#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f9o h GLY 42 N 0.00 1.16 -5.09 0.00 0.00 -1.97 -3.44 103.07 93.73 3f9o h GLY 42 Ca 0.00 -0.51 -0.18 0.00 0.00 0.00 0.00 47.33 46.64 3f9o h GLY 42 CO 0.00 0.49 -0.60 -0.29 0.00 0.00 0.00 176.54 176.14 3f9o s MET 43 N -5.74 0.29 0.07 4.80 -2.45 -1.26 -1.50 119.30 113.51 3f9o s MET 43 Ca -0.12 -0.27 0.04 0.00 -1.25 0.00 0.00 55.69 54.10 3f9o s MET 43 Cb 0.17 0.12 -0.03 0.00 1.25 0.00 0.00 34.83 36.34 3f9o s MET 43 CO 0.81 -0.06 -0.12 -1.54 1.05 0.00 0.00 175.02 175.16 3f9o s SER 44 N -0.88 1.46 -0.15 1.11 1.04 -0.67 -5.00 113.70 110.61 3f9o s SER 44 Ca -0.10 -0.62 -0.00 0.00 0.48 0.00 0.00 55.95 55.70 3f9o s SER 44 Cb -0.06 -0.02 0.04 0.00 0.10 0.00 0.00 66.02 66.08 3f9o s SER 44 CO 0.00 -0.13 -0.06 -0.22 0.98 0.00 0.00 173.24 173.81 3f9o s LEU 45 N -1.79 1.49 -0.02 2.42 2.96 -1.26 -1.50 118.68 120.99 3f9o s LEU 45 Ca -0.03 -0.55 0.01 0.00 -0.22 0.00 0.00 54.13 53.34 3f9o s LEU 45 Cb -0.09 -0.90 0.01 0.00 0.50 0.00 0.00 46.19 45.71 3f9o s LEU 45 CO 0.02 -0.16 -0.01 -0.89 -1.32 0.00 0.00 176.35 173.99 3f9o s THR 46 N 1.65 0.16 0.09 3.68 2.01 -0.35 -4.97 115.64 117.91 3f9o s THR 46 Ca 0.02 0.01 -0.31 0.00 0.31 0.00 0.00 61.69 61.73 3f9o s THR 46 Cb -0.14 -0.21 -0.08 0.00 0.01 0.00 0.00 72.50 72.07 3f9o s THR 46 CO -0.08 0.10 1.57 -1.58 -0.69 0.00 0.00 174.62 173.94 3f9o s GLN 47 N 0.55 4.22 -0.23 4.92 0.74 -1.26 -0.28 119.66 128.32 3f9o s GLN 47 Ca -0.05 2.27 -0.17 0.00 0.05 0.00 0.00 55.36 57.46 3f9o s GLN 47 Cb -0.08 -3.45 -0.13 0.00 1.10 0.00 0.00 33.01 30.45 3f9o s GLN 47 CO -0.01 -0.65 -0.14 0.28 -0.55 0.00 0.00 175.29 174.22 3f9o n VAL 48 N 4.46 1.52 -3.65 1.34 0.31 -0.02 -4.88 118.33 117.41 3f9o n VAL 48 Ca 0.15 -0.14 -0.02 0.00 -0.01 0.00 0.00 64.34 64.32 3f9o n VAL 48 Cb 0.41 -2.04 -0.05 0.00 -0.91 0.00 0.00 33.84 31.25 3f9o n VAL 48 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3f9o s SER 49 N -6.92 -1.07 1.05 4.52 0.15 -0.82 -5.04 113.70 105.58 3f9o s SER 49 Ca -0.32 1.53 0.00 0.00 0.70 0.00 0.00 55.95 57.86 3f9o s SER 49 Cb 0.09 2.17 0.00 0.00 -1.71 0.00 0.00 66.02 66.57 3f9o s SER 49 CO 0.49 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.32 3f9o n GLY 50 N 5.36 3.29 0.09 9.45 0.00 -1.26 -0.40 105.19 121.73 3f9o n GLY 50 Ca -0.12 0.21 0.09 0.00 0.00 0.00 0.00 46.02 46.19 3f9o n GLY 50 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3f9o n PRO 51 N 14.00 1.12 -3.59 1.61 -0.04 -1.26 -4.80 135.00 142.04 3f9o n PRO 51 Ca 0.00 -0.18 -0.38 0.00 -0.04 0.00 0.00 63.50 62.91 3f9o n PRO 51 Cb 0.00 -1.30 -0.10 0.00 -0.04 0.00 0.00 33.50 32.06 3f9o n PRO 51 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3f9o s VAL 52 N -1.97 5.31 0.11 0.52 1.01 0.47 -1.35 120.40 124.51 3f9o s VAL 52 Ca 0.28 0.21 0.09 0.00 0.00 0.00 0.00 61.98 62.56 3f9o s VAL 52 Cb 0.13 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 3f9o s VAL 52 CO 0.22 0.27 -0.24 -0.31 0.00 0.00 0.00 175.10 175.04 3f9o s TYR 53 N 1.58 2.06 -0.10 5.22 1.51 0.15 -0.84 117.35 126.93 3f9o s TYR 53 Ca 0.08 -0.40 -0.02 0.00 -1.01 0.00 0.00 57.07 55.72 3f9o s TYR 53 Cb -0.15 -1.14 -0.03 0.00 -0.11 0.00 0.00 41.96 40.53 3f9o s TYR 53 CO 0.09 0.25 -0.00 0.54 -1.11 0.00 0.00 175.55 175.32 3f9o s VAL 54 N -1.06 4.28 -0.24 0.71 0.11 0.62 -1.28 120.40 123.54 3f9o s VAL 54 Ca 0.10 -0.25 -0.08 0.00 -2.93 0.00 0.00 61.98 58.82 3f9o s VAL 54 Cb -0.10 -2.81 -0.03 0.00 -1.53 0.00 0.00 36.38 31.91 3f9o s VAL 54 CO 0.05 0.58 0.08 -0.69 -3.33 0.00 0.00 175.10 171.79 3f9o s VAL 55 N -0.67 4.46 -0.40 2.04 1.01 0.12 -1.21 120.40 125.75 3f9o s VAL 55 Ca 0.11 -0.12 -0.13 0.00 0.00 0.00 0.00 61.98 61.84 3f9o s VAL 55 Cb -0.12 -3.08 0.03 0.00 0.00 0.00 0.00 36.38 33.22 3f9o s VAL 55 CO 0.02 0.35 0.26 -0.70 0.00 0.00 0.00 175.10 175.03 3f9o s GLU 56 N 1.40 2.87 -0.47 2.72 2.12 -0.56 -0.88 118.70 125.90 3f9o s GLU 56 Ca 0.05 -1.11 -0.12 0.00 0.36 0.00 0.00 54.97 54.15 3f9o s GLU 56 Cb -0.15 -3.86 0.09 0.00 0.26 0.00 0.00 34.13 30.48 3f9o s GLU 56 CO 0.04 -0.76 0.36 0.34 -0.54 0.00 0.00 175.26 174.70 3f9o s ASP 57 N 1.71 5.90 0.00 -1.70 2.15 0.07 -1.66 116.67 123.14 3f9o s ASP 57 Ca 0.03 -1.59 0.17 0.00 0.43 0.00 0.00 52.55 51.60 3f9o s ASP 57 Cb -0.20 -2.09 0.63 0.00 -0.30 0.00 0.00 42.92 40.97 3f9o s ASP 57 CO 0.08 -0.66 1.46 0.59 -0.17 0.00 0.00 175.17 176.47 3f9o n ASN 58 N 5.06 1.50 -4.77 -0.34 3.02 -0.56 -1.26 115.26 117.91 3f9o n ASN 58 Ca -0.11 -1.77 -0.38 0.00 -0.03 0.00 0.00 54.58 52.28 3f9o n ASN 58 Cb 0.42 -0.13 -0.01 0.00 -0.61 0.00 0.00 39.78 39.46 3f9o n ASN 58 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3f9o s TYR 59 N -1.75 2.87 0.00 3.10 2.02 -1.26 -4.59 117.35 117.76 3f9o s TYR 59 Ca 0.28 1.48 0.00 0.00 -0.37 0.00 0.00 57.07 58.46 3f9o s TYR 59 Cb 0.15 -3.53 0.00 0.00 -0.40 0.00 0.00 41.96 38.18 3f9o s TYR 59 CO 0.22 -1.77 0.00 0.66 -1.57 0.00 0.00 175.55 173.09 3f9o n TYR 60 N -0.11 0.00 -3.14 2.71 4.01 -1.26 -3.93 117.16 115.43 3f9o n TYR 60 Ca 0.05 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.40 3f9o n TYR 60 Cb 0.46 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.43 3f9o n TYR 60 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3f9o s VAL 67 N 0.00 5.05 0.09 -0.72 1.01 -1.26 -5.00 120.40 119.57 3f9o s VAL 67 Ca 0.00 1.18 -0.36 0.00 0.00 0.00 0.00 61.98 62.80 3f9o s VAL 67 Cb 0.00 -3.93 -0.15 0.00 0.00 0.00 0.00 36.38 32.29 3f9o s VAL 67 CO 0.00 0.16 1.48 1.67 0.00 0.00 0.00 175.10 178.41 3f9o n GLN 68 N 4.67 1.60 -4.48 2.72 7.27 -1.25 -4.93 117.38 122.98 3f9o n GLN 68 Ca -0.02 0.58 -0.23 0.00 0.07 0.00 0.00 57.00 57.40 3f9o n GLN 68 Cb 0.50 -2.28 -0.14 0.00 2.41 0.00 0.00 30.24 30.73 3f9o n GLN 68 CO 0.00 0.00 0.00 -1.83 0.07 0.00 0.00 177.06 175.30 3f9o s GLU 69 N 0.93 1.17 -0.12 3.69 4.04 -0.39 -4.28 118.70 123.74 3f9o s GLU 69 Ca 0.83 -0.90 -0.00 0.00 0.04 0.00 0.00 54.97 54.94 3f9o s GLU 69 Cb -0.84 -1.26 -0.02 0.00 0.02 0.00 0.00 34.13 32.03 3f9o s GLU 69 CO 0.44 0.31 -0.10 -0.80 -1.84 0.00 0.00 175.26 173.28 3f9o s ASN 70 N -1.26 4.33 0.30 0.83 0.01 0.11 -0.75 114.94 118.52 3f9o s ASN 70 Ca 0.05 -0.21 0.01 0.00 -0.71 0.00 0.00 52.86 52.01 3f9o s ASN 70 Cb -0.09 -1.49 -0.01 0.00 0.41 0.00 0.00 41.25 40.08 3f9o s ASN 70 CO 0.02 0.22 0.05 -1.20 -1.51 0.00 0.00 177.10 174.68 3f9o n SER 71 N 3.16 1.95 -4.19 -1.22 7.64 -0.06 -4.59 113.62 116.30 3f9o n SER 71 Ca -0.18 -2.47 -0.11 0.00 1.01 0.00 0.00 58.87 57.12 3f9o n SER 71 Cb 0.53 0.49 -0.10 0.00 -1.01 0.00 0.00 64.21 64.11 3f9o n SER 71 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 3f9o s MET 72 N -3.12 1.00 -0.01 1.43 -1.94 -0.33 0.12 119.30 116.44 3f9o s MET 72 Ca 0.08 -1.48 -0.01 0.00 -1.71 0.00 0.00 55.69 52.57 3f9o s MET 72 Cb 0.00 0.02 0.01 0.00 2.01 0.00 0.00 34.83 36.88 3f9o s MET 72 CO 0.05 -0.20 0.03 0.08 -0.01 0.00 0.00 175.02 174.97 3f9o s VAL 73 N -3.88 -0.02 -0.17 -6.03 1.01 -0.40 -0.66 120.40 110.25 3f9o s VAL 73 Ca 0.24 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.30 3f9o s VAL 73 Cb 0.07 -0.06 0.02 0.00 0.00 0.00 0.00 36.38 36.41 3f9o s VAL 73 CO 0.02 0.03 -0.20 -0.47 0.00 0.00 0.00 175.10 174.49 3f9o s TYR 74 N 0.38 2.76 -0.57 5.22 5.04 0.26 -0.67 117.35 129.78 3f9o s TYR 74 Ca -0.03 -1.54 -0.19 0.00 -2.44 0.00 0.00 57.07 52.86 3f9o s TYR 74 Cb -0.04 -1.90 0.09 0.00 0.35 0.00 0.00 41.96 40.45 3f9o s TYR 74 CO -0.01 -0.75 0.70 -0.06 -1.34 0.00 0.00 175.55 174.09 3f9o s PHE 75 N 1.19 2.99 0.58 4.97 0.08 -0.45 -1.12 117.98 126.21 3f9o s PHE 75 Ca 0.02 -0.78 0.10 0.00 0.12 0.00 0.00 56.93 56.39 3f9o s PHE 75 Cb -0.14 -3.88 0.10 0.00 -0.57 0.00 0.00 43.02 38.53 3f9o s PHE 75 CO -0.10 -1.24 0.79 0.41 -0.10 0.00 0.00 175.22 174.99 3f9o n GLY 76 N 5.25 1.98 0.16 4.36 0.00 0.36 -4.76 105.19 112.53 3f9o n GLY 76 Ca -0.08 -2.23 -0.10 0.00 0.00 0.00 0.00 46.02 43.62 3f9o n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f9o h ALA 77 N 0.13 0.42 0.00 4.61 0.00 -1.96 -3.12 119.26 119.33 3f9o h ALA 77 Ca -0.27 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 3f9o h ALA 77 Cb 1.25 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 3f9o h ALA 77 CO 0.39 -0.00 -1.10 1.63 0.00 0.00 0.00 179.25 180.17 3f9o n LYS 78 N -4.74 0.61 -3.38 0.00 5.02 -1.26 -5.05 118.16 109.36 3f9o n LYS 78 Ca -0.02 0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 3f9o n LYS 78 Cb 0.12 -1.81 0.00 0.00 -0.02 0.00 0.00 35.03 33.32 3f9o n LYS 78 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3f9o n GLY 79 N 1.20 -0.50 3.59 0.72 0.00 -1.18 -4.39 105.19 104.63 3f9o n GLY 79 Ca -0.01 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 44.63 3f9o n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f9o s VAL 80 N -3.14 4.19 -0.19 1.61 1.01 -0.11 -0.49 120.40 123.27 3f9o s VAL 80 Ca 0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 61.98 61.67 3f9o s VAL 80 Cb 0.00 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 3f9o s VAL 80 CO 0.00 0.53 -0.01 -0.89 0.00 0.00 0.00 175.10 174.73 3f9o s THR 81 N -0.12 3.88 -0.14 3.92 2.01 -0.27 -0.55 115.64 124.37 3f9o s THR 81 Ca 0.04 -0.34 -0.10 0.00 0.31 0.00 0.00 61.69 61.59 3f9o s THR 81 Cb -0.13 -2.74 -0.05 0.00 0.01 0.00 0.00 72.50 69.59 3f9o s THR 81 CO 0.02 0.44 0.20 -0.69 -0.69 0.00 0.00 174.62 173.90 3f9o s VAL 82 N 0.92 5.38 -0.32 3.82 1.01 -0.15 -0.57 120.40 130.49 3f9o s VAL 82 Ca 0.01 0.34 -0.02 0.00 0.00 0.00 0.00 61.98 62.32 3f9o s VAL 82 Cb -0.14 -3.50 0.06 0.00 0.00 0.00 0.00 36.38 32.79 3f9o s VAL 82 CO 0.02 0.51 0.03 -0.69 0.00 0.00 0.00 175.10 174.97 3f9o s VAL 83 N -0.31 3.00 0.00 2.92 1.01 0.17 -0.67 120.40 126.53 3f9o s VAL 83 Ca 0.14 -1.53 0.00 0.00 0.00 0.00 0.00 61.98 60.60 3f9o s VAL 83 Cb -0.12 -2.80 0.00 0.00 0.00 0.00 0.00 36.38 33.46 3f9o s VAL 83 CO 0.03 -0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.53 3f9o n GLY 84 N 4.60 -0.20 0.00 4.51 0.00 -0.29 -1.19 105.19 112.62 3f9o n GLY 84 Ca -0.11 -1.00 0.11 0.00 0.00 0.00 0.00 46.02 45.02 3f9o n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f9o n ALA 85 N 2.11 2.19 -0.66 4.61 0.00 -0.39 -4.76 120.51 123.60 3f9o n ALA 85 Ca 0.00 -0.11 0.09 0.00 0.00 0.00 0.00 53.44 53.42 3f9o n ALA 85 Cb 0.00 -1.38 -0.03 0.00 0.00 0.00 0.00 19.45 18.04 3f9o n ALA 85 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3f9o n THR 86 N -1.31 0.00 -0.22 0.00 -2.24 -1.25 -3.55 114.28 105.72 3f9o n THR 86 Ca 0.11 0.20 -0.07 0.00 -2.27 0.00 0.00 64.05 62.01 3f9o n THR 86 Cb 0.20 -0.42 0.03 0.00 -2.10 0.00 0.00 70.33 68.04 3f9o n THR 86 CO 0.00 0.00 0.00 -0.50 -0.57 0.00 0.00 175.07 174.00 3f9o h TRP 87 N -0.63 0.91 -4.19 4.78 4.06 -1.75 -0.44 115.95 118.69 3f9o h TRP 87 Ca -0.03 -0.06 -0.15 0.00 2.06 0.00 0.00 58.89 60.71 3f9o h TRP 87 Cb 0.62 -0.28 -0.14 0.00 -1.00 0.00 0.00 29.16 28.37 3f9o h TRP 87 CO -0.20 0.70 -0.48 0.95 -3.56 0.00 0.00 178.44 175.86 3f9o s THR 88 N -5.64 0.06 0.42 1.49 -4.23 -1.26 -3.98 115.64 102.51 3f9o s THR 88 Ca -0.13 -1.69 0.13 0.00 -1.18 0.00 0.00 61.69 58.82 3f9o s THR 88 Cb 0.13 -2.06 0.33 0.00 1.34 0.00 0.00 72.50 72.24 3f9o s THR 88 CO 0.79 -0.28 1.97 -0.65 -0.54 0.00 0.00 174.62 175.90 3f9o h PRO 89 N 2.65 0.45 -0.12 3.99 0.11 -1.76 -0.35 132.00 136.97 3f9o h PRO 89 Ca -0.33 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 3f9o h PRO 89 Cb 1.22 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3f9o h PRO 89 CO 0.52 0.30 0.04 -0.44 -0.21 0.00 0.00 178.00 178.20 3f9o h ASP 90 N 0.46 0.17 -0.09 -2.05 5.19 -1.93 -1.10 116.42 117.06 3f9o h ASP 90 Ca 0.30 -0.19 -0.08 0.00 -0.62 0.00 0.00 57.03 56.44 3f9o h ASP 90 Cb 0.55 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.00 3f9o h ASP 90 CO -0.09 0.31 -0.18 0.71 -3.12 0.00 0.00 179.24 176.88 3f9o h THR 91 N 0.01 1.24 -0.39 0.35 1.35 -1.83 -1.44 112.91 112.21 3f9o h THR 91 Ca 0.04 -1.11 -0.01 0.00 -0.55 0.00 0.00 66.41 64.78 3f9o h THR 91 Cb 0.20 1.23 -0.02 0.00 -1.73 0.00 0.00 68.15 67.84 3f9o h THR 91 CO -0.00 0.36 0.20 0.00 -0.25 0.00 0.00 175.52 175.82 3f9o h ALA 92 N 1.39 0.50 -0.82 6.62 0.00 -0.92 -0.58 119.26 125.44 3f9o h ALA 92 Ca 0.07 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.92 3f9o h ALA 92 Cb 0.56 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 3f9o h ALA 92 CO 0.04 0.04 0.52 -0.09 0.00 0.00 0.00 179.25 179.76 3f9o h ARG 93 N 0.49 0.99 -0.61 0.00 2.43 -0.85 0.11 114.38 116.93 3f9o h ARG 93 Ca 0.13 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 3f9o h ARG 93 Cb 0.09 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 3f9o h ARG 93 CO -0.02 0.65 0.36 0.93 -1.51 0.00 0.00 179.97 180.38 3f9o h GLU 94 N 1.02 0.84 -0.62 0.20 4.39 -0.88 -0.76 114.58 118.77 3f9o h GLU 94 Ca 0.33 -0.08 -0.03 0.00 0.34 0.00 0.00 59.36 59.91 3f9o h GLU 94 Cb 0.02 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.47 3f9o h GLU 94 CO -0.12 0.61 0.26 1.25 -1.16 0.00 0.00 179.01 179.86 3f9o h LEU 95 N 0.83 0.84 -1.27 1.33 5.85 -0.44 -2.63 115.31 119.83 3f9o h LEU 95 Ca 0.22 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3f9o h LEU 95 Cb -0.00 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 3f9o h LEU 95 CO -0.04 0.77 0.36 -0.74 -0.34 0.00 0.00 178.44 178.46 3f9o h HIS 96 N 0.86 0.84 -0.76 1.25 2.76 -0.34 -0.86 115.15 118.90 3f9o h HIS 96 Ca 0.21 -0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.33 3f9o h HIS 96 Cb 0.18 -0.28 -0.03 0.00 1.55 0.00 0.00 27.41 28.83 3f9o h HIS 96 CO 0.01 0.58 0.29 0.87 -1.30 0.00 0.00 177.93 178.37 3f9o h LYS 97 N 0.88 1.15 -0.64 5.26 1.57 -0.82 -1.08 116.57 122.89 3f9o h LYS 97 Ca 0.23 -0.22 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 3f9o h LYS 97 Cb -0.00 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.10 3f9o h LYS 97 CO -0.04 0.95 0.19 -0.07 -0.57 0.00 0.00 179.45 179.90 3f9o h LEU 98 N 1.11 0.95 -0.57 2.94 3.38 -1.05 -3.05 115.31 119.01 3f9o h LEU 98 Ca 0.25 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3f9o h LEU 98 Cb 0.24 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 3f9o h LEU 98 CO -0.02 0.91 0.35 0.40 0.09 0.00 0.00 178.44 180.18 3f9o h ILE 99 N 0.93 1.17 0.00 1.22 2.04 -0.68 -2.69 117.51 119.50 3f9o h ILE 99 Ca 0.21 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 3f9o h ILE 99 Cb 0.32 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 36.77 3f9o h ILE 99 CO -0.00 0.17 -0.06 0.11 0.00 0.00 0.00 178.15 178.36 3f9o h LYS 100 N 0.77 0.00 0.00 2.37 1.57 -1.16 -0.01 116.57 120.11 3f9o h LYS 100 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3f9o h LYS 100 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.29 3f9o h LYS 100 CO -0.04 0.06 0.00 0.00 -0.57 0.00 0.00 179.45 178.90 3f9o h ARG 102 N 0.00 0.00 0.00 3.15 3.08 -1.37 -3.36 114.38 115.88 3f9o h ARG 102 Ca -0.00 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.71 3f9o h ARG 102 Cb 0.28 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.27 3f9o h ARG 102 CO 0.01 0.00 -2.27 0.28 -1.07 0.00 0.00 179.97 176.92 3f9o n VAL 103 N -2.69 1.27 -3.83 2.04 0.31 -0.41 -5.03 118.33 109.99 3f9o n VAL 103 Ca 0.04 -0.60 -0.12 0.00 -0.01 0.00 0.00 64.34 63.65 3f9o n VAL 103 Cb 0.46 -0.99 -0.12 0.00 -0.91 0.00 0.00 33.84 32.27 3f9o n VAL 103 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3f9o s SER 104 N -5.80 -0.11 0.00 4.52 0.15 -0.15 -5.02 113.70 107.29 3f9o s SER 104 Ca -0.22 0.16 0.26 0.00 0.70 0.00 0.00 55.95 56.86 3f9o s SER 104 Cb 0.07 0.29 0.78 0.00 -1.71 0.00 0.00 66.02 65.44 3f9o s SER 104 CO 0.61 -0.14 1.59 -2.11 1.20 0.00 0.00 173.24 174.39 3f9o n ARG 105 N 2.56 0.26 -2.13 5.44 1.85 -1.26 -4.20 116.66 119.18 3f9o n ARG 105 Ca -0.15 -0.13 -0.34 0.00 -1.00 0.00 0.00 57.85 56.23 3f9o n ARG 105 Cb 0.58 -1.50 0.01 0.00 -1.05 0.00 0.00 32.46 30.50 3f9o n ARG 105 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3f9o s LYS 106 N -2.83 3.31 0.54 2.89 1.02 -1.26 -4.99 119.74 118.42 3f9o s LYS 106 Ca 0.17 1.36 -0.20 0.00 0.02 0.00 0.00 55.97 57.32 3f9o s LYS 106 Cb 0.18 -2.02 -0.06 0.00 -0.52 0.00 0.00 37.83 35.41 3f9o s LYS 106 CO 0.61 -0.84 1.12 -1.25 -0.92 0.00 0.00 175.35 174.07 3f9o s PRO 108 N -3.74 3.39 -0.39 -1.68 0.04 -1.26 -4.68 135.00 126.68 3f9o s PRO 108 Ca 0.67 1.59 -0.29 0.00 0.04 0.00 0.00 61.00 63.01 3f9o s PRO 108 Cb -0.19 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.35 3f9o s PRO 108 CO 0.32 -0.81 1.38 0.08 0.04 0.00 0.00 177.00 178.01 3f9o s VAL 109 N -1.79 3.96 0.01 -0.36 1.01 -1.26 -0.94 120.40 121.04 3f9o s VAL 109 Ca 0.72 1.01 -0.17 0.00 0.00 0.00 0.00 61.98 63.55 3f9o s VAL 109 Cb -0.23 -4.20 -0.35 0.00 0.00 0.00 0.00 36.38 31.60 3f9o s VAL 109 CO 0.26 -0.69 0.96 -0.07 0.00 0.00 0.00 175.10 175.55 3f9o h LEU 110 N 11.86 0.78 -7.00 3.92 3.38 -1.17 -3.39 115.31 123.69 3f9o h LEU 110 Ca -0.27 -0.93 0.03 0.00 0.09 0.00 0.00 57.88 56.80 3f9o h LEU 110 Cb 1.10 -0.25 -0.18 0.00 0.09 0.00 0.00 40.66 41.42 3f9o h LEU 110 CO 1.07 1.67 0.38 -1.83 0.09 0.00 0.00 178.44 179.82 3f9o s GLU 111 N -2.57 0.89 -0.06 1.13 -1.05 -1.21 -1.41 118.70 114.41 3f9o s GLU 111 Ca -0.10 -0.01 0.02 0.00 -0.15 0.00 0.00 54.97 54.73 3f9o s GLU 111 Cb 0.04 0.42 0.01 0.00 -0.44 0.00 0.00 34.13 34.15 3f9o s GLU 111 CO 0.92 -0.32 -0.11 0.08 0.95 0.00 0.00 175.26 176.77 3f9o s VAL 112 N -1.98 1.07 -0.23 1.83 1.01 0.55 -0.98 120.40 121.66 3f9o s VAL 112 Ca -0.03 -0.45 -0.14 0.00 0.00 0.00 0.00 61.98 61.37 3f9o s VAL 112 Cb -0.01 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 3f9o s VAL 112 CO -0.00 0.34 0.31 -0.63 0.00 0.00 0.00 175.10 175.11 3f9o s ILE 113 N 0.62 5.25 -0.63 2.22 1.01 0.16 0.35 121.20 130.18 3f9o s ILE 113 Ca -0.13 0.50 -0.25 0.00 0.00 0.00 0.00 60.65 60.77 3f9o s ILE 113 Cb -0.15 -3.64 0.04 0.00 0.01 0.00 0.00 42.46 38.72 3f9o s ILE 113 CO 0.03 0.27 1.07 0.20 0.00 0.00 0.00 174.94 176.50 3f9o s ASN 114 N 1.17 6.27 0.25 3.58 0.01 0.78 -1.14 114.94 125.85 3f9o s ASN 114 Ca 0.14 -0.48 0.26 0.00 -0.71 0.00 0.00 52.86 52.07 3f9o s ASN 114 Cb -0.15 -2.48 0.85 0.00 0.41 0.00 0.00 41.25 39.88 3f9o s ASN 114 CO 0.07 -1.47 1.76 0.71 -1.51 0.00 0.00 177.10 176.66 3f9o h THR 115 N 6.03 0.00 -3.21 1.60 1.35 -1.85 -3.43 112.91 113.40 3f9o h THR 115 Ca -0.27 -0.44 -0.14 0.00 -0.55 0.00 0.00 66.41 65.00 3f9o h THR 115 Cb 1.06 1.37 -0.03 0.00 -1.73 0.00 0.00 68.15 68.83 3f9o h THR 115 CO 1.17 0.00 -0.01 -0.46 -0.25 0.00 0.00 175.52 175.98 3f9o n ASN 116 N -2.33 -1.19 -0.50 5.36 0.23 -1.26 -1.58 115.26 113.99 3f9o n ASN 116 Ca 0.04 -2.29 0.12 0.00 -0.53 0.00 0.00 54.58 51.93 3f9o n ASN 116 Cb 0.38 2.12 0.46 0.00 -2.08 0.00 0.00 39.78 40.66 3f9o n ASN 116 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3f9o n TYR 117 N -0.40 0.10 -1.60 -2.53 0.18 -1.26 -4.48 117.16 107.17 3f9o n TYR 117 Ca -0.02 -0.05 -0.30 0.00 1.88 0.00 0.00 57.90 59.41 3f9o n TYR 117 Cb 0.42 0.00 0.07 0.00 -0.38 0.00 0.00 39.34 39.45 3f9o n TYR 117 CO 0.00 0.00 0.00 -1.01 -2.08 0.00 0.00 176.86 173.77 3f9o s HIS 118 N -1.90 3.00 0.31 -3.48 3.76 -1.26 -4.78 115.29 110.94 3f9o s HIS 118 Ca 0.35 1.25 0.01 0.00 -0.15 0.00 0.00 55.06 56.52 3f9o s HIS 118 Cb 0.19 -3.02 0.54 0.00 1.11 0.00 0.00 32.58 31.41 3f9o s HIS 118 CO 0.30 -1.49 1.92 1.79 -0.85 0.00 0.00 174.74 176.40 3f9o h THR 119 N -0.89 1.07 0.00 1.30 1.35 -1.92 -0.03 112.91 113.78 3f9o h THR 119 Ca -0.46 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 3f9o h THR 119 Cb 1.24 -0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.63 3f9o h THR 119 CO 0.59 0.18 0.00 -2.24 -0.25 0.00 0.00 175.52 173.80 3f9o h ASP 120 N 1.01 0.00 0.00 5.36 2.03 -1.85 0.11 116.42 123.08 3f9o h ASP 120 Ca 0.38 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.68 3f9o h ASP 120 Cb 0.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.68 3f9o h ASP 120 CO -0.14 0.00 -0.91 0.54 -1.03 0.00 0.00 179.24 177.70 3f9o n ARG 121 N -2.62 2.09 0.00 4.15 5.12 -0.85 -3.74 116.66 120.81 3f9o n ARG 121 Ca 0.02 -0.04 0.00 0.00 -1.93 0.00 0.00 57.85 55.90 3f9o n ARG 121 Cb 0.30 -1.16 0.00 0.00 -1.16 0.00 0.00 32.46 30.44 3f9o n ARG 121 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3f9o n ALA 122 N -1.50 0.91 0.25 7.54 0.00 -0.08 -1.27 120.51 126.35 3f9o n ALA 122 Ca 0.01 -0.12 0.09 0.00 0.00 0.00 0.00 53.44 53.41 3f9o n ALA 122 Cb 0.24 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.33 3f9o n ALA 122 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3f9o h GLY 123 N 0.00 0.00 1.77 0.00 0.00 -0.52 -2.30 103.07 102.03 3f9o h GLY 123 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3f9o h GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3f9o n GLY 124 N -1.17 -1.17 0.29 4.60 0.00 -0.20 -3.11 105.19 104.43 3f9o n GLY 124 Ca -0.03 -0.10 0.09 0.00 0.00 0.00 0.00 46.02 45.99 3f9o n GLY 124 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3f9o h ASN 125 N 0.00 0.13 -0.79 1.61 2.35 -1.66 -0.73 115.58 116.48 3f9o h ASN 125 Ca 0.00 0.16 0.13 0.00 -0.55 0.00 0.00 56.30 56.04 3f9o h ASN 125 Cb 0.30 0.18 -0.09 0.00 0.05 0.00 0.00 38.32 38.77 3f9o h ASN 125 CO 0.00 -0.04 0.39 0.00 -1.65 0.00 0.00 177.43 176.13 3f9o h ALA 126 N 1.68 1.15 -0.22 -0.83 0.00 -1.85 0.44 119.26 119.62 3f9o h ALA 126 Ca 0.49 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.43 3f9o h ALA 126 Cb 0.90 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 3f9o h ALA 126 CO -0.54 -0.10 -0.05 -0.92 0.00 0.00 0.00 179.25 177.63 3f9o h TYR 127 N 0.58 0.48 -0.72 0.00 3.20 -1.43 -2.05 116.97 117.03 3f9o h TYR 127 Ca 0.42 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 62.17 3f9o h TYR 127 Cb 0.57 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.69 3f9o h TYR 127 CO -0.11 0.66 0.35 -1.49 -1.64 0.00 0.00 178.16 175.93 3f9o h TRP 128 N 0.16 1.02 -0.85 -3.82 4.06 -1.20 -1.55 115.95 113.78 3f9o h TRP 128 Ca 0.06 -0.05 0.05 0.00 2.06 0.00 0.00 58.89 61.01 3f9o h TRP 128 Cb 0.51 -0.32 -0.06 0.00 -1.00 0.00 0.00 29.16 28.29 3f9o h TRP 128 CO 0.05 0.75 0.54 0.87 -3.56 0.00 0.00 178.44 177.09 3f9o h LYS 129 N 1.00 0.98 0.00 0.49 1.79 -0.93 -1.85 116.57 118.06 3f9o h LYS 129 Ca 0.25 -0.06 -0.04 0.00 -2.18 0.00 0.00 60.65 58.62 3f9o h LYS 129 Cb 0.11 -0.22 -0.01 0.00 -1.58 0.00 0.00 32.23 30.53 3f9o h LYS 129 CO -0.03 0.65 -0.17 0.66 -1.08 0.00 0.00 179.45 179.48 3f9o h SER 130 N 1.01 0.00 -0.35 0.86 4.64 -0.54 -1.52 113.55 117.66 3f9o h SER 130 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 3f9o h SER 130 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3f9o h SER 130 CO -0.14 0.17 0.00 2.30 -0.87 0.00 0.00 176.83 178.29 3f9o n ILE 131 N -4.05 0.45 -0.88 0.95 -5.35 -1.00 -4.95 119.36 104.53 3f9o n ILE 131 Ca -0.02 -0.62 0.00 0.00 -0.27 0.00 0.00 62.75 61.83 3f9o n ILE 131 Cb 0.25 0.71 0.00 0.00 -1.74 0.00 0.00 39.64 38.85 3f9o n ILE 131 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3f9o n GLY 133 N 1.38 0.52 3.75 3.28 0.00 -0.57 -5.01 105.19 108.53 3f9o n GLY 133 Ca 0.18 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 3f9o n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f9o s ALA 134 N -2.00 3.37 0.48 4.61 0.00 -0.72 -4.98 121.76 122.52 3f9o s ALA 134 Ca 0.00 0.76 -0.23 0.00 0.00 0.00 0.00 51.96 52.49 3f9o s ALA 134 Cb 0.00 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 19.77 3f9o s ALA 134 CO 0.00 -0.03 1.23 0.15 0.00 0.00 0.00 175.76 177.11 3f9o s LYS 135 N -1.06 3.58 -0.22 0.00 1.02 -0.50 -4.21 119.74 118.36 3f9o s LYS 135 Ca 0.44 1.93 -0.02 0.00 0.02 0.00 0.00 55.97 58.34 3f9o s LYS 135 Cb -0.29 -2.38 0.01 0.00 -0.52 0.00 0.00 37.83 34.65 3f9o s LYS 135 CO 0.36 -0.74 -0.09 0.08 -0.92 0.00 0.00 175.35 174.04 3f9o s VAL 136 N -1.46 2.94 -0.08 3.17 1.01 -1.26 -0.33 120.40 124.40 3f9o s VAL 136 Ca 0.66 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.97 3f9o s VAL 136 Cb -0.33 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 3f9o s VAL 136 CO 0.39 0.41 -0.19 -0.69 0.00 0.00 0.00 175.10 175.03 3f9o s VAL 137 N 1.40 2.62 0.31 2.92 1.01 0.15 -0.88 120.40 127.94 3f9o s VAL 137 Ca 0.05 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 61.04 3f9o s VAL 137 Cb -0.14 -2.02 0.02 0.00 0.00 0.00 0.00 36.38 34.23 3f9o s VAL 137 CO -0.06 0.56 0.61 -0.94 0.00 0.00 0.00 175.10 175.28 3f9o s SER 138 N -0.14 0.07 0.70 3.32 1.04 -0.62 -0.16 113.70 117.91 3f9o s SER 138 Ca -0.02 -1.01 -0.11 0.00 0.48 0.00 0.00 55.95 55.29 3f9o s SER 138 Cb -0.14 0.70 0.01 0.00 0.10 0.00 0.00 66.02 66.69 3f9o s SER 138 CO 0.04 -1.36 1.06 0.42 0.98 0.00 0.00 173.24 174.38 3f9o s THR 139 N -3.39 3.94 0.21 2.02 -4.23 -1.26 -1.15 115.64 111.76 3f9o s THR 139 Ca 0.19 0.63 -0.10 0.00 -1.18 0.00 0.00 61.69 61.24 3f9o s THR 139 Cb -0.03 -3.47 0.14 0.00 1.34 0.00 0.00 72.50 70.48 3f9o s THR 139 CO 0.11 -0.82 1.80 -0.09 -0.54 0.00 0.00 174.62 175.08 3f9o h ARG 140 N -0.68 0.64 -0.35 3.99 9.65 -1.43 -2.03 114.38 124.16 3f9o h ARG 140 Ca -0.45 -0.04 0.04 0.00 -1.10 0.00 0.00 59.98 58.43 3f9o h ARG 140 Cb 1.22 -0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 29.62 3f9o h ARG 140 CO 0.60 0.42 0.13 0.37 2.80 0.00 0.00 179.97 184.29 3f9o h GLN 141 N 0.66 0.28 -0.62 0.20 4.15 -1.94 0.40 115.11 118.24 3f9o h GLN 141 Ca 0.29 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.70 3f9o h GLN 141 Cb 0.19 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.78 3f9o h GLN 141 CO -0.18 0.18 0.41 1.15 -1.93 0.00 0.00 178.83 178.46 3f9o h THR 142 N 0.29 1.16 -0.49 2.39 2.02 -1.81 0.21 112.91 116.68 3f9o h THR 142 Ca 0.15 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 3f9o h THR 142 Cb 0.12 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 3f9o h THR 142 CO -0.15 0.15 0.22 -0.09 0.37 0.00 0.00 175.52 176.03 3f9o h ARG 143 N 0.84 0.71 -0.37 6.66 2.43 -0.92 0.87 114.38 124.60 3f9o h ARG 143 Ca 0.23 -0.11 -0.06 0.00 -0.81 0.00 0.00 59.98 59.22 3f9o h ARG 143 Cb -0.10 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.32 3f9o h ARG 143 CO -0.05 0.61 -0.02 -0.44 -1.51 0.00 0.00 179.97 178.56 3f9o h ASP 144 N 0.64 0.65 -0.31 -3.80 3.32 -0.51 -1.36 116.42 115.06 3f9o h ASP 144 Ca 0.17 -0.32 -0.07 0.00 0.02 0.00 0.00 57.03 56.82 3f9o h ASP 144 Cb 0.15 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 3f9o h ASP 144 CO -0.02 0.82 -0.06 -0.07 -1.72 0.00 0.00 179.24 178.19 3f9o h LEU 145 N 0.48 0.67 -0.48 1.55 3.38 -0.89 -2.07 115.31 117.95 3f9o h LEU 145 Ca 0.10 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3f9o h LEU 145 Cb 0.49 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3f9o h LEU 145 CO 0.02 0.77 0.17 -0.03 0.09 0.00 0.00 178.44 179.46 3f9o h MET 146 N 0.64 0.74 -0.56 1.13 4.05 -0.49 0.38 114.93 120.82 3f9o h MET 146 Ca 0.12 -0.15 -0.00 0.00 -0.28 0.00 0.00 59.70 59.39 3f9o h MET 146 Cb 0.48 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.14 3f9o h MET 146 CO 0.02 0.68 0.34 -0.22 0.23 0.00 0.00 176.91 177.97 3f9o h LYS 147 N 0.64 0.75 0.10 0.39 3.64 -1.06 -1.20 116.57 119.83 3f9o h LYS 147 Ca 0.16 -0.06 -0.26 0.00 -1.27 0.00 0.00 60.65 59.21 3f9o h LYS 147 Cb 0.24 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 3f9o h LYS 147 CO -0.01 0.53 -1.16 0.66 -2.27 0.00 0.00 179.45 177.21 3f9o h SER 148 N 0.75 0.46 0.00 4.20 4.64 -1.17 -3.40 113.55 119.03 3f9o h SER 148 Ca 0.20 -0.45 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 3f9o h SER 148 Cb -0.03 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 3f9o h SER 148 CO -0.04 1.32 0.00 0.47 -0.87 0.00 0.00 176.83 177.71 3f9o n ASP 149 N -3.60 1.68 -0.12 4.97 9.92 0.13 -4.75 116.55 124.79 3f9o n ASP 149 Ca -0.08 -1.70 -0.09 0.00 -0.53 0.00 0.00 54.79 52.39 3f9o n ASP 149 Cb 0.97 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 41.44 3f9o n ASP 149 CO 0.00 0.00 0.00 -0.25 0.13 0.00 0.00 177.20 177.08 3f9o h TRP 150 N 0.00 0.50 -0.89 1.24 2.91 -1.35 -1.09 115.95 117.26 3f9o h TRP 150 Ca 0.00 -0.01 0.06 0.00 1.13 0.00 0.00 58.89 60.07 3f9o h TRP 150 Cb 0.37 -0.16 -0.06 0.00 -0.51 0.00 0.00 29.16 28.79 3f9o h TRP 150 CO 0.00 0.38 0.56 0.00 -1.03 0.00 0.00 178.44 178.36 3f9o h ALA 151 N 1.07 1.22 -0.26 2.65 0.00 -1.85 0.45 119.26 122.53 3f9o h ALA 151 Ca 0.13 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 3f9o h ALA 151 Cb 0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3f9o h ALA 151 CO -0.02 0.35 -0.09 0.93 0.00 0.00 0.00 179.25 180.41 3f9o h GLU 152 N 1.05 0.53 -0.17 0.00 3.07 -1.78 -1.37 114.58 115.90 3f9o h GLU 152 Ca 0.38 -0.21 -0.11 0.00 -0.50 0.00 0.00 59.36 58.92 3f9o h GLU 152 Cb 0.13 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 3f9o h GLU 152 CO -0.16 0.76 -0.36 0.97 -1.40 0.00 0.00 179.01 178.82 3f9o h ILE 153 N 0.27 1.29 -0.04 3.13 6.09 -0.79 -0.13 117.51 127.32 3f9o h ILE 153 Ca 0.06 -1.44 -0.00 0.00 -1.37 0.00 0.00 64.86 62.11 3f9o h ILE 153 Cb 0.58 1.56 -0.00 0.00 0.47 0.00 0.00 36.82 39.43 3f9o h ILE 153 CO 0.03 0.44 0.01 0.58 -3.07 0.00 0.00 178.15 176.15 3f9o h VAL 154 N 0.31 1.16 -0.60 2.19 2.07 -0.86 -0.37 116.25 120.15 3f9o h VAL 154 Ca 0.03 -0.47 0.09 0.00 0.82 0.00 0.00 66.70 67.17 3f9o h VAL 154 Cb 0.78 1.39 -0.07 0.00 -1.52 0.00 0.00 31.29 31.88 3f9o h VAL 154 CO 0.06 0.13 0.24 0.00 0.02 0.00 0.00 177.57 178.02 3f9o h ALA 155 N 0.83 0.78 -0.51 1.67 0.00 -1.08 -1.23 119.26 119.72 3f9o h ALA 155 Ca 0.01 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 3f9o h ALA 155 Cb 0.19 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3f9o h ALA 155 CO -0.00 -0.17 -0.05 0.35 0.00 0.00 0.00 179.25 179.38 3f9o h PHE 156 N 0.43 0.97 -0.61 0.00 3.57 -0.89 -2.19 116.94 118.22 3f9o h PHE 156 Ca 0.30 -0.16 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 3f9o h PHE 156 Cb 0.35 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 3f9o h PHE 156 CO -0.16 0.90 0.35 1.15 -2.23 0.00 0.00 178.31 178.32 3f9o h THR 157 N 0.81 1.19 0.00 4.41 2.02 -0.62 -2.68 112.91 118.04 3f9o h THR 157 Ca 0.14 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.86 3f9o h THR 157 Cb 0.55 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 3f9o h THR 157 CO 0.03 0.20 0.00 0.03 0.37 0.00 0.00 175.52 176.16 3f9o h ARG 158 N 0.83 0.00 0.42 6.66 3.08 -0.89 0.11 114.38 124.59 3f9o h ARG 158 Ca 0.22 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.25 3f9o h ARG 158 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 3f9o h ARG 158 CO -0.04 0.00 -0.20 0.87 -1.07 0.00 0.00 179.97 179.53 3f9o h LYS 159 N 0.00 -0.55 0.00 0.04 1.79 -1.04 -2.20 116.57 114.61 3f9o h LYS 159 Ca 0.00 0.04 -0.12 0.00 -2.18 0.00 0.00 60.65 58.39 3f9o h LYS 159 Cb 0.46 0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.21 3f9o h LYS 159 CO 0.00 -0.29 -0.65 0.78 -1.08 0.00 0.00 179.45 178.21 3f9o h GLY 160 N -0.71 0.00 -6.47 3.86 0.00 -1.55 -3.39 103.07 94.81 3f9o h GLY 160 Ca -0.06 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.68 3f9o h GLY 160 CO 0.09 0.00 -0.78 1.04 0.00 0.00 0.00 176.54 176.89 3f9o n LEU 161 N -3.18 1.79 0.19 3.11 4.77 0.36 -4.96 117.00 119.08 3f9o n LEU 161 Ca 0.00 -4.96 0.16 0.00 -0.03 0.00 0.00 56.01 51.17 3f9o n LEU 161 Cb 0.75 -0.14 0.77 0.00 -2.33 0.00 0.00 43.42 42.47 3f9o n LEU 161 CO 0.41 1.92 1.14 -0.65 -1.33 0.00 0.00 177.39 178.87 3f9o h PRO 162 N 4.87 0.00 0.00 3.23 0.11 -1.61 0.62 132.00 139.23 3f9o h PRO 162 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 3f9o h PRO 162 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 3f9o h PRO 162 CO 0.61 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.45 3f9o h GLU 163 N 0.00 0.00 -6.80 1.05 9.09 -1.93 -3.45 114.58 112.54 3f9o h GLU 163 Ca 0.09 0.00 -0.52 0.00 0.05 0.00 0.00 59.36 58.98 3f9o h GLU 163 Cb 0.43 0.00 0.06 0.00 -1.65 0.00 0.00 28.75 27.58 3f9o h GLU 163 CO -0.00 0.00 0.67 -0.47 0.05 0.00 0.00 179.01 179.26 3f9o s TYR 164 N -3.55 3.09 0.59 2.06 5.04 0.21 -4.97 117.35 119.82 3f9o s TYR 164 Ca 0.02 1.28 -0.17 0.00 -2.44 0.00 0.00 57.07 55.76 3f9o s TYR 164 Cb 0.09 -3.69 -0.04 0.00 0.35 0.00 0.00 41.96 38.67 3f9o s TYR 164 CO 0.44 -2.04 1.10 -1.25 -1.34 0.00 0.00 175.55 172.45 3f9o s PRO 165 N -1.08 3.20 -1.33 4.97 0.04 -1.26 -4.88 135.00 134.66 3f9o s PRO 165 Ca 0.53 1.42 -0.15 0.00 0.04 0.00 0.00 61.00 62.85 3f9o s PRO 165 Cb -0.39 -2.00 0.10 0.00 0.04 0.00 0.00 34.50 32.24 3f9o s PRO 165 CO 0.47 -0.94 1.86 -3.47 0.04 0.00 0.00 177.00 174.97 3f9o n ASP 166 N -1.81 4.69 -4.71 6.66 2.03 -1.26 -4.98 116.55 117.18 3f9o n ASP 166 Ca 0.10 -2.94 -0.42 0.00 0.52 0.00 0.00 54.79 52.05 3f9o n ASP 166 Cb 0.52 -1.64 -0.03 0.00 -0.72 0.00 0.00 41.12 39.24 3f9o n ASP 166 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3f9o s LEU 167 N 2.39 4.35 0.84 -2.67 1.43 -1.26 -5.03 118.68 118.74 3f9o s LEU 167 Ca 0.47 1.99 -0.11 0.00 -1.03 0.00 0.00 54.13 55.45 3f9o s LEU 167 Cb 0.07 -3.57 0.10 0.00 0.03 0.00 0.00 46.19 42.81 3f9o s LEU 167 CO 0.00 -0.51 1.09 -2.16 0.23 0.00 0.00 176.35 175.01 3f9o s PRO 168 N 1.35 1.67 0.17 1.29 0.04 -1.26 -4.95 135.00 133.32 3f9o s PRO 168 Ca 0.59 1.01 -0.31 0.00 0.04 0.00 0.00 61.00 62.32 3f9o s PRO 168 Cb -0.29 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.31 3f9o s PRO 168 CO 0.28 -2.01 1.57 -1.17 0.04 0.00 0.00 177.00 175.70 3f9o s LEU 169 N -6.12 4.37 -0.23 -3.56 2.96 -1.26 -5.00 118.68 109.84 3f9o s LEU 169 Ca 0.63 2.63 -0.02 0.00 -0.22 0.00 0.00 54.13 57.15 3f9o s LEU 169 Cb -0.18 -3.60 0.07 0.00 0.50 0.00 0.00 46.19 42.98 3f9o s LEU 169 CO 0.57 -0.82 0.04 -0.69 -1.32 0.00 0.00 176.35 174.12 3f9o s VAL 170 N 1.05 0.77 0.38 1.68 1.01 -1.26 -5.08 120.40 118.95 3f9o s VAL 170 Ca 0.69 -0.87 -0.17 0.00 0.00 0.00 0.00 61.98 61.63 3f9o s VAL 170 Cb -0.44 -1.31 -0.10 0.00 0.00 0.00 0.00 36.38 34.53 3f9o s VAL 170 CO 0.32 -0.31 0.83 -0.76 0.00 0.00 0.00 175.10 175.19 3f9o s LEU 171 N 1.72 3.98 0.50 3.92 1.43 -1.26 -4.91 118.68 124.07 3f9o s LEU 171 Ca 0.01 1.45 -0.22 0.00 -1.03 0.00 0.00 54.13 54.33 3f9o s LEU 171 Cb -0.17 -4.28 -0.07 0.00 0.03 0.00 0.00 46.19 41.69 3f9o s LEU 171 CO -0.12 -0.29 1.15 -2.65 0.23 0.00 0.00 176.35 174.67 3f9o n PRO 172 N -0.58 1.47 -0.01 1.29 -0.02 -1.26 -4.94 135.00 130.94 3f9o n PRO 172 Ca 0.05 0.54 0.05 0.00 -2.02 0.00 0.00 63.50 62.12 3f9o n PRO 172 Cb 0.54 -2.29 0.05 0.00 -0.02 0.00 0.00 33.50 31.77 3f9o n PRO 172 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3f9o n ASN 173 N -0.27 1.91 -3.96 2.55 6.94 -0.06 -4.84 115.26 117.54 3f9o n ASN 173 Ca 0.10 -1.46 -0.31 0.00 -0.02 0.00 0.00 54.58 52.89 3f9o n ASN 173 Cb 0.43 -0.02 -0.15 0.00 -2.36 0.00 0.00 39.78 37.67 3f9o n ASN 173 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3f9o s VAL 174 N -0.83 1.67 -0.14 3.53 1.01 -0.49 -4.93 120.40 120.22 3f9o s VAL 174 Ca 0.12 -1.37 0.02 0.00 0.00 0.00 0.00 61.98 60.75 3f9o s VAL 174 Cb 0.08 -1.93 0.01 0.00 0.00 0.00 0.00 36.38 34.54 3f9o s VAL 174 CO 0.12 -0.14 -0.21 -0.69 0.00 0.00 0.00 175.10 174.18 3f9o s VAL 175 N 1.32 1.98 -0.09 2.92 1.01 -1.26 -1.58 120.40 124.69 3f9o s VAL 175 Ca -0.05 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 60.98 3f9o s VAL 175 Cb -0.19 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 3f9o s VAL 175 CO -0.07 0.53 0.04 -1.00 0.00 0.00 0.00 175.10 174.61 3f9o s HIS 176 N 0.87 3.27 0.35 5.22 3.76 -0.30 -4.83 115.29 123.62 3f9o s HIS 176 Ca -0.06 0.27 0.05 0.00 -0.15 0.00 0.00 55.06 55.17 3f9o s HIS 176 Cb -0.15 -1.82 0.65 0.00 1.11 0.00 0.00 32.58 32.37 3f9o s HIS 176 CO -0.02 0.54 1.89 -0.44 -0.85 0.00 0.00 174.74 175.86 3f9o h ASP 177 N 5.04 0.45 0.00 1.40 3.32 -1.96 -0.75 116.42 123.92 3f9o h ASP 177 Ca -0.52 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.45 3f9o h ASP 177 Cb 1.20 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.63 3f9o h ASP 177 CO 0.56 0.52 0.00 0.61 -1.72 0.00 0.00 179.24 179.21 3f9o n GLY 178 N -0.93 4.27 3.78 2.75 0.00 -1.26 -4.79 105.19 109.01 3f9o n GLY 178 Ca 0.01 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.31 3f9o n GLY 178 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3f9o s ASP 179 N 1.62 5.77 0.14 1.61 1.01 -1.26 -4.89 116.67 120.67 3f9o s ASP 179 Ca 0.00 2.16 -0.16 0.00 0.71 0.00 0.00 52.55 55.26 3f9o s ASP 179 Cb 0.00 -2.58 0.03 0.00 1.01 0.00 0.00 42.92 41.38 3f9o s ASP 179 CO 0.00 -1.18 0.42 0.72 0.21 0.00 0.00 175.17 175.33 3f9o s PHE 180 N -1.79 -0.18 0.24 4.23 -0.12 -0.45 -5.02 117.98 114.89 3f9o s PHE 180 Ca 0.72 -0.14 0.10 0.00 -0.05 0.00 0.00 56.93 57.56 3f9o s PHE 180 Cb -0.23 0.27 -0.05 0.00 -0.63 0.00 0.00 43.02 42.38 3f9o s PHE 180 CO 0.26 -0.73 -0.17 0.95 -0.05 0.00 0.00 175.22 175.48 3f9o s THR 181 N -3.82 2.08 0.27 -4.49 -4.23 -1.26 0.05 115.64 104.24 3f9o s THR 181 Ca 0.04 -2.30 0.02 0.00 -1.18 0.00 0.00 61.69 58.27 3f9o s THR 181 Cb 0.01 -2.17 -0.04 0.00 1.34 0.00 0.00 72.50 71.64 3f9o s THR 181 CO -0.10 -0.50 0.13 -0.76 -0.54 0.00 0.00 174.62 172.84 3f9o s LEU 182 N -3.41 1.59 -1.26 4.79 1.02 0.23 -4.88 118.68 116.76 3f9o s LEU 182 Ca 0.26 -1.46 -0.02 0.00 0.02 0.00 0.00 54.13 52.94 3f9o s LEU 182 Cb -0.03 0.13 -0.01 0.00 0.02 0.00 0.00 46.19 46.31 3f9o s LEU 182 CO 0.11 -0.81 0.76 0.00 0.02 0.00 0.00 176.35 176.43 3f9o n GLN 183 N -0.49 -4.77 -3.75 1.70 1.13 -1.26 -2.19 117.38 107.75 3f9o n GLN 183 Ca 0.01 0.66 -0.26 0.00 -1.94 0.00 0.00 57.00 55.46 3f9o n GLN 183 Cb 0.66 -5.26 0.05 0.00 0.11 0.00 0.00 30.24 25.80 3f9o n GLN 183 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3f9o n GLU 184 N -4.18 -6.54 -0.98 -1.09 1.02 -1.26 -1.51 120.64 106.10 3f9o n GLU 184 Ca -0.27 0.71 0.00 0.00 -0.02 0.00 0.00 57.16 57.57 3f9o n GLU 184 Cb 0.67 -5.65 0.00 0.00 -0.02 0.00 0.00 31.44 26.44 3f9o n GLU 184 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3f9o n GLY 185 N -1.79 0.76 0.32 0.62 0.00 -0.94 -4.91 105.19 99.25 3f9o n GLY 185 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 3f9o n GLY 185 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3f9o n LYS 186 N -2.28 1.06 -3.88 1.61 4.76 -0.57 -4.63 118.16 114.23 3f9o n LYS 186 Ca 0.00 -0.65 -0.27 0.00 -2.87 0.00 0.00 58.31 54.53 3f9o n LYS 186 Cb 0.01 -1.49 -0.17 0.00 -1.84 0.00 0.00 35.03 31.55 3f9o n LYS 186 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3f9o s VAL 187 N -2.39 0.95 -0.21 -0.18 1.01 -0.93 -4.14 120.40 114.51 3f9o s VAL 187 Ca 0.27 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.97 3f9o s VAL 187 Cb 0.20 -1.01 0.05 0.00 0.00 0.00 0.00 36.38 35.61 3f9o s VAL 187 CO 0.48 0.32 -0.09 -0.13 0.00 0.00 0.00 175.10 175.68 3f9o s ARG 188 N 1.73 1.95 -0.18 2.72 0.52 -0.07 -0.60 118.95 125.02 3f9o s ARG 188 Ca 0.04 -0.88 -0.10 0.00 -0.52 0.00 0.00 55.73 54.28 3f9o s ARG 188 Cb -0.13 -2.45 -0.05 0.00 0.52 0.00 0.00 34.95 32.84 3f9o s ARG 188 CO -0.08 -0.46 0.15 0.00 0.02 0.00 0.00 175.30 174.93 3f9o s ALA 189 N 1.39 3.72 0.02 2.13 0.00 0.11 -0.46 121.76 128.67 3f9o s ALA 189 Ca -0.02 -0.66 -0.13 0.00 0.00 0.00 0.00 51.96 51.15 3f9o s ALA 189 Cb -0.17 -2.15 0.02 0.00 0.00 0.00 0.00 23.12 20.82 3f9o s ALA 189 CO -0.08 0.25 0.27 -0.59 0.00 0.00 0.00 175.76 175.62 3f9o s PHE 190 N 0.08 -0.09 -0.17 0.00 -0.71 -0.48 -1.34 117.98 115.26 3f9o s PHE 190 Ca 0.10 0.03 -0.08 0.00 -1.04 0.00 0.00 56.93 55.94 3f9o s PHE 190 Cb -0.11 0.06 -0.04 0.00 -1.21 0.00 0.00 43.02 41.71 3f9o s PHE 190 CO -0.00 -0.43 0.11 -0.47 -1.34 0.00 0.00 175.22 173.09 3f9o s TYR 191 N -1.98 3.40 -0.07 3.49 5.04 -1.26 -1.02 117.35 124.94 3f9o s TYR 191 Ca -0.09 0.30 0.11 0.00 -2.44 0.00 0.00 57.07 54.94 3f9o s TYR 191 Cb -0.03 -2.08 0.16 0.00 0.35 0.00 0.00 41.96 40.36 3f9o s TYR 191 CO -0.00 0.35 1.05 0.00 -1.34 0.00 0.00 175.55 175.61 3f9o n ALA 192 N 3.16 2.08 0.00 3.97 0.00 -1.26 -5.02 120.51 123.43 3f9o n ALA 192 Ca -0.17 -1.87 0.00 0.00 0.00 0.00 0.00 53.44 51.40 3f9o n ALA 192 Cb 0.53 -0.30 0.00 0.00 0.00 0.00 0.00 19.45 19.67 3f9o n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f9o n GLY 193 N -0.89 1.45 3.79 0.00 0.00 -1.26 -4.49 105.19 103.79 3f9o n GLY 193 Ca 0.09 -2.14 -0.34 0.00 0.00 0.00 0.00 46.02 43.63 3f9o n GLY 193 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3f9o s PRO 194 N -1.60 3.58 0.00 1.61 0.04 -1.26 -4.77 135.00 132.60 3f9o s PRO 194 Ca 0.00 1.36 0.00 0.00 0.04 0.00 0.00 61.00 62.40 3f9o s PRO 194 Cb 0.00 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.48 3f9o s PRO 194 CO 0.00 -0.62 0.00 0.00 0.04 0.00 0.00 177.00 176.42 3f9o n ALA 195 N -1.35 0.00 -0.24 8.56 0.00 -1.26 -4.14 120.51 122.08 3f9o n ALA 195 Ca 0.09 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.48 3f9o n ALA 195 Cb 0.52 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.02 3f9o n ALA 195 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3f9o h HIS 196 N 0.00 0.90 -1.88 0.00 -0.00 -1.90 -1.07 115.15 111.20 3f9o h HIS 196 Ca 0.00 -0.01 -0.58 0.00 -0.00 0.00 0.00 60.37 59.77 3f9o h HIS 196 Cb 0.00 -0.29 -0.13 0.00 -0.00 0.00 0.00 27.41 26.98 3f9o h HIS 196 CO 0.00 0.63 -0.57 0.95 -0.00 0.00 0.00 177.93 178.94 3f9o s THR 197 N -5.91 1.41 0.15 6.26 -4.23 -1.26 -3.37 115.64 108.69 3f9o s THR 197 Ca -0.13 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.62 3f9o s THR 197 Cb 0.14 -2.69 0.24 0.00 1.34 0.00 0.00 72.50 71.53 3f9o s THR 197 CO 0.78 0.00 1.84 -0.65 -0.54 0.00 0.00 174.62 176.05 3f9o h PRO 198 N 1.79 0.00 0.00 3.99 0.11 -1.84 -3.36 132.00 132.68 3f9o h PRO 198 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3f9o h PRO 198 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3f9o h PRO 198 CO 0.73 0.22 -0.42 -0.40 -0.21 0.00 0.00 178.00 177.92 3f9o n ASP 199 N -3.40 0.43 -4.68 -2.05 5.75 -1.26 -4.01 116.55 107.33 3f9o n ASP 199 Ca 0.00 -0.71 -0.45 0.00 -0.01 0.00 0.00 54.79 53.62 3f9o n ASP 199 Cb 0.42 1.00 -0.03 0.00 -1.03 0.00 0.00 41.12 41.48 3f9o n ASP 199 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3f9o n GLY 200 N 1.21 0.97 3.74 6.12 0.00 -1.26 -4.80 105.19 111.16 3f9o n GLY 200 Ca 0.02 0.55 -0.24 0.00 0.00 0.00 0.00 46.02 46.35 3f9o n GLY 200 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3f9o s ILE 201 N 0.33 4.06 0.20 -0.61 -4.36 -0.62 -4.65 121.20 115.56 3f9o s ILE 201 Ca 0.72 -1.43 -0.06 0.00 -0.26 0.00 0.00 60.65 59.62 3f9o s ILE 201 Cb -0.65 -3.12 -0.06 0.00 1.25 0.00 0.00 42.46 39.89 3f9o s ILE 201 CO 0.45 -0.23 0.46 -0.36 0.24 0.00 0.00 174.94 175.50 3f9o s PHE 202 N -1.96 3.46 -0.11 1.37 0.08 -0.19 -4.73 117.98 115.90 3f9o s PHE 202 Ca 0.31 0.63 0.01 0.00 0.12 0.00 0.00 56.93 58.00 3f9o s PHE 202 Cb -0.08 -2.08 0.02 0.00 -0.57 0.00 0.00 43.02 40.31 3f9o s PHE 202 CO 0.22 0.33 -0.14 0.08 -0.10 0.00 0.00 175.22 175.61 3f9o s VAL 203 N -1.80 1.43 -0.06 -0.44 1.01 -1.21 -1.38 120.40 117.94 3f9o s VAL 203 Ca 0.43 -0.59 0.05 0.00 0.00 0.00 0.00 61.98 61.87 3f9o s VAL 203 Cb -0.11 -1.32 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 3f9o s VAL 203 CO 0.25 0.43 -0.21 -0.47 0.00 0.00 0.00 175.10 175.10 3f9o s TYR 204 N 1.07 2.54 -0.57 5.22 5.04 0.40 0.08 117.35 131.12 3f9o s TYR 204 Ca -0.05 -0.58 -0.03 0.00 -2.44 0.00 0.00 57.07 53.97 3f9o s TYR 204 Cb -0.15 -1.63 0.15 0.00 0.35 0.00 0.00 41.96 40.68 3f9o s TYR 204 CO -0.02 -0.12 0.38 -0.06 -1.34 0.00 0.00 175.55 174.39 3f9o s PHE 205 N -0.24 3.45 0.35 4.97 0.08 0.23 -0.89 117.98 125.93 3f9o s PHE 205 Ca -0.01 -2.62 0.03 0.00 0.12 0.00 0.00 56.93 54.45 3f9o s PHE 205 Cb -0.13 -3.22 0.65 0.00 -0.57 0.00 0.00 43.02 39.75 3f9o s PHE 205 CO 0.03 -0.88 1.98 -1.00 -0.10 0.00 0.00 175.22 175.25 3f9o h PRO 209 N 7.31 0.73 -0.69 0.24 0.13 -1.85 0.86 132.00 138.73 3f9o h PRO 209 Ca -0.05 -0.07 -0.06 0.00 -0.87 0.00 0.00 66.00 64.95 3f9o h PRO 209 Cb 0.98 -0.15 -0.03 0.00 0.13 0.00 0.00 31.00 31.93 3f9o h PRO 209 CO 0.71 0.54 0.18 -0.44 -0.23 0.00 0.00 178.00 178.76 3f9o h ASP 210 N 0.74 1.03 0.07 1.44 3.32 -1.94 -3.14 116.42 117.93 3f9o h ASP 210 Ca 0.19 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3f9o h ASP 210 Cb 0.02 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.30 3f9o h ASP 210 CO -0.03 0.98 -0.68 -0.62 -1.72 0.00 0.00 179.24 177.16 3f9o n GLU 211 N -4.24 0.54 -3.75 3.56 4.71 -1.03 -4.98 120.64 115.44 3f9o n GLU 211 Ca 0.05 -0.43 -0.22 0.00 -0.01 0.00 0.00 57.16 56.55 3f9o n GLU 211 Cb 0.25 -1.49 0.02 0.00 -1.01 0.00 0.00 31.44 29.21 3f9o n GLU 211 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 3f9o n GLN 215 N -0.86 -4.67 -4.80 3.49 6.02 0.27 -4.73 117.38 112.10 3f9o n GLN 215 Ca 0.07 0.58 -0.33 0.00 -0.01 0.00 0.00 57.00 57.31 3f9o n GLN 215 Cb 0.39 -5.08 -0.14 0.00 1.02 0.00 0.00 30.24 26.42 3f9o n GLN 215 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3f9o s VAL 216 N -3.70 3.05 -0.18 5.09 1.01 -1.09 -0.74 120.40 123.84 3f9o s VAL 216 Ca 0.03 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.31 3f9o s VAL 216 Cb -0.02 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 34.09 3f9o s VAL 216 CO 0.83 0.54 -0.08 -0.22 0.00 0.00 0.00 175.10 176.16 3f9o s LEU 217 N 0.15 2.83 -0.22 3.92 2.96 0.02 -0.60 118.68 127.74 3f9o s LEU 217 Ca -0.07 -0.36 -0.27 0.00 -0.22 0.00 0.00 54.13 53.21 3f9o s LEU 217 Cb -0.15 -1.69 -0.00 0.00 0.50 0.00 0.00 46.19 44.85 3f9o s LEU 217 CO 0.05 0.06 0.93 -0.47 -1.32 0.00 0.00 176.35 175.60 3f9o s TYR 218 N 0.98 3.35 -1.22 5.38 5.04 0.11 -0.71 117.35 130.29 3f9o s TYR 218 Ca -0.01 1.32 0.27 0.00 -2.44 0.00 0.00 57.07 56.22 3f9o s TYR 218 Cb -0.15 -3.15 0.95 0.00 0.35 0.00 0.00 41.96 39.97 3f9o s TYR 218 CO -0.00 -0.40 1.71 0.41 -1.34 0.00 0.00 175.55 175.92 3f9o n GLY 219 N 3.49 -1.21 7.00 8.97 0.00 0.11 -3.34 105.19 120.21 3f9o n GLY 219 Ca 0.08 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3f9o n GLY 219 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3f9o n ASN 220 N -1.31 -0.81 0.00 1.61 2.85 -1.26 -1.07 115.26 115.28 3f9o n ASN 220 Ca 0.09 0.00 0.16 0.00 -0.11 0.00 0.00 54.58 54.71 3f9o n ASN 220 Cb 0.32 0.00 0.92 0.00 1.24 0.00 0.00 39.78 42.26 3f9o n ASN 220 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3f9o h ILE 222 N 0.00 1.36 -3.88 0.00 2.04 -1.49 -3.45 117.51 112.09 3f9o h ILE 222 Ca 0.00 -2.00 -0.69 0.00 1.00 0.00 0.00 64.86 63.17 3f9o h ILE 222 Cb 0.00 2.32 -0.30 0.00 -0.74 0.00 0.00 36.82 38.10 3f9o h ILE 222 CO 0.00 0.60 -0.86 -0.76 0.00 0.00 0.00 178.15 177.13 3f9o s LEU 223 N -8.40 2.19 0.04 1.44 1.43 -0.59 -4.91 118.68 109.89 3f9o s LEU 223 Ca -0.12 -0.47 -0.27 0.00 -1.03 0.00 0.00 54.13 52.23 3f9o s LEU 223 Cb 0.06 -1.42 0.10 0.00 0.03 0.00 0.00 46.19 44.96 3f9o s LEU 223 CO 0.85 0.24 1.21 -1.59 0.23 0.00 0.00 176.35 177.29 3f9o s LYS 224 N -0.11 0.65 -0.10 1.70 -2.85 -1.26 -1.53 119.74 116.24 3f9o s LYS 224 Ca -0.05 -0.40 -0.22 0.00 -1.00 0.00 0.00 55.97 54.31 3f9o s LYS 224 Cb -0.14 0.19 -0.28 0.00 -2.06 0.00 0.00 37.83 35.54 3f9o s LYS 224 CO 0.04 -0.30 0.72 0.93 0.10 0.00 0.00 175.35 176.84 3f9o h GLU 225 N 2.00 0.19 -6.16 1.78 5.08 -1.89 -3.43 114.58 112.16 3f9o h GLU 225 Ca -0.26 -0.33 -0.58 0.00 -1.00 0.00 0.00 59.36 57.19 3f9o h GLU 225 Cb 1.20 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.53 3f9o h GLU 225 CO 0.31 1.16 -0.27 0.15 -1.00 0.00 0.00 179.01 179.36 3f9o s LYS 226 N -2.39 3.70 0.15 2.33 1.02 -1.26 -4.96 119.74 118.33 3f9o s LYS 226 Ca -0.18 0.07 -0.22 0.00 0.02 0.00 0.00 55.97 55.66 3f9o s LYS 226 Cb 0.01 -2.90 0.03 0.00 -0.52 0.00 0.00 37.83 34.46 3f9o s LYS 226 CO 0.76 0.50 1.64 1.25 -0.92 0.00 0.00 175.35 178.58 3f9o h LEU 231 N 3.23 -0.72 0.00 3.17 5.85 -1.97 -3.49 115.31 121.38 3f9o h LEU 231 Ca -0.48 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.38 3f9o h LEU 231 Cb 1.18 0.35 0.00 0.00 0.37 0.00 0.00 40.66 42.55 3f9o h LEU 231 CO 0.69 -0.26 0.00 0.61 -0.34 0.00 0.00 178.44 179.14 3f9o n GLY 232 N -1.37 -1.86 0.06 3.75 0.00 -1.26 -4.73 105.19 99.78 3f9o n GLY 232 Ca -0.01 -1.73 0.09 0.00 0.00 0.00 0.00 46.02 44.37 3f9o n GLY 232 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3f9o n ASN 233 N 0.42 0.37 -0.64 1.61 3.02 -1.26 -5.01 115.26 113.76 3f9o n ASN 233 Ca 0.00 0.15 -0.08 0.00 -0.03 0.00 0.00 54.58 54.62 3f9o n ASN 233 Cb 0.00 1.24 -0.03 0.00 -0.61 0.00 0.00 39.78 40.38 3f9o n ASN 233 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3f9o n LEU 234 N -2.49 -0.68 0.20 3.41 4.77 -1.26 -4.96 117.00 115.99 3f9o n LEU 234 Ca -0.05 0.17 -0.15 0.00 -0.03 0.00 0.00 56.01 55.95 3f9o n LEU 234 Cb 0.63 -1.40 -0.07 0.00 -2.33 0.00 0.00 43.42 40.25 3f9o n LEU 234 CO 0.43 -0.37 0.72 0.28 -1.33 0.00 0.00 177.39 177.12 3f9o h SER 235 N 0.00 -0.58 -0.50 -1.43 0.02 -1.95 -2.85 113.55 106.26 3f9o h SER 235 Ca -0.17 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3f9o h SER 235 Cb 0.60 0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.32 3f9o h SER 235 CO 0.23 -0.35 0.00 0.49 -1.14 0.00 0.00 176.83 176.07 3f9o n PHE 236 N -5.35 0.76 -3.14 3.45 3.01 -1.26 -4.97 117.46 109.95 3f9o n PHE 236 Ca -0.09 -0.36 -0.35 0.00 1.01 0.00 0.00 57.45 57.66 3f9o n PHE 236 Cb 0.26 -0.04 -0.06 0.00 -0.01 0.00 0.00 39.48 39.63 3f9o n PHE 236 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3f9o s ALA 237 N -1.40 3.40 -0.89 4.37 0.00 -1.08 -4.52 121.76 121.65 3f9o s ALA 237 Ca 0.35 0.10 -0.17 0.00 0.00 0.00 0.00 51.96 52.24 3f9o s ALA 237 Cb 0.19 -2.78 0.16 0.00 0.00 0.00 0.00 23.12 20.70 3f9o s ALA 237 CO 0.22 0.34 0.98 0.34 0.00 0.00 0.00 175.76 177.65 3f9o s ASP 238 N -1.84 6.68 0.21 0.00 -1.08 -0.41 -4.92 116.67 115.31 3f9o s ASP 238 Ca 0.46 -2.29 -0.06 0.00 -0.52 0.00 0.00 52.55 50.13 3f9o s ASP 238 Cb -0.15 -2.32 0.16 0.00 -1.46 0.00 0.00 42.92 39.15 3f9o s ASP 238 CO 0.20 -0.87 1.67 0.58 0.52 0.00 0.00 175.17 177.27 3f9o h VAL 239 N 5.42 1.26 -0.12 1.11 2.07 -1.93 -0.94 116.25 123.12 3f9o h VAL 239 Ca 0.13 -1.15 -0.20 0.00 0.82 0.00 0.00 66.70 66.31 3f9o h VAL 239 Cb 1.03 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 3f9o h VAL 239 CO 0.97 0.41 -0.73 0.11 0.02 0.00 0.00 177.57 178.34 3f9o h LYS 240 N 0.87 0.58 0.00 1.57 1.57 -1.93 -3.12 116.57 116.11 3f9o h LYS 240 Ca 0.15 -0.46 -0.06 0.00 -1.87 0.00 0.00 60.65 58.41 3f9o h LYS 240 Cb 0.56 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 3f9o h LYS 240 CO 0.03 1.09 -0.31 0.00 -0.57 0.00 0.00 179.45 179.69 3f9o h ALA 241 N 0.78 1.03 -0.21 3.86 0.00 -1.82 -3.37 119.26 119.54 3f9o h ALA 241 Ca -0.04 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.65 3f9o h ALA 241 Cb 1.33 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 19.00 3f9o h ALA 241 CO 0.14 0.38 -0.25 -0.92 0.00 0.00 0.00 179.25 178.60 3f9o h TYR 242 N 0.00 -0.67 0.00 0.00 -0.00 -1.11 -0.25 116.97 114.94 3f9o h TYR 242 Ca -0.00 0.04 -0.06 0.00 -0.00 0.00 0.00 58.73 58.70 3f9o h TYR 242 Cb 0.81 0.32 -0.01 0.00 -0.00 0.00 0.00 36.73 37.85 3f9o h TYR 242 CO 0.00 -0.33 -0.29 -1.00 -0.00 0.00 0.00 178.16 176.54 3f9o h PRO 243 N -0.27 0.00 -0.39 1.82 0.13 -1.76 -2.03 132.00 129.50 3f9o h PRO 243 Ca 0.12 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.16 3f9o h PRO 243 Cb 0.47 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.58 3f9o h PRO 243 CO -0.37 0.29 -0.16 1.96 -0.23 0.00 0.00 178.00 179.49 3f9o h GLN 244 N 0.00 0.72 -0.41 0.86 4.20 -1.30 0.44 115.11 119.63 3f9o h GLN 244 Ca -0.00 -0.26 -0.05 0.00 0.06 0.00 0.00 58.65 58.40 3f9o h GLN 244 Cb 0.64 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.35 3f9o h GLN 244 CO 0.04 0.84 0.07 1.15 -0.67 0.00 0.00 178.83 180.26 3f9o h THR 245 N 0.64 1.24 -0.37 -0.54 2.02 -0.76 -0.84 112.91 114.31 3f9o h THR 245 Ca 0.10 -0.86 -0.07 0.00 0.77 0.00 0.00 66.41 66.35 3f9o h THR 245 Cb 0.64 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 68.05 3f9o h THR 245 CO 0.04 0.30 -0.05 -0.07 0.37 0.00 0.00 175.52 176.11 3f9o h LEU 246 N 0.52 0.58 -0.59 2.58 3.38 -1.06 -0.91 115.31 119.82 3f9o h LEU 246 Ca 0.12 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 3f9o h LEU 246 Cb 0.37 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3f9o h LEU 246 CO 0.01 0.69 -0.58 -0.33 0.09 0.00 0.00 178.44 178.31 3f9o h GLU 247 N 0.57 0.39 -0.94 1.13 4.39 -0.85 -0.67 114.58 118.59 3f9o h GLU 247 Ca 0.11 -0.26 -0.01 0.00 0.34 0.00 0.00 59.36 59.55 3f9o h GLU 247 Cb 0.44 0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.08 3f9o h GLU 247 CO 0.02 0.86 0.56 0.00 -1.16 0.00 0.00 179.01 179.30 3f9o h ARG 248 N 0.29 1.27 -0.16 2.33 3.08 -0.64 0.01 114.38 120.56 3f9o h ARG 248 Ca -0.00 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 3f9o h ARG 248 Cb 1.11 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.88 3f9o h ARG 248 CO 0.10 0.89 0.08 1.25 -1.07 0.00 0.00 179.97 181.22 3f9o h LEU 249 N 1.29 0.21 -0.92 3.04 5.85 -1.01 -3.02 115.31 120.76 3f9o h LEU 249 Ca 0.34 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.97 3f9o h LEU 249 Cb -0.05 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 40.86 3f9o h LEU 249 CO -0.06 0.28 0.59 0.11 -0.34 0.00 0.00 178.44 179.02 3f9o h LYS 250 N 0.13 1.10 0.00 1.25 1.57 -0.78 -2.05 116.57 117.79 3f9o h LYS 250 Ca 0.06 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3f9o h LYS 250 Cb 0.12 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 3f9o h LYS 250 CO -0.01 0.73 -0.03 0.00 -0.57 0.00 0.00 179.45 179.57 3f9o h ALA 251 N 1.39 1.10 0.00 3.86 0.00 -0.91 -0.95 119.26 123.76 3f9o h ALA 251 Ca 0.38 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 3f9o h ALA 251 Cb 0.05 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3f9o h ALA 251 CO -0.14 0.03 -0.03 0.52 0.00 0.00 0.00 179.25 179.64 3f9o h MET 252 N 0.00 0.00 -6.42 0.00 2.86 -1.24 -3.47 114.93 106.66 3f9o h MET 252 Ca -0.00 0.00 -0.49 0.00 -2.06 0.00 0.00 59.70 57.15 3f9o h MET 252 Cb 0.21 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.83 3f9o h MET 252 CO 0.00 0.03 -0.87 1.63 1.06 0.00 0.00 176.91 178.76 3f9o n LYS 253 N -3.15 -3.66 -2.37 1.72 5.02 -0.36 -4.93 118.16 110.42 3f9o n LYS 253 Ca -0.00 0.45 -0.41 0.00 -2.02 0.00 0.00 58.31 56.33 3f9o n LYS 253 Cb 0.28 -4.70 -0.04 0.00 -0.02 0.00 0.00 35.03 30.55 3f9o n LYS 253 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3f9o s LEU 254 N -6.93 4.48 -0.07 -0.35 1.43 -1.26 -4.97 118.68 111.01 3f9o s LEU 254 Ca 0.04 2.31 -0.29 0.00 -1.03 0.00 0.00 54.13 55.16 3f9o s LEU 254 Cb -0.02 -3.62 -0.06 0.00 0.03 0.00 0.00 46.19 42.52 3f9o s LEU 254 CO 0.87 -0.32 1.84 -2.84 0.23 0.00 0.00 176.35 176.13 3f9o s PRO 255 N -0.83 3.96 -0.10 1.29 0.02 -1.26 -4.98 135.00 133.10 3f9o s PRO 255 Ca 0.50 2.23 -0.00 0.00 0.02 0.00 0.00 61.00 63.75 3f9o s PRO 255 Cb -0.33 -4.11 0.02 0.00 0.02 0.00 0.00 34.50 30.10 3f9o s PRO 255 CO 0.40 -1.14 -0.06 0.42 -0.33 0.00 0.00 177.00 176.29 3f9o s ILE 256 N 4.98 0.89 -0.21 2.83 1.01 -1.26 -4.62 121.20 124.82 3f9o s ILE 256 Ca 0.82 -0.21 0.12 0.00 0.00 0.00 0.00 60.65 61.38 3f9o s ILE 256 Cb -0.35 -0.93 -0.22 0.00 0.01 0.00 0.00 42.46 40.97 3f9o s ILE 256 CO 0.35 0.34 0.02 0.29 0.00 0.00 0.00 174.94 175.93 3f9o n LYS 257 N 4.89 0.68 -4.04 2.79 5.02 0.08 -4.58 118.16 122.99 3f9o n LYS 257 Ca -0.12 0.06 -0.18 0.00 -2.02 0.00 0.00 58.31 56.05 3f9o n LYS 257 Cb 0.50 -1.54 -0.16 0.00 -0.02 0.00 0.00 35.03 33.81 3f9o n LYS 257 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3f9o s THR 258 N -2.51 0.33 -0.11 -0.18 2.01 -0.89 -4.17 115.64 110.13 3f9o s THR 258 Ca -0.18 -0.03 0.00 0.00 0.31 0.00 0.00 61.69 61.79 3f9o s THR 258 Cb 0.07 -0.37 -0.02 0.00 0.01 0.00 0.00 72.50 72.18 3f9o s THR 258 CO 0.76 0.16 -0.11 -0.69 -0.69 0.00 0.00 174.62 174.06 3f9o s VAL 259 N 0.80 3.32 -0.36 3.82 1.01 0.04 -0.80 120.40 128.24 3f9o s VAL 259 Ca -0.09 -0.59 -0.12 0.00 0.00 0.00 0.00 61.98 61.18 3f9o s VAL 259 Cb -0.12 -2.38 0.01 0.00 0.00 0.00 0.00 36.38 33.88 3f9o s VAL 259 CO -0.01 0.55 0.22 -0.63 0.00 0.00 0.00 175.10 175.23 3f9o s ILE 260 N -0.08 4.89 0.32 2.22 -1.09 0.11 -1.47 121.20 126.11 3f9o s ILE 260 Ca -0.01 -0.56 -0.27 0.00 -2.23 0.00 0.00 60.65 57.58 3f9o s ILE 260 Cb -0.14 -3.62 -0.09 0.00 -1.58 0.00 0.00 42.46 37.03 3f9o s ILE 260 CO 0.03 -0.12 1.07 -0.83 -1.23 0.00 0.00 174.94 173.86 3f9o s GLY 261 N 1.63 2.95 0.00 6.18 0.00 -0.58 0.05 107.32 117.55 3f9o s GLY 261 Ca 0.04 0.80 0.28 0.00 0.00 0.00 0.00 44.72 45.85 3f9o s GLY 261 CO 0.08 1.34 1.93 0.61 0.00 0.00 0.00 173.10 177.06 3f9o n GLY 262 N 0.90 -1.41 3.36 0.20 0.00 -0.58 -4.52 105.19 103.14 3f9o n GLY 262 Ca 0.01 -0.11 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 3f9o n GLY 262 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3f9o s HIS 263 N -2.88 1.02 0.00 1.61 3.76 -1.26 -0.71 115.29 116.83 3f9o s HIS 263 Ca 0.17 -1.24 0.00 0.00 -0.15 0.00 0.00 55.06 53.85 3f9o s HIS 263 Cb 0.19 -0.31 0.00 0.00 1.11 0.00 0.00 32.58 33.57 3f9o s HIS 263 CO 0.49 -0.84 0.00 -0.25 -0.85 0.00 0.00 174.74 173.29 3f9o n ASP 264 N -0.65 -1.06 -4.67 1.40 8.00 -1.26 -4.29 116.55 114.02 3f9o n ASP 264 Ca 0.02 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.09 3f9o n ASP 264 Cb 0.64 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.71 3f9o n ASP 264 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3f9o s SER 265 N -4.00 6.92 0.15 -2.24 0.01 -1.26 -4.89 113.70 108.40 3f9o s SER 265 Ca 0.00 1.88 -0.09 0.00 1.31 0.00 0.00 55.95 59.05 3f9o s SER 265 Cb 0.00 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.67 3f9o s SER 265 CO 0.00 -0.72 1.48 1.55 0.41 0.00 0.00 173.24 175.97 3f9o h PRO 266 N 8.05 0.88 -6.27 12.44 0.13 -1.81 -3.42 132.00 142.00 3f9o h PRO 266 Ca -0.33 -0.47 -0.58 0.00 -0.87 0.00 0.00 66.00 63.75 3f9o h PRO 266 Cb 1.15 0.02 -0.08 0.00 0.13 0.00 0.00 31.00 32.21 3f9o h PRO 266 CO 0.93 1.12 0.71 -0.51 -0.23 0.00 0.00 178.00 180.02 3f9o s LEU 267 N -8.80 3.91 0.21 1.56 1.43 -1.26 -1.53 118.68 114.19 3f9o s LEU 267 Ca -0.10 0.58 0.00 0.00 -1.03 0.00 0.00 54.13 53.58 3f9o s LEU 267 Cb 0.11 -3.37 -0.05 0.00 0.03 0.00 0.00 46.19 42.92 3f9o s LEU 267 CO 0.88 -0.98 0.08 -1.00 0.23 0.00 0.00 176.35 175.56 3f9o s HIS 289 N 3.76 1.28 0.58 0.29 3.76 -0.54 -5.02 115.29 119.41 3f9o s HIS 289 Ca 0.41 -1.21 -0.06 0.00 -0.15 0.00 0.00 55.06 54.05 3f9o s HIS 289 Cb -0.11 -0.71 0.13 0.00 1.11 0.00 0.00 32.58 33.00 3f9o s HIS 289 CO 0.22 -0.42 0.80 0.41 -0.85 0.00 0.00 174.74 174.89 3f9o n GLY 290 N -0.32 -0.33 0.28 -2.22 0.00 -1.26 -0.78 105.19 100.56 3f9o n GLY 290 Ca -0.01 -1.86 0.19 0.00 0.00 0.00 0.00 46.02 44.34 3f9o n GLY 290 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3f9o h PRO 291 N 0.00 0.00 -0.02 1.61 0.13 -1.81 -2.59 132.00 129.32 3f9o h PRO 291 Ca -0.26 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.88 3f9o h PRO 291 Cb 0.83 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.96 3f9o h PRO 291 CO 0.23 0.00 0.06 0.93 -0.23 0.00 0.00 178.00 178.99 3f9o h GLU 292 N 0.00 0.00 -0.81 0.86 5.08 -1.95 -2.51 114.58 115.25 3f9o h GLU 292 Ca 0.00 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 58.49 3f9o h GLU 292 Cb 0.06 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.26 3f9o h GLU 292 CO 0.00 0.00 0.53 1.25 -1.00 0.00 0.00 179.01 179.79 3f9o h LEU 293 N 0.00 0.56 0.12 1.33 5.85 -1.84 0.13 115.31 121.47 3f9o h LEU 293 Ca 0.01 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 3f9o h LEU 293 Cb 0.14 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.08 3f9o h LEU 293 CO -0.00 0.30 -0.06 0.40 -0.34 0.00 0.00 178.44 178.74 3f9o h ILE 294 N 0.60 0.88 -0.48 4.05 2.04 -1.71 -1.34 117.51 121.56 3f9o h ILE 294 Ca 0.39 -0.02 -0.07 0.00 1.00 0.00 0.00 64.86 66.16 3f9o h ILE 294 Cb 0.69 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 3f9o h ILE 294 CO -0.16 0.01 0.00 0.44 0.00 0.00 0.00 178.15 178.44 3f9o h ASP 295 N -0.18 0.76 0.07 1.72 3.32 -1.51 -1.21 116.42 119.39 3f9o h ASP 295 Ca -0.02 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 56.86 3f9o h ASP 295 Cb 0.14 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3f9o h ASP 295 CO 0.03 0.83 -0.13 -0.74 -1.72 0.00 0.00 179.24 177.50 3f9o h HIS 296 N 0.74 -0.34 -0.10 4.55 2.76 -0.56 -1.60 115.15 120.60 3f9o h HIS 296 Ca 0.14 0.01 -0.18 0.00 -2.20 0.00 0.00 60.37 58.15 3f9o h HIS 296 Cb 0.45 0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.55 3f9o h HIS 296 CO 0.02 -0.20 -0.68 -0.92 -1.30 0.00 0.00 177.93 174.86 3f9o h TYR 297 N -0.26 0.57 -0.57 5.26 3.20 -1.14 -2.58 116.97 121.45 3f9o h TYR 297 Ca 0.02 -0.23 0.05 0.00 3.14 0.00 0.00 58.73 61.71 3f9o h TYR 297 Cb 0.28 -0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.41 3f9o h TYR 297 CO -0.16 0.98 0.30 1.49 -1.64 0.00 0.00 178.16 179.12 3f9o h GLU 298 N 0.30 0.55 -0.57 1.82 4.81 -1.10 0.90 114.58 121.30 3f9o h GLU 298 Ca -0.02 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 3f9o h GLU 298 Cb 1.24 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 3f9o h GLU 298 CO 0.12 0.36 0.21 0.00 -0.73 0.00 0.00 179.01 178.97 3f9o h ALA 299 N 1.30 0.74 -0.21 2.92 0.00 -1.21 -1.52 119.26 121.27 3f9o h ALA 299 Ca 0.25 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3f9o h ALA 299 Cb 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3f9o h ALA 299 CO -0.17 0.37 0.12 -0.07 0.00 0.00 0.00 179.25 179.50 3f9o h LEU 300 N 0.78 0.26 -0.98 0.00 3.38 -0.98 -2.77 115.31 115.01 3f9o h LEU 300 Ca 0.19 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 3f9o h LEU 300 Cb 0.24 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3f9o h LEU 300 CO -0.01 0.27 -0.51 -0.29 0.09 0.00 0.00 178.44 177.99 3f9o h ILE 301 N 0.23 1.36 0.00 1.22 6.09 -0.78 -2.42 117.51 123.21 3f9o h ILE 301 Ca 0.07 -1.75 0.00 0.00 -1.37 0.00 0.00 64.86 61.81 3f9o h ILE 301 Cb 0.06 1.95 0.00 0.00 0.47 0.00 0.00 36.82 39.30 3f9o h ILE 301 CO -0.01 0.50 0.00 0.11 -3.07 0.00 0.00 178.15 175.68 3f9o h LYS 302 N 0.00 0.00 -0.01 2.19 1.57 -1.21 -2.45 116.57 116.66 3f9o h LYS 302 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3f9o h LYS 302 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 3f9o h LYS 302 CO 0.07 0.00 -0.31 0.00 -0.57 0.00 0.00 179.45 178.64 3f9o n ALA 303 N -2.04 3.19 -1.63 3.86 0.00 -0.94 -5.01 120.51 117.94 3f9o n ALA 303 Ca 0.01 -0.47 -0.34 0.00 0.00 0.00 0.00 53.44 52.64 3f9o n ALA 303 Cb 0.33 -1.04 0.03 0.00 0.00 0.00 0.00 19.45 18.77 3f9o n ALA 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3f9o s ALA 304 N -2.47 2.55 0.11 0.00 0.00 -0.92 -4.92 121.76 116.10 3f9o s ALA 304 Ca 0.23 0.69 -0.07 0.00 0.00 0.00 0.00 51.96 52.81 3f9o s ALA 304 Cb 0.19 -3.35 0.12 0.00 0.00 0.00 0.00 23.12 20.08 3f9o s ALA 304 CO 0.53 -1.08 0.69 -2.30 0.00 0.00 0.00 175.76 173.60 3f9o n PRO 305 N -1.93 -0.10 -0.09 0.00 -0.02 -1.26 -5.07 135.00 126.53 3f9o n PRO 305 Ca 0.11 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 3f9o n PRO 305 Cb 0.51 -1.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.97 3f9o n PRO 305 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48