99 119.74 118.78 3fai s LYS 106 Ca 0.24 1.42 -0.15 0.00 0.02 0.00 0.00 55.97 57.50 3fai s LYS 106 Cb 0.19 -2.00 -0.01 0.00 -0.52 0.00 0.00 37.83 35.49 3fai s LYS 106 CO 0.53 -0.93 1.10 -1.25 -0.92 0.00 0.00 175.35 173.88 3fai s PRO 108 N -3.72 2.88 -0.40 -1.68 0.04 -1.26 -4.65 135.00 126.21 3fai s PRO 108 Ca 0.68 1.36 -0.25 0.00 0.04 0.00 0.00 61.00 62.83 3fai s PRO 108 Cb -0.20 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.39 3fai s PRO 108 CO 0.33 -1.18 0.91 0.08 0.04 0.00 0.00 177.00 177.18 3fai s VAL 109 N -2.36 4.56 -0.08 -0.36 1.01 -1.26 -0.47 120.40 121.44 3fai s VAL 109 Ca 0.66 1.02 -0.19 0.00 0.00 0.00 0.00 61.98 63.47 3fai s VAL 109 Cb -0.20 -4.35 -0.29 0.00 0.00 0.00 0.00 36.38 31.54 3fai s VAL 109 CO 0.41 -0.62 0.70 -0.07 0.00 0.00 0.00 175.10 175.52 3fai h LEU 110 N 10.20 0.41 -7.09 3.92 3.38 -1.18 -3.38 115.31 121.57 3fai h LEU 110 Ca -0.24 -0.89 -0.04 0.00 0.09 0.00 0.00 57.88 56.80 3fai h LEU 110 Cb 1.08 -0.13 -0.15 0.00 0.09 0.00 0.00 40.66 41.55 3fai h LEU 110 CO 0.99 1.50 0.14 -1.83 0.09 0.00 0.00 178.44 179.33 3fai s GLU 111 N -2.45 1.15 -0.06 1.13 -1.05 -1.22 -1.42 118.70 114.78 3fai s GLU 111 Ca -0.17 -0.26 0.02 0.00 -0.15 0.00 0.00 54.97 54.40 3fai s GLU 111 Cb 0.03 0.53 0.02 0.00 -0.44 0.00 0.00 34.13 34.26 3fai s GLU 111 CO 0.79 -0.45 -0.09 0.08 0.95 0.00 0.00 175.26 176.54 3fai s VAL 112 N -2.82 0.94 -0.18 1.83 1.01 0.38 -0.95 120.40 120.61 3fai s VAL 112 Ca -0.03 -0.35 -0.14 0.00 0.00 0.00 0.00 61.98 61.46 3fai s VAL 112 Cb -0.00 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 3fai s VAL 112 CO -0.05 0.32 0.31 -0.63 0.00 0.00 0.00 175.10 175.05 3fai s ILE 113 N 0.85 5.28 -0.55 2.22 1.01 0.31 -0.13 121.20 130.19 3fai s ILE 113 Ca -0.12 0.56 -0.23 0.00 0.00 0.00 0.00 60.65 60.87 3fai s ILE 113 Cb -0.15 -3.65 0.05 0.00 0.01 0.00 0.00 42.46 38.72 3fai s ILE 113 CO 0.02 0.34 0.86 0.20 0.00 0.00 0.00 174.94 176.35 3fai s ASN 114 N 0.71 6.30 0.14 3.58 0.01 -0.08 -0.33 114.94 125.27 3fai s ASN 114 Ca 0.16 -0.55 0.22 0.00 -0.71 0.00 0.00 52.86 51.98 3fai s ASN 114 Cb -0.14 -2.39 0.88 0.00 0.41 0.00 0.00 41.25 40.01 3fai s ASN 114 CO 0.05 -1.15 1.68 0.35 -1.51 0.00 0.00 177.10 176.52 3fai n THR 115 N 6.02 0.72 -3.59 1.60 -2.24 -1.26 -4.65 114.28 110.89 3fai n THR 115 Ca -0.01 0.11 -0.06 0.00 -2.27 0.00 0.00 64.05 61.82 3fai n THR 115 Cb 0.47 -0.92 0.01 0.00 -2.10 0.00 0.00 70.33 67.78 3fai n THR 115 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3fai n ASN 116 N -1.93 -1.24 -0.56 3.42 0.23 -1.26 -1.50 115.26 112.41 3fai n ASN 116 Ca 0.04 -2.02 0.11 0.00 -0.53 0.00 0.00 54.58 52.18 3fai n ASN 116 Cb 0.26 2.12 0.39 0.00 -2.08 0.00 0.00 39.78 40.47 3fai n ASN 116 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3fai n TYR 117 N -0.33 0.19 -1.94 -2.53 0.18 -1.26 -4.53 117.16 106.93 3fai n TYR 117 Ca -0.04 -0.09 -0.30 0.00 1.88 0.00 0.00 57.90 59.35 3fai n TYR 117 Cb 0.36 0.00 0.03 0.00 -0.38 0.00 0.00 39.34 39.35 3fai n TYR 117 CO 0.00 0.00 0.00 -1.01 -2.08 0.00 0.00 176.86 173.77 3fai s HIS 118 N -1.81 3.47 0.37 -3.48 3.76 -1.26 -4.81 115.29 111.53 3fai s HIS 118 Ca 0.33 1.13 0.05 0.00 -0.15 0.00 0.00 55.06 56.42 3fai s HIS 118 Cb 0.18 -2.86 0.74 0.00 1.11 0.00 0.00 32.58 31.75 3fai s HIS 118 CO 0.27 -0.90 2.00 1.79 -0.85 0.00 0.00 174.74 177.06 3fai h THR 119 N -0.44 1.09 0.00 1.30 1.35 -1.92 -0.26 112.91 114.03 3fai h THR 119 Ca -0.45 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 3fai h THR 119 Cb 1.22 0.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.93 3fai h THR 119 CO 0.63 0.14 0.00 -0.90 -0.25 0.00 0.00 175.52 175.13 3fai n ASP 120 N -4.46 0.20 -0.00 5.36 5.75 -1.26 -0.86 116.55 121.28 3fai n ASP 120 Ca 0.07 0.54 0.03 0.00 -0.01 0.00 0.00 54.79 55.41 3fai n ASP 120 Cb 0.12 -0.58 -0.04 0.00 -1.03 0.00 0.00 41.12 39.59 3fai n ASP 120 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3fai n ARG 121 N -1.71 3.15 0.00 0.11 5.12 -0.82 -3.88 116.66 118.64 3fai n ARG 121 Ca 0.05 -0.02 0.00 0.00 -1.93 0.00 0.00 57.85 55.94 3fai n ARG 121 Cb 0.26 -0.92 0.00 0.00 -1.16 0.00 0.00 32.46 30.65 3fai n ARG 121 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3fai n ALA 122 N -1.36 1.17 0.29 7.54 0.00 -0.17 -0.98 120.51 127.00 3fai n ALA 122 Ca 0.00 -0.12 0.15 0.00 0.00 0.00 0.00 53.44 53.48 3fai n ALA 122 Cb 0.11 0.00 0.89 0.00 0.00 0.00 0.00 19.45 20.45 3fai n ALA 122 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3fai h GLY 123 N 0.00 0.00 1.51 0.00 0.00 -0.65 -2.00 103.07 101.93 3fai h GLY 123 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fai h GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3fai n GLY 124 N -1.04 -1.20 0.29 4.60 0.00 -0.32 -3.07 105.19 104.45 3fai n GLY 124 Ca -0.02 -0.14 0.08 0.00 0.00 0.00 0.00 46.02 45.93 3fai n GLY 124 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3fai h ASN 125 N 0.00 0.28 -0.86 1.61 2.35 -1.62 -0.45 115.58 116.90 3fai h ASN 125 Ca 0.00 0.13 0.16 0.00 -0.55 0.00 0.00 56.30 56.03 3fai h ASN 125 Cb 0.24 0.11 -0.10 0.00 0.05 0.00 0.00 38.32 38.62 3fai h ASN 125 CO 0.00 0.07 0.44 0.00 -1.65 0.00 0.00 177.43 176.28 3fai h ALA 126 N 1.61 1.31 -0.21 -0.83 0.00 -1.84 0.26 119.26 119.55 3fai h ALA 126 Ca 0.47 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.39 3fai h ALA 126 Cb 0.77 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3fai h ALA 126 CO -0.45 -0.11 -0.18 -0.92 0.00 0.00 0.00 179.25 177.58 3fai h TYR 127 N 0.61 0.60 -0.61 0.00 3.20 -1.38 -2.01 116.97 117.38 3fai h TYR 127 Ca 0.48 -0.17 -0.03 0.00 3.14 0.00 0.00 58.73 62.15 3fai h TYR 127 Cb 0.70 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.82 3fai h TYR 127 CO -0.09 0.83 0.28 -1.49 -1.64 0.00 0.00 178.16 176.05 3fai h TRP 128 N 0.19 0.90 -0.88 -3.82 4.06 -1.20 -1.14 115.95 114.07 3fai h TRP 128 Ca 0.04 -0.05 0.02 0.00 2.06 0.00 0.00 58.89 60.95 3fai h TRP 128 Cb 0.72 -0.28 -0.05 0.00 -1.00 0.00 0.00 29.16 28.56 3fai h TRP 128 CO 0.08 0.70 0.58 0.87 -3.56 0.00 0.00 178.44 177.10 3fai h LYS 129 N 0.84 1.14 0.00 0.49 1.79 -0.96 -1.86 116.57 118.01 3fai h LYS 129 Ca 0.21 -0.07 -0.01 0.00 -2.18 0.00 0.00 60.65 58.60 3fai h LYS 129 Cb 0.15 -0.26 -0.00 0.00 -1.58 0.00 0.00 32.23 30.54 3fai h LYS 129 CO -0.02 0.75 -0.05 0.77 -1.08 0.00 0.00 179.45 179.82 3fai h SER 130 N 1.17 0.00 -0.49 0.86 0.02 -0.44 -0.44 113.55 114.23 3fai h SER 130 Ca 0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 3fai h SER 130 Cb -0.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.44 3fai h SER 130 CO -0.08 0.05 0.00 2.30 -1.14 0.00 0.00 176.83 177.95 3fai n ILE 131 N -4.04 0.65 -0.87 3.27 -5.35 -0.89 -4.95 119.36 107.17 3fai n ILE 131 Ca -0.03 -0.71 0.00 0.00 -0.27 0.00 0.00 62.75 61.75 3fai n ILE 131 Cb 0.13 0.49 0.00 0.00 -1.74 0.00 0.00 39.64 38.52 3fai n ILE 131 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fai n GLY 133 N 1.39 0.57 3.76 3.28 0.00 -0.17 -4.98 105.19 109.04 3fai n GLY 133 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 3fai n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fai s ALA 134 N -2.05 3.32 0.47 4.61 0.00 -0.73 -4.96 121.76 122.43 3fai s ALA 134 Ca 0.00 0.72 -0.23 0.00 0.00 0.00 0.00 51.96 52.45 3fai s ALA 134 Cb 0.00 -3.25 -0.07 0.00 0.00 0.00 0.00 23.12 19.79 3fai s ALA 134 CO 0.00 0.03 1.18 0.15 0.00 0.00 0.00 175.76 177.12 3fai s LYS 135 N -1.52 3.68 -0.22 0.00 1.02 -0.51 -4.13 119.74 118.07 3fai s LYS 135 Ca 0.45 1.80 -0.03 0.00 0.02 0.00 0.00 55.97 58.21 3fai s LYS 135 Cb -0.27 -2.37 0.00 0.00 -0.52 0.00 0.00 37.83 34.67 3fai s LYS 135 CO 0.34 -0.62 -0.06 0.08 -0.92 0.00 0.00 175.35 174.16 3fai s VAL 136 N -1.54 3.16 -0.06 3.17 1.01 -1.26 -0.47 120.40 124.41 3fai s VAL 136 Ca 0.65 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 62.03 3fai s VAL 136 Cb -0.29 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 3fai s VAL 136 CO 0.35 0.40 -0.14 -0.69 0.00 0.00 0.00 175.10 175.02 3fai s VAL 137 N 1.44 3.08 0.34 2.92 1.01 0.82 -1.11 120.40 128.89 3fai s VAL 137 Ca 0.05 -0.71 -0.13 0.00 0.00 0.00 0.00 61.98 61.19 3fai s VAL 137 Cb -0.14 -2.21 0.03 0.00 0.00 0.00 0.00 36.38 34.05 3fai s VAL 137 CO -0.05 0.59 0.67 -0.94 0.00 0.00 0.00 175.10 175.37 3fai s SER 138 N -0.66 0.18 0.72 3.32 1.04 -0.76 -0.90 113.70 116.64 3fai s SER 138 Ca 0.10 -1.12 -0.11 0.00 0.48 0.00 0.00 55.95 55.29 3fai s SER 138 Cb -0.11 0.76 0.02 0.00 0.10 0.00 0.00 66.02 66.79 3fai s SER 138 CO 0.01 -1.48 1.08 0.42 0.98 0.00 0.00 173.24 174.24 3fai s THR 139 N -2.93 3.70 0.20 2.02 -4.23 -1.26 -0.98 115.64 112.17 3fai s THR 139 Ca 0.19 0.55 -0.11 0.00 -1.18 0.00 0.00 61.69 61.15 3fai s THR 139 Cb -0.04 -3.39 0.14 0.00 1.34 0.00 0.00 72.50 70.55 3fai s THR 139 CO 0.13 -0.72 1.86 -0.09 -0.54 0.00 0.00 174.62 175.25 3fai h ARG 140 N -0.76 0.87 -0.23 3.99 2.43 -1.31 -1.53 114.38 117.83 3fai h ARG 140 Ca -0.45 -0.05 0.05 0.00 -0.81 0.00 0.00 59.98 58.72 3fai h ARG 140 Cb 1.24 -0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 30.54 3fai h ARG 140 CO 0.60 0.57 -0.11 0.37 -1.51 0.00 0.00 179.97 179.90 3fai h GLN 141 N 0.89 -0.07 -0.74 0.20 4.15 -1.93 0.15 115.11 117.76 3fai h GLN 141 Ca 0.27 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.71 3fai h GLN 141 Cb -0.03 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.63 3fai h GLN 141 CO -0.09 -0.05 0.48 1.15 -1.93 0.00 0.00 178.83 178.40 3fai h THR 142 N -0.08 1.15 -0.59 2.39 2.02 -1.79 -0.82 112.91 115.19 3fai h THR 142 Ca 0.12 -0.33 -0.08 0.00 0.77 0.00 0.00 66.41 66.89 3fai h THR 142 Cb 0.26 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 3fai h THR 142 CO -0.28 0.18 0.04 -0.09 0.37 0.00 0.00 175.52 175.74 3fai h ARG 143 N 0.96 0.99 -0.39 6.66 1.12 -0.75 -0.29 114.38 122.68 3fai h ARG 143 Ca 0.28 -0.28 -0.10 0.00 -1.11 0.00 0.00 59.98 58.77 3fai h ARG 143 Cb -0.05 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 29.79 3fai h ARG 143 CO -0.08 0.95 -0.16 -0.44 -3.11 0.00 0.00 179.97 177.12 3fai h ASP 144 N 0.92 0.82 0.18 -3.80 3.32 -0.38 -1.51 116.42 115.97 3fai h ASP 144 Ca 0.18 -0.39 -0.11 0.00 0.02 0.00 0.00 57.03 56.72 3fai h ASP 144 Cb 0.48 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 3fai h ASP 144 CO 0.02 1.03 -0.40 -0.07 -1.72 0.00 0.00 179.24 178.10 3fai h LEU 145 N 0.61 0.30 -0.41 1.55 3.38 -1.00 -2.36 115.31 117.38 3fai h LEU 145 Ca 0.09 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 3fai h LEU 145 Cb 0.71 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 3fai h LEU 145 CO 0.05 0.68 0.04 -0.03 0.09 0.00 0.00 178.44 179.27 3fai h MET 146 N 0.24 0.70 -0.67 1.13 4.05 -0.71 0.20 114.93 119.87 3fai h MET 146 Ca 0.02 -0.20 0.01 0.00 -0.28 0.00 0.00 59.70 59.25 3fai h MET 146 Cb 0.82 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 31.51 3fai h MET 146 CO 0.06 0.75 0.44 -0.22 0.23 0.00 0.00 176.91 178.18 3fai h LYS 147 N 0.54 0.88 0.05 0.39 1.63 -1.01 -0.73 116.57 118.32 3fai h LYS 147 Ca 0.12 -0.05 -0.24 0.00 -0.85 0.00 0.00 60.65 59.63 3fai h LYS 147 Cb 0.41 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 31.83 3fai h LYS 147 CO 0.01 0.58 -1.14 0.66 -3.45 0.00 0.00 179.45 176.11 3fai h SER 148 N 0.91 0.17 0.00 4.20 4.64 -1.25 -3.40 113.55 118.82 3fai h SER 148 Ca 0.25 -0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3fai h SER 148 Cb -0.10 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 61.93 3fai h SER 148 CO -0.05 1.15 0.00 0.47 -0.87 0.00 0.00 176.83 177.52 3fai n ASP 149 N -3.41 1.11 -0.05 4.97 9.92 0.69 -4.73 116.55 125.05 3fai n ASP 149 Ca -0.05 -1.14 -0.08 0.00 -0.53 0.00 0.00 54.79 53.00 3fai n ASP 149 Cb 0.98 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 41.44 3fai n ASP 149 CO 0.00 0.00 0.00 -0.25 0.13 0.00 0.00 177.20 177.08 3fai h TRP 150 N 0.00 -0.28 -0.99 1.24 2.91 -1.25 -0.62 115.95 116.96 3fai h TRP 150 Ca 0.00 0.03 0.10 0.00 1.13 0.00 0.00 58.89 60.15 3fai h TRP 150 Cb 0.09 0.16 -0.08 0.00 -0.51 0.00 0.00 29.16 28.82 3fai h TRP 150 CO 0.00 -0.18 0.62 0.00 -1.03 0.00 0.00 178.44 177.85 3fai h ALA 151 N 1.09 1.45 -0.48 2.65 0.00 -1.85 0.13 119.26 122.26 3fai h ALA 151 Ca 0.12 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3fai h ALA 151 Cb 0.27 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3fai h ALA 151 CO -0.28 0.27 0.13 0.93 0.00 0.00 0.00 179.25 180.30 3fai h GLU 152 N 1.02 0.75 -0.02 0.00 5.08 -1.67 -1.02 114.58 118.73 3fai h GLU 152 Ca 0.47 -0.17 -0.14 0.00 -1.00 0.00 0.00 59.36 58.52 3fai h GLU 152 Cb 0.40 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 3fai h GLU 152 CO -0.24 0.73 -0.65 0.97 -1.00 0.00 0.00 179.01 178.82 3fai h ILE 153 N 0.64 1.44 -0.36 3.13 6.09 -0.32 -0.87 117.51 127.26 3fai h ILE 153 Ca 0.15 -2.16 -0.08 0.00 -1.37 0.00 0.00 64.86 61.40 3fai h ILE 153 Cb 0.30 2.15 -0.01 0.00 0.47 0.00 0.00 36.82 39.73 3fai h ILE 153 CO -0.00 0.62 -0.10 0.58 -3.07 0.00 0.00 178.15 176.18 3fai h VAL 154 N 0.06 1.28 -0.79 2.19 2.07 -0.61 0.53 116.25 120.98 3fai h VAL 154 Ca -0.01 -1.18 -0.05 0.00 0.82 0.00 0.00 66.70 66.28 3fai h VAL 154 Cb 1.15 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 32.18 3fai h VAL 154 CO 0.09 0.39 0.32 0.00 0.02 0.00 0.00 177.57 178.38 3fai h ALA 155 N 0.82 1.03 -0.56 1.67 0.00 -1.02 -1.14 119.26 120.06 3fai h ALA 155 Ca 0.09 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 3fai h ALA 155 Cb 0.62 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3fai h ALA 155 CO 0.04 0.66 -0.02 0.35 0.00 0.00 0.00 179.25 180.28 3fai h PHE 156 N 1.15 1.07 -0.80 0.00 3.57 -0.90 -1.54 116.94 119.48 3fai h PHE 156 Ca 0.26 -0.18 0.02 0.00 3.53 0.00 0.00 57.97 61.60 3fai h PHE 156 Cb 0.22 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 3fai h PHE 156 CO 0.02 0.96 0.52 1.15 -2.23 0.00 0.00 178.31 178.73 3fai h THR 157 N 0.90 1.17 0.00 4.41 2.02 -0.45 -2.42 112.91 118.54 3fai h THR 157 Ca 0.16 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.98 3fai h THR 157 Cb 0.55 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 3fai h THR 157 CO 0.03 0.19 0.00 0.03 0.37 0.00 0.00 175.52 176.14 3fai h ARG 158 N 1.04 0.00 -0.16 6.66 3.08 -0.70 0.07 114.38 124.37 3fai h ARG 158 Ca 0.31 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.35 3fai h ARG 158 Cb -0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 3fai h ARG 158 CO -0.09 0.00 0.08 0.87 -1.07 0.00 0.00 179.97 179.76 3fai h LYS 159 N 0.00 0.23 0.00 0.04 1.57 -0.78 -2.66 116.57 114.97 3fai h LYS 159 Ca 0.00 -0.03 -0.15 0.00 -1.87 0.00 0.00 60.65 58.60 3fai h LYS 159 Cb 0.75 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 3fai h LYS 159 CO 0.00 0.26 -0.75 0.78 -0.57 0.00 0.00 179.45 179.16 3fai h GLY 160 N 0.14 0.00 -6.46 3.86 0.00 -1.46 -3.40 103.07 95.75 3fai h GLY 160 Ca 0.06 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.79 3fai h GLY 160 CO -0.01 0.00 -0.87 1.04 0.00 0.00 0.00 176.54 176.70 3fai n LEU 161 N -3.26 0.81 0.28 3.11 4.77 -0.02 -4.95 117.00 117.74 3fai n LEU 161 Ca 0.01 -4.71 0.14 0.00 -0.03 0.00 0.00 56.01 51.41 3fai n LEU 161 Cb 0.83 0.15 0.83 0.00 -2.33 0.00 0.00 43.42 42.90 3fai n LEU 161 CO 0.43 1.89 1.07 -0.65 -1.33 0.00 0.00 177.39 178.80 3fai h PRO 162 N 5.18 0.00 0.00 3.23 0.11 -1.70 0.70 132.00 139.52 3fai h PRO 162 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 3fai h PRO 162 Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 3fai h PRO 162 CO 0.51 0.04 0.00 1.05 -0.21 0.00 0.00 178.00 179.39 3fai h GLU 163 N 0.00 0.00 -6.76 1.05 9.09 -1.93 -3.45 114.58 112.58 3fai h GLU 163 Ca -0.00 0.00 -0.51 0.00 0.05 0.00 0.00 59.36 58.89 3fai h GLU 163 Cb 0.11 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 27.24 3fai h GLU 163 CO 0.01 0.00 0.55 -0.47 0.05 0.00 0.00 179.01 179.15 3fai s TYR 164 N -3.42 3.39 0.63 2.06 5.04 0.24 -4.98 117.35 120.31 3fai s TYR 164 Ca 0.03 1.51 -0.16 0.00 -2.44 0.00 0.00 57.07 56.01 3fai s TYR 164 Cb 0.09 -3.44 -0.01 0.00 0.35 0.00 0.00 41.96 38.94 3fai s TYR 164 CO 0.41 -1.16 1.10 -1.25 -1.34 0.00 0.00 175.55 173.31 3fai s PRO 165 N -1.01 2.95 -1.27 4.97 0.04 -1.26 -4.89 135.00 134.52 3fai s PRO 165 Ca 0.49 1.39 -0.15 0.00 0.04 0.00 0.00 61.00 62.77 3fai s PRO 165 Cb -0.34 -1.97 0.12 0.00 0.04 0.00 0.00 34.50 32.35 3fai s PRO 165 CO 0.42 -1.14 1.66 -3.47 0.04 0.00 0.00 177.00 174.52 3fai n ASP 166 N -2.22 4.99 -4.74 6.66 2.03 -1.26 -4.98 116.55 117.04 3fai n ASP 166 Ca 0.10 -2.96 -0.41 0.00 0.52 0.00 0.00 54.79 52.04 3fai n ASP 166 Cb 0.52 -1.63 -0.04 0.00 -0.72 0.00 0.00 41.12 39.24 3fai n ASP 166 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3fai s LEU 167 N 2.41 4.51 0.65 -2.67 1.43 -1.26 -5.01 118.68 118.74 3fai s LEU 167 Ca 0.47 2.07 -0.12 0.00 -1.03 0.00 0.00 54.13 55.51 3fai s LEU 167 Cb 0.02 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.63 3fai s LEU 167 CO 0.02 -0.16 1.05 -2.16 0.23 0.00 0.00 176.35 175.34 3fai s PRO 168 N -0.54 3.14 0.25 1.29 0.04 -1.26 -4.96 135.00 132.95 3fai s PRO 168 Ca 0.48 1.01 -0.30 0.00 0.04 0.00 0.00 61.00 62.22 3fai s PRO 168 Cb -0.29 -2.02 -0.10 0.00 0.04 0.00 0.00 34.50 32.14 3fai s PRO 168 CO 0.35 -0.94 1.48 -1.17 0.04 0.00 0.00 177.00 176.75 3fai s LEU 169 N -5.17 4.38 -0.23 -3.56 2.96 -1.26 -4.99 118.68 110.81 3fai s LEU 169 Ca 0.59 2.71 -0.03 0.00 -0.22 0.00 0.00 54.13 57.18 3fai s LEU 169 Cb -0.14 -3.62 0.07 0.00 0.50 0.00 0.00 46.19 43.00 3fai s LEU 169 CO 0.49 -0.75 0.07 -0.69 -1.32 0.00 0.00 176.35 174.15 3fai s VAL 170 N 0.12 0.34 0.28 1.68 1.01 -1.26 -5.08 120.40 117.50 3fai s VAL 170 Ca 0.61 -0.65 -0.16 0.00 0.00 0.00 0.00 61.98 61.79 3fai s VAL 170 Cb -0.43 -1.03 -0.09 0.00 0.00 0.00 0.00 36.38 34.83 3fai s VAL 170 CO 0.43 -0.40 0.71 -0.76 0.00 0.00 0.00 175.10 175.08 3fai s LEU 171 N 1.92 4.15 0.38 3.92 1.43 -1.26 -4.89 118.68 124.33 3fai s LEU 171 Ca 0.03 1.27 -0.25 0.00 -1.03 0.00 0.00 54.13 54.15 3fai s LEU 171 Cb -0.17 -3.89 -0.12 0.00 0.03 0.00 0.00 46.19 42.04 3fai s LEU 171 CO -0.16 -0.12 0.90 -2.65 0.23 0.00 0.00 176.35 174.54 3fai n PRO 172 N -0.04 1.14 -0.05 1.29 -0.02 -1.26 -4.94 135.00 131.12 3fai n PRO 172 Ca 0.01 0.41 0.06 0.00 -2.02 0.00 0.00 63.50 61.96 3fai n PRO 172 Cb 0.53 -1.84 0.08 0.00 -0.02 0.00 0.00 33.50 32.25 3fai n PRO 172 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3fai n ASN 173 N 0.92 2.30 -3.78 2.55 0.23 -0.27 -4.85 115.26 112.36 3fai n ASN 173 Ca 0.10 -1.65 -0.28 0.00 -0.53 0.00 0.00 54.58 52.22 3fai n ASN 173 Cb 0.37 -0.07 -0.16 0.00 -2.08 0.00 0.00 39.78 37.83 3fai n ASN 173 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 3fai s VAL 174 N -1.01 0.72 -0.07 3.53 1.01 -0.58 -4.93 120.40 119.07 3fai s VAL 174 Ca 0.17 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 61.58 3fai s VAL 174 Cb 0.11 -1.15 -0.01 0.00 0.00 0.00 0.00 36.38 35.34 3fai s VAL 174 CO 0.16 -0.14 -0.25 -0.69 0.00 0.00 0.00 175.10 174.18 3fai s VAL 175 N 1.77 2.07 -0.09 2.92 1.01 -1.26 -1.83 120.40 124.99 3fai s VAL 175 Ca -0.01 -1.05 -0.01 0.00 0.00 0.00 0.00 61.98 60.91 3fai s VAL 175 Cb -0.17 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 3fai s VAL 175 CO -0.07 0.57 -0.06 -1.00 0.00 0.00 0.00 175.10 174.54 3fai s HIS 176 N -0.02 2.98 -0.45 5.22 3.76 -0.15 -4.82 115.29 121.81 3fai s HIS 176 Ca -0.08 -0.06 0.24 0.00 -0.15 0.00 0.00 55.06 55.01 3fai s HIS 176 Cb -0.15 -1.79 0.47 0.00 1.11 0.00 0.00 32.58 32.23 3fai s HIS 176 CO 0.05 0.24 1.66 -0.44 -0.85 0.00 0.00 174.74 175.40 3fai h ASP 177 N 5.65 0.00 -0.12 1.40 3.32 -1.95 -0.02 116.42 124.71 3fai h ASP 177 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 3fai h ASP 177 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3fai h ASP 177 CO 0.55 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.68 3fai n GLY 178 N 1.05 5.58 3.75 2.75 0.00 -1.26 -4.87 105.19 112.18 3fai n GLY 178 Ca 0.04 -1.47 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 3fai n GLY 178 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3fai s ASP 179 N 1.00 4.37 0.08 1.61 1.01 -1.26 -4.93 116.67 118.55 3fai s ASP 179 Ca 0.00 1.95 -0.17 0.00 0.71 0.00 0.00 52.55 55.04 3fai s ASP 179 Cb 0.00 -2.54 0.04 0.00 1.01 0.00 0.00 42.92 41.43 3fai s ASP 179 CO 0.00 -2.13 0.41 0.72 0.21 0.00 0.00 175.17 174.38 3fai s PHE 180 N -2.68 -0.24 0.18 4.23 -0.12 -0.83 -5.03 117.98 113.49 3fai s PHE 180 Ca 0.64 0.07 0.07 0.00 -0.05 0.00 0.00 56.93 57.66 3fai s PHE 180 Cb -0.20 0.24 -0.04 0.00 -0.63 0.00 0.00 43.02 42.39 3fai s PHE 180 CO 0.52 -0.64 -0.14 0.95 -0.05 0.00 0.00 175.22 175.87 3fai s THR 181 N -3.12 1.59 0.31 -4.49 -4.23 -1.26 -0.25 115.64 104.18 3fai s THR 181 Ca -0.01 -2.06 0.03 0.00 -1.18 0.00 0.00 61.69 58.47 3fai s THR 181 Cb 0.01 -1.89 -0.05 0.00 1.34 0.00 0.00 72.50 71.91 3fai s THR 181 CO -0.07 -0.55 0.11 -0.76 -0.54 0.00 0.00 174.62 172.81 3fai s LEU 182 N -3.05 1.82 -1.26 4.79 1.02 0.11 -4.86 118.68 117.26 3fai s LEU 182 Ca 0.18 -1.48 -0.04 0.00 0.02 0.00 0.00 54.13 52.82 3fai s LEU 182 Cb -0.02 -0.04 -0.01 0.00 0.02 0.00 0.00 46.19 46.15 3fai s LEU 182 CO 0.05 -0.78 0.73 0.00 0.02 0.00 0.00 176.35 176.37 3fai n GLN 183 N -0.62 -4.10 -3.61 1.70 1.13 -1.26 -2.05 117.38 108.57 3fai n GLN 183 Ca -0.01 0.62 -0.26 0.00 -1.94 0.00 0.00 57.00 55.40 3fai n GLN 183 Cb 0.66 -5.08 0.04 0.00 0.11 0.00 0.00 30.24 25.97 3fai n GLN 183 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3fai n GLU 184 N -4.16 -5.97 -1.00 -1.09 1.02 -1.26 -1.62 120.64 106.56 3fai n GLU 184 Ca -0.25 0.71 0.00 0.00 -0.02 0.00 0.00 57.16 57.60 3fai n GLU 184 Cb 0.66 -5.63 0.00 0.00 -0.02 0.00 0.00 31.44 26.45 3fai n GLU 184 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3fai n GLY 185 N -1.71 0.50 0.12 0.62 0.00 -0.87 -4.91 105.19 98.94 3fai n GLY 185 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3fai n GLY 185 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fai n LYS 186 N -2.94 0.34 -3.93 1.61 4.76 -0.64 -4.64 118.16 112.72 3fai n LYS 186 Ca 0.00 -0.23 -0.29 0.00 -2.87 0.00 0.00 58.31 54.92 3fai n LYS 186 Cb 0.01 -1.50 -0.16 0.00 -1.84 0.00 0.00 35.03 31.54 3fai n LYS 186 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3fai s VAL 187 N -2.82 1.34 -0.20 -0.18 1.01 -0.92 -4.05 120.40 114.58 3fai s VAL 187 Ca 0.15 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.32 3fai s VAL 187 Cb 0.18 -1.48 0.04 0.00 0.00 0.00 0.00 36.38 35.12 3fai s VAL 187 CO 0.68 0.13 -0.11 -0.13 0.00 0.00 0.00 175.10 175.66 3fai s ARG 188 N 1.53 2.08 -0.12 2.72 0.52 0.33 -0.71 118.95 125.30 3fai s ARG 188 Ca -0.00 -0.86 -0.05 0.00 -0.52 0.00 0.00 55.73 54.29 3fai s ARG 188 Cb -0.16 -2.44 -0.04 0.00 0.52 0.00 0.00 34.95 32.83 3fai s ARG 188 CO -0.08 -0.42 0.07 0.00 0.02 0.00 0.00 175.30 174.89 3fai s ALA 189 N 1.38 3.56 0.04 2.13 0.00 0.65 -0.40 121.76 129.13 3fai s ALA 189 Ca -0.01 -0.72 -0.14 0.00 0.00 0.00 0.00 51.96 51.08 3fai s ALA 189 Cb -0.16 -1.78 0.02 0.00 0.00 0.00 0.00 23.12 21.20 3fai s ALA 189 CO -0.08 0.51 0.31 -0.59 0.00 0.00 0.00 175.76 175.91 3fai s PHE 190 N -0.68 -0.12 -0.16 0.00 -0.12 -0.38 -1.97 117.98 114.56 3fai s PHE 190 Ca 0.12 -0.00 -0.07 0.00 -0.05 0.00 0.00 56.93 56.93 3fai s PHE 190 Cb -0.12 0.10 -0.04 0.00 -0.63 0.00 0.00 43.02 42.34 3fai s PHE 190 CO 0.02 -0.50 0.08 -0.47 -0.05 0.00 0.00 175.22 174.30 3fai s TYR 191 N -2.50 3.33 -0.08 3.49 5.04 -1.26 -1.06 117.35 124.31 3fai s TYR 191 Ca -0.05 0.22 0.12 0.00 -2.44 0.00 0.00 57.07 54.92 3fai s TYR 191 Cb -0.01 -2.02 0.23 0.00 0.35 0.00 0.00 41.96 40.50 3fai s TYR 191 CO -0.03 0.34 1.11 0.00 -1.34 0.00 0.00 175.55 175.63 3fai n ALA 192 N 3.01 2.37 0.00 3.97 0.00 -1.26 -5.03 120.51 123.57 3fai n ALA 192 Ca -0.17 -2.14 0.00 0.00 0.00 0.00 0.00 53.44 51.12 3fai n ALA 192 Cb 0.53 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.52 3fai n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fai n GLY 193 N -0.70 1.70 3.80 0.00 0.00 -1.26 -4.52 105.19 104.21 3fai n GLY 193 Ca 0.10 -2.08 -0.34 0.00 0.00 0.00 0.00 46.02 43.70 3fai n GLY 193 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3fai s PRO 194 N -1.87 3.92 0.00 1.61 0.04 -1.26 -4.76 135.00 132.68 3fai s PRO 194 Ca 0.00 1.31 0.00 0.00 0.04 0.00 0.00 61.00 62.35 3fai s PRO 194 Cb 0.00 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.41 3fai s PRO 194 CO 0.00 -0.32 0.00 0.00 0.04 0.00 0.00 177.00 176.72 3fai n ALA 195 N -0.85 0.00 -0.20 8.56 0.00 -1.26 -4.10 120.51 122.66 3fai n ALA 195 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.49 3fai n ALA 195 Cb 0.53 0.00 0.14 0.00 0.00 0.00 0.00 19.45 20.12 3fai n ALA 195 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3fai h HIS 196 N 0.00 1.02 -3.03 0.00 -0.00 -1.89 -0.83 115.15 110.41 3fai h HIS 196 Ca 0.00 -0.08 -0.49 0.00 -0.00 0.00 0.00 60.37 59.80 3fai h HIS 196 Cb 0.00 -0.30 -0.14 0.00 -0.00 0.00 0.00 27.41 26.97 3fai h HIS 196 CO 0.00 0.80 -0.56 0.95 -0.00 0.00 0.00 177.93 179.12 3fai s THR 197 N -5.37 0.72 0.19 6.26 -4.23 -1.26 -2.84 115.64 109.10 3fai s THR 197 Ca -0.11 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.65 3fai s THR 197 Cb 0.16 -2.53 0.24 0.00 1.34 0.00 0.00 72.50 71.71 3fai s THR 197 CO 0.82 0.00 1.87 -0.65 -0.54 0.00 0.00 174.62 176.12 3fai h PRO 198 N 2.02 0.00 0.00 3.99 0.11 -1.85 -3.33 132.00 132.93 3fai h PRO 198 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3fai h PRO 198 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3fai h PRO 198 CO 0.60 0.21 -0.79 -0.40 -0.21 0.00 0.00 178.00 177.41 3fai n ASP 199 N -3.43 0.86 -4.64 -2.05 5.75 -1.26 -4.01 116.55 107.76 3fai n ASP 199 Ca -0.00 -0.65 -0.45 0.00 -0.01 0.00 0.00 54.79 53.68 3fai n ASP 199 Cb 0.39 1.11 -0.02 0.00 -1.03 0.00 0.00 41.12 41.58 3fai n ASP 199 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fai n GLY 200 N 1.39 0.30 3.61 6.12 0.00 -1.25 -4.81 105.19 110.54 3fai n GLY 200 Ca 0.02 0.41 -0.28 0.00 0.00 0.00 0.00 46.02 46.17 3fai n GLY 200 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fai s ILE 201 N -0.60 3.44 0.29 -0.61 -4.36 -0.56 -4.66 121.20 114.14 3fai s ILE 201 Ca 0.63 -1.43 -0.07 0.00 -0.26 0.00 0.00 60.65 59.52 3fai s ILE 201 Cb -0.68 -2.68 -0.06 0.00 1.25 0.00 0.00 42.46 40.29 3fai s ILE 201 CO 0.56 -0.03 0.59 -0.36 0.24 0.00 0.00 174.94 175.94 3fai s PHE 202 N -1.53 3.46 -0.08 1.37 0.08 -0.23 -4.80 117.98 116.26 3fai s PHE 202 Ca 0.24 0.78 0.01 0.00 0.12 0.00 0.00 56.93 58.08 3fai s PHE 202 Cb -0.10 -2.21 0.02 0.00 -0.57 0.00 0.00 43.02 40.16 3fai s PHE 202 CO 0.16 0.15 -0.11 0.08 -0.10 0.00 0.00 175.22 175.40 3fai s VAL 203 N -2.06 1.10 -0.03 -0.44 1.01 -1.08 -1.25 120.40 117.64 3fai s VAL 203 Ca 0.46 -0.42 0.06 0.00 0.00 0.00 0.00 61.98 62.09 3fai s VAL 203 Cb -0.11 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.21 3fai s VAL 203 CO 0.28 0.36 -0.21 -0.47 0.00 0.00 0.00 175.10 175.05 3fai s TYR 204 N 1.01 2.48 -0.41 5.22 5.04 0.47 -0.07 117.35 131.08 3fai s TYR 204 Ca -0.08 -0.34 0.01 0.00 -2.44 0.00 0.00 57.07 54.22 3fai s TYR 204 Cb -0.15 -1.55 0.11 0.00 0.35 0.00 0.00 41.96 40.72 3fai s TYR 204 CO -0.00 0.04 0.16 -0.06 -1.34 0.00 0.00 175.55 174.35 3fai s PHE 205 N -0.65 3.60 0.29 4.97 0.08 -0.07 -0.51 117.98 125.69 3fai s PHE 205 Ca 0.10 -2.80 0.01 0.00 0.12 0.00 0.00 56.93 54.37 3fai s PHE 205 Cb -0.10 -3.04 0.43 0.00 -0.57 0.00 0.00 43.02 39.73 3fai s PHE 205 CO -0.00 -0.92 1.77 -1.00 -0.10 0.00 0.00 175.22 174.96 3fai h PRO 209 N 7.58 0.59 -0.67 0.24 0.13 -1.85 0.14 132.00 138.17 3fai h PRO 209 Ca -0.07 -0.18 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 3fai h PRO 209 Cb 1.01 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 32.05 3fai h PRO 209 CO 0.62 0.70 0.31 -0.44 -0.23 0.00 0.00 178.00 178.96 3fai h ASP 210 N 0.55 0.89 0.15 1.44 3.32 -1.94 -2.99 116.42 117.83 3fai h ASP 210 Ca 0.10 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.01 3fai h ASP 210 Cb 0.52 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.84 3fai h ASP 210 CO 0.03 0.78 -0.51 -0.62 -1.72 0.00 0.00 179.24 177.21 3fai n GLU 211 N -4.45 0.68 -3.72 3.56 4.71 -1.10 -4.97 120.64 115.35 3fai n GLU 211 Ca 0.05 -0.50 -0.22 0.00 -0.01 0.00 0.00 57.16 56.48 3fai n GLU 211 Cb 0.14 -1.49 0.03 0.00 -1.01 0.00 0.00 31.44 29.11 3fai n GLU 211 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 3fai n GLN 215 N -0.73 -4.99 -4.80 3.49 6.02 0.01 -4.73 117.38 111.65 3fai n GLN 215 Ca 0.09 0.62 -0.33 0.00 -0.01 0.00 0.00 57.00 57.37 3fai n GLN 215 Cb 0.38 -5.21 -0.14 0.00 1.02 0.00 0.00 30.24 26.29 3fai n GLN 215 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3fai s VAL 216 N -3.64 3.03 -0.20 5.09 1.01 -1.02 -0.76 120.40 123.90 3fai s VAL 216 Ca 0.06 -0.68 -0.03 0.00 0.00 0.00 0.00 61.98 61.33 3fai s VAL 216 Cb -0.03 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 3fai s VAL 216 CO 0.81 0.53 -0.06 -0.22 0.00 0.00 0.00 175.10 176.17 3fai s LEU 217 N 0.23 2.86 -0.19 3.92 2.96 0.02 -0.89 118.68 127.58 3fai s LEU 217 Ca -0.09 -0.38 -0.22 0.00 -0.22 0.00 0.00 54.13 53.23 3fai s LEU 217 Cb -0.15 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.80 3fai s LEU 217 CO 0.05 0.01 0.67 -0.47 -1.32 0.00 0.00 176.35 175.30 3fai s TYR 218 N 1.27 3.38 -0.77 5.38 5.04 0.89 -0.67 117.35 131.87 3fai s TYR 218 Ca 0.03 0.99 0.24 0.00 -2.44 0.00 0.00 57.07 55.89 3fai s TYR 218 Cb -0.14 -2.84 0.24 0.00 0.35 0.00 0.00 41.96 39.56 3fai s TYR 218 CO -0.02 -0.19 1.21 0.41 -1.34 0.00 0.00 175.55 175.61 3fai n GLY 219 N 3.74 -1.25 7.00 8.97 0.00 -0.67 -2.65 105.19 120.32 3fai n GLY 219 Ca -0.00 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.65 3fai n GLY 219 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fai n GLY 220 N 1.41 1.51 0.00 -0.02 0.00 -1.26 -1.05 105.19 105.79 3fai n GLY 220 Ca 0.03 -0.53 0.09 0.00 0.00 0.00 0.00 46.02 45.62 3fai n GLY 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fai h ILE 222 N 0.00 1.36 -3.76 0.00 2.04 -1.49 -3.45 117.51 112.22 3fai h ILE 222 Ca 0.00 -2.33 -0.63 0.00 1.00 0.00 0.00 64.86 62.90 3fai h ILE 222 Cb 0.22 2.34 -0.32 0.00 -0.74 0.00 0.00 36.82 38.32 3fai h ILE 222 CO 0.00 0.70 -0.86 -0.76 0.00 0.00 0.00 178.15 177.23 3fai s LEU 223 N -7.90 1.98 0.00 1.44 1.43 -1.19 -4.93 118.68 109.52 3fai s LEU 223 Ca -0.07 -0.45 -0.28 0.00 -1.03 0.00 0.00 54.13 52.30 3fai s LEU 223 Cb 0.09 -1.20 0.10 0.00 0.03 0.00 0.00 46.19 45.20 3fai s LEU 223 CO 0.88 0.17 1.26 -1.59 0.23 0.00 0.00 176.35 177.30 3fai s LYS 224 N 0.10 0.48 -0.08 1.70 -2.85 -1.26 -1.50 119.74 116.34 3fai s LYS 224 Ca -0.08 -0.31 -0.10 0.00 -1.00 0.00 0.00 55.97 54.48 3fai s LYS 224 Cb -0.14 0.13 -0.29 0.00 -2.06 0.00 0.00 37.83 35.47 3fai s LYS 224 CO 0.04 -0.23 0.55 0.93 0.10 0.00 0.00 175.35 176.75 3fai h GLU 225 N 2.00 0.34 -6.07 1.78 5.08 -1.90 -3.42 114.58 112.40 3fai h GLU 225 Ca -0.23 -0.58 -0.65 0.00 -1.00 0.00 0.00 59.36 56.89 3fai h GLU 225 Cb 1.19 0.22 -0.11 0.00 0.50 0.00 0.00 28.75 30.55 3fai h GLU 225 CO 0.32 1.28 -0.60 0.15 -1.00 0.00 0.00 179.01 179.16 3fai s LYS 226 N -2.57 2.96 0.20 2.33 1.02 -1.26 -4.96 119.74 117.47 3fai s LYS 226 Ca -0.19 -0.55 -0.14 0.00 0.02 0.00 0.00 55.97 55.12 3fai s LYS 226 Cb 0.06 -2.79 0.23 0.00 -0.52 0.00 0.00 37.83 34.80 3fai s LYS 226 CO 0.82 0.63 1.64 1.25 -0.92 0.00 0.00 175.35 178.76 3fai h LEU 231 N 4.03 -0.51 0.00 3.17 5.85 -1.96 -3.47 115.31 122.41 3fai h LEU 231 Ca -0.49 0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.41 3fai h LEU 231 Cb 1.18 0.35 -0.00 0.00 0.37 0.00 0.00 40.66 42.56 3fai h LEU 231 CO 0.62 -0.18 -0.01 0.61 -0.34 0.00 0.00 178.44 179.13 3fai n GLY 232 N -1.40 -1.98 3.73 3.75 0.00 -1.26 -4.81 105.19 103.22 3fai n GLY 232 Ca 0.07 -1.39 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 3fai n GLY 232 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3fai s ASN 233 N -3.86 7.52 -0.17 1.61 2.47 -1.26 -4.96 114.94 116.28 3fai s ASN 233 Ca 0.00 1.81 0.17 0.00 0.42 0.00 0.00 52.86 55.26 3fai s ASN 233 Cb 0.00 -2.59 0.50 0.00 -1.45 0.00 0.00 41.25 37.71 3fai s ASN 233 CO 0.00 -0.02 1.39 0.18 -3.72 0.00 0.00 177.10 174.93 3fai n LEU 234 N 2.54 3.68 0.25 3.21 4.77 -1.26 -4.76 117.00 125.42 3fai n LEU 234 Ca 0.01 -3.05 0.11 0.00 -0.03 0.00 0.00 56.01 53.06 3fai n LEU 234 Cb 0.49 -0.53 0.63 0.00 -2.33 0.00 0.00 43.42 41.68 3fai n LEU 234 CO 0.51 0.69 0.91 0.77 -1.33 0.00 0.00 177.39 178.94 3fai h SER 235 N 1.53 0.00 -0.02 -1.43 4.64 -1.93 -1.52 113.55 114.83 3fai h SER 235 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fai h SER 235 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 3fai h SER 235 CO 0.20 0.17 -0.13 0.49 -0.87 0.00 0.00 176.83 176.68 3fai n PHE 236 N -3.62 0.00 -2.78 4.77 3.72 -1.26 -5.02 117.46 113.28 3fai n PHE 236 Ca -0.01 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.06 3fai n PHE 236 Cb 0.30 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.77 3fai n PHE 236 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fai s ALA 237 N -1.86 3.06 -0.77 4.37 0.00 -0.57 -4.37 121.76 121.62 3fai s ALA 237 Ca 0.21 0.34 -0.15 0.00 0.00 0.00 0.00 51.96 52.36 3fai s ALA 237 Cb 0.17 -3.12 0.18 0.00 0.00 0.00 0.00 23.12 20.35 3fai s ALA 237 CO 0.33 0.09 0.76 0.34 0.00 0.00 0.00 175.76 177.28 3fai s ASP 238 N -2.33 6.59 0.12 0.00 -1.08 -0.32 -4.94 116.67 114.72 3fai s ASP 238 Ca 0.61 -2.32 -0.13 0.00 -0.52 0.00 0.00 52.55 50.19 3fai s ASP 238 Cb -0.09 -2.24 -0.06 0.00 -1.46 0.00 0.00 42.92 39.07 3fai s ASP 238 CO 0.16 -0.74 1.46 0.58 0.52 0.00 0.00 175.17 177.15 3fai h VAL 239 N 5.23 1.29 -0.30 1.11 2.07 -1.85 -0.33 116.25 123.46 3fai h VAL 239 Ca -0.00 -1.44 -0.10 0.00 0.82 0.00 0.00 66.70 65.98 3fai h VAL 239 Cb 1.05 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 3fai h VAL 239 CO 0.88 0.47 -0.25 0.11 0.02 0.00 0.00 177.57 178.81 3fai h LYS 240 N 0.60 0.60 0.00 1.57 1.57 -1.92 -3.08 116.57 115.90 3fai h LYS 240 Ca 0.06 -0.23 -0.10 0.00 -1.87 0.00 0.00 60.65 58.51 3fai h LYS 240 Cb 0.85 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 3fai h LYS 240 CO 0.07 0.79 -0.46 0.00 -0.57 0.00 0.00 179.45 179.28 3fai h ALA 241 N 1.21 0.86 -0.54 3.86 0.00 -1.83 -3.37 119.26 119.45 3fai h ALA 241 Ca 0.07 -0.42 0.09 0.00 0.00 0.00 0.00 54.91 54.65 3fai h ALA 241 Cb 0.70 -0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.31 3fai h ALA 241 CO 0.05 0.58 -0.38 -0.92 0.00 0.00 0.00 179.25 178.58 3fai h TYR 242 N 0.00 -1.09 0.00 0.00 -0.00 -0.96 0.12 116.97 115.03 3fai h TYR 242 Ca -0.00 0.07 -0.06 0.00 -0.00 0.00 0.00 58.73 58.74 3fai h TYR 242 Cb 1.10 0.56 -0.01 0.00 -0.00 0.00 0.00 36.73 38.37 3fai h TYR 242 CO 0.00 -0.41 -0.27 -1.00 -0.00 0.00 0.00 178.16 176.49 3fai h PRO 243 N -0.22 0.00 -0.69 1.82 0.13 -1.75 -1.34 132.00 129.96 3fai h PRO 243 Ca 0.19 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.25 3fai h PRO 243 Cb 0.56 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.66 3fai h PRO 243 CO -0.65 0.27 0.15 1.96 -0.23 0.00 0.00 178.00 179.50 3fai h GLN 244 N 0.00 1.10 -0.48 0.86 4.20 -1.06 0.72 115.11 120.45 3fai h GLN 244 Ca -0.00 -0.27 -0.03 0.00 0.06 0.00 0.00 58.65 58.41 3fai h GLN 244 Cb 0.72 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.34 3fai h GLN 244 CO 0.03 0.98 0.20 1.15 -0.67 0.00 0.00 178.83 180.52 3fai h THR 245 N 1.04 1.21 -0.30 -0.54 2.02 -0.38 -0.10 112.91 115.87 3fai h THR 245 Ca 0.21 -0.63 -0.07 0.00 0.77 0.00 0.00 66.41 66.70 3fai h THR 245 Cb 0.38 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 3fai h THR 245 CO 0.00 0.24 -0.11 -0.07 0.37 0.00 0.00 175.52 175.96 3fai h LEU 246 N 0.63 0.48 -0.42 2.58 3.38 -0.94 0.45 115.31 121.46 3fai h LEU 246 Ca 0.16 -0.12 -0.18 0.00 0.09 0.00 0.00 57.88 57.83 3fai h LEU 246 Cb 0.18 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 3fai h LEU 246 CO -0.01 0.62 -0.73 -0.33 0.09 0.00 0.00 178.44 178.07 3fai h GLU 247 N 0.46 0.35 -0.82 1.13 4.39 -0.65 -0.65 114.58 118.79 3fai h GLU 247 Ca 0.09 -0.29 -0.02 0.00 0.34 0.00 0.00 59.36 59.47 3fai h GLU 247 Cb 0.47 0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.14 3fai h GLU 247 CO 0.03 0.94 0.41 0.00 -1.16 0.00 0.00 179.01 179.23 3fai h ARG 248 N 0.24 1.16 -0.04 2.33 3.08 -0.51 -1.03 114.38 119.60 3fai h ARG 248 Ca -0.03 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 59.86 3fai h ARG 248 Cb 1.30 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 31.13 3fai h ARG 248 CO 0.12 0.87 0.02 1.25 -1.07 0.00 0.00 179.97 181.17 3fai h LEU 249 N 1.16 0.06 -1.53 3.04 5.85 -0.65 -2.74 115.31 120.49 3fai h LEU 249 Ca 0.28 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.87 3fai h LEU 249 Cb 0.08 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 3fai h LEU 249 CO -0.04 0.20 0.34 0.11 -0.34 0.00 0.00 178.44 178.71 3fai h LYS 250 N -0.08 0.60 0.00 1.25 1.57 -0.88 -2.04 116.57 116.99 3fai h LYS 250 Ca 0.02 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3fai h LYS 250 Cb 0.16 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.33 3fai h LYS 250 CO -0.00 0.40 0.00 0.00 -0.57 0.00 0.00 179.45 179.28 3fai h ALA 251 N 1.69 1.00 0.00 3.86 0.00 -0.89 -1.62 119.26 123.30 3fai h ALA 251 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3fai h ALA 251 Cb 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3fai h ALA 251 CO -0.05 0.00 -0.04 0.52 0.00 0.00 0.00 179.25 179.68 3fai h MET 252 N 0.00 0.00 -6.29 0.00 2.86 -1.23 -3.47 114.93 106.80 3fai h MET 252 Ca 0.00 0.00 -0.47 0.00 -2.06 0.00 0.00 59.70 57.17 3fai h MET 252 Cb 0.44 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 3fai h MET 252 CO 0.00 0.04 -0.77 1.63 1.06 0.00 0.00 176.91 178.87 3fai n LYS 253 N -3.29 -5.38 -2.04 1.72 5.02 -0.61 -4.94 118.16 108.64 3fai n LYS 253 Ca -0.01 0.59 -0.41 0.00 -2.02 0.00 0.00 58.31 56.46 3fai n LYS 253 Cb 0.20 -5.43 -0.02 0.00 -0.02 0.00 0.00 35.03 29.76 3fai n LYS 253 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3fai s LEU 254 N -7.22 4.40 -0.19 -0.35 1.43 -1.26 -4.94 118.68 110.55 3fai s LEU 254 Ca 0.58 2.68 -0.29 0.00 -1.03 0.00 0.00 54.13 56.07 3fai s LEU 254 Cb -0.29 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.26 3fai s LEU 254 CO 0.83 -0.65 1.81 -2.84 0.23 0.00 0.00 176.35 175.73 3fai s PRO 255 N -0.88 3.67 -0.13 1.29 0.02 -1.26 -4.96 135.00 132.74 3fai s PRO 255 Ca 0.56 1.86 -0.00 0.00 0.02 0.00 0.00 61.00 63.44 3fai s PRO 255 Cb -0.41 -4.14 0.03 0.00 0.02 0.00 0.00 34.50 30.00 3fai s PRO 255 CO 0.47 -1.46 -0.07 0.42 -0.33 0.00 0.00 177.00 176.03 3fai s ILE 256 N 5.86 1.10 -0.15 2.83 1.01 -1.26 -4.61 121.20 125.97 3fai s ILE 256 Ca 0.81 -0.42 0.05 0.00 0.00 0.00 0.00 60.65 61.08 3fai s ILE 256 Cb -0.29 -1.15 -0.23 0.00 0.01 0.00 0.00 42.46 40.80 3fai s ILE 256 CO 0.33 0.30 0.22 0.29 0.00 0.00 0.00 174.94 176.08 3fai n LYS 257 N 4.91 0.69 -4.06 2.79 5.02 0.06 -4.67 118.16 122.90 3fai n LYS 257 Ca -0.13 0.19 -0.17 0.00 -2.02 0.00 0.00 58.31 56.18 3fai n LYS 257 Cb 0.49 -1.64 -0.15 0.00 -0.02 0.00 0.00 35.03 33.71 3fai n LYS 257 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3fai s THR 258 N -2.54 0.33 -0.11 -0.18 2.01 -0.91 -4.29 115.64 109.95 3fai s THR 258 Ca -0.19 -0.07 0.01 0.00 0.31 0.00 0.00 61.69 61.75 3fai s THR 258 Cb 0.07 -0.35 -0.02 0.00 0.01 0.00 0.00 72.50 72.22 3fai s THR 258 CO 0.75 0.15 -0.14 -0.69 -0.69 0.00 0.00 174.62 174.00 3fai s VAL 259 N 0.56 3.02 -0.32 3.82 1.01 0.13 -0.80 120.40 127.82 3fai s VAL 259 Ca -0.06 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.11 3fai s VAL 259 Cb -0.09 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 3fai s VAL 259 CO -0.01 0.54 0.21 -0.63 0.00 0.00 0.00 175.10 175.21 3fai s ILE 260 N 0.10 5.11 0.35 2.22 -1.09 0.16 -1.76 121.20 126.28 3fai s ILE 260 Ca -0.06 -0.21 -0.26 0.00 -2.23 0.00 0.00 60.65 57.89 3fai s ILE 260 Cb -0.15 -3.59 -0.09 0.00 -1.58 0.00 0.00 42.46 37.05 3fai s ILE 260 CO 0.05 0.05 1.04 -0.83 -1.23 0.00 0.00 174.94 174.01 3fai s GLY 261 N 1.70 2.84 0.00 6.18 0.00 -0.37 -1.67 107.32 116.00 3fai s GLY 261 Ca 0.06 0.71 0.28 0.00 0.00 0.00 0.00 44.72 45.77 3fai s GLY 261 CO 0.09 1.19 1.77 0.61 0.00 0.00 0.00 173.10 176.76 3fai n GLY 262 N 0.63 -0.85 3.39 0.20 0.00 -0.56 -4.51 105.19 103.48 3fai n GLY 262 Ca 0.03 -0.31 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 3fai n GLY 262 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fai s HIS 263 N -2.49 0.96 0.00 1.61 3.76 -1.26 -1.04 115.29 116.83 3fai s HIS 263 Ca 0.27 -1.19 0.00 0.00 -0.15 0.00 0.00 55.06 53.99 3fai s HIS 263 Cb 0.20 -0.25 0.00 0.00 1.11 0.00 0.00 32.58 33.64 3fai s HIS 263 CO 0.49 -0.87 0.00 -0.25 -0.85 0.00 0.00 174.74 173.26 3fai n ASP 264 N -0.66 -3.40 -4.71 1.40 8.00 -1.26 -4.40 116.55 111.52 3fai n ASP 264 Ca 0.01 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.09 3fai n ASP 264 Cb 0.63 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.71 3fai n ASP 264 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3fai s SER 265 N -4.00 6.92 0.13 -2.24 1.04 -1.26 -4.87 113.70 109.42 3fai s SER 265 Ca 0.00 2.16 -0.07 0.00 0.48 0.00 0.00 55.95 58.52 3fai s SER 265 Cb 0.00 -2.58 -0.07 0.00 0.10 0.00 0.00 66.02 63.47 3fai s SER 265 CO 0.00 -0.60 1.34 1.55 0.98 0.00 0.00 173.24 176.50 3fai h PRO 266 N 7.05 0.56 -6.01 4.02 0.13 -1.81 -3.42 132.00 132.52 3fai h PRO 266 Ca -0.41 -0.50 -0.60 0.00 -0.87 0.00 0.00 66.00 63.63 3fai h PRO 266 Cb 1.20 0.12 -0.09 0.00 0.13 0.00 0.00 31.00 32.36 3fai h PRO 266 CO 0.86 1.13 0.56 -0.51 -0.23 0.00 0.00 178.00 179.80 3fai s LEU 267 N -8.05 4.03 0.18 1.56 1.43 -1.26 -1.24 118.68 115.32 3fai s LEU 267 Ca -0.07 0.59 -0.00 0.00 -1.03 0.00 0.00 54.13 53.61 3fai s LEU 267 Cb 0.09 -3.22 -0.04 0.00 0.03 0.00 0.00 46.19 43.05 3fai s LEU 267 CO 0.88 -0.80 0.08 -1.00 0.23 0.00 0.00 176.35 175.73 3fai s HIS 289 N 3.35 1.10 0.06 0.29 3.76 -0.72 -5.02 115.29 118.12 3fai s HIS 289 Ca 0.37 -1.24 -0.00 0.00 -0.15 0.00 0.00 55.06 54.03 3fai s HIS 289 Cb -0.12 -0.60 0.01 0.00 1.11 0.00 0.00 32.58 32.98 3fai s HIS 289 CO 0.17 -0.49 0.09 0.41 -0.85 0.00 0.00 174.74 174.07 3fai n GLY 290 N -0.22 0.40 0.31 -2.22 0.00 -1.26 -0.69 105.19 101.50 3fai n GLY 290 Ca -0.02 -1.91 0.19 0.00 0.00 0.00 0.00 46.02 44.28 3fai n GLY 290 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3fai h PRO 291 N 0.00 0.00 -0.03 1.61 0.11 -1.83 -2.16 132.00 129.70 3fai h PRO 291 Ca -0.03 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.09 3fai h PRO 291 Cb 0.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.21 3fai h PRO 291 CO 0.03 0.02 0.21 1.05 -0.21 0.00 0.00 178.00 179.10 3fai h GLU 292 N 0.00 0.00 -0.25 1.05 9.09 -1.96 -1.88 114.58 120.63 3fai h GLU 292 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3fai h GLU 292 Cb 0.21 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.30 3fai h GLU 292 CO 0.00 0.00 0.16 1.25 0.05 0.00 0.00 179.01 180.47 3fai h LEU 293 N 0.00 0.29 -0.19 3.06 5.85 -1.76 0.99 115.31 123.54 3fai h LEU 293 Ca 0.02 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 3fai h LEU 293 Cb 0.43 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 3fai h LEU 293 CO -0.00 0.22 0.08 0.40 -0.34 0.00 0.00 178.44 178.80 3fai h ILE 294 N 0.34 1.15 -0.29 4.05 2.04 -1.59 -1.26 117.51 121.94 3fai h ILE 294 Ca 0.09 -0.44 -0.09 0.00 1.00 0.00 0.00 64.86 65.42 3fai h ILE 294 Cb -0.03 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3fai h ILE 294 CO -0.02 0.14 -0.20 0.44 0.00 0.00 0.00 178.15 178.52 3fai h ASP 295 N 0.17 0.54 0.22 1.72 3.32 -1.50 -0.31 116.42 120.57 3fai h ASP 295 Ca 0.06 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 3fai h ASP 295 Cb 0.15 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3fai h ASP 295 CO -0.01 0.75 -0.11 -0.74 -1.72 0.00 0.00 179.24 177.41 3fai h HIS 296 N 0.49 -0.28 -0.24 4.55 2.76 -0.63 -1.60 115.15 120.20 3fai h HIS 296 Ca 0.08 -0.01 -0.14 0.00 -2.20 0.00 0.00 60.37 58.11 3fai h HIS 296 Cb 0.62 0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.66 3fai h HIS 296 CO 0.02 -0.12 -0.41 -0.92 -1.30 0.00 0.00 177.93 175.20 3fai h TYR 297 N -0.36 0.69 -0.52 5.26 3.20 -1.10 -2.29 116.97 121.85 3fai h TYR 297 Ca -0.03 -0.20 0.06 0.00 3.14 0.00 0.00 58.73 61.70 3fai h TYR 297 Cb 0.28 -0.15 -0.06 0.00 1.54 0.00 0.00 36.73 38.35 3fai h TYR 297 CO -0.04 0.90 0.21 1.49 -1.64 0.00 0.00 178.16 179.08 3fai h GLU 298 N 0.47 0.40 -0.74 1.82 4.81 -0.92 -0.16 114.58 120.26 3fai h GLU 298 Ca 0.04 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 3fai h GLU 298 Cb 0.92 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.18 3fai h GLU 298 CO 0.08 0.27 0.24 0.00 -0.73 0.00 0.00 179.01 178.87 3fai h ALA 299 N 1.33 1.04 -0.05 2.92 0.00 -1.10 -1.97 119.26 121.43 3fai h ALA 299 Ca 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3fai h ALA 299 Cb 0.24 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 3fai h ALA 299 CO -0.23 0.65 0.03 -0.07 0.00 0.00 0.00 179.25 179.64 3fai h LEU 300 N 1.09 0.06 -1.11 0.00 3.38 -0.75 -2.89 115.31 115.08 3fai h LEU 300 Ca 0.24 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.13 3fai h LEU 300 Cb 0.28 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3fai h LEU 300 CO -0.01 0.04 -0.37 -0.29 0.09 0.00 0.00 178.44 177.91 3fai h ILE 301 N 0.06 0.98 0.00 1.22 6.09 -0.97 -2.36 117.51 122.53 3fai h ILE 301 Ca 0.02 -1.41 -0.01 0.00 -1.37 0.00 0.00 64.86 62.09 3fai h ILE 301 Cb -0.00 1.83 -0.00 0.00 0.47 0.00 0.00 36.82 39.11 3fai h ILE 301 CO -0.00 0.36 -0.03 0.11 -3.07 0.00 0.00 178.15 175.52 3fai h LYS 302 N 0.00 0.00 -0.00 2.19 1.57 -1.26 -2.46 116.57 116.61 3fai h LYS 302 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3fai h LYS 302 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.11 3fai h LYS 302 CO 0.05 0.03 -0.44 0.00 -0.57 0.00 0.00 179.45 178.51 3fai n ALA 303 N -2.11 3.42 -1.40 3.86 0.00 -0.91 -4.83 120.51 118.55 3fai n ALA 303 Ca 0.02 -0.33 -0.30 0.00 0.00 0.00 0.00 53.44 52.83 3fai n ALA 303 Cb 0.39 -1.15 0.12 0.00 0.00 0.00 0.00 19.45 18.80 3fai n ALA 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fai s ALA 304 N -2.98 1.85 0.37 0.00 0.00 -0.93 -4.94 121.76 115.12 3fai s ALA 304 Ca 0.12 -0.20 -0.28 0.00 0.00 0.00 0.00 51.96 51.60 3fai s ALA 304 Cb 0.18 -3.13 -0.11 0.00 0.00 0.00 0.00 23.12 20.06 3fai s ALA 304 CO 0.68 -2.10 1.44 -2.14 0.00 0.00 0.00 175.76 173.64 3fai s PRO 305 N -5.07 4.17 -0.03 0.00 0.02 -1.26 -2.80 135.00 130.03 3fai s PRO 305 Ca 0.62 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.12 3fai s PRO 305 Cb -0.16 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.37 3fai s PRO 305 CO 0.55 -0.45 0.00 0.00 -0.33 0.00 0.00 177.00 176.78 3fai n GLN 306 N 0.54 -0.11 0.00 5.54 -0.00 -1.26 -4.97 117.38 117.12 3fai n GLN 306 Ca 0.01 0.14 0.16 0.00 -0.00 0.00 0.00 57.00 57.30 3fai n GLN 306 Cb 0.40 -3.32 0.92 0.00 -0.00 0.00 0.00 30.24 28.24 3fai n GLN 306 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49