#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m3j s ILE 31 N 0.00 2.48 -0.20 0.53 -5.25 -1.26 -4.85 121.20 112.65 1m3j s ILE 31 Ca 0.00 0.22 0.26 0.00 -0.99 0.00 0.00 60.65 60.14 1m3j s ILE 31 Cb 0.00 -2.75 0.26 0.00 2.95 0.00 0.00 42.46 42.93 1m3j s ILE 31 CO 0.00 -0.13 1.77 0.74 -1.79 0.00 0.00 174.94 175.53 1m3j h THR 32 N -0.36 0.00 0.00 8.37 2.02 -2.05 0.96 112.91 121.86 1m3j h THR 32 Ca -0.47 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1m3j h THR 32 Cb 1.28 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 1m3j h THR 32 CO 0.50 0.00 0.00 0.47 0.37 0.00 0.00 175.52 176.86 1m3j n ASP 33 N -2.40 0.00 -0.73 4.18 8.00 -1.26 -4.85 116.55 119.50 1m3j n ASP 33 Ca -0.00 -0.45 -0.07 0.00 0.71 0.00 0.00 54.79 54.97 1m3j n ASP 33 Cb 0.14 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.20 1m3j n ASP 33 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1m3j n LYS 34 N -0.93 -1.64 -2.90 -1.24 -0.00 0.33 -4.86 118.16 106.92 1m3j n LYS 34 Ca 0.08 0.58 -0.41 0.00 -0.00 0.00 0.00 58.31 58.57 1m3j n LYS 34 Cb 0.04 -4.63 0.01 0.00 -0.00 0.00 0.00 35.03 30.44 1m3j n LYS 34 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1m3j n ASN 35 N -0.13 6.54 0.14 -5.58 3.02 -1.26 -4.79 115.26 113.22 1m3j n ASN 35 Ca -0.07 -3.52 -0.24 0.00 -0.03 0.00 0.00 54.58 50.72 1m3j n ASN 35 Cb 0.39 -1.18 -0.16 0.00 -0.61 0.00 0.00 39.78 38.23 1m3j n ASN 35 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1m3j h GLN 36 N 4.86 0.52 -7.00 3.52 4.20 -1.89 -3.42 115.11 115.90 1m3j h GLN 36 Ca 0.31 -0.88 -0.50 0.00 0.06 0.00 0.00 58.65 57.63 1m3j h GLN 36 Cb 0.51 0.33 0.06 0.00 0.30 0.00 0.00 27.48 28.68 1m3j h GLN 36 CO 1.24 1.42 0.48 0.45 -0.67 0.00 0.00 178.83 181.75 1m3j s SER 37 N -7.54 6.21 0.04 1.46 0.15 -1.26 -4.28 113.70 108.47 1m3j s SER 37 Ca -0.09 2.28 -0.27 0.00 0.70 0.00 0.00 55.95 58.58 1m3j s SER 37 Cb 0.04 -2.60 -0.15 0.00 -1.71 0.00 0.00 66.02 61.60 1m3j s SER 37 CO 0.94 -0.89 1.40 -0.29 1.20 0.00 0.00 173.24 175.60 1m3j h ILE 38 N 1.88 0.00 0.00 6.45 6.09 -1.90 -2.53 117.51 127.50 1m3j h ILE 38 Ca -0.49 -0.00 0.00 0.00 -1.37 0.00 0.00 64.86 62.99 1m3j h ILE 38 Cb 1.25 0.00 0.00 0.00 0.47 0.00 0.00 36.82 38.54 1m3j h ILE 38 CO 0.60 0.00 0.00 0.47 -3.07 0.00 0.00 178.15 176.15 1m3j n ASP 39 N -4.66 0.32 -0.02 2.19 8.00 -1.26 -2.59 116.55 118.53 1m3j n ASP 39 Ca -0.12 0.63 -0.17 0.00 0.71 0.00 0.00 54.79 55.83 1m3j n ASP 39 Cb 0.39 -0.68 -0.14 0.00 -0.02 0.00 0.00 41.12 40.68 1m3j n ASP 39 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1m3j h SER 40 N 0.00 0.20 0.02 -2.24 0.87 -1.86 -2.78 113.55 107.77 1m3j h SER 40 Ca 0.00 -0.96 0.02 0.00 -1.23 0.00 0.00 61.79 59.61 1m3j h SER 40 Cb 0.09 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 1m3j h SER 40 CO 0.00 1.19 -0.11 1.23 -0.53 0.00 0.00 176.83 178.60 1m3j h GLY 41 N -0.72 -0.16 0.00 5.77 0.00 -1.20 0.16 103.07 106.93 1m3j h GLY 41 Ca -0.07 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1m3j h GLY 41 CO 0.06 -0.12 0.00 1.39 0.00 0.00 0.00 176.54 177.87 1m3j n ILE 42 N -5.24 0.00 -0.31 2.60 5.41 -1.21 -1.77 119.36 118.84 1m3j n ILE 42 Ca -0.06 1.32 0.35 0.00 1.00 0.00 0.00 62.75 65.36 1m3j n ILE 42 Cb 0.16 -2.31 0.69 0.00 -0.71 0.00 0.00 39.64 37.48 1m3j n ILE 42 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1m3j h SER 43 N 0.00 0.00 -0.88 4.38 4.64 -1.56 1.31 113.55 121.44 1m3j h SER 43 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 1m3j h SER 43 Cb 0.00 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 61.78 1m3j h SER 43 CO 0.00 0.00 0.34 -0.24 -0.87 0.00 0.00 176.83 176.06 1m3j n SER 44 N -3.81 6.09 -4.31 4.97 2.88 0.57 -4.94 113.62 115.08 1m3j n SER 44 Ca 0.26 -3.76 -0.39 0.00 -1.33 0.00 0.00 58.87 53.65 1m3j n SER 44 Cb 1.38 -0.77 -0.12 0.00 -0.75 0.00 0.00 64.21 63.95 1m3j n SER 44 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1m3j s LEU 45 N -3.66 4.43 0.44 2.46 0.20 0.45 -4.86 118.68 118.14 1m3j s LEU 45 Ca 0.59 -1.08 -0.25 0.00 0.69 0.00 0.00 54.13 54.08 1m3j s LEU 45 Cb 0.47 -1.92 -0.08 0.00 -0.43 0.00 0.00 46.19 44.24 1m3j s LEU 45 CO 0.02 -0.34 1.31 -0.55 -0.29 0.00 0.00 176.35 176.50 1m3j s SER 46 N 1.45 6.08 0.00 3.68 0.15 -1.26 -4.97 113.70 118.83 1m3j s SER 46 Ca -0.00 2.66 0.00 0.00 0.70 0.00 0.00 55.95 59.31 1m3j s SER 46 Cb -0.19 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.48 1m3j s SER 46 CO 0.04 -1.01 0.00 0.00 1.20 0.00 0.00 173.24 173.47 1m3j n TYR 47 N -0.17 0.00 -4.04 3.44 0.18 -1.26 -4.09 117.16 111.22 1m3j n TYR 47 Ca 0.05 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.50 1m3j n TYR 47 Cb 0.44 0.00 -0.15 0.00 -0.38 0.00 0.00 39.34 39.25 1m3j n TYR 47 CO 0.00 0.00 0.00 1.21 -2.08 0.00 0.00 176.86 175.99 1m3j s ASN 48 N 0.00 4.36 0.28 9.48 2.47 -1.26 -5.00 114.94 125.28 1m3j s ASN 48 Ca 0.00 -1.24 -0.02 0.00 0.42 0.00 0.00 52.86 52.02 1m3j s ASN 48 Cb 0.00 -1.58 0.61 0.00 -1.45 0.00 0.00 41.25 38.82 1m3j s ASN 48 CO 0.00 -0.17 1.61 0.08 -3.72 0.00 0.00 177.10 174.89 1m3j h ARG 49 N 7.85 0.07 -2.01 0.43 0.11 -1.99 -1.84 114.38 117.01 1m3j h ARG 49 Ca -0.24 -0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.81 1m3j h ARG 49 Cb 1.06 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 32.12 1m3j h ARG 49 CO 0.50 0.05 -0.05 0.09 0.10 0.00 0.00 179.97 180.66 1m3j n ASN 50 N -5.41 5.12 0.14 0.08 5.03 -1.26 -3.85 115.26 115.12 1m3j n ASN 50 Ca 0.19 -2.37 0.00 0.00 0.87 0.00 0.00 54.58 53.27 1m3j n ASN 50 Cb 0.62 -1.12 0.00 0.00 -1.02 0.00 0.00 39.78 38.26 1m3j n ASN 50 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 1m3j n GLU 51 N 1.65 0.00 -0.56 3.52 2.13 -0.75 -4.92 120.64 121.72 1m3j n GLU 51 Ca 0.05 0.00 0.46 0.00 0.66 0.00 0.00 57.16 58.33 1m3j n GLU 51 Cb 0.53 0.00 0.78 0.00 0.27 0.00 0.00 31.44 33.02 1m3j n GLU 51 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 1m3j h VAL 52 N 0.00 0.15 -2.95 6.31 -1.51 -1.51 -0.31 116.25 116.42 1m3j h VAL 52 Ca 0.00 -0.01 -0.68 0.00 -1.23 0.00 0.00 66.70 64.78 1m3j h VAL 52 Cb 0.00 0.13 -0.37 0.00 -2.13 0.00 0.00 31.29 28.92 1m3j h VAL 52 CO 0.00 0.00 -0.14 0.18 -1.23 0.00 0.00 177.57 176.38 1m3j n LEU 53 N -4.12 4.29 -4.12 4.19 4.77 -1.25 -4.42 117.00 116.35 1m3j n LEU 53 Ca 0.38 -5.23 -0.18 0.00 -0.03 0.00 0.00 56.01 50.94 1m3j n LEU 53 Cb 1.70 -0.98 -0.13 0.00 -2.33 0.00 0.00 43.42 41.69 1m3j n LEU 53 CO 0.40 1.73 -0.45 0.00 -1.33 0.00 0.00 177.39 177.74 1m3j s ALA 54 N -1.88 1.00 -0.45 -1.18 0.00 -0.13 0.30 121.76 119.42 1m3j s ALA 54 Ca 0.31 -0.81 0.08 0.00 0.00 0.00 0.00 51.96 51.54 1m3j s ALA 54 Cb 0.01 -0.11 0.27 0.00 0.00 0.00 0.00 23.12 23.29 1m3j s ALA 54 CO -0.07 0.15 0.63 -1.13 0.00 0.00 0.00 175.76 175.35 1m3j n SER 55 N 1.74 1.35 -4.52 0.00 3.41 -0.61 -4.82 113.62 110.18 1m3j n SER 55 Ca -0.19 -2.98 -0.45 0.00 -0.26 0.00 0.00 58.87 54.99 1m3j n SER 55 Cb 0.55 -0.64 -0.05 0.00 -0.26 0.00 0.00 64.21 63.81 1m3j n SER 55 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1m3j n ASN 56 N 0.98 2.42 -3.81 4.04 5.15 -1.26 -3.62 115.26 119.17 1m3j n ASN 56 Ca 0.24 0.15 0.00 0.00 -0.60 0.00 0.00 54.58 54.37 1m3j n ASN 56 Cb 0.52 -1.40 0.00 0.00 -0.53 0.00 0.00 39.78 38.37 1m3j n ASN 56 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1m3j n GLY 57 N 6.19 -3.24 3.77 8.20 0.00 0.13 -4.93 105.19 115.31 1m3j n GLY 57 Ca 0.38 -1.10 -0.33 0.00 0.00 0.00 0.00 46.02 44.98 1m3j n GLY 57 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1m3j s ASP 58 N -2.06 5.03 -0.68 1.61 1.47 -1.26 -4.93 116.67 115.85 1m3j s ASP 58 Ca 0.00 1.96 0.05 0.00 1.18 0.00 0.00 52.55 55.75 1m3j s ASP 58 Cb 0.00 -2.55 0.19 0.00 -0.34 0.00 0.00 42.92 40.23 1m3j s ASP 58 CO 0.00 -1.68 0.56 1.17 0.68 0.00 0.00 175.17 175.90 1m3j n LYS 59 N -2.59 1.98 -1.70 2.11 4.81 -1.26 -3.97 118.16 117.54 1m3j n LYS 59 Ca 0.10 -4.50 -0.32 0.00 -0.87 0.00 0.00 58.31 52.72 1m3j n LYS 59 Cb 0.52 -2.25 0.05 0.00 0.02 0.00 0.00 35.03 33.37 1m3j n LYS 59 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 1m3j s ILE 60 N -1.72 3.60 -0.18 3.15 2.07 -1.26 -5.00 121.20 121.87 1m3j s ILE 60 Ca 0.29 0.65 0.09 0.00 -1.41 0.00 0.00 60.65 60.28 1m3j s ILE 60 Cb 0.02 -3.21 0.25 0.00 0.13 0.00 0.00 42.46 39.65 1m3j s ILE 60 CO -0.13 -0.56 1.28 1.21 -1.91 0.00 0.00 174.94 174.83 1m3j n GLU 61 N -2.69 0.77 -3.64 3.50 4.07 -1.26 -5.03 120.64 116.35 1m3j n GLU 61 Ca 0.09 -1.33 -0.02 0.00 -0.06 0.00 0.00 57.16 55.84 1m3j n GLU 61 Cb 0.53 0.29 -0.04 0.00 -0.06 0.00 0.00 31.44 32.16 1m3j n GLU 61 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 1m3j s SER 62 N -1.32 -0.03 0.00 4.31 1.04 -1.26 -5.18 113.70 111.26 1m3j s SER 62 Ca 0.08 0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.54 1m3j s SER 62 Cb 0.26 0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.40 1m3j s SER 62 CO -0.07 -0.03 0.00 2.22 0.98 0.00 0.00 173.24 176.33 1m3j n PHE 63 N 0.41 0.00 -3.43 5.02 1.16 -1.26 -5.12 117.46 114.24 1m3j n PHE 63 Ca 0.01 0.00 -0.17 0.00 -1.87 0.00 0.00 57.45 55.42 1m3j n PHE 63 Cb 0.58 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.35 1m3j n PHE 63 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1m3j s VAL 64 N -3.65 -0.38 0.33 1.97 1.01 -1.26 -5.04 120.40 113.38 1m3j s VAL 64 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1m3j s VAL 64 Cb 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 36.38 35.50 1m3j s VAL 64 CO 0.00 -0.37 0.67 -0.81 0.00 0.00 0.00 175.10 174.58 1m3j n PRO 65 N 5.31 0.01 -3.61 2.72 -0.04 -1.26 -4.07 135.00 134.07 1m3j n PRO 65 Ca -0.03 0.47 -0.09 0.00 -0.04 0.00 0.00 63.50 63.81 1m3j n PRO 65 Cb 0.47 -1.95 -0.06 0.00 -0.04 0.00 0.00 33.50 31.92 1m3j n PRO 65 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1m3j s LYS 66 N -2.76 0.49 -0.28 0.54 2.20 -1.26 -2.59 119.74 116.08 1m3j s LYS 66 Ca 0.00 0.29 -0.22 0.00 -0.36 0.00 0.00 55.97 55.68 1m3j s LYS 66 Cb 0.00 0.23 0.11 0.00 -1.51 0.00 0.00 37.83 36.66 1m3j s LYS 66 CO 0.00 -0.12 0.88 -2.00 -0.36 0.00 0.00 175.35 173.76 1m3j s GLU 67 N -0.54 0.61 0.30 4.03 2.12 -0.71 -4.37 118.70 120.13 1m3j s GLU 67 Ca 0.01 0.82 0.07 0.00 0.36 0.00 0.00 54.97 56.23 1m3j s GLU 67 Cb -0.02 0.25 -0.03 0.00 0.26 0.00 0.00 34.13 34.58 1m3j s GLU 67 CO -0.03 -0.09 0.24 0.20 -0.54 0.00 0.00 175.26 175.05 1m3j s GLY 68 N 0.67 1.62 -0.28 -1.50 0.00 -1.25 0.12 107.32 106.70 1m3j s GLY 68 Ca -0.02 -1.56 -0.18 0.00 0.00 0.00 0.00 44.72 42.96 1m3j s GLY 68 CO -0.08 -1.54 0.76 1.25 0.00 0.00 0.00 173.10 173.49 1m3j s LYS 69 N -3.92 0.68 -0.19 2.90 2.20 0.35 -4.92 119.74 116.84 1m3j s LYS 69 Ca 0.37 1.06 -0.25 0.00 -0.36 0.00 0.00 55.97 56.80 1m3j s LYS 69 Cb -0.07 0.19 -0.01 0.00 -1.51 0.00 0.00 37.83 36.43 1m3j s LYS 69 CO 0.26 -0.12 0.83 -1.59 -0.36 0.00 0.00 175.35 174.36 1m3j s LYS 70 N 1.25 4.26 -0.48 4.03 0.00 -1.26 0.42 119.74 127.96 1m3j s LYS 70 Ca -0.07 0.99 0.06 0.00 0.00 0.00 0.00 55.97 56.95 1m3j s LYS 70 Cb -0.05 -3.60 0.18 0.00 0.00 0.00 0.00 37.83 34.37 1m3j s LYS 70 CO -0.14 -0.38 0.64 0.00 0.00 0.00 0.00 175.35 175.46 1m3j s ALA 71 N 2.35 -1.46 0.00 0.59 0.00 -1.09 -5.00 121.76 117.15 1m3j s ALA 71 Ca 0.37 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.60 1m3j s ALA 71 Cb -0.16 -2.50 0.00 0.00 0.00 0.00 0.00 23.12 20.46 1m3j s ALA 71 CO 0.11 -2.19 0.00 0.41 0.00 0.00 0.00 175.76 174.09 1m3j n GLY 72 N 3.13 -1.85 1.94 0.00 0.00 -1.26 -4.22 105.19 102.93 1m3j n GLY 72 Ca 0.19 -1.76 -0.00 0.00 0.00 0.00 0.00 46.02 44.45 1m3j n GLY 72 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1m3j n ASN 73 N 0.40 1.32 -3.80 1.61 3.02 -1.26 -4.69 115.26 111.86 1m3j n ASN 73 Ca 0.00 -1.39 -0.10 0.00 -0.03 0.00 0.00 54.58 53.06 1m3j n ASN 73 Cb 0.00 -0.29 -0.07 0.00 -0.61 0.00 0.00 39.78 38.81 1m3j n ASN 73 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1m3j s LYS 74 N 1.63 0.85 -0.24 3.52 1.02 -1.26 -3.51 119.74 121.75 1m3j s LYS 74 Ca 0.02 -0.77 0.02 0.00 0.02 0.00 0.00 55.97 55.27 1m3j s LYS 74 Cb 0.01 0.36 0.05 0.00 -0.52 0.00 0.00 37.83 37.73 1m3j s LYS 74 CO 0.00 -0.28 -0.12 0.12 -0.92 0.00 0.00 175.35 174.15 1m3j s PHE 75 N -3.36 3.03 0.04 3.18 5.36 -0.86 -2.67 117.98 122.71 1m3j s PHE 75 Ca 0.01 -2.09 -0.20 0.00 -0.96 0.00 0.00 56.93 53.69 1m3j s PHE 75 Cb 0.02 -1.87 -0.06 0.00 -0.34 0.00 0.00 43.02 40.77 1m3j s PHE 75 CO -0.08 -0.85 0.57 0.42 -1.46 0.00 0.00 175.22 173.82 1m3j s ILE 76 N 1.18 4.82 -0.18 3.12 -1.09 0.17 -2.05 121.20 127.18 1m3j s ILE 76 Ca -0.05 1.21 -0.00 0.00 -2.23 0.00 0.00 60.65 59.58 1m3j s ILE 76 Cb -0.18 -3.90 0.04 0.00 -1.58 0.00 0.00 42.46 36.84 1m3j s ILE 76 CO -0.07 0.50 -0.06 -0.69 -1.23 0.00 0.00 174.94 173.39 1m3j s VAL 77 N -0.72 1.21 0.32 2.92 1.01 -0.89 0.13 120.40 124.38 1m3j s VAL 77 Ca 0.30 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.62 1m3j s VAL 77 Cb -0.19 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 1m3j s VAL 77 CO 0.18 0.11 0.28 -0.69 0.00 0.00 0.00 175.10 174.99 1m3j s VAL 78 N 1.58 3.76 -0.11 2.92 1.01 0.32 -2.16 120.40 127.72 1m3j s VAL 78 Ca -0.00 -1.35 -0.11 0.00 0.00 0.00 0.00 61.98 60.52 1m3j s VAL 78 Cb -0.16 -3.25 0.03 0.00 0.00 0.00 0.00 36.38 33.00 1m3j s VAL 78 CO -0.08 -0.21 0.31 -1.61 0.00 0.00 0.00 175.10 173.51 1m3j s GLU 79 N -3.98 0.37 -0.32 2.72 2.02 -0.18 -1.74 118.70 117.59 1m3j s GLU 79 Ca 0.39 0.41 0.04 0.00 0.02 0.00 0.00 54.97 55.83 1m3j s GLU 79 Cb -0.06 0.18 0.09 0.00 0.10 0.00 0.00 34.13 34.44 1m3j s GLU 79 CO 0.27 -0.05 0.02 1.03 0.02 0.00 0.00 175.26 176.55 1m3j s ARG 80 N 0.11 1.58 0.09 1.61 1.81 -1.07 -2.55 118.95 120.53 1m3j s ARG 80 Ca -0.00 -1.73 0.03 0.00 -1.72 0.00 0.00 55.73 52.30 1m3j s ARG 80 Cb -0.02 -3.09 -0.04 0.00 -0.45 0.00 0.00 34.95 31.35 1m3j s ARG 80 CO 0.01 -0.87 0.11 -0.65 -0.68 0.00 0.00 175.30 173.21 1m3j s GLN 81 N 0.98 2.99 -0.14 3.54 -1.52 -1.22 -4.32 119.66 119.97 1m3j s GLN 81 Ca 0.07 -0.67 -0.22 0.00 -1.95 0.00 0.00 55.36 52.60 1m3j s GLN 81 Cb -0.19 -2.77 -0.03 0.00 -0.22 0.00 0.00 33.01 29.79 1m3j s GLN 81 CO -0.08 0.56 0.65 0.21 -0.25 0.00 0.00 175.29 176.38 1m3j s LYS 82 N -2.52 4.32 0.03 2.91 2.20 -1.26 -0.59 119.74 124.84 1m3j s LYS 82 Ca 0.30 0.72 0.08 0.00 -0.36 0.00 0.00 55.97 56.71 1m3j s LYS 82 Cb -0.12 -3.51 -0.03 0.00 -1.51 0.00 0.00 37.83 32.67 1m3j s LYS 82 CO 0.23 -0.08 -0.24 1.03 -0.36 0.00 0.00 175.35 175.94 1m3j s ARG 83 N 1.34 1.65 -0.38 4.03 1.81 0.24 -4.94 118.95 122.70 1m3j s ARG 83 Ca 0.32 -0.99 0.01 0.00 -1.72 0.00 0.00 55.73 53.35 1m3j s ARG 83 Cb -0.16 -1.76 0.12 0.00 -0.45 0.00 0.00 34.95 32.70 1m3j s ARG 83 CO 0.13 0.46 0.18 -1.12 -0.68 0.00 0.00 175.30 174.27 1m3j s SER 84 N -1.08 3.75 -0.48 0.23 0.01 -1.26 0.97 113.70 115.84 1m3j s SER 84 Ca 0.10 -2.21 -0.22 0.00 1.31 0.00 0.00 55.95 54.92 1m3j s SER 84 Cb -0.09 -0.93 0.04 0.00 0.21 0.00 0.00 66.02 65.25 1m3j s SER 84 CO 0.01 -0.33 0.75 -0.22 0.41 0.00 0.00 173.24 173.86 1m3j s LEU 85 N 0.89 4.45 -0.14 2.44 2.96 -0.41 -4.94 118.68 123.95 1m3j s LEU 85 Ca 0.15 -0.42 -0.04 0.00 -0.22 0.00 0.00 54.13 53.60 1m3j s LEU 85 Cb -0.22 -2.75 -0.03 0.00 0.50 0.00 0.00 46.19 43.69 1m3j s LEU 85 CO -0.09 -0.95 -0.00 0.28 -1.32 0.00 0.00 176.35 174.27 1m3j s THR 86 N 3.16 4.24 -0.02 3.68 -1.32 -1.26 -3.08 115.64 121.04 1m3j s THR 86 Ca 0.25 -0.25 -0.07 0.00 -1.21 0.00 0.00 61.69 60.41 1m3j s THR 86 Cb -0.14 -2.84 0.01 0.00 -1.51 0.00 0.00 72.50 68.01 1m3j s THR 86 CO 0.18 0.53 0.15 0.42 -2.21 0.00 0.00 174.62 173.69 1m3j s THR 87 N -0.08 0.06 -0.42 5.08 -4.23 -0.35 -5.03 115.64 110.67 1m3j s THR 87 Ca 0.04 -0.47 0.02 0.00 -1.18 0.00 0.00 61.69 60.09 1m3j s THR 87 Cb -0.13 -0.38 0.13 0.00 1.34 0.00 0.00 72.50 73.46 1m3j s THR 87 CO 0.02 -0.26 0.20 -0.44 -0.54 0.00 0.00 174.62 173.60 1m3j s SER 88 N -0.93 3.83 0.49 3.99 0.01 -1.26 -1.39 113.70 118.45 1m3j s SER 88 Ca -0.10 -2.45 -0.09 0.00 1.31 0.00 0.00 55.95 54.62 1m3j s SER 88 Cb -0.06 -1.08 -0.05 0.00 0.21 0.00 0.00 66.02 65.04 1m3j s SER 88 CO 0.01 -0.30 0.84 -2.16 0.41 0.00 0.00 173.24 172.05 1m3j s PRO 89 N 0.57 3.65 0.00 12.44 0.04 -0.99 -4.79 135.00 145.92 1m3j s PRO 89 Ca 0.16 0.44 0.00 0.00 0.04 0.00 0.00 61.00 61.63 1m3j s PRO 89 Cb -0.23 -2.30 0.00 0.00 0.04 0.00 0.00 34.50 32.01 1m3j s PRO 89 CO -0.04 -0.24 0.00 1.33 0.04 0.00 0.00 177.00 178.09 1m3j n VAL 90 N -2.04 0.00 -2.35 -0.36 0.24 -1.26 -0.66 118.33 111.90 1m3j n VAL 90 Ca 0.03 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 61.97 1m3j n VAL 90 Cb 0.54 -0.99 -0.04 0.00 -1.47 0.00 0.00 33.84 31.89 1m3j n VAL 90 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1m3j s ASP 91 N -4.50 5.92 0.20 -1.34 2.15 -1.26 -4.44 116.67 113.40 1m3j s ASP 91 Ca 0.00 -0.99 -0.21 0.00 0.43 0.00 0.00 52.55 51.78 1m3j s ASP 91 Cb 0.00 -2.56 -0.08 0.00 -0.30 0.00 0.00 42.92 39.98 1m3j s ASP 91 CO 0.00 -2.02 0.73 -0.63 -0.17 0.00 0.00 175.17 173.08 1m3j s ILE 92 N 7.08 4.53 -0.19 4.11 1.01 -0.47 -4.83 121.20 132.43 1m3j s ILE 92 Ca 0.55 1.39 -0.15 0.00 0.00 0.00 0.00 60.65 62.44 1m3j s ILE 92 Cb -0.04 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 1m3j s ILE 92 CO -0.03 0.30 0.34 -0.55 0.00 0.00 0.00 174.94 175.00 1m3j s SER 93 N -1.50 6.40 -0.04 3.58 0.15 -1.26 0.12 113.70 121.14 1m3j s SER 93 Ca 0.41 0.47 -0.30 0.00 0.70 0.00 0.00 55.95 57.23 1m3j s SER 93 Cb -0.18 -2.20 -0.02 0.00 -1.71 0.00 0.00 66.02 61.90 1m3j s SER 93 CO 0.22 -0.01 1.00 -0.63 1.20 0.00 0.00 173.24 175.03 1m3j s ILE 94 N 1.02 4.80 0.00 6.45 1.01 -0.23 -4.85 121.20 129.40 1m3j s ILE 94 Ca 0.17 2.03 0.00 0.00 0.00 0.00 0.00 60.65 62.85 1m3j s ILE 94 Cb -0.14 -4.30 0.00 0.00 0.01 0.00 0.00 42.46 38.03 1m3j s ILE 94 CO 0.06 0.09 0.23 -0.38 0.00 0.00 0.00 174.94 174.95 1m3j n ILE 95 N 4.17 0.00 -1.55 2.92 2.08 -1.26 -4.24 119.36 121.48 1m3j n ILE 95 Ca 0.07 0.70 -0.14 0.00 0.56 0.00 0.00 62.75 63.95 1m3j n ILE 95 Cb 0.50 -1.64 -0.09 0.00 -0.75 0.00 0.00 39.64 37.66 1m3j n ILE 95 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1m3j n ASP 96 N -0.25 1.41 0.00 4.38 8.00 -1.26 -4.79 116.55 124.03 1m3j n ASP 96 Ca 0.00 -1.49 0.00 0.00 0.71 0.00 0.00 54.79 54.01 1m3j n ASP 96 Cb 0.00 -1.55 0.00 0.00 -0.02 0.00 0.00 41.12 39.55 1m3j n ASP 96 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1m3j n SER 97 N 17.45 0.00 -0.07 -2.24 7.64 -1.26 -0.53 113.62 134.60 1m3j n SER 97 Ca 0.48 0.58 0.00 0.00 1.01 0.00 0.00 58.87 60.94 1m3j n SER 97 Cb 0.41 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 1m3j n SER 97 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1m3j n VAL 98 N -0.94 0.00 0.00 0.44 0.24 -1.22 -4.34 118.33 112.52 1m3j n VAL 98 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1m3j n VAL 98 Cb 0.00 -0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.12 1m3j n VAL 98 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1m3j n ASN 99 N -0.39 0.00 -2.17 -1.34 4.13 -0.79 -5.09 115.26 109.61 1m3j n ASN 99 Ca 0.00 0.00 -0.24 0.00 1.68 0.00 0.00 54.58 56.02 1m3j n ASN 99 Cb 0.02 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.24 1m3j n ASN 99 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1m3j n ASP 100 N 0.00 -0.59 -3.99 6.41 -0.08 0.31 -4.93 116.55 113.67 1m3j n ASP 100 Ca 0.00 0.56 -0.30 0.00 -1.51 0.00 0.00 54.79 53.53 1m3j n ASP 100 Cb 0.00 -0.47 -0.16 0.00 2.34 0.00 0.00 41.12 42.83 1m3j n ASP 100 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1m3j s ARG 101 N -0.47 2.02 0.07 -0.67 3.03 -1.26 -4.83 118.95 116.84 1m3j s ARG 101 Ca 0.32 -0.84 0.06 0.00 2.03 0.00 0.00 55.73 57.29 1m3j s ARG 101 Cb -0.47 -2.42 -0.03 0.00 -1.03 0.00 0.00 34.95 31.01 1m3j s ARG 101 CO 0.28 -0.43 -0.15 -0.08 -1.13 0.00 0.00 175.30 173.79 1m3j s THR 102 N 1.40 1.19 0.22 4.99 -1.32 -1.26 -5.07 115.64 115.78 1m3j s THR 102 Ca -0.01 -1.32 -0.21 0.00 -1.21 0.00 0.00 61.69 58.93 1m3j s THR 102 Cb -0.16 -1.13 0.04 0.00 -1.51 0.00 0.00 72.50 69.73 1m3j s THR 102 CO -0.08 -0.19 0.62 -0.72 -2.21 0.00 0.00 174.62 172.04 1m3j s TYR 103 N -1.24 -0.29 -0.31 9.09 -0.85 -1.26 -5.01 117.35 117.47 1m3j s TYR 103 Ca -0.01 -0.05 -0.27 0.00 -0.52 0.00 0.00 57.07 56.22 1m3j s TYR 103 Cb -0.10 0.57 -0.06 0.00 0.38 0.00 0.00 41.96 42.75 1m3j s TYR 103 CO 0.02 -1.02 2.29 -1.25 -1.52 0.00 0.00 175.55 174.08 1m3j s PRO 104 N -3.85 2.76 0.00 -3.49 0.04 -1.26 -1.30 135.00 127.90 1m3j s PRO 104 Ca 0.07 1.81 0.00 0.00 0.04 0.00 0.00 61.00 62.92 1m3j s PRO 104 Cb -0.03 -4.45 0.00 0.00 0.04 0.00 0.00 34.50 30.06 1m3j s PRO 104 CO -0.03 -2.53 0.00 0.41 0.04 0.00 0.00 177.00 174.90 1m3j n GLY 105 N 5.85 4.16 3.55 0.56 0.00 -1.17 -4.85 105.19 113.29 1m3j n GLY 105 Ca 0.32 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 1m3j n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m3j n ALA 106 N 0.00 -0.62 -3.79 4.61 0.00 -0.42 -4.60 120.51 115.70 1m3j n ALA 106 Ca 0.00 0.27 -0.34 0.00 0.00 0.00 0.00 53.44 53.37 1m3j n ALA 106 Cb 0.00 -1.95 -0.14 0.00 0.00 0.00 0.00 19.45 17.37 1m3j n ALA 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1m3j s LEU 107 N 0.64 4.12 -0.11 0.00 1.02 -1.26 -2.06 118.68 121.04 1m3j s LEU 107 Ca 0.62 -1.51 0.00 0.00 0.02 0.00 0.00 54.13 53.26 1m3j s LEU 107 Cb -0.64 -1.69 -0.02 0.00 0.02 0.00 0.00 46.19 43.86 1m3j s LEU 107 CO 0.58 -0.30 -0.11 -1.10 0.02 0.00 0.00 176.35 175.44 1m3j s GLN 108 N 1.17 3.17 0.48 1.70 -0.21 -0.02 0.17 119.66 126.10 1m3j s GLN 108 Ca -0.02 -0.64 -0.23 0.00 0.02 0.00 0.00 55.36 54.50 1m3j s GLN 108 Cb -0.20 -2.63 -0.07 0.00 1.00 0.00 0.00 33.01 31.11 1m3j s GLN 108 CO -0.03 0.37 1.22 -0.51 -2.12 0.00 0.00 175.29 174.22 1m3j s LEU 109 N -0.04 3.98 -0.91 2.90 1.43 -1.25 -0.15 118.68 124.64 1m3j s LEU 109 Ca -0.02 2.43 -0.19 0.00 -1.03 0.00 0.00 54.13 55.32 1m3j s LEU 109 Cb -0.14 -4.23 0.12 0.00 0.03 0.00 0.00 46.19 41.97 1m3j s LEU 109 CO 0.04 -1.07 1.13 0.00 0.23 0.00 0.00 176.35 176.67 1m3j s ALA 110 N -1.47 3.30 0.28 4.21 0.00 0.94 -4.67 121.76 124.35 1m3j s ALA 110 Ca 0.65 -2.65 0.05 0.00 0.00 0.00 0.00 51.96 50.01 1m3j s ALA 110 Cb -0.32 -4.06 -0.02 0.00 0.00 0.00 0.00 23.12 18.72 1m3j s ALA 110 CO 0.38 -3.00 0.19 -0.40 0.00 0.00 0.00 175.76 172.94 1m3j n ASP 111 N 6.79 -0.06 -0.13 0.00 5.68 -1.26 -4.11 116.55 123.46 1m3j n ASP 111 Ca 0.22 -2.71 -0.09 0.00 -0.50 0.00 0.00 54.79 51.71 1m3j n ASP 111 Cb 0.49 1.17 -0.01 0.00 -1.14 0.00 0.00 41.12 41.63 1m3j n ASP 111 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1m3j h LYS 112 N 0.00 0.56 -0.97 0.11 2.10 -1.91 -2.33 116.57 114.14 1m3j h LYS 112 Ca -0.20 -0.08 0.22 0.00 -2.00 0.00 0.00 60.65 58.59 1m3j h LYS 112 Cb 0.94 -0.10 -0.18 0.00 -0.90 0.00 0.00 32.23 31.99 1m3j h LYS 112 CO 0.30 0.49 -0.13 0.00 -2.00 0.00 0.00 179.45 178.11 1m3j n ALA 113 N -2.27 0.35 -0.14 0.07 0.00 -1.26 0.14 120.51 117.39 1m3j n ALA 113 Ca -0.00 1.05 -0.04 0.00 0.00 0.00 0.00 53.44 54.45 1m3j n ALA 113 Cb 0.10 -0.69 0.02 0.00 0.00 0.00 0.00 19.45 18.89 1m3j n ALA 113 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1m3j h LEU 114 N 0.00 -0.56 -1.04 0.00 5.85 -1.53 -1.03 115.31 117.00 1m3j h LEU 114 Ca 0.52 0.15 0.08 0.00 0.84 0.00 0.00 57.88 59.47 1m3j h LEU 114 Cb 0.92 0.33 -0.07 0.00 0.37 0.00 0.00 40.66 42.22 1m3j h LEU 114 CO -0.96 -0.19 0.63 0.58 -0.34 0.00 0.00 178.44 178.16 1m3j h VAL 115 N -0.06 1.03 -0.02 1.05 2.07 0.12 -0.44 116.25 119.99 1m3j h VAL 115 Ca 0.22 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 1m3j h VAL 115 Cb 0.39 -0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.00 1m3j h VAL 115 CO -0.50 0.20 0.00 -0.62 0.02 0.00 0.00 177.57 176.68 1m3j n GLU 116 N -4.53 1.14 -2.05 1.57 1.02 -0.45 -4.81 120.64 112.52 1m3j n GLU 116 Ca 0.16 -0.12 -0.17 0.00 -0.02 0.00 0.00 57.16 57.01 1m3j n GLU 116 Cb 0.24 -1.46 -0.03 0.00 -0.02 0.00 0.00 31.44 30.17 1m3j n GLU 116 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1m3j n ASN 117 N 0.08 -4.87 -3.16 1.62 4.13 -0.17 -4.85 115.26 108.03 1m3j n ASN 117 Ca 0.01 0.21 -0.21 0.00 1.68 0.00 0.00 54.58 56.28 1m3j n ASN 117 Cb 0.32 -4.20 -0.04 0.00 -1.54 0.00 0.00 39.78 34.33 1m3j n ASN 117 CO 0.00 0.00 0.00 -2.11 0.28 0.00 0.00 177.26 175.43 1m3j n ARG 118 N -2.62 1.34 -2.27 3.52 1.85 -0.84 -4.48 116.66 113.17 1m3j n ARG 118 Ca -0.19 -3.63 -0.40 0.00 -1.00 0.00 0.00 57.85 52.62 1m3j n ARG 118 Cb 0.62 -1.74 -0.03 0.00 -1.05 0.00 0.00 32.46 30.26 1m3j n ARG 118 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1m3j s PRO 119 N -2.43 4.41 0.81 2.89 0.04 -1.21 -3.89 135.00 135.62 1m3j s PRO 119 Ca 0.41 2.01 -0.11 0.00 0.04 0.00 0.00 61.00 63.35 1m3j s PRO 119 Cb 0.31 -3.05 0.08 0.00 0.04 0.00 0.00 34.50 31.87 1m3j s PRO 119 CO -0.09 -0.06 1.09 0.99 0.04 0.00 0.00 177.00 178.97 1m3j s THR 120 N -1.19 3.11 0.09 1.26 2.01 -1.26 -4.87 115.64 114.79 1m3j s THR 120 Ca 0.48 0.36 0.07 0.00 0.31 0.00 0.00 61.69 62.91 1m3j s THR 120 Cb -0.36 -2.81 -0.03 0.00 0.01 0.00 0.00 72.50 69.31 1m3j s THR 120 CO 0.46 -0.47 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.11 1m3j s ILE 121 N -2.89 1.49 -0.18 1.82 -1.09 -1.26 -3.89 121.20 115.20 1m3j s ILE 121 Ca 0.62 -1.42 -0.06 0.00 -2.23 0.00 0.00 60.65 57.55 1m3j s ILE 121 Cb -0.18 -1.37 -0.04 0.00 -1.58 0.00 0.00 42.46 39.30 1m3j s ILE 121 CO 0.56 -0.09 0.03 -0.76 -1.23 0.00 0.00 174.94 173.45 1m3j s LEU 122 N -1.77 3.59 -0.23 2.97 1.43 0.13 -4.95 118.68 119.84 1m3j s LEU 122 Ca 0.04 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 1m3j s LEU 122 Cb -0.10 -1.90 0.06 0.00 0.03 0.00 0.00 46.19 44.28 1m3j s LEU 122 CO 0.03 0.15 -0.07 -0.04 0.23 0.00 0.00 176.35 176.65 1m3j s MET 123 N 0.51 1.79 0.23 1.70 -1.94 -1.26 -4.31 119.30 116.01 1m3j s MET 123 Ca 0.01 -1.02 -0.03 0.00 -1.71 0.00 0.00 55.69 52.94 1m3j s MET 123 Cb -0.13 -2.60 -0.03 0.00 2.01 0.00 0.00 34.83 34.07 1m3j s MET 123 CO 0.01 -0.56 0.24 0.14 -0.01 0.00 0.00 175.02 174.84 1m3j s VAL 124 N 1.35 0.00 0.15 -6.03 -7.23 -1.26 -5.11 120.40 102.27 1m3j s VAL 124 Ca -0.06 -1.84 -0.31 0.00 -1.81 0.00 0.00 61.98 57.96 1m3j s VAL 124 Cb -0.19 -2.44 -0.09 0.00 0.56 0.00 0.00 36.38 34.23 1m3j s VAL 124 CO -0.06 0.00 1.45 -0.75 -0.31 0.00 0.00 175.10 175.42 1m3j s LYS 125 N -4.02 4.29 -0.13 4.82 2.20 -1.26 -4.99 119.74 120.65 1m3j s LYS 125 Ca 0.35 2.19 -0.02 0.00 -0.36 0.00 0.00 55.97 58.13 1m3j s LYS 125 Cb 0.05 -3.20 -0.03 0.00 -1.51 0.00 0.00 37.83 33.14 1m3j s LYS 125 CO 0.13 -0.47 -0.06 1.03 -0.36 0.00 0.00 175.35 175.62 1m3j s ARG 126 N 0.83 3.37 0.02 4.03 1.81 -1.26 -2.06 118.95 125.69 1m3j s ARG 126 Ca 0.65 -0.54 -0.17 0.00 -1.72 0.00 0.00 55.73 53.95 1m3j s ARG 126 Cb -0.40 -2.79 -0.06 0.00 -0.45 0.00 0.00 34.95 31.25 1m3j s ARG 126 CO 0.33 0.37 0.47 0.15 -0.68 0.00 0.00 175.30 175.94 1m3j s LYS 127 N -0.00 4.06 0.66 3.54 1.02 0.23 -4.53 119.74 124.72 1m3j s LYS 127 Ca -0.00 0.54 -0.15 0.00 0.02 0.00 0.00 55.97 56.38 1m3j s LYS 127 Cb -0.13 -3.25 -0.13 0.00 -0.52 0.00 0.00 37.83 33.80 1m3j s LYS 127 CO 0.03 0.63 -0.42 -2.30 -0.92 0.00 0.00 175.35 172.36 1m3j n PRO 128 N 1.94 0.00 -4.07 -1.68 -0.02 -1.23 -4.71 135.00 125.23 1m3j n PRO 128 Ca -0.12 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.22 1m3j n PRO 128 Cb 0.52 -0.85 -0.04 0.00 -0.02 0.00 0.00 33.50 33.11 1m3j n PRO 128 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1m3j s ILE 129 N -1.70 0.00 -0.06 4.25 2.07 -0.96 -4.93 121.20 119.86 1m3j s ILE 129 Ca 0.41 -1.55 0.05 0.00 -1.41 0.00 0.00 60.65 58.14 1m3j s ILE 129 Cb -0.28 -2.62 -0.00 0.00 0.13 0.00 0.00 42.46 39.69 1m3j s ILE 129 CO 0.64 0.00 -0.22 0.20 -1.91 0.00 0.00 174.94 173.65 1m3j s ASN 130 N -3.21 2.74 0.22 4.50 0.02 -1.26 -0.12 114.94 117.83 1m3j s ASN 130 Ca 0.29 -0.47 0.06 0.00 -1.02 0.00 0.00 52.86 51.72 1m3j s ASN 130 Cb -0.01 -0.90 -0.04 0.00 0.02 0.00 0.00 41.25 40.33 1m3j s ASN 130 CO 0.19 0.19 0.21 -0.63 0.02 0.00 0.00 177.10 177.08 1m3j s ILE 131 N 0.05 4.64 -0.25 0.60 1.09 -0.10 -2.55 121.20 124.68 1m3j s ILE 131 Ca -0.08 -1.21 -0.14 0.00 -1.10 0.00 0.00 60.65 58.13 1m3j s ILE 131 Cb -0.14 -3.46 0.08 0.00 -1.06 0.00 0.00 42.46 37.87 1m3j s ILE 131 CO 0.04 -0.27 0.60 0.20 -0.10 0.00 0.00 174.94 175.42 1m3j s ASN 132 N -3.62 -0.81 0.12 3.58 -0.87 -1.10 -2.63 114.94 109.60 1m3j s ASN 132 Ca 0.33 1.32 -0.00 0.00 -1.57 0.00 0.00 52.86 52.94 1m3j s ASN 132 Cb -0.09 1.23 -0.04 0.00 -0.02 0.00 0.00 41.25 42.33 1m3j s ASN 132 CO 0.25 -0.22 0.28 -0.51 -2.57 0.00 0.00 177.10 174.33 1m3j s ILE 133 N 1.62 5.31 -2.13 0.60 2.07 -1.11 -0.37 121.20 127.20 1m3j s ILE 133 Ca -0.10 -0.41 0.17 0.00 -1.41 0.00 0.00 60.65 58.90 1m3j s ILE 133 Cb -0.06 -3.68 0.44 0.00 0.13 0.00 0.00 42.46 39.28 1m3j s ILE 133 CO -0.18 0.01 1.41 -0.90 -1.91 0.00 0.00 174.94 173.37 1m3j n ASP 134 N -0.13 2.52 -4.62 4.50 3.85 -1.24 -4.91 116.55 116.52 1m3j n ASP 134 Ca -0.05 -1.93 -0.45 0.00 -0.71 0.00 0.00 54.79 51.65 1m3j n ASP 134 Cb 0.52 -0.27 -0.02 0.00 -1.35 0.00 0.00 41.12 40.01 1m3j n ASP 134 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1m3j n LEU 135 N 0.87 2.26 -4.76 -2.12 4.77 -1.26 -4.92 117.00 111.84 1m3j n LEU 135 Ca 0.17 1.18 -0.38 0.00 -0.03 0.00 0.00 56.01 56.95 1m3j n LEU 135 Cb 0.42 -1.33 0.01 0.00 -2.33 0.00 0.00 43.42 40.19 1m3j n LEU 135 CO 0.12 -1.10 0.90 -2.16 -1.33 0.00 0.00 177.39 173.83 1m3j s PRO 136 N -1.31 3.50 -0.67 3.23 0.04 -1.26 -3.92 135.00 134.62 1m3j s PRO 136 Ca 0.61 1.98 -0.00 0.00 0.04 0.00 0.00 61.00 63.63 1m3j s PRO 136 Cb -0.69 -2.36 0.00 0.00 0.04 0.00 0.00 34.50 31.50 1m3j s PRO 136 CO 0.58 -0.82 0.05 0.41 0.04 0.00 0.00 177.00 177.26 1m3j n GLY 137 N 0.57 0.08 0.00 0.56 0.00 -1.26 -4.91 105.19 100.23 1m3j n GLY 137 Ca 0.08 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1m3j n GLY 137 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1m3j n LEU 138 N -1.28 0.14 -4.43 0.99 7.94 -1.25 -5.06 117.00 114.05 1m3j n LEU 138 Ca -0.08 -0.19 -0.47 0.00 -1.11 0.00 0.00 56.01 54.16 1m3j n LEU 138 Cb 0.57 0.00 -0.13 0.00 0.53 0.00 0.00 43.42 44.39 1m3j n LEU 138 CO 0.13 0.03 2.04 0.29 -1.11 0.00 0.00 177.39 178.77 1m3j n LYS 139 N -0.10 0.15 0.00 1.96 5.02 -1.26 -0.79 118.16 123.15 1m3j n LYS 139 Ca 0.00 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1m3j n LYS 139 Cb 0.11 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 1m3j n LYS 139 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1m3j n GLY 140 N 6.76 0.90 0.06 0.72 0.00 -1.26 -4.90 105.19 107.47 1m3j n GLY 140 Ca 0.59 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.62 1m3j n GLY 140 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1m3j n GLU 141 N 0.00 1.47 -0.76 1.61 0.28 0.03 -4.80 120.64 118.48 1m3j n GLU 141 Ca 0.00 -1.25 -0.13 0.00 -0.16 0.00 0.00 57.16 55.63 1m3j n GLU 141 Cb 0.00 -0.84 0.04 0.00 1.43 0.00 0.00 31.44 32.07 1m3j n GLU 141 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1m3j n ASN 142 N -0.40 5.66 -3.70 -1.84 0.23 -1.09 -4.86 115.26 109.25 1m3j n ASN 142 Ca 0.02 -2.89 -0.13 0.00 -0.53 0.00 0.00 54.58 51.05 1m3j n ASN 142 Cb 0.43 -0.98 -0.13 0.00 -2.08 0.00 0.00 39.78 37.02 1m3j n ASN 142 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 1m3j s SER 143 N 0.40 -0.07 0.40 0.53 0.01 -1.26 -2.74 113.70 110.98 1m3j s SER 143 Ca 0.25 0.57 0.06 0.00 1.31 0.00 0.00 55.95 58.14 1m3j s SER 143 Cb 0.20 0.53 -0.07 0.00 0.21 0.00 0.00 66.02 66.89 1m3j s SER 143 CO 0.01 -0.19 0.02 -0.51 0.41 0.00 0.00 173.24 172.97 1m3j s ILE 144 N 1.67 1.76 0.11 1.44 1.10 -1.08 -4.96 121.20 121.24 1m3j s ILE 144 Ca -0.06 -2.00 0.08 0.00 -0.51 0.00 0.00 60.65 58.16 1m3j s ILE 144 Cb -0.11 -2.88 -0.04 0.00 0.15 0.00 0.00 42.46 39.58 1m3j s ILE 144 CO -0.09 0.00 -0.13 -0.75 -2.11 0.00 0.00 174.94 171.87 1m3j s LYS 145 N -3.76 2.01 -0.43 3.50 2.20 -1.26 -0.92 119.74 121.07 1m3j s LYS 145 Ca 0.32 -1.08 0.02 0.00 -0.36 0.00 0.00 55.97 54.88 1m3j s LYS 145 Cb 0.09 -2.24 0.12 0.00 -1.51 0.00 0.00 37.83 34.29 1m3j s LYS 145 CO 0.16 0.50 0.18 0.08 -0.36 0.00 0.00 175.35 175.91 1m3j s VAL 146 N -1.20 2.67 0.54 4.02 1.01 0.83 -4.95 120.40 123.31 1m3j s VAL 146 Ca 0.20 -2.68 0.27 0.00 0.00 0.00 0.00 61.98 59.77 1m3j s VAL 146 Cb -0.11 -2.88 0.41 0.00 0.00 0.00 0.00 36.38 33.80 1m3j s VAL 146 CO 0.13 -0.70 1.97 0.44 0.00 0.00 0.00 175.10 176.94 1m3j h ASP 147 N 7.26 0.00 -2.27 3.32 5.19 -1.94 -2.56 116.42 125.42 1m3j h ASP 147 Ca -0.06 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.81 1m3j h ASP 147 Cb 0.98 0.00 -0.36 0.00 0.18 0.00 0.00 39.33 40.13 1m3j h ASP 147 CO 0.62 0.00 -0.89 -0.62 -3.12 0.00 0.00 179.24 175.23 1m3j s ASP 148 N -6.01 1.53 -0.55 6.45 3.68 -1.26 -3.55 116.67 116.95 1m3j s ASP 148 Ca -0.05 -2.63 -0.39 0.00 2.13 0.00 0.00 52.55 51.61 1m3j s ASP 148 Cb 0.19 -0.16 -0.17 0.00 -1.45 0.00 0.00 42.92 41.33 1m3j s ASP 148 CO 0.71 -0.20 2.26 -2.65 0.13 0.00 0.00 175.17 175.42 1m3j n PRO 149 N 3.26 0.27 -3.51 4.34 -0.02 -1.24 -4.73 135.00 133.37 1m3j n PRO 149 Ca 0.23 0.06 -0.15 0.00 -2.02 0.00 0.00 63.50 61.62 1m3j n PRO 149 Cb 0.46 -1.78 -0.05 0.00 -0.02 0.00 0.00 33.50 32.11 1m3j n PRO 149 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1m3j s THR 150 N 7.03 0.00 0.00 3.45 2.01 -1.26 -4.86 115.64 122.01 1m3j s THR 150 Ca 1.20 0.00 0.00 0.00 0.31 0.00 0.00 61.69 63.20 1m3j s THR 150 Cb -1.27 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 70.24 1m3j s THR 150 CO 0.58 0.00 0.49 0.00 -0.69 0.00 0.00 174.62 175.00 1m3j n TYR 151 N 0.55 0.00 -0.36 4.92 9.36 -1.26 0.29 117.16 130.66 1m3j n TYR 151 Ca -0.17 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 60.97 1m3j n TYR 151 Cb 0.59 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 39.23 1m3j n TYR 151 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1m3j n GLY 152 N -0.96 -2.22 0.00 2.98 0.00 -1.26 0.62 105.19 104.36 1m3j n GLY 152 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 46.02 47.05 1m3j n GLY 152 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1m3j n LYS 153 N -5.12 0.00 -0.37 1.61 3.00 0.06 -0.17 118.16 117.18 1m3j n LYS 153 Ca 0.03 0.59 -0.06 0.00 -0.00 0.00 0.00 58.31 58.86 1m3j n LYS 153 Cb 0.24 -1.11 -0.02 0.00 0.00 0.00 0.00 35.03 34.14 1m3j n LYS 153 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1m3j h VAL 154 N 0.00 0.01 -0.14 3.15 2.07 0.63 -1.14 116.25 120.82 1m3j h VAL 154 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1m3j h VAL 154 Cb 0.00 0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 29.74 1m3j h VAL 154 CO 0.00 0.00 -0.33 0.28 0.02 0.00 0.00 177.57 177.54 1m3j h SER 155 N -0.04 -1.08 -0.73 0.57 0.02 0.79 -0.42 113.55 112.67 1m3j h SER 155 Ca 0.25 0.13 0.12 0.00 -0.84 0.00 0.00 61.79 61.46 1m3j h SER 155 Cb 0.52 0.43 -0.13 0.00 0.14 0.00 0.00 62.40 63.36 1m3j h SER 155 CO -0.92 -0.27 -0.34 1.23 -1.14 0.00 0.00 176.83 175.38 1m3j h GLY 156 N -0.31 0.00 -0.36 -3.77 0.00 0.26 0.28 103.07 99.18 1m3j h GLY 156 Ca 0.03 0.45 0.05 0.00 0.00 0.00 0.00 47.33 47.86 1m3j h GLY 156 CO -0.30 -0.21 -0.52 0.00 0.00 0.00 0.00 176.54 175.51 1m3j h ALA 157 N 1.18 -0.68 -0.59 3.60 0.00 -0.37 0.32 119.26 122.72 1m3j h ALA 157 Ca 0.28 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.32 1m3j h ALA 157 Cb 0.57 1.05 -0.10 0.00 0.00 0.00 0.00 17.79 19.30 1m3j h ALA 157 CO -0.79 -1.00 -0.06 0.82 0.00 0.00 0.00 179.25 178.22 1m3j h ILE 158 N -0.39 0.47 -0.36 0.00 2.04 0.84 0.63 117.51 120.74 1m3j h ILE 158 Ca 0.09 -0.02 0.08 0.00 1.00 0.00 0.00 64.86 66.00 1m3j h ILE 158 Cb 0.60 0.40 -0.09 0.00 -0.74 0.00 0.00 36.82 37.00 1m3j h ILE 158 CO -0.58 0.01 -0.30 0.44 0.00 0.00 0.00 178.15 177.72 1m3j h ASP 159 N 0.06 -1.00 -0.81 1.72 3.45 0.28 1.19 116.42 121.31 1m3j h ASP 159 Ca 0.30 0.18 0.02 0.00 0.43 0.00 0.00 57.03 57.95 1m3j h ASP 159 Cb 0.47 0.47 -0.04 0.00 -0.56 0.00 0.00 39.33 39.67 1m3j h ASP 159 CO -0.54 -0.31 0.53 -0.08 -1.57 0.00 0.00 179.24 177.26 1m3j h GLU 160 N -0.25 1.03 0.63 3.56 4.81 0.17 -1.78 114.58 122.75 1m3j h GLU 160 Ca 0.16 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.30 1m3j h GLU 160 Cb 0.52 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1m3j h GLU 160 CO -0.50 0.68 -0.40 -0.07 -0.73 0.00 0.00 179.01 178.00 1m3j h LEU 161 N 1.07 -1.00 0.00 1.64 3.38 0.32 -1.58 115.31 119.13 1m3j h LEU 161 Ca 0.30 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1m3j h LEU 161 Cb -0.09 0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1m3j h LEU 161 CO -0.08 -0.60 0.00 0.52 0.09 0.00 0.00 178.44 178.37 1m3j n VAL 162 N -4.89 0.00 -0.36 1.22 0.31 0.38 -1.61 118.33 113.38 1m3j n VAL 162 Ca -0.12 1.43 -0.06 0.00 -0.01 0.00 0.00 64.34 65.59 1m3j n VAL 162 Cb 0.40 -1.99 -0.03 0.00 -0.91 0.00 0.00 33.84 31.32 1m3j n VAL 162 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1m3j n SER 163 N -2.61 -0.78 -0.35 4.52 3.41 -0.69 0.13 113.62 117.26 1m3j n SER 163 Ca 0.00 1.59 0.33 0.00 -0.26 0.00 0.00 58.87 60.52 1m3j n SER 163 Cb 0.00 -0.28 0.60 0.00 -0.26 0.00 0.00 64.21 64.27 1m3j n SER 163 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1m3j h LYS 164 N 0.00 0.03 0.29 4.33 3.64 -0.29 1.01 116.57 125.59 1m3j h LYS 164 Ca 0.23 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1m3j h LYS 164 Cb 0.45 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1m3j h LYS 164 CO -0.87 0.02 -0.14 2.35 -2.27 0.00 0.00 179.45 178.54 1m3j h TRP 165 N 0.03 -0.37 -0.94 1.91 7.01 0.15 -2.39 115.95 121.36 1m3j h TRP 165 Ca 0.85 -0.01 0.28 0.00 2.11 0.00 0.00 58.89 62.11 1m3j h TRP 165 Cb 2.31 0.12 -0.16 0.00 -2.10 0.00 0.00 29.16 29.33 1m3j h TRP 165 CO -0.01 -0.11 0.19 -0.91 -2.79 0.00 0.00 178.44 174.81 1m3j h ASN 166 N -0.57 -0.16 -0.62 2.65 2.35 0.13 0.60 115.58 119.95 1m3j h ASN 166 Ca -0.04 0.24 -0.02 0.00 -0.55 0.00 0.00 56.30 55.93 1m3j h ASN 166 Cb 0.42 0.36 -0.03 0.00 0.05 0.00 0.00 38.32 39.12 1m3j h ASN 166 CO 0.07 -0.28 0.31 -0.33 -1.65 0.00 0.00 177.43 175.55 1m3j h GLU 167 N 0.09 0.89 0.00 0.81 3.07 -0.94 0.23 114.58 118.73 1m3j h GLU 167 Ca 0.61 -0.12 0.00 0.00 -0.50 0.00 0.00 59.36 59.35 1m3j h GLU 167 Cb 1.32 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 29.07 1m3j h GLU 167 CO -0.78 0.70 0.00 -0.22 -1.40 0.00 0.00 179.01 177.31 1m3j h LYS 168 N 0.85 0.00 -2.36 2.33 3.64 0.46 -3.31 116.57 118.18 1m3j h LYS 168 Ca 0.21 0.00 -0.59 0.00 -1.27 0.00 0.00 60.65 59.01 1m3j h LYS 168 Cb 0.10 0.00 -0.39 0.00 -0.41 0.00 0.00 32.23 31.53 1m3j h LYS 168 CO -0.03 0.00 -0.95 0.66 -2.27 0.00 0.00 179.45 176.86 1m3j n TYR 169 N -2.67 -0.29 0.05 1.91 4.02 0.12 -4.96 117.16 115.33 1m3j n TYR 169 Ca 0.03 -3.47 -0.09 0.00 -0.01 0.00 0.00 57.90 54.36 1m3j n TYR 169 Cb 0.37 0.04 -0.13 0.00 -0.02 0.00 0.00 39.34 39.61 1m3j n TYR 169 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 1m3j h SER 170 N 5.26 0.06 -0.11 7.72 0.02 -0.70 -3.29 113.55 122.50 1m3j h SER 170 Ca 0.22 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1m3j h SER 170 Cb 0.88 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.40 1m3j h SER 170 CO 0.43 1.06 0.00 -0.24 -1.14 0.00 0.00 176.83 176.94 1m3j n SER 171 N -3.33 0.71 -4.17 3.07 2.88 -1.26 -4.73 113.62 106.78 1m3j n SER 171 Ca -0.04 -1.85 -0.28 0.00 -1.33 0.00 0.00 58.87 55.36 1m3j n SER 171 Cb 0.97 -0.08 -0.16 0.00 -0.75 0.00 0.00 64.21 64.19 1m3j n SER 171 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1m3j s THR 172 N -1.85 1.68 0.00 2.46 -4.23 -1.24 -4.98 115.64 107.48 1m3j s THR 172 Ca 0.16 -0.84 0.00 0.00 -1.18 0.00 0.00 61.69 59.83 1m3j s THR 172 Cb 0.08 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.48 1m3j s THR 172 CO 0.12 0.47 0.00 1.41 -0.54 0.00 0.00 174.62 176.08 1m3j n HIS 173 N 3.23 0.00 -3.65 3.99 8.25 -1.26 -4.97 115.22 120.81 1m3j n HIS 173 Ca -0.19 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.07 1m3j n HIS 173 Cb 0.53 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.46 1m3j n HIS 173 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1m3j s THR 174 N -0.60 -0.13 0.19 1.59 -4.23 -1.26 -1.37 115.64 109.82 1m3j s THR 174 Ca 0.00 0.27 0.10 0.00 -1.18 0.00 0.00 61.69 60.89 1m3j s THR 174 Cb 0.00 -0.28 -0.04 0.00 1.34 0.00 0.00 72.50 73.52 1m3j s THR 174 CO 0.00 0.06 -0.18 -0.76 -0.54 0.00 0.00 174.62 173.20 1m3j s LEU 175 N 2.19 2.66 0.67 4.79 1.43 -0.79 -4.87 118.68 124.75 1m3j s LEU 175 Ca 0.04 -0.75 -0.17 0.00 -1.03 0.00 0.00 54.13 52.22 1m3j s LEU 175 Cb -0.13 -1.37 0.01 0.00 0.03 0.00 0.00 46.19 44.73 1m3j s LEU 175 CO -0.05 0.11 1.23 -2.84 0.23 0.00 0.00 176.35 175.03 1m3j s PRO 176 N -2.74 2.47 0.03 1.29 0.02 -1.26 -1.36 135.00 133.46 1m3j s PRO 176 Ca 0.23 1.85 0.02 0.00 0.02 0.00 0.00 61.00 63.11 1m3j s PRO 176 Cb -0.08 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 1m3j s PRO 176 CO 0.12 -1.60 0.03 0.00 -0.33 0.00 0.00 177.00 175.23 1m3j s ALA 177 N -1.74 3.41 -0.36 -1.55 0.00 -0.80 -4.81 121.76 115.90 1m3j s ALA 177 Ca 0.77 -0.98 -0.29 0.00 0.00 0.00 0.00 51.96 51.46 1m3j s ALA 177 Cb -0.31 -1.38 0.02 0.00 0.00 0.00 0.00 23.12 21.44 1m3j s ALA 177 CO 0.41 0.69 1.10 1.03 0.00 0.00 0.00 175.76 178.98 1m3j s ARG 178 N -1.91 3.98 -0.12 0.00 0.52 0.69 -4.73 118.95 117.39 1m3j s ARG 178 Ca 0.23 0.96 -0.06 0.00 -0.52 0.00 0.00 55.73 56.34 1m3j s ARG 178 Cb -0.12 -3.78 -0.04 0.00 0.52 0.00 0.00 34.95 31.53 1m3j s ARG 178 CO 0.15 -1.02 0.11 0.99 0.02 0.00 0.00 175.30 175.55 1m3j s THR 179 N 3.87 5.25 -0.19 0.02 2.01 -1.26 -0.93 115.64 124.41 1m3j s THR 179 Ca 0.46 0.11 0.01 0.00 0.31 0.00 0.00 61.69 62.58 1m3j s THR 179 Cb -0.11 -3.29 0.04 0.00 0.01 0.00 0.00 72.50 69.15 1m3j s THR 179 CO 0.19 0.60 -0.10 -1.10 -0.69 0.00 0.00 174.62 173.52 1m3j s GLN 180 N -0.86 2.02 -0.04 4.92 -0.21 -0.80 -4.99 119.66 119.69 1m3j s GLN 180 Ca 0.14 -0.76 -0.17 0.00 0.02 0.00 0.00 55.36 54.59 1m3j s GLN 180 Cb -0.12 -2.32 -0.05 0.00 1.00 0.00 0.00 33.01 31.52 1m3j s GLN 180 CO 0.03 -0.39 0.46 -0.47 -2.12 0.00 0.00 175.29 172.80 1m3j s TYR 181 N 1.44 3.64 0.09 0.91 5.04 -1.26 -2.62 117.35 124.59 1m3j s TYR 181 Ca 0.00 0.98 0.03 0.00 -2.44 0.00 0.00 57.07 55.64 1m3j s TYR 181 Cb -0.15 -2.44 -0.04 0.00 0.35 0.00 0.00 41.96 39.68 1m3j s TYR 181 CO -0.09 0.42 -0.09 -1.12 -1.34 0.00 0.00 175.55 173.33 1m3j s SER 182 N -0.30 1.29 -0.23 4.32 0.01 -1.14 -5.03 113.70 112.62 1m3j s SER 182 Ca 0.25 -0.84 -0.27 0.00 1.31 0.00 0.00 55.95 56.40 1m3j s SER 182 Cb -0.16 0.04 0.13 0.00 0.21 0.00 0.00 66.02 66.24 1m3j s SER 182 CO 0.13 -0.32 1.06 -0.70 0.41 0.00 0.00 173.24 173.82 1m3j s GLU 183 N -2.98 0.49 -0.22 12.44 2.12 -1.26 -2.32 118.70 126.96 1m3j s GLU 183 Ca 0.06 0.34 -0.36 0.00 0.36 0.00 0.00 54.97 55.37 1m3j s GLU 183 Cb -0.01 0.23 0.15 0.00 0.26 0.00 0.00 34.13 34.76 1m3j s GLU 183 CO -0.01 -0.11 1.32 0.45 -0.54 0.00 0.00 175.26 176.37 1m3j s SER 184 N -0.39 -0.06 0.79 -1.70 0.15 -1.18 -5.01 113.70 106.30 1m3j s SER 184 Ca 0.02 -0.01 -0.10 0.00 0.70 0.00 0.00 55.95 56.56 1m3j s SER 184 Cb -0.03 0.07 0.09 0.00 -1.71 0.00 0.00 66.02 64.44 1m3j s SER 184 CO -0.04 -0.11 1.12 -0.04 1.20 0.00 0.00 173.24 175.37 1m3j s MET 185 N -2.19 1.83 -0.17 5.44 -1.94 -1.26 -1.04 119.30 119.95 1m3j s MET 185 Ca 0.11 -0.20 0.01 0.00 -1.71 0.00 0.00 55.69 53.90 1m3j s MET 185 Cb 0.00 -2.05 0.01 0.00 2.01 0.00 0.00 34.83 34.81 1m3j s MET 185 CO -0.04 -1.57 -0.18 0.08 -0.01 0.00 0.00 175.02 173.30 1m3j s VAL 186 N -3.47 2.30 -0.04 -6.03 1.01 0.80 -4.79 120.40 110.19 1m3j s VAL 186 Ca 0.63 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.77 1m3j s VAL 186 Cb -0.09 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 1m3j s VAL 186 CO 0.48 0.52 0.00 -1.22 0.00 0.00 0.00 175.10 174.88 1m3j n TYR 187 N 4.46 0.00 -3.49 5.22 0.53 -1.26 -4.66 117.16 117.96 1m3j n TYR 187 Ca -0.20 0.00 -0.13 0.00 -1.02 0.00 0.00 57.90 56.55 1m3j n TYR 187 Cb 0.51 -0.19 -0.04 0.00 -1.03 0.00 0.00 39.34 38.59 1m3j n TYR 187 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 1m3j s SER 188 N -3.65 -0.53 0.16 7.72 0.15 -1.26 -4.71 113.70 111.57 1m3j s SER 188 Ca -0.03 0.31 -0.16 0.00 0.70 0.00 0.00 55.95 56.77 1m3j s SER 188 Cb 0.01 0.49 0.05 0.00 -1.71 0.00 0.00 66.02 64.87 1m3j s SER 188 CO 0.15 -0.69 1.77 0.11 1.20 0.00 0.00 173.24 175.78 1m3j h LYS 189 N 2.43 0.34 0.00 5.44 1.57 -1.98 0.38 116.57 124.75 1m3j h LYS 189 Ca -0.27 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 1m3j h LYS 189 Cb 1.22 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1m3j h LYS 189 CO 0.36 0.23 0.01 1.03 -0.57 0.00 0.00 179.45 180.51 1m3j h SER 190 N 0.36 0.00 0.00 0.86 0.87 -1.98 0.31 113.55 113.97 1m3j h SER 190 Ca 0.16 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.55 1m3j h SER 190 Cb 0.09 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.02 1m3j h SER 190 CO -0.13 0.00 -1.22 1.67 -0.53 0.00 0.00 176.83 176.63 1m3j n GLN 191 N -3.00 0.53 0.31 2.24 0.00 0.97 -3.85 117.38 114.57 1m3j n GLN 191 Ca -0.03 0.46 0.19 0.00 -0.00 0.00 0.00 57.00 57.62 1m3j n GLN 191 Cb 0.07 -1.64 0.97 0.00 0.00 0.00 0.00 30.24 29.64 1m3j n GLN 191 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.06 178.03 1m3j h ILE 192 N -1.00 0.10 -0.03 1.69 6.09 -0.48 -2.19 117.51 121.69 1m3j h ILE 192 Ca -0.25 -0.24 -0.11 0.00 -1.37 0.00 0.00 64.86 62.88 1m3j h ILE 192 Cb 1.07 1.22 -0.01 0.00 0.47 0.00 0.00 36.82 39.56 1m3j h ILE 192 CO -0.15 0.02 -0.50 -1.28 -3.07 0.00 0.00 178.15 173.17 1m3j h SER 193 N 0.00 0.09 0.09 2.19 0.87 -1.09 -1.83 113.55 113.88 1m3j h SER 193 Ca -0.00 -0.04 -0.37 0.00 -1.23 0.00 0.00 61.79 60.15 1m3j h SER 193 Cb 0.21 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.12 1m3j h SER 193 CO 0.00 0.57 -2.09 -0.24 -0.53 0.00 0.00 176.83 174.54 1m3j n SER 194 N -3.95 2.09 0.21 6.23 2.88 -0.89 -3.02 113.62 117.16 1m3j n SER 194 Ca -0.02 0.14 -0.08 0.00 -1.33 0.00 0.00 58.87 57.58 1m3j n SER 194 Cb 0.52 -0.77 -0.04 0.00 -0.75 0.00 0.00 64.21 63.17 1m3j n SER 194 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1m3j h ALA 195 N 0.03 -1.13 0.00 -1.46 0.00 -1.47 -3.19 119.26 112.05 1m3j h ALA 195 Ca -0.46 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1m3j h ALA 195 Cb 1.98 0.22 0.00 0.00 0.00 0.00 0.00 17.79 20.00 1m3j h ALA 195 CO 0.04 -1.09 0.00 -0.07 0.00 0.00 0.00 179.25 178.12 1m3j h LEU 196 N -0.53 0.00 -1.34 0.00 3.38 -1.55 -3.48 115.31 111.79 1m3j h LEU 196 Ca -0.05 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.75 1m3j h LEU 196 Cb 0.41 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.23 1m3j h LEU 196 CO 0.08 0.00 -0.32 -3.20 0.09 0.00 0.00 178.44 175.09 1m3j n ASN 197 N -2.87 -3.09 -4.22 -0.43 4.05 -1.17 -5.07 115.26 102.47 1m3j n ASN 197 Ca 0.02 -0.25 -0.13 0.00 0.45 0.00 0.00 54.58 54.67 1m3j n ASN 197 Cb 0.36 -2.52 -0.10 0.00 1.23 0.00 0.00 39.78 38.75 1m3j n ASN 197 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1m3j s VAL 198 N -3.15 0.66 0.19 3.44 -7.23 -1.21 -4.49 120.40 108.62 1m3j s VAL 198 Ca 0.14 -1.97 -0.30 0.00 -1.81 0.00 0.00 61.98 58.04 1m3j s VAL 198 Cb -0.06 -2.00 -0.09 0.00 0.56 0.00 0.00 36.38 34.79 1m3j s VAL 198 CO 0.32 -0.58 1.36 0.21 -0.31 0.00 0.00 175.10 176.10 1m3j s ASN 199 N -3.13 6.83 0.31 4.85 3.84 -1.26 -4.66 114.94 121.71 1m3j s ASN 199 Ca 0.21 2.44 0.02 0.00 0.21 0.00 0.00 52.86 55.74 1m3j s ASN 199 Cb 0.06 -2.61 0.51 0.00 -0.55 0.00 0.00 41.25 38.66 1m3j s ASN 199 CO 0.02 -0.59 1.84 0.00 -2.79 0.00 0.00 177.10 175.58 1m3j h ALA 200 N 5.65 1.29 -0.73 1.71 0.00 -1.90 -2.55 119.26 122.73 1m3j h ALA 200 Ca -0.44 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 54.37 1m3j h ALA 200 Cb 1.21 -0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 1m3j h ALA 200 CO 0.80 0.49 0.32 0.87 0.00 0.00 0.00 179.25 181.72 1m3j h LYS 201 N 0.61 0.49 -0.01 0.00 1.79 -1.96 -2.26 116.57 115.23 1m3j h LYS 201 Ca 0.13 -0.03 0.02 0.00 -2.18 0.00 0.00 60.65 58.59 1m3j h LYS 201 Cb 0.34 -0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 30.84 1m3j h LYS 201 CO 0.01 0.33 -0.40 0.28 -1.08 0.00 0.00 179.45 178.59 1m3j h VAL 202 N 0.51 0.00 -0.33 0.50 2.07 -1.84 -2.83 116.25 114.32 1m3j h VAL 202 Ca 0.38 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.98 1m3j h VAL 202 Cb 0.51 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.21 1m3j h VAL 202 CO -0.34 0.00 -0.16 -0.07 0.02 0.00 0.00 177.57 177.01 1m3j h LEU 203 N -0.49 -0.55 -1.72 2.57 3.38 -1.53 0.04 115.31 117.01 1m3j h LEU 203 Ca 0.01 0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.16 1m3j h LEU 203 Cb 0.53 0.30 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1m3j h LEU 203 CO -0.27 -0.20 0.49 -0.08 0.09 0.00 0.00 178.44 178.47 1m3j h GLU 204 N -0.11 0.00 0.00 1.13 4.81 -1.21 0.57 114.58 119.77 1m3j h GLU 204 Ca 0.17 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 1m3j h GLU 204 Cb 0.37 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.75 1m3j h GLU 204 CO -0.40 0.00 -0.65 0.09 -0.73 0.00 0.00 179.01 177.31 1m3j n ASN 205 N -3.11 1.40 -0.15 1.04 4.13 -0.72 -3.21 115.26 114.64 1m3j n ASN 205 Ca 0.02 0.23 0.03 0.00 1.68 0.00 0.00 54.58 56.55 1m3j n ASN 205 Cb 0.58 -0.62 0.32 0.00 -1.54 0.00 0.00 39.78 38.53 1m3j n ASN 205 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 1m3j h SER 206 N -0.65 0.70 -0.00 6.41 0.02 -0.90 -2.69 113.55 116.44 1m3j h SER 206 Ca 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1m3j h SER 206 Cb 0.65 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.03 1m3j h SER 206 CO 0.00 0.49 -0.50 0.18 -1.14 0.00 0.00 176.83 175.86 1m3j n LEU 207 N -4.45 0.64 -3.10 5.07 4.77 0.19 -4.91 117.00 115.20 1m3j n LEU 207 Ca 0.08 -0.53 -0.15 0.00 -0.03 0.00 0.00 56.01 55.37 1m3j n LEU 207 Cb 0.10 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.20 1m3j n LEU 207 CO 0.35 0.15 -0.27 0.61 -1.33 0.00 0.00 177.39 176.90 1m3j n GLY 208 N 1.23 -1.17 3.90 -0.72 0.00 -0.64 -4.96 105.19 102.84 1m3j n GLY 208 Ca 0.03 0.83 -0.30 0.00 0.00 0.00 0.00 46.02 46.58 1m3j n GLY 208 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m3j s VAL 209 N -1.74 5.09 -0.46 1.61 1.01 -1.20 -4.98 120.40 119.74 1m3j s VAL 209 Ca 0.20 0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.24 1m3j s VAL 209 Cb -0.03 -3.68 0.43 0.00 0.00 0.00 0.00 36.38 33.10 1m3j s VAL 209 CO 0.65 -0.13 1.40 -0.67 0.00 0.00 0.00 175.10 176.35 1m3j n ASP 210 N -0.41 5.61 0.00 3.32 2.03 -1.26 -4.95 116.55 120.90 1m3j n ASP 210 Ca -0.02 -3.76 0.00 0.00 0.52 0.00 0.00 54.79 51.53 1m3j n ASP 210 Cb 0.53 -0.56 0.00 0.00 -0.72 0.00 0.00 41.12 40.36 1m3j n ASP 210 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1m3j n PHE 211 N -0.65 0.00 0.07 -0.67 3.01 -1.26 0.22 117.46 118.18 1m3j n PHE 211 Ca 0.47 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.96 1m3j n PHE 211 Cb 0.74 -0.32 0.18 0.00 -0.01 0.00 0.00 39.48 40.06 1m3j n PHE 211 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1m3j n ASN 212 N -3.03 0.17 -0.03 4.37 4.13 -1.26 0.16 115.26 119.77 1m3j n ASN 212 Ca 0.00 0.45 -0.10 0.00 1.68 0.00 0.00 54.58 56.62 1m3j n ASN 212 Cb 0.00 -0.44 -0.14 0.00 -1.54 0.00 0.00 39.78 37.66 1m3j n ASN 212 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1m3j n ALA 213 N -1.46 1.46 0.08 5.41 0.00 0.61 -2.87 120.51 123.74 1m3j n ALA 213 Ca -0.00 -0.83 -0.15 0.00 0.00 0.00 0.00 53.44 52.46 1m3j n ALA 213 Cb 0.21 -0.76 -0.14 0.00 0.00 0.00 0.00 19.45 18.76 1m3j n ALA 213 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1m3j h VAL 214 N 0.00 1.37 -0.28 0.00 2.07 -0.12 0.42 116.25 119.71 1m3j h VAL 214 Ca -0.33 -3.00 0.08 0.00 0.82 0.00 0.00 66.70 64.28 1m3j h VAL 214 Cb 2.04 2.83 -0.01 0.00 -1.52 0.00 0.00 31.29 34.64 1m3j h VAL 214 CO 0.07 0.86 0.26 0.00 0.02 0.00 0.00 177.57 178.78 1m3j h ALA 215 N 0.63 2.03 -0.17 1.67 0.00 0.15 0.48 119.26 124.05 1m3j h ALA 215 Ca -0.17 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1m3j h ALA 215 Cb 1.96 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 19.73 1m3j h ALA 215 CO 0.17 -0.41 -0.18 0.09 0.00 0.00 0.00 179.25 178.92 1m3j n ASN 216 N -3.99 2.41 -4.39 0.00 3.02 -1.14 -4.98 115.26 106.20 1m3j n ASN 216 Ca 0.04 -3.59 -0.38 0.00 -0.03 0.00 0.00 54.58 50.62 1m3j n ASN 216 Cb 0.41 -0.55 -0.06 0.00 -0.61 0.00 0.00 39.78 38.96 1m3j n ASN 216 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1m3j n ASN 217 N -1.10 -1.68 -0.14 6.41 5.15 0.16 -4.81 115.26 119.25 1m3j n ASN 217 Ca 0.24 -1.17 -0.30 0.00 -0.60 0.00 0.00 54.58 52.75 1m3j n ASN 217 Cb 0.84 -2.01 -0.10 0.00 -0.53 0.00 0.00 39.78 37.98 1m3j n ASN 217 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1m3j n GLU 218 N -4.26 0.59 -4.04 1.20 1.02 0.12 -4.92 120.64 110.34 1m3j n GLU 218 Ca 0.01 0.26 -0.32 0.00 -0.02 0.00 0.00 57.16 57.09 1m3j n GLU 218 Cb 0.52 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.38 1m3j n GLU 218 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1m3j s LYS 219 N -2.51 3.10 -0.14 3.49 1.02 0.63 -4.21 119.74 121.11 1m3j s LYS 219 Ca -0.39 -0.52 0.01 0.00 0.02 0.00 0.00 55.97 55.09 1m3j s LYS 219 Cb 0.15 -2.87 0.02 0.00 -0.52 0.00 0.00 37.83 34.61 1m3j s LYS 219 CO 0.49 0.62 -0.14 0.15 -0.92 0.00 0.00 175.35 175.55 1m3j s LYS 220 N -2.05 2.26 0.02 1.68 1.02 0.12 -3.61 119.74 119.18 1m3j s LYS 220 Ca 0.27 -0.55 0.07 0.00 0.02 0.00 0.00 55.97 55.77 1m3j s LYS 220 Cb -0.12 -2.03 -0.02 0.00 -0.52 0.00 0.00 37.83 35.13 1m3j s LYS 220 CO 0.19 -0.19 -0.20 0.08 -0.92 0.00 0.00 175.35 174.31 1m3j s VAL 221 N 1.36 1.57 -0.04 3.17 1.01 -1.26 -0.04 120.40 126.17 1m3j s VAL 221 Ca 0.02 -1.04 0.01 0.00 0.00 0.00 0.00 61.98 60.97 1m3j s VAL 221 Cb -0.13 -1.34 0.02 0.00 0.00 0.00 0.00 36.38 34.93 1m3j s VAL 221 CO -0.08 0.28 -0.04 -0.32 0.00 0.00 0.00 175.10 174.93 1m3j s MET 222 N -0.89 0.80 0.00 2.72 1.75 0.26 -0.14 119.30 123.81 1m3j s MET 222 Ca 0.07 -0.10 0.01 0.00 -1.25 0.00 0.00 55.69 54.42 1m3j s MET 222 Cb -0.08 -0.81 -0.04 0.00 2.84 0.00 0.00 34.83 36.74 1m3j s MET 222 CO 0.01 -0.07 0.03 0.42 -0.65 0.00 0.00 175.02 174.75 1m3j s ILE 223 N 0.87 4.34 -0.09 10.11 1.01 -0.21 -0.28 121.20 136.96 1m3j s ILE 223 Ca -0.12 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 59.97 1m3j s ILE 223 Cb -0.14 -2.96 -0.03 0.00 0.01 0.00 0.00 42.46 39.34 1m3j s ILE 223 CO 0.00 0.35 -0.07 -0.76 0.00 0.00 0.00 174.94 174.47 1m3j s LEU 224 N -1.67 3.16 -0.52 2.97 1.43 0.38 -3.09 118.68 121.34 1m3j s LEU 224 Ca 0.21 -0.06 0.04 0.00 -1.03 0.00 0.00 54.13 53.29 1m3j s LEU 224 Cb -0.12 -1.70 0.13 0.00 0.03 0.00 0.00 46.19 44.53 1m3j s LEU 224 CO 0.12 0.32 0.26 0.00 0.23 0.00 0.00 176.35 177.28 1m3j s ALA 225 N -0.55 3.32 -1.10 4.21 0.00 -0.98 -2.28 121.76 124.37 1m3j s ALA 225 Ca 0.08 -3.28 -0.13 0.00 0.00 0.00 0.00 51.96 48.63 1m3j s ALA 225 Cb -0.12 -2.17 0.21 0.00 0.00 0.00 0.00 23.12 21.04 1m3j s ALA 225 CO 0.02 -2.02 1.22 0.71 0.00 0.00 0.00 175.76 175.69 1m3j s TYR 226 N -0.30 3.74 -0.40 0.00 1.51 0.13 -2.87 117.35 119.16 1m3j s TYR 226 Ca 0.17 -2.21 -0.29 0.00 -1.01 0.00 0.00 57.07 53.73 1m3j s TYR 226 Cb -0.26 -4.10 0.01 0.00 -0.11 0.00 0.00 41.96 37.50 1m3j s TYR 226 CO -0.00 -1.22 1.38 0.21 -1.11 0.00 0.00 175.55 174.82 1m3j s LYS 227 N 0.62 3.62 0.11 -0.62 2.20 -1.08 -0.05 119.74 124.54 1m3j s LYS 227 Ca 0.35 0.95 -0.18 0.00 -0.36 0.00 0.00 55.97 56.73 1m3j s LYS 227 Cb -0.06 -4.00 -0.07 0.00 -1.51 0.00 0.00 37.83 32.19 1m3j s LYS 227 CO -0.05 -1.51 0.58 -0.65 -0.36 0.00 0.00 175.35 173.37 1m3j s GLN 228 N 4.83 4.15 -0.01 4.03 -1.52 -0.48 -1.90 119.66 128.77 1m3j s GLN 228 Ca 0.60 0.69 0.03 0.00 -1.95 0.00 0.00 55.36 54.73 1m3j s GLN 228 Cb -0.14 -3.12 -0.01 0.00 -0.22 0.00 0.00 33.01 29.53 1m3j s GLN 228 CO 0.32 0.57 -0.10 0.42 -0.25 0.00 0.00 175.29 176.25 1m3j s ILE 229 N -1.24 0.79 -0.06 1.08 1.01 -0.11 -2.91 121.20 119.77 1m3j s ILE 229 Ca 0.33 -0.42 0.04 0.00 0.00 0.00 0.00 60.65 60.60 1m3j s ILE 229 Cb -0.18 -0.67 -0.06 0.00 0.01 0.00 0.00 42.46 41.56 1m3j s ILE 229 CO 0.19 0.23 0.00 0.49 0.00 0.00 0.00 174.94 175.85 1m3j n PHE 230 N 2.91 0.00 -1.19 3.97 3.72 -0.47 -0.22 117.46 126.17 1m3j n PHE 230 Ca -0.14 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.26 1m3j n PHE 230 Cb 0.56 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 1m3j n PHE 230 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 1m3j n TYR 231 N -2.31 0.00 -3.75 1.38 4.11 -1.23 -4.89 117.16 110.48 1m3j n TYR 231 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.81 1m3j n TYR 231 Cb 0.66 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 40.00 1m3j n TYR 231 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 1m3j n THR 232 N 1.03 0.00 -3.49 -3.48 -2.24 -1.26 -0.54 114.28 104.30 1m3j n THR 232 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 1m3j n THR 232 Cb 0.00 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.19 1m3j n THR 232 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1m3j s VAL 233 N -1.55 -0.95 -0.17 2.28 1.01 0.20 -3.73 120.40 117.49 1m3j s VAL 233 Ca 0.00 0.01 -0.05 0.00 0.00 0.00 0.00 61.98 61.94 1m3j s VAL 233 Cb 0.00 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.39 1m3j s VAL 233 CO 0.00 0.00 -0.00 -0.94 0.00 0.00 0.00 175.10 174.16 1m3j s SER 234 N 2.85 5.08 -0.56 3.32 1.04 0.50 -1.44 113.70 124.48 1m3j s SER 234 Ca 0.03 -0.06 -0.20 0.00 0.48 0.00 0.00 55.95 56.19 1m3j s SER 234 Cb -0.13 -1.85 0.07 0.00 0.10 0.00 0.00 66.02 64.21 1m3j s SER 234 CO -0.19 0.16 0.76 0.00 0.98 0.00 0.00 173.24 174.95 1m3j s ALA 235 N 0.40 3.31 -0.38 5.32 0.00 -1.19 -2.71 121.76 126.51 1m3j s ALA 235 Ca -0.01 -1.81 -0.36 0.00 0.00 0.00 0.00 51.96 49.78 1m3j s ALA 235 Cb -0.14 -3.55 -0.15 0.00 0.00 0.00 0.00 23.12 19.28 1m3j s ALA 235 CO 0.02 -2.30 1.22 -0.25 0.00 0.00 0.00 175.76 174.45 1m3j n ASP 236 N 6.71 0.91 -4.68 0.00 10.43 -1.06 -4.76 116.55 124.10 1m3j n ASP 236 Ca -0.05 0.89 -0.46 0.00 2.57 0.00 0.00 54.79 57.74 1m3j n ASP 236 Cb 0.45 -0.67 -0.04 0.00 1.84 0.00 0.00 41.12 42.70 1m3j n ASP 236 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1m3j n LEU 237 N 3.10 3.28 -4.69 0.64 4.77 -1.26 -4.87 117.00 117.98 1m3j n LEU 237 Ca 0.24 1.06 -0.41 0.00 -0.03 0.00 0.00 56.01 56.87 1m3j n LEU 237 Cb -0.05 -1.44 -0.04 0.00 -2.33 0.00 0.00 43.42 39.56 1m3j n LEU 237 CO 0.68 -0.19 0.54 -2.16 -1.33 0.00 0.00 177.39 174.94 1m3j s PRO 238 N 1.38 4.36 0.32 3.23 0.04 -1.26 -4.95 135.00 138.11 1m3j s PRO 238 Ca 0.80 0.99 0.08 0.00 0.04 0.00 0.00 61.00 62.90 1m3j s PRO 238 Cb -0.65 -3.53 0.79 0.00 0.04 0.00 0.00 34.50 31.16 1m3j s PRO 238 CO 0.39 -0.18 1.77 1.57 0.04 0.00 0.00 177.00 180.59 1m3j h LYS 239 N 7.13 0.69 -3.80 4.56 -0.00 -1.97 -3.42 116.57 119.75 1m3j h LYS 239 Ca -0.34 -0.04 -0.16 0.00 -0.00 0.00 0.00 60.65 60.11 1m3j h LYS 239 Cb 1.16 -0.15 -0.21 0.00 -0.00 0.00 0.00 32.23 33.03 1m3j h LYS 239 CO 0.80 0.45 -0.61 -0.80 -0.00 0.00 0.00 179.45 179.29 1m3j s ASN 240 N -5.40 0.16 0.16 7.07 0.01 -1.26 -5.08 114.94 110.60 1m3j s ASN 240 Ca -0.11 -0.40 -0.23 0.00 -0.71 0.00 0.00 52.86 51.41 1m3j s ASN 240 Cb 0.25 0.15 0.04 0.00 0.41 0.00 0.00 41.25 42.10 1m3j s ASN 240 CO 0.80 -0.34 1.61 -0.65 -1.51 0.00 0.00 177.10 177.01 1m3j h PRO 241 N 4.45 -0.26 0.00 -0.60 0.11 -1.85 -1.44 132.00 132.40 1m3j h PRO 241 Ca -0.32 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1m3j h PRO 241 Cb 1.20 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1m3j h PRO 241 CO 0.41 -0.17 0.27 -1.13 -0.21 0.00 0.00 178.00 177.17 1m3j n SER 242 N -5.41 0.19 -0.24 -2.05 3.41 -1.26 -0.97 113.62 107.29 1m3j n SER 242 Ca 0.00 0.44 0.03 0.00 -0.26 0.00 0.00 58.87 59.07 1m3j n SER 242 Cb 0.32 -0.40 0.09 0.00 -0.26 0.00 0.00 64.21 63.97 1m3j n SER 242 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1m3j n ASP 243 N -1.72 0.69 0.04 4.04 8.00 -0.54 -4.02 116.55 123.04 1m3j n ASP 243 Ca -0.00 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.53 1m3j n ASP 243 Cb 0.29 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 1m3j n ASP 243 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1m3j n LEU 244 N -0.14 0.82 -4.76 0.64 4.77 -0.15 -4.83 117.00 113.34 1m3j n LEU 244 Ca 0.05 0.12 -0.39 0.00 -0.03 0.00 0.00 56.01 55.76 1m3j n LEU 244 Cb 0.11 -0.23 -0.04 0.00 -2.33 0.00 0.00 43.42 40.93 1m3j n LEU 244 CO 0.04 -0.59 0.82 -0.36 -1.33 0.00 0.00 177.39 175.96 1m3j s PHE 245 N -2.00 3.38 0.37 -1.77 0.40 -1.25 0.77 117.98 117.89 1m3j s PHE 245 Ca 0.00 1.63 -0.26 0.00 -0.60 0.00 0.00 56.93 57.70 1m3j s PHE 245 Cb 0.00 -3.34 -0.09 0.00 0.51 0.00 0.00 43.02 40.10 1m3j s PHE 245 CO 0.00 -0.87 1.19 0.34 0.70 0.00 0.00 175.22 176.58 1m3j s ASP 246 N -0.96 6.65 0.25 1.36 2.15 -0.87 -4.75 116.67 120.49 1m3j s ASP 246 Ca 0.49 2.41 0.09 0.00 0.43 0.00 0.00 52.55 55.97 1m3j s ASP 246 Cb -0.31 -2.62 0.78 0.00 -0.30 0.00 0.00 42.92 40.46 1m3j s ASP 246 CO 0.40 -0.59 1.14 0.47 -0.17 0.00 0.00 175.17 176.42 1m3j n ASP 247 N 0.35 0.09 0.00 -0.34 8.00 -1.26 0.26 116.55 123.65 1m3j n ASP 247 Ca 0.03 1.21 0.00 0.00 0.71 0.00 0.00 54.79 56.74 1m3j n ASP 247 Cb 0.45 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 1m3j n ASP 247 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1m3j n SER 248 N -4.80 0.00 -4.39 -2.24 3.41 -1.26 -4.21 113.62 100.13 1m3j n SER 248 Ca 0.23 0.35 -0.45 0.00 -0.26 0.00 0.00 58.87 58.74 1m3j n SER 248 Cb 0.76 -0.35 -0.06 0.00 -0.26 0.00 0.00 64.21 64.29 1m3j n SER 248 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1m3j s VAL 249 N -2.69 5.09 -0.09 -3.33 1.01 0.71 -5.05 120.40 116.06 1m3j s VAL 249 Ca 0.00 -0.99 -0.16 0.00 0.00 0.00 0.00 61.98 60.83 1m3j s VAL 249 Cb 0.00 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 32.09 1m3j s VAL 249 CO 0.00 -0.75 0.42 0.42 0.00 0.00 0.00 175.10 175.20 1m3j s THR 250 N 2.00 5.16 0.28 3.92 -4.23 -1.26 -4.83 115.64 116.67 1m3j s THR 250 Ca 0.07 0.85 0.14 0.00 -1.18 0.00 0.00 61.69 61.57 1m3j s THR 250 Cb -0.24 -3.75 0.28 0.00 1.34 0.00 0.00 72.50 70.13 1m3j s THR 250 CO 0.07 0.41 1.23 0.33 -0.54 0.00 0.00 174.62 176.13 1m3j n PHE 251 N 3.09 0.84 0.32 3.99 7.35 -1.26 0.18 117.46 131.96 1m3j n PHE 251 Ca -0.10 0.93 0.20 0.00 -0.76 0.00 0.00 57.45 57.71 1m3j n PHE 251 Cb 0.52 -1.30 1.04 0.00 0.35 0.00 0.00 39.48 40.09 1m3j n PHE 251 CO 0.00 0.00 0.00 -0.97 -0.76 0.00 0.00 176.76 175.03 1m3j h ASN 252 N 0.00 0.00 1.36 -2.13 -0.00 -1.82 0.49 115.58 113.48 1m3j h ASN 252 Ca 0.63 0.00 -0.12 0.00 -0.00 0.00 0.00 56.30 56.80 1m3j h ASN 252 Cb 1.61 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 39.91 1m3j h ASN 252 CO -0.63 0.00 -0.59 0.44 -0.00 0.00 0.00 177.43 176.65 1m3j h ASP 253 N 0.00 0.00 0.20 1.15 3.32 0.15 -2.57 116.42 118.67 1m3j h ASP 253 Ca 0.01 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.79 1m3j h ASP 253 Cb 0.25 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.83 1m3j h ASP 253 CO -0.00 0.59 -1.18 -0.07 -1.72 0.00 0.00 179.24 176.87 1m3j h LEU 254 N 0.00 0.68 -2.41 1.55 3.38 -0.20 0.45 115.31 118.76 1m3j h LEU 254 Ca -0.01 -0.93 0.02 0.00 0.09 0.00 0.00 57.88 57.05 1m3j h LEU 254 Cb 1.44 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1m3j h LEU 254 CO 0.08 1.57 0.13 0.50 0.09 0.00 0.00 178.44 180.80 1m3j h LYS 255 N -0.09 0.00 0.16 1.13 3.64 -0.67 -0.44 116.57 120.29 1m3j h LYS 255 Ca -0.20 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 58.88 1m3j h LYS 255 Cb 1.93 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.76 1m3j h LYS 255 CO 0.22 0.00 -1.43 0.37 -2.27 0.00 0.00 179.45 176.34 1m3j h GLN 256 N 0.00 0.34 0.00 1.90 5.75 -1.21 -3.29 115.11 118.60 1m3j h GLN 256 Ca 0.04 -0.57 0.00 0.00 -0.15 0.00 0.00 58.65 57.97 1m3j h GLN 256 Cb 0.29 0.21 0.00 0.00 1.07 0.00 0.00 27.48 29.06 1m3j h GLN 256 CO -0.00 1.27 0.00 1.63 -2.65 0.00 0.00 178.83 179.08 1m3j n LYS 257 N -3.83 0.06 0.00 1.69 5.02 0.13 -4.81 118.16 116.42 1m3j n LYS 257 Ca -0.22 0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1m3j n LYS 257 Cb 0.97 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.48 1m3j n LYS 257 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1m3j n GLY 258 N -0.75 1.27 3.08 0.72 0.00 -0.81 -4.97 105.19 103.73 1m3j n GLY 258 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1m3j n GLY 258 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1m3j n VAL 259 N 0.00 0.00 0.00 1.61 0.31 -0.99 -4.69 118.33 114.57 1m3j n VAL 259 Ca 0.00 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1m3j n VAL 259 Cb 0.00 -0.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.78 1m3j n VAL 259 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1m3j n SER 260 N 2.23 0.00 0.12 4.52 3.41 -1.25 -4.76 113.62 117.89 1m3j n SER 260 Ca -0.01 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.68 1m3j n SER 260 Cb 0.66 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 65.01 1m3j n SER 260 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1m3j n ASN 261 N 0.00 0.38 -0.20 4.04 3.02 -1.26 0.08 115.26 121.33 1m3j n ASN 261 Ca 0.00 0.66 0.10 0.00 -0.03 0.00 0.00 54.58 55.30 1m3j n ASN 261 Cb 0.00 -0.70 0.16 0.00 -0.61 0.00 0.00 39.78 38.63 1m3j n ASN 261 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1m3j n GLU 262 N -2.02 1.56 -2.35 3.52 4.71 -1.26 -4.61 120.64 120.19 1m3j n GLU 262 Ca -0.01 -2.61 -0.02 0.00 -0.01 0.00 0.00 57.16 54.51 1m3j n GLU 262 Cb 0.07 -1.55 0.07 0.00 -1.01 0.00 0.00 31.44 29.02 1m3j n GLU 262 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1m3j n ALA 263 N -1.28 2.91 -1.68 0.62 0.00 0.11 -4.50 120.51 116.69 1m3j n ALA 263 Ca 0.17 -1.54 -0.50 0.00 0.00 0.00 0.00 53.44 51.57 1m3j n ALA 263 Cb 0.68 -0.75 -0.05 0.00 0.00 0.00 0.00 19.45 19.32 1m3j n ALA 263 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1m3j n PRO 264 N -0.87 1.87 -1.98 0.00 -0.02 -0.89 -3.81 135.00 129.29 1m3j n PRO 264 Ca -0.11 0.68 -0.36 0.00 -2.02 0.00 0.00 63.50 61.69 1m3j n PRO 264 Cb 0.85 -2.46 0.03 0.00 -0.02 0.00 0.00 33.50 31.91 1m3j n PRO 264 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1m3j s PRO 265 N 3.00 3.03 0.02 0.52 0.04 -1.26 -0.04 135.00 140.31 1m3j s PRO 265 Ca 0.90 1.90 0.04 0.00 0.04 0.00 0.00 61.00 63.88 1m3j s PRO 265 Cb -0.79 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 31.72 1m3j s PRO 265 CO 0.51 -1.18 -0.11 -0.51 0.04 0.00 0.00 177.00 175.75 1m3j s LEU 266 N -3.92 2.14 -0.10 -3.56 1.43 0.79 -2.88 118.68 112.57 1m3j s LEU 266 Ca 0.76 -0.38 -0.00 0.00 -1.03 0.00 0.00 54.13 53.48 1m3j s LEU 266 Cb -0.32 -0.48 -0.03 0.00 0.03 0.00 0.00 46.19 45.39 1m3j s LEU 266 CO 0.36 0.02 -0.08 -0.32 0.23 0.00 0.00 176.35 176.56 1m3j s MET 267 N -0.91 3.11 -0.65 1.70 -2.45 0.27 -0.84 119.30 119.53 1m3j s MET 267 Ca 0.00 -0.57 -0.26 0.00 -1.25 0.00 0.00 55.69 53.61 1m3j s MET 267 Cb -0.07 -2.67 -0.06 0.00 1.25 0.00 0.00 34.83 33.28 1m3j s MET 267 CO 0.01 0.46 2.12 0.08 1.05 0.00 0.00 175.02 178.74 1m3j s VAL 268 N -0.27 3.21 -1.56 10.11 1.01 -0.87 0.22 120.40 132.25 1m3j s VAL 268 Ca 0.03 0.02 0.30 0.00 0.00 0.00 0.00 61.98 62.34 1m3j s VAL 268 Cb -0.13 -3.54 0.61 0.00 0.00 0.00 0.00 36.38 33.32 1m3j s VAL 268 CO 0.03 -0.52 2.08 -1.54 0.00 0.00 0.00 175.10 175.15 1m3j n SER 269 N 14.75 0.00 -3.62 3.32 3.41 0.52 -3.03 113.62 128.97 1m3j n SER 269 Ca 0.32 -0.34 -0.08 0.00 -0.26 0.00 0.00 58.87 58.51 1m3j n SER 269 Cb 0.51 -0.22 -0.06 0.00 -0.26 0.00 0.00 64.21 64.18 1m3j n SER 269 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1m3j s ASN 270 N -2.44 -0.32 -0.07 4.04 0.01 -0.38 -3.18 114.94 112.61 1m3j s ASN 270 Ca 0.33 0.51 -0.06 0.00 -0.71 0.00 0.00 52.86 52.93 1m3j s ASN 270 Cb 0.20 0.48 0.02 0.00 0.41 0.00 0.00 41.25 42.37 1m3j s ASN 270 CO 0.43 -0.18 0.18 -0.69 -1.51 0.00 0.00 177.10 175.33 1m3j s VAL 271 N -0.37 -0.01 -0.07 1.60 1.01 -0.52 -0.77 120.40 121.28 1m3j s VAL 271 Ca 0.03 0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.05 1m3j s VAL 271 Cb -0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 36.38 36.06 1m3j s VAL 271 CO -0.05 0.01 -0.13 0.00 0.00 0.00 0.00 175.10 174.93 1m3j s ALA 272 N 0.22 2.72 0.01 5.51 0.00 -0.23 0.60 121.76 130.59 1m3j s ALA 272 Ca -0.01 -0.94 0.05 0.00 0.00 0.00 0.00 51.96 51.06 1m3j s ALA 272 Cb -0.02 -1.07 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 1m3j s ALA 272 CO -0.01 0.49 -0.14 0.71 0.00 0.00 0.00 175.76 176.82 1m3j s TYR 273 N -0.52 2.69 -5.00 0.00 1.51 0.29 -1.90 117.35 114.43 1m3j s TYR 273 Ca 0.07 -0.17 0.00 0.00 -1.01 0.00 0.00 57.07 55.96 1m3j s TYR 273 Cb -0.12 -1.55 0.00 0.00 -0.11 0.00 0.00 41.96 40.19 1m3j s TYR 273 CO 0.02 0.27 0.00 0.41 -1.11 0.00 0.00 175.55 175.14 1m3j n GLY 274 N 1.72 -0.10 0.00 0.71 0.00 0.10 -1.37 105.19 106.25 1m3j n GLY 274 Ca -0.16 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1m3j n GLY 274 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1m3j n ARG 275 N 0.00 0.89 -3.65 1.61 1.85 -1.14 -4.21 116.66 112.01 1m3j n ARG 275 Ca 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 57.85 56.80 1m3j n ARG 275 Cb 0.00 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 31.34 1m3j n ARG 275 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1m3j s THR 276 N -1.07 -0.64 0.01 8.89 2.01 0.60 -1.38 115.64 124.06 1m3j s THR 276 Ca 0.00 0.06 -0.18 0.00 0.31 0.00 0.00 61.69 61.88 1m3j s THR 276 Cb 0.00 -0.87 -0.06 0.00 0.01 0.00 0.00 72.50 71.58 1m3j s THR 276 CO 0.00 0.02 0.50 -0.63 -0.69 0.00 0.00 174.62 173.83 1m3j s ILE 277 N 2.47 4.92 -0.27 1.82 1.01 0.93 -0.75 121.20 131.32 1m3j s ILE 277 Ca -0.06 1.05 -0.02 0.00 0.00 0.00 0.00 60.65 61.63 1m3j s ILE 277 Cb -0.10 -3.83 0.09 0.00 0.01 0.00 0.00 42.46 38.62 1m3j s ILE 277 CO -0.17 0.52 0.07 -0.31 0.00 0.00 0.00 174.94 175.05 1m3j s TYR 278 N -0.76 1.39 0.07 3.97 1.51 0.69 0.22 117.35 124.44 1m3j s TYR 278 Ca 0.27 -1.37 -0.11 0.00 -1.01 0.00 0.00 57.07 54.84 1m3j s TYR 278 Cb -0.18 -1.41 -0.06 0.00 -0.11 0.00 0.00 41.96 40.21 1m3j s TYR 278 CO 0.16 -0.78 0.42 0.08 -1.11 0.00 0.00 175.55 174.31 1m3j s VAL 279 N 1.73 5.06 -0.20 0.71 1.01 -0.97 -2.60 120.40 125.14 1m3j s VAL 279 Ca 0.05 0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.61 1m3j s VAL 279 Cb -0.17 -3.67 0.05 0.00 0.00 0.00 0.00 36.38 32.59 1m3j s VAL 279 CO -0.20 0.34 -0.09 -0.75 0.00 0.00 0.00 175.10 174.40 1m3j s LYS 280 N -1.76 1.89 -0.57 2.72 2.20 1.00 0.14 119.74 125.36 1m3j s LYS 280 Ca 0.32 -0.84 -0.11 0.00 -0.36 0.00 0.00 55.97 54.98 1m3j s LYS 280 Cb -0.15 -2.41 0.15 0.00 -1.51 0.00 0.00 37.83 33.91 1m3j s LYS 280 CO 0.17 -0.46 0.46 -0.51 -0.36 0.00 0.00 175.35 174.65 1m3j s LEU 281 N 1.42 5.93 0.01 5.43 1.02 0.61 -1.92 118.68 131.18 1m3j s LEU 281 Ca -0.02 -2.16 0.04 0.00 0.02 0.00 0.00 54.13 52.01 1m3j s LEU 281 Cb -0.17 -2.06 -0.03 0.00 0.02 0.00 0.00 46.19 43.95 1m3j s LEU 281 CO -0.08 -0.66 -0.10 -0.70 0.02 0.00 0.00 176.35 174.83 1m3j s GLU 282 N 1.00 2.44 0.25 1.70 2.12 -1.09 -0.57 118.70 124.54 1m3j s GLU 282 Ca 0.09 -0.78 -0.13 0.00 0.36 0.00 0.00 54.97 54.51 1m3j s GLU 282 Cb -0.23 -2.42 -0.00 0.00 0.26 0.00 0.00 34.13 31.73 1m3j s GLU 282 CO -0.02 0.59 0.47 -0.08 -0.54 0.00 0.00 175.26 175.68 1m3j s THR 283 N -0.96 0.00 -0.55 -1.70 -1.32 0.95 -1.02 115.64 111.04 1m3j s THR 283 Ca 0.16 -1.41 0.16 0.00 -1.21 0.00 0.00 61.69 59.39 1m3j s THR 283 Cb -0.11 -2.20 -0.19 0.00 -1.51 0.00 0.00 72.50 68.49 1m3j s THR 283 CO 0.07 -0.00 0.58 0.35 -2.21 0.00 0.00 174.62 173.40 1m3j n THR 284 N -0.38 0.00 -0.45 5.08 -2.24 -1.00 0.14 114.28 115.43 1m3j n THR 284 Ca -0.02 -0.20 -0.30 0.00 -2.27 0.00 0.00 64.05 61.27 1m3j n THR 284 Cb 0.62 0.76 0.28 0.00 -2.10 0.00 0.00 70.33 69.89 1m3j n THR 284 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1m3j s SER 285 N -2.87 -0.37 0.00 3.42 0.15 -1.26 -4.71 113.70 108.06 1m3j s SER 285 Ca 0.03 1.06 0.00 0.00 0.70 0.00 0.00 55.95 57.74 1m3j s SER 285 Cb 0.11 -1.57 0.00 0.00 -1.71 0.00 0.00 66.02 62.85 1m3j s SER 285 CO 0.66 -4.97 0.02 -1.20 1.20 0.00 0.00 173.24 168.95 1m3j n SER 286 N -5.39 0.00 -4.62 5.45 7.64 -1.26 -4.64 113.62 110.81 1m3j n SER 286 Ca 0.09 -1.00 -0.43 0.00 1.01 0.00 0.00 58.87 58.54 1m3j n SER 286 Cb 0.58 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.75 1m3j n SER 286 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1m3j s SER 287 N 0.00 5.92 0.33 6.43 0.15 -1.26 -2.78 113.70 122.49 1m3j s SER 287 Ca 0.00 1.84 0.17 0.00 0.70 0.00 0.00 55.95 58.66 1m3j s SER 287 Cb 0.00 -2.52 0.60 0.00 -1.71 0.00 0.00 66.02 62.39 1m3j s SER 287 CO 0.00 -1.60 0.74 2.29 1.20 0.00 0.00 173.24 175.88 1m3j n LYS 288 N 8.24 0.01 -0.27 5.44 2.85 -1.07 -1.41 118.16 131.94 1m3j n LYS 288 Ca 0.24 0.57 -0.04 0.00 -1.05 0.00 0.00 58.31 58.03 1m3j n LYS 288 Cb 0.45 -1.39 0.06 0.00 -0.65 0.00 0.00 35.03 33.49 1m3j n LYS 288 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1m3j n ASP 289 N -2.51 2.89 0.10 -5.58 10.43 -1.26 -4.34 116.55 116.28 1m3j n ASP 289 Ca 0.15 -2.34 -0.04 0.00 2.57 0.00 0.00 54.79 55.13 1m3j n ASP 289 Cb 0.91 -0.57 -0.02 0.00 1.84 0.00 0.00 41.12 43.27 1m3j n ASP 289 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 1m3j h VAL 290 N 0.45 0.00 -0.97 2.53 2.07 -1.61 0.54 116.25 119.26 1m3j h VAL 290 Ca 0.11 -0.29 0.24 0.00 0.82 0.00 0.00 66.70 67.58 1m3j h VAL 290 Cb 1.29 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 1m3j h VAL 290 CO 0.23 0.00 0.65 -0.61 0.02 0.00 0.00 177.57 177.85 1m3j h GLN 291 N -0.58 0.31 0.00 1.57 4.15 -1.88 0.80 115.11 119.48 1m3j h GLN 291 Ca -0.03 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1m3j h GLN 291 Cb 0.22 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.84 1m3j h GLN 291 CO 0.05 0.20 0.00 0.00 -1.93 0.00 0.00 178.83 177.15 1m3j n ALA 292 N -2.55 -0.25 -0.41 3.38 0.00 -1.19 -0.24 120.51 119.26 1m3j n ALA 292 Ca 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.58 1m3j n ALA 292 Cb 0.83 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.23 1m3j n ALA 292 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m3j h ALA 293 N -2.00 -0.30 -0.63 0.00 0.00 0.93 0.65 119.26 117.92 1m3j h ALA 293 Ca 0.00 0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.18 1m3j h ALA 293 Cb 0.00 1.25 -0.11 0.00 0.00 0.00 0.00 17.79 18.93 1m3j h ALA 293 CO 0.00 -0.85 -0.44 0.74 0.00 0.00 0.00 179.25 178.70 1m3j h PHE 294 N -0.00 -1.32 -0.52 0.00 0.05 0.57 0.63 116.94 116.36 1m3j h PHE 294 Ca 0.23 0.09 0.02 0.00 3.82 0.00 0.00 57.97 62.12 1m3j h PHE 294 Cb 0.48 0.66 -0.03 0.00 2.00 0.00 0.00 35.95 39.06 1m3j h PHE 294 CO -0.97 -0.42 0.32 0.87 -0.18 0.00 0.00 178.31 177.93 1m3j h LYS 295 N -0.20 0.63 -0.20 1.51 1.57 0.33 0.86 116.57 121.06 1m3j h LYS 295 Ca 0.19 -0.04 0.05 0.00 -1.87 0.00 0.00 60.65 58.98 1m3j h LYS 295 Cb 0.56 -0.14 -0.06 0.00 0.08 0.00 0.00 32.23 32.67 1m3j h LYS 295 CO -0.72 0.42 -0.17 0.00 -0.57 0.00 0.00 179.45 178.41 1m3j h ALA 296 N 1.21 -0.03 0.03 3.86 0.00 0.20 -1.19 119.26 123.34 1m3j h ALA 296 Ca 0.20 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.21 1m3j h ALA 296 Cb -0.03 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1m3j h ALA 296 CO -0.07 -0.59 -0.47 1.25 0.00 0.00 0.00 179.25 179.37 1m3j h LEU 297 N -0.17 -1.44 0.00 0.00 5.85 0.12 0.84 115.31 120.50 1m3j h LEU 297 Ca 0.12 0.16 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1m3j h LEU 297 Cb 0.36 0.55 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1m3j h LEU 297 CO -0.31 -0.50 0.00 -0.38 -0.34 0.00 0.00 178.44 176.91 1m3j n ILE 298 N -5.46 0.00 0.00 4.05 5.41 0.20 -0.91 119.36 122.65 1m3j n ILE 298 Ca -0.07 1.37 0.00 0.00 1.00 0.00 0.00 62.75 65.05 1m3j n ILE 298 Cb 0.39 -2.11 0.00 0.00 -0.71 0.00 0.00 39.64 37.21 1m3j n ILE 298 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1m3j n LYS 299 N -2.07 0.00 -3.46 0.38 5.02 -0.51 -4.80 118.16 112.73 1m3j n LYS 299 Ca 0.00 0.36 -0.18 0.00 -2.02 0.00 0.00 58.31 56.47 1m3j n LYS 299 Cb 0.00 -1.61 0.02 0.00 -0.02 0.00 0.00 35.03 33.42 1m3j n LYS 299 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1m3j n ASN 300 N -1.36 -6.18 -4.81 4.39 5.15 0.18 -4.97 115.26 107.67 1m3j n ASN 300 Ca 0.00 -0.66 -0.36 0.00 -0.60 0.00 0.00 54.58 52.96 1m3j n ASN 300 Cb 0.11 -3.82 -0.07 0.00 -0.53 0.00 0.00 39.78 35.48 1m3j n ASN 300 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1m3j s THR 301 N -3.20 5.06 -0.09 -0.44 -1.32 -0.58 -4.97 115.64 110.10 1m3j s THR 301 Ca 0.21 -0.03 0.04 0.00 -1.21 0.00 0.00 61.69 60.71 1m3j s THR 301 Cb -0.07 -3.21 0.04 0.00 -1.51 0.00 0.00 72.50 67.75 1m3j s THR 301 CO 0.82 0.56 0.88 -0.67 -2.21 0.00 0.00 174.62 174.00 1m3j n ASP 302 N 1.85 0.10 0.10 8.08 -0.08 -1.26 -0.06 116.55 125.29 1m3j n ASP 302 Ca -0.18 0.30 0.13 0.00 -1.51 0.00 0.00 54.79 53.53 1m3j n ASP 302 Cb 0.54 -0.24 0.43 0.00 2.34 0.00 0.00 41.12 44.20 1m3j n ASP 302 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 1m3j n ILE 303 N -1.56 0.60 1.11 5.18 2.08 -1.26 -3.15 119.36 122.36 1m3j n ILE 303 Ca -0.00 -0.18 0.00 0.00 0.56 0.00 0.00 62.75 63.13 1m3j n ILE 303 Cb 0.41 -0.68 0.00 0.00 -0.75 0.00 0.00 39.64 38.62 1m3j n ILE 303 CO 0.00 0.00 0.00 2.29 0.56 0.00 0.00 176.55 179.40 1m3j n LYS 304 N -2.21 0.64 -0.26 0.38 2.85 0.91 -1.90 118.16 118.58 1m3j n LYS 304 Ca 0.05 0.00 0.07 0.00 -1.05 0.00 0.00 58.31 57.38 1m3j n LYS 304 Cb 0.39 -1.08 0.19 0.00 -0.65 0.00 0.00 35.03 33.88 1m3j n LYS 304 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1m3j n ASN 305 N -0.33 3.25 -4.77 -5.58 3.02 -1.19 -4.67 115.26 105.00 1m3j n ASN 305 Ca 0.00 -2.24 -0.39 0.00 -0.03 0.00 0.00 54.58 51.92 1m3j n ASN 305 Cb 0.04 -0.32 -0.01 0.00 -0.61 0.00 0.00 39.78 38.88 1m3j n ASN 305 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1m3j s SER 306 N -1.20 6.35 0.22 6.41 0.15 -0.80 -4.89 113.70 119.94 1m3j s SER 306 Ca 0.29 2.48 -0.07 0.00 0.70 0.00 0.00 55.95 59.35 1m3j s SER 306 Cb 0.18 -2.62 0.18 0.00 -1.71 0.00 0.00 66.02 62.05 1m3j s SER 306 CO 0.15 -0.81 1.76 -0.61 1.20 0.00 0.00 173.24 174.94 1m3j h GLN 307 N 2.54 1.13 0.37 5.44 5.75 -1.93 -0.06 115.11 128.35 1m3j h GLN 307 Ca -0.49 -0.24 -0.00 0.00 -0.15 0.00 0.00 58.65 57.77 1m3j h GLN 307 Cb 1.24 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 29.60 1m3j h GLN 307 CO 0.62 0.96 -0.41 0.37 -2.65 0.00 0.00 178.83 177.72 1m3j h GLN 308 N 1.09 -0.78 0.15 1.69 5.75 -1.97 -1.59 115.11 119.44 1m3j h GLN 308 Ca 0.24 0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.81 1m3j h GLN 308 Cb 0.29 0.18 -0.05 0.00 1.07 0.00 0.00 27.48 28.98 1m3j h GLN 308 CO -0.01 -0.52 -0.47 1.88 -2.65 0.00 0.00 178.83 177.06 1m3j h TYR 309 N -0.81 -1.33 -1.55 3.99 -1.99 -1.86 -0.44 116.97 112.98 1m3j h TYR 309 Ca -0.03 0.03 0.48 0.00 2.00 0.00 0.00 58.73 61.21 1m3j h TYR 309 Cb 0.73 0.56 -0.09 0.00 2.00 0.00 0.00 36.73 39.93 1m3j h TYR 309 CO -0.24 -0.56 1.08 1.63 -0.00 0.00 0.00 178.16 180.07 1m3j n LYS 310 N -5.48 -0.01 -0.03 4.88 4.76 -0.05 0.12 118.16 122.35 1m3j n LYS 310 Ca -0.08 1.01 -0.15 0.00 -2.87 0.00 0.00 58.31 56.22 1m3j n LYS 310 Cb 0.40 -2.20 -0.12 0.00 -1.84 0.00 0.00 35.03 31.27 1m3j n LYS 310 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 1m3j h ASP 311 N 0.00 0.21 0.35 4.39 5.19 -0.11 -3.23 116.42 123.22 1m3j h ASP 311 Ca 0.81 -0.81 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 1m3j h ASP 311 Cb 3.02 -0.06 -0.00 0.00 0.18 0.00 0.00 39.33 42.47 1m3j h ASP 311 CO -0.16 0.99 -0.04 0.40 -3.12 0.00 0.00 179.24 177.31 1m3j h ILE 312 N -0.55 0.23 -0.04 0.35 2.04 0.14 -2.65 117.51 117.02 1m3j h ILE 312 Ca -0.03 -0.29 -0.21 0.00 1.00 0.00 0.00 64.86 65.32 1m3j h ILE 312 Cb 1.04 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 1m3j h ILE 312 CO 0.05 0.04 -0.86 1.88 0.00 0.00 0.00 178.15 179.25 1m3j h TYR 313 N 0.00 0.65 -0.01 1.37 0.99 -1.15 -3.31 116.97 115.51 1m3j h TYR 313 Ca -0.00 -0.33 0.03 0.00 2.00 0.00 0.00 58.73 60.44 1m3j h TYR 313 Cb 0.23 -0.09 -0.05 0.00 1.00 0.00 0.00 36.73 37.82 1m3j h TYR 313 CO 0.00 1.13 -0.36 0.93 -0.00 0.00 0.00 178.16 179.86 1m3j h GLU 314 N 0.28 -0.49 -2.34 4.88 5.08 -1.49 -2.63 114.58 117.87 1m3j h GLU 314 Ca -0.06 0.03 -0.45 0.00 -1.00 0.00 0.00 59.36 57.88 1m3j h GLU 314 Cb 1.48 0.11 -0.07 0.00 0.50 0.00 0.00 28.75 30.77 1m3j h GLU 314 CO 0.15 -0.32 1.24 0.09 -1.00 0.00 0.00 179.01 179.17 1m3j n ASN 315 N -5.43 6.77 -3.75 1.42 4.13 -1.25 -4.82 115.26 112.33 1m3j n ASN 315 Ca -0.05 -2.73 -0.12 0.00 1.68 0.00 0.00 54.58 53.36 1m3j n ASN 315 Cb 0.34 -1.41 -0.12 0.00 -1.54 0.00 0.00 39.78 37.05 1m3j n ASN 315 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1m3j s SER 316 N 1.53 -0.28 -0.16 6.41 0.01 -0.99 -2.38 113.70 117.84 1m3j s SER 316 Ca 0.65 0.53 0.01 0.00 1.31 0.00 0.00 55.95 58.45 1m3j s SER 316 Cb 0.28 0.48 0.00 0.00 0.21 0.00 0.00 66.02 66.99 1m3j s SER 316 CO -0.07 -0.13 -0.16 -0.55 0.41 0.00 0.00 173.24 172.74 1m3j s SER 317 N 0.71 3.56 -0.41 2.44 0.15 -0.19 -4.64 113.70 115.31 1m3j s SER 317 Ca -0.05 -0.50 -0.08 0.00 0.70 0.00 0.00 55.95 56.02 1m3j s SER 317 Cb -0.06 -1.54 0.08 0.00 -1.71 0.00 0.00 66.02 62.78 1m3j s SER 317 CO -0.04 0.07 0.25 -0.36 1.20 0.00 0.00 173.24 174.36 1m3j s PHE 318 N 0.88 3.35 -0.15 3.44 0.40 -0.73 -2.67 117.98 122.50 1m3j s PHE 318 Ca -0.04 -1.59 -0.06 0.00 -0.60 0.00 0.00 56.93 54.63 1m3j s PHE 318 Cb -0.15 -2.94 -0.04 0.00 0.51 0.00 0.00 43.02 40.40 1m3j s PHE 318 CO -0.01 -0.85 0.07 0.99 0.70 0.00 0.00 175.22 176.11 1m3j s THR 319 N 1.40 4.88 -0.07 0.64 2.01 -0.81 -0.51 115.64 123.19 1m3j s THR 319 Ca 0.03 -0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.02 1m3j s THR 319 Cb -0.23 -3.16 0.02 0.00 0.01 0.00 0.00 72.50 69.15 1m3j s THR 319 CO 0.02 0.52 -0.04 0.00 -0.69 0.00 0.00 174.62 174.42 1m3j s ALA 320 N -0.16 0.85 0.18 7.40 0.00 -0.20 -0.00 121.76 129.84 1m3j s ALA 320 Ca 0.08 -0.20 0.07 0.00 0.00 0.00 0.00 51.96 51.91 1m3j s ALA 320 Cb -0.12 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1m3j s ALA 320 CO 0.01 -0.21 -0.15 0.14 0.00 0.00 0.00 175.76 175.55 1m3j s VAL 321 N 1.36 1.66 -0.16 0.00 -7.23 -1.07 -1.48 120.40 113.48 1m3j s VAL 321 Ca -0.04 -2.10 0.00 0.00 -1.81 0.00 0.00 61.98 58.04 1m3j s VAL 321 Cb -0.13 -1.94 0.03 0.00 0.56 0.00 0.00 36.38 34.90 1m3j s VAL 321 CO -0.03 -0.55 -0.10 -0.69 -0.31 0.00 0.00 175.10 173.42 1m3j s VAL 322 N -2.77 1.43 0.19 1.32 1.01 -1.26 -0.22 120.40 120.10 1m3j s VAL 322 Ca 0.19 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.56 1m3j s VAL 322 Cb -0.02 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1m3j s VAL 322 CO 0.06 0.30 -0.07 -0.76 0.00 0.00 0.00 175.10 174.63 1m3j s LEU 323 N 1.52 3.06 0.00 3.92 1.43 0.07 -4.84 118.68 123.83 1m3j s LEU 323 Ca 0.02 -0.56 0.00 0.00 -1.03 0.00 0.00 54.13 52.57 1m3j s LEU 323 Cb -0.14 -1.71 0.00 0.00 0.03 0.00 0.00 46.19 44.36 1m3j s LEU 323 CO -0.09 0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.19 1m3j n GLY 324 N -0.09 3.34 0.00 -3.19 0.00 -1.26 0.22 105.19 104.21 1m3j n GLY 324 Ca -0.10 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1m3j n GLY 324 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m3j n GLY 325 N 0.00 0.91 3.97 -0.02 0.00 -1.26 -3.39 105.19 105.39 1m3j n GLY 325 Ca 0.00 -1.16 -0.39 0.00 0.00 0.00 0.00 46.02 44.47 1m3j n GLY 325 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1m3j n ASP 326 N 0.00 -4.45 0.00 1.61 9.92 -1.26 -4.91 116.55 117.45 1m3j n ASP 326 Ca 0.00 -1.18 0.00 0.00 -0.53 0.00 0.00 54.79 53.08 1m3j n ASP 326 Cb 0.00 -1.81 0.00 0.00 -0.64 0.00 0.00 41.12 38.67 1m3j n ASP 326 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1m3j n ALA 327 N -4.31 0.00 -0.51 2.24 0.00 -1.26 -5.11 120.51 111.57 1m3j n ALA 327 Ca -0.17 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.03 1m3j n ALA 327 Cb 0.60 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.00 1m3j n ALA 327 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1m3j n GLN 328 N 0.00 0.00 -1.31 0.00 1.13 -1.26 -4.78 117.38 111.16 1m3j n GLN 328 Ca 0.00 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.70 1m3j n GLN 328 Cb 0.00 -0.60 0.08 0.00 0.11 0.00 0.00 30.24 29.83 1m3j n GLN 328 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 1m3j n GLU 329 N 2.93 0.40 -0.62 -1.09 2.13 -1.26 -1.92 120.64 121.20 1m3j n GLU 329 Ca 0.21 0.18 0.00 0.00 0.66 0.00 0.00 57.16 58.22 1m3j n GLU 329 Cb -0.02 -2.00 0.00 0.00 0.27 0.00 0.00 31.44 29.69 1m3j n GLU 329 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1m3j n HIS 330 N -2.42 0.00 -0.65 4.31 8.25 -1.26 -4.95 115.22 118.49 1m3j n HIS 330 Ca 0.11 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.26 1m3j n HIS 330 Cb 0.50 -1.33 0.18 0.00 1.12 0.00 0.00 29.99 30.46 1m3j n HIS 330 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1m3j n ASN 331 N -0.09 -1.74 0.00 0.41 0.23 -0.81 -5.01 115.26 108.25 1m3j n ASN 331 Ca 0.00 0.06 0.00 0.00 -0.53 0.00 0.00 54.58 54.11 1m3j n ASN 331 Cb 0.04 -1.18 0.00 0.00 -2.08 0.00 0.00 39.78 36.57 1m3j n ASN 331 CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 1m3j n LYS 332 N -3.04 0.00 -4.02 -3.83 4.81 -1.26 -4.69 118.16 106.13 1m3j n LYS 332 Ca 0.04 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.40 1m3j n LYS 332 Cb 0.56 0.00 -0.11 0.00 0.02 0.00 0.00 35.03 35.51 1m3j n LYS 332 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1m3j s VAL 333 N -2.00 0.15 -0.25 3.15 1.01 -0.55 -4.95 120.40 116.96 1m3j s VAL 333 Ca 0.00 -1.26 -0.02 0.00 0.00 0.00 0.00 61.98 60.71 1m3j s VAL 333 Cb 0.00 -0.76 0.13 0.00 0.00 0.00 0.00 36.38 35.75 1m3j s VAL 333 CO 0.00 -0.69 0.31 -0.69 0.00 0.00 0.00 175.10 174.03 1m3j s VAL 334 N -2.43 -0.46 0.05 2.92 1.01 -1.25 -1.03 120.40 119.20 1m3j s VAL 334 Ca -0.07 -0.25 0.04 0.00 0.00 0.00 0.00 61.98 61.70 1m3j s VAL 334 Cb -0.03 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 1m3j s VAL 334 CO -0.05 -0.28 -0.12 -0.89 0.00 0.00 0.00 175.10 173.76 1m3j s THR 335 N 2.42 0.92 -0.21 3.92 2.01 0.34 -4.91 115.64 120.13 1m3j s THR 335 Ca 0.10 -1.05 0.20 0.00 0.31 0.00 0.00 61.69 61.25 1m3j s THR 335 Cb -0.15 -0.88 -0.01 0.00 0.01 0.00 0.00 72.50 71.47 1m3j s THR 335 CO -0.22 -0.15 1.05 0.11 -0.69 0.00 0.00 174.62 174.71 1m3j h LYS 336 N 4.73 0.00 -5.06 4.92 1.57 -1.86 -1.93 116.57 118.93 1m3j h LYS 336 Ca -0.37 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 57.73 1m3j h LYS 336 Cb 1.19 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.32 1m3j h LYS 336 CO 0.42 0.13 -0.05 0.34 -0.57 0.00 0.00 179.45 179.72 1m3j s ASP 337 N -5.65 6.24 0.56 0.86 2.15 -1.26 -4.94 116.67 114.64 1m3j s ASP 337 Ca -0.00 -0.61 0.31 0.00 0.43 0.00 0.00 52.55 52.68 1m3j s ASP 337 Cb 0.09 -2.27 1.66 0.00 -0.30 0.00 0.00 42.92 42.10 1m3j s ASP 337 CO 0.78 -0.70 2.15 0.15 -0.17 0.00 0.00 175.17 177.38 1m3j h PHE 338 N 8.82 0.00 -1.10 -5.34 3.57 -1.97 -2.43 116.94 118.50 1m3j h PHE 338 Ca -0.26 0.00 0.32 0.00 3.53 0.00 0.00 57.97 61.55 1m3j h PHE 338 Cb 1.10 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.79 1m3j h PHE 338 CO 0.68 0.07 0.78 -0.44 -2.23 0.00 0.00 178.31 177.17 1m3j h ASP 339 N 0.00 0.03 0.09 0.41 3.45 -1.97 0.54 116.42 118.97 1m3j h ASP 339 Ca -0.00 0.01 -0.17 0.00 0.43 0.00 0.00 57.03 57.29 1m3j h ASP 339 Cb 0.23 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.00 1m3j h ASP 339 CO 0.01 0.01 -0.63 -0.33 -1.57 0.00 0.00 179.24 176.73 1m3j h GLU 340 N 0.03 0.53 -0.41 3.56 5.08 -1.85 -2.69 114.58 118.83 1m3j h GLU 340 Ca 0.53 -0.37 -0.05 0.00 -1.00 0.00 0.00 59.36 58.47 1m3j h GLU 340 Cb 2.06 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 31.35 1m3j h GLU 340 CO -0.03 0.99 0.07 0.82 -1.00 0.00 0.00 179.01 179.86 1m3j h ILE 341 N 0.39 1.24 0.01 3.13 1.08 -0.14 -3.18 117.51 120.04 1m3j h ILE 341 Ca -0.01 -0.86 0.02 0.00 -0.39 0.00 0.00 64.86 63.63 1m3j h ILE 341 Cb 1.19 1.00 -0.06 0.00 -3.07 0.00 0.00 36.82 35.89 1m3j h ILE 341 CO 0.12 0.30 -0.51 0.03 -0.69 0.00 0.00 178.15 177.39 1m3j h ARG 342 N 0.53 -0.64 -1.04 2.37 3.08 -1.12 -2.00 114.38 115.57 1m3j h ARG 342 Ca 0.13 0.04 0.26 0.00 0.07 0.00 0.00 59.98 60.48 1m3j h ARG 342 Cb 0.36 0.14 -0.10 0.00 0.08 0.00 0.00 29.97 30.45 1m3j h ARG 342 CO 0.01 -0.43 0.65 -0.22 -1.07 0.00 0.00 179.97 178.91 1m3j h LYS 343 N -0.66 0.44 0.77 0.04 3.64 -1.49 -2.07 116.57 117.23 1m3j h LYS 343 Ca 0.02 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1m3j h LYS 343 Cb 0.72 -0.10 0.01 0.00 -0.41 0.00 0.00 32.23 32.44 1m3j h LYS 343 CO -0.34 0.29 -0.37 0.28 -2.27 0.00 0.00 179.45 177.04 1m3j h VAL 344 N 0.45 0.00 0.00 2.00 2.07 -1.35 -2.00 116.25 117.42 1m3j h VAL 344 Ca 0.62 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 68.04 1m3j h VAL 344 Cb 1.44 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 1m3j h VAL 344 CO -0.36 0.00 0.00 -0.38 0.02 0.00 0.00 177.57 176.85 1m3j n ILE 345 N -5.05 0.00 -0.22 4.57 5.41 -0.82 -2.64 119.36 120.61 1m3j n ILE 345 Ca -0.13 1.40 -0.05 0.00 1.00 0.00 0.00 62.75 64.97 1m3j n ILE 345 Cb 0.41 -2.06 0.01 0.00 -0.71 0.00 0.00 39.64 37.28 1m3j n ILE 345 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 176.55 176.62 1m3j h LYS 346 N 0.00 -0.15 -0.00 0.38 2.10 -1.59 0.56 116.57 117.88 1m3j h LYS 346 Ca 0.00 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 1m3j h LYS 346 Cb 0.00 0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.36 1m3j h LYS 346 CO 0.00 -0.10 0.00 -0.25 -2.00 0.00 0.00 179.45 177.10 1m3j n ASP 347 N -5.44 0.00 -1.39 7.07 8.00 -0.75 -0.90 116.55 123.14 1m3j n ASP 347 Ca 0.04 -0.06 -0.01 0.00 0.71 0.00 0.00 54.79 55.47 1m3j n ASP 347 Cb 0.36 -0.00 0.10 0.00 -0.02 0.00 0.00 41.12 41.56 1m3j n ASP 347 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1m3j n ASN 348 N -0.37 2.19 -0.11 -2.24 3.02 0.20 -4.67 115.26 113.28 1m3j n ASN 348 Ca 0.00 -3.17 -0.18 0.00 -0.03 0.00 0.00 54.58 51.20 1m3j n ASN 348 Cb 0.00 -0.43 -0.13 0.00 -0.61 0.00 0.00 39.78 38.62 1m3j n ASN 348 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1m3j n ALA 349 N -0.57 1.36 -1.71 5.41 0.00 -0.08 -4.96 120.51 119.96 1m3j n ALA 349 Ca 0.20 -1.04 -0.38 0.00 0.00 0.00 0.00 53.44 52.22 1m3j n ALA 349 Cb 0.88 -0.20 0.05 0.00 0.00 0.00 0.00 19.45 20.17 1m3j n ALA 349 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1m3j n THR 350 N -3.27 4.14 -3.54 0.00 -1.04 -1.26 -1.91 114.28 107.41 1m3j n THR 350 Ca -0.43 -0.50 -0.28 0.00 -2.04 0.00 0.00 64.05 60.81 1m3j n THR 350 Cb 1.01 -1.50 -0.15 0.00 -1.82 0.00 0.00 70.33 67.87 1m3j n THR 350 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1m3j s PHE 351 N -1.36 0.23 -0.04 -1.42 5.36 -0.46 -4.82 117.98 115.47 1m3j s PHE 351 Ca 0.76 -0.74 -0.30 0.00 -0.96 0.00 0.00 56.93 55.69 1m3j s PHE 351 Cb -0.41 -0.83 -0.06 0.00 -0.34 0.00 0.00 43.02 41.38 1m3j s PHE 351 CO 0.46 -0.80 1.63 0.45 -1.46 0.00 0.00 175.22 175.51 1m3j s SER 352 N 2.13 6.68 0.06 6.13 0.15 -1.26 -1.89 113.70 125.69 1m3j s SER 352 Ca 0.08 2.24 0.19 0.00 0.70 0.00 0.00 55.95 59.17 1m3j s SER 352 Cb -0.16 -2.54 0.80 0.00 -1.71 0.00 0.00 66.02 62.41 1m3j s SER 352 CO -0.33 -0.91 1.60 0.35 1.20 0.00 0.00 173.24 175.15 1m3j n THR 353 N 5.36 0.79 -0.11 6.45 -2.24 -0.47 -3.78 114.28 120.28 1m3j n THR 353 Ca 0.17 0.18 -0.23 0.00 -2.27 0.00 0.00 64.05 61.90 1m3j n THR 353 Cb 0.43 -0.93 -0.11 0.00 -2.10 0.00 0.00 70.33 67.61 1m3j n THR 353 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1m3j n LYS 354 N -1.68 0.57 -2.60 -0.78 4.76 -1.26 -4.86 118.16 112.32 1m3j n LYS 354 Ca 0.04 0.53 -0.36 0.00 -2.87 0.00 0.00 58.31 55.65 1m3j n LYS 354 Cb 0.22 -1.71 -0.05 0.00 -1.84 0.00 0.00 35.03 31.65 1m3j n LYS 354 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1m3j s ASN 355 N -6.95 6.85 0.23 4.39 0.01 -1.25 -4.98 114.94 113.24 1m3j s ASN 355 Ca -0.30 1.98 -0.31 0.00 -0.71 0.00 0.00 52.86 53.52 1m3j s ASN 355 Cb 0.07 -2.58 -0.14 0.00 0.41 0.00 0.00 41.25 39.01 1m3j s ASN 355 CO 0.58 -0.43 1.32 -0.81 -1.51 0.00 0.00 177.10 176.25 1m3j n PRO 356 N -0.04 1.78 -4.17 -0.60 -0.04 -1.26 -4.90 135.00 125.77 1m3j n PRO 356 Ca 0.05 0.63 -0.34 0.00 -0.04 0.00 0.00 63.50 63.80 1m3j n PRO 356 Cb 0.50 -2.23 -0.11 0.00 -0.04 0.00 0.00 33.50 31.62 1m3j n PRO 356 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1m3j s ALA 357 N -0.20 3.25 0.07 0.55 0.00 -1.26 -4.47 121.76 119.69 1m3j s ALA 357 Ca 0.68 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.88 1m3j s ALA 357 Cb -0.70 -1.76 -0.04 0.00 0.00 0.00 0.00 23.12 20.62 1m3j s ALA 357 CO 0.51 0.21 0.18 0.71 0.00 0.00 0.00 175.76 177.38 1m3j s TYR 358 N 0.32 3.45 0.42 0.00 4.12 -1.26 -4.76 117.35 119.63 1m3j s TYR 358 Ca 0.00 0.21 -0.26 0.00 0.02 0.00 0.00 57.07 57.05 1m3j s TYR 358 Cb -0.13 -1.73 -0.09 0.00 -1.52 0.00 0.00 41.96 38.49 1m3j s TYR 358 CO 0.01 0.57 1.37 -1.25 0.02 0.00 0.00 175.55 176.28 1m3j s PRO 359 N -2.49 3.87 0.00 -1.71 0.04 -1.26 0.00 135.00 133.45 1m3j s PRO 359 Ca 0.34 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.68 1m3j s PRO 359 Cb -0.13 -2.74 0.00 0.00 0.04 0.00 0.00 34.50 31.68 1m3j s PRO 359 CO 0.27 -0.63 0.00 0.44 0.04 0.00 0.00 177.00 177.12 1m3j n ILE 360 N 0.03 0.00 -3.93 0.56 -5.35 -0.80 -4.65 119.36 105.22 1m3j n ILE 360 Ca 0.04 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.42 1m3j n ILE 360 Cb 0.42 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 38.23 1m3j n ILE 360 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1m3j s SER 361 N -0.35 0.17 0.05 7.28 0.15 -1.20 -1.07 113.70 118.73 1m3j s SER 361 Ca 0.00 -0.47 -0.27 0.00 0.70 0.00 0.00 55.95 55.91 1m3j s SER 361 Cb 0.00 0.19 0.08 0.00 -1.71 0.00 0.00 66.02 64.58 1m3j s SER 361 CO 0.00 -0.44 0.70 -0.72 1.20 0.00 0.00 173.24 173.98 1m3j s TYR 362 N -2.14 -0.54 -0.16 3.44 -0.85 0.12 -1.06 117.35 116.15 1m3j s TYR 362 Ca -0.09 0.59 -0.03 0.00 -0.52 0.00 0.00 57.07 57.02 1m3j s TYR 362 Cb -0.04 0.50 0.05 0.00 0.38 0.00 0.00 41.96 42.85 1m3j s TYR 362 CO -0.03 -0.69 0.05 0.95 -1.52 0.00 0.00 175.55 174.31 1m3j s THR 363 N -2.65 0.26 0.53 -3.49 -4.23 0.05 -1.37 115.64 104.74 1m3j s THR 363 Ca -0.02 -0.26 -0.02 0.00 -1.18 0.00 0.00 61.69 60.21 1m3j s THR 363 Cb -0.01 -0.75 0.11 0.00 1.34 0.00 0.00 72.50 73.20 1m3j s THR 363 CO -0.04 -0.14 0.73 -1.54 -0.54 0.00 0.00 174.62 173.09 1m3j n SER 364 N 5.16 0.82 -3.79 3.99 3.41 -1.26 -0.36 113.62 121.60 1m3j n SER 364 Ca -0.08 -1.73 -0.13 0.00 -0.26 0.00 0.00 58.87 56.67 1m3j n SER 364 Cb 0.48 -0.49 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 1m3j n SER 364 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1m3j s VAL 365 N -2.22 0.04 -0.04 -3.33 1.01 0.13 -2.88 120.40 113.11 1m3j s VAL 365 Ca 0.47 -0.31 -0.30 0.00 0.00 0.00 0.00 61.98 61.84 1m3j s VAL 365 Cb -0.02 -0.49 -0.05 0.00 0.00 0.00 0.00 36.38 35.82 1m3j s VAL 365 CO 0.32 -0.17 1.43 -0.36 0.00 0.00 0.00 175.10 176.31 1m3j s PHE 366 N -0.70 2.67 0.11 5.22 0.40 -0.71 -0.56 117.98 124.41 1m3j s PHE 366 Ca -0.08 0.72 -0.26 0.00 -0.60 0.00 0.00 56.93 56.71 1m3j s PHE 366 Cb -0.04 -3.69 -0.10 0.00 0.51 0.00 0.00 43.02 39.70 1m3j s PHE 366 CO 0.02 -2.61 1.66 -0.07 0.70 0.00 0.00 175.22 174.92 1m3j h LEU 367 N 8.95 -0.59 0.00 -0.37 3.38 -1.87 0.53 115.31 125.34 1m3j h LEU 367 Ca -0.36 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1m3j h LEU 367 Cb 1.17 0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1m3j h LEU 367 CO 0.92 -0.30 0.00 1.17 0.09 0.00 0.00 178.44 180.32 1m3j n LYS 368 N -5.34 0.00 -0.13 1.13 4.81 -1.26 -2.19 118.16 115.18 1m3j n LYS 368 Ca -0.07 0.71 0.08 0.00 -0.87 0.00 0.00 58.31 58.16 1m3j n LYS 368 Cb 0.25 -1.29 0.26 0.00 0.02 0.00 0.00 35.03 34.27 1m3j n LYS 368 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1m3j n ASP 369 N -2.04 1.74 -1.38 3.14 5.75 -1.24 -4.86 116.55 117.65 1m3j n ASP 369 Ca 0.00 -1.86 -0.09 0.00 -0.01 0.00 0.00 54.79 52.83 1m3j n ASP 369 Cb 0.00 -0.17 -0.04 0.00 -1.03 0.00 0.00 41.12 39.88 1m3j n ASP 369 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1m3j n ASN 370 N 0.41 -2.54 -4.84 -1.12 3.02 0.18 -4.91 115.26 105.46 1m3j n ASN 370 Ca 0.14 0.24 -0.33 0.00 -0.03 0.00 0.00 54.58 54.59 1m3j n ASN 370 Cb 0.31 -2.48 -0.06 0.00 -0.61 0.00 0.00 39.78 36.93 1m3j n ASN 370 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1m3j s SER 371 N -1.82 6.84 0.07 6.41 1.04 -1.21 -4.76 113.70 120.29 1m3j s SER 371 Ca 0.00 1.29 -0.31 0.00 0.48 0.00 0.00 55.95 57.41 1m3j s SER 371 Cb 0.00 -2.37 -0.09 0.00 0.10 0.00 0.00 66.02 63.66 1m3j s SER 371 CO 0.00 -0.12 1.76 -0.69 0.98 0.00 0.00 173.24 175.17 1m3j s VAL 372 N -1.83 2.90 -0.01 5.02 1.01 -1.26 -1.73 120.40 124.49 1m3j s VAL 372 Ca 0.50 0.28 -0.30 0.00 0.00 0.00 0.00 61.98 62.46 1m3j s VAL 372 Cb -0.12 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 1m3j s VAL 372 CO 0.19 -0.01 1.08 0.00 0.00 0.00 0.00 175.10 176.36 1m3j s ALA 373 N 3.04 3.31 0.10 5.51 0.00 -1.14 -4.90 121.76 127.67 1m3j s ALA 373 Ca 0.78 0.61 0.10 0.00 0.00 0.00 0.00 51.96 53.45 1m3j s ALA 373 Cb -0.42 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.25 1m3j s ALA 373 CO 0.35 -0.43 -0.24 0.00 0.00 0.00 0.00 175.76 175.44 1m3j s ALA 374 N 1.36 2.44 0.22 0.00 0.00 -1.26 -4.71 121.76 119.81 1m3j s ALA 374 Ca 0.54 -1.36 -0.07 0.00 0.00 0.00 0.00 51.96 51.07 1m3j s ALA 374 Cb -0.23 -0.50 -0.06 0.00 0.00 0.00 0.00 23.12 22.32 1m3j s ALA 374 CO 0.26 0.55 0.50 0.08 0.00 0.00 0.00 175.76 177.15 1m3j s VAL 375 N -1.00 5.03 -0.67 0.00 1.01 0.16 -4.50 120.40 120.43 1m3j s VAL 375 Ca 0.14 0.21 0.05 0.00 0.00 0.00 0.00 61.98 62.38 1m3j s VAL 375 Cb -0.10 -3.66 0.17 0.00 0.00 0.00 0.00 36.38 32.79 1m3j s VAL 375 CO 0.06 -0.12 0.46 -1.00 0.00 0.00 0.00 175.10 174.50 1m3j s HIS 376 N -1.86 3.41 -0.17 5.22 3.76 0.15 -2.34 115.29 123.46 1m3j s HIS 376 Ca 0.44 -3.27 -0.29 0.00 -0.15 0.00 0.00 55.06 51.79 1m3j s HIS 376 Cb -0.11 -2.63 -0.01 0.00 1.11 0.00 0.00 32.58 30.94 1m3j s HIS 376 CO 0.25 -0.58 1.14 -0.80 -0.85 0.00 0.00 174.74 173.90 1m3j s ASN 377 N -1.27 7.05 -0.06 1.40 -0.87 -0.49 -1.57 114.94 119.13 1m3j s ASN 377 Ca 0.24 1.56 -0.02 0.00 -1.57 0.00 0.00 52.86 53.07 1m3j s ASN 377 Cb -0.06 -2.54 0.03 0.00 -0.02 0.00 0.00 41.25 38.66 1m3j s ASN 377 CO -0.15 -0.67 0.05 -0.54 -2.57 0.00 0.00 177.10 173.22 1m3j s LYS 378 N 3.08 0.09 -0.12 -0.60 1.02 -1.24 -1.21 119.74 120.77 1m3j s LYS 378 Ca 0.50 0.26 -0.26 0.00 0.02 0.00 0.00 55.97 56.49 1m3j s LYS 378 Cb -0.19 -0.78 0.06 0.00 -0.52 0.00 0.00 37.83 36.40 1m3j s LYS 378 CO 0.12 -0.37 0.62 -0.08 -0.92 0.00 0.00 175.35 174.73 1m3j s THR 379 N 2.12 0.01 -0.11 2.17 -1.32 -1.18 0.18 115.64 117.51 1m3j s THR 379 Ca 0.05 -0.06 -0.02 0.00 -1.21 0.00 0.00 61.69 60.45 1m3j s THR 379 Cb -0.13 -0.91 -0.03 0.00 -1.51 0.00 0.00 72.50 69.92 1m3j s THR 379 CO -0.04 -0.03 -0.03 -1.81 -2.21 0.00 0.00 174.62 170.49 1m3j s ASP 380 N -0.63 4.91 0.15 8.08 -0.00 -1.25 -1.28 116.67 126.64 1m3j s ASP 380 Ca -0.07 -0.01 -0.04 0.00 -0.00 0.00 0.00 52.55 52.43 1m3j s ASP 380 Cb -0.02 -1.50 -0.03 0.00 -0.00 0.00 0.00 42.92 41.36 1m3j s ASP 380 CO 0.06 0.29 0.15 -0.72 -0.00 0.00 0.00 175.17 174.95 1m3j s TYR 381 N -0.38 0.72 -0.06 4.23 -0.85 0.27 -4.46 117.35 116.82 1m3j s TYR 381 Ca 0.06 -1.08 -0.11 0.00 -0.52 0.00 0.00 57.07 55.43 1m3j s TYR 381 Cb -0.12 -0.33 -0.05 0.00 0.38 0.00 0.00 41.96 41.84 1m3j s TYR 381 CO 0.02 -0.61 0.28 0.42 -1.52 0.00 0.00 175.55 174.14 1m3j s ILE 382 N -4.03 5.26 -0.45 -3.49 1.01 -1.26 0.80 121.20 119.04 1m3j s ILE 382 Ca 0.23 0.53 -0.11 0.00 0.00 0.00 0.00 60.65 61.30 1m3j s ILE 382 Cb 0.06 -3.56 0.09 0.00 0.01 0.00 0.00 42.46 39.06 1m3j s ILE 382 CO 0.02 0.60 0.33 -0.70 0.00 0.00 0.00 174.94 175.19 1m3j s GLU 383 N -1.06 2.68 0.20 2.79 2.12 0.24 -4.84 118.70 120.84 1m3j s GLU 383 Ca 0.19 -1.54 -0.30 0.00 0.36 0.00 0.00 54.97 53.68 1m3j s GLU 383 Cb -0.14 -3.93 -0.09 0.00 0.26 0.00 0.00 34.13 30.23 1m3j s GLU 383 CO 0.09 -1.06 1.32 0.99 -0.54 0.00 0.00 175.26 176.05 1m3j s THR 384 N 1.46 3.18 0.01 -1.70 2.01 -1.26 -3.43 115.64 115.92 1m3j s THR 384 Ca 0.04 0.97 0.02 0.00 0.31 0.00 0.00 61.69 63.03 1m3j s THR 384 Cb -0.25 -3.62 -0.01 0.00 0.01 0.00 0.00 72.50 68.63 1m3j s THR 384 CO 0.02 0.15 -0.06 0.42 -0.69 0.00 0.00 174.62 174.46 1m3j s THR 385 N 0.11 0.45 0.24 -0.82 -4.23 -1.06 -4.98 115.64 105.35 1m3j s THR 385 Ca 0.57 -0.49 -0.22 0.00 -1.18 0.00 0.00 61.69 60.37 1m3j s THR 385 Cb -0.37 -0.43 0.03 0.00 1.34 0.00 0.00 72.50 73.08 1m3j s THR 385 CO 0.38 -0.04 0.79 -0.94 -0.54 0.00 0.00 174.62 174.28 1m3j s SER 386 N -0.57 -0.23 -0.00 3.99 1.04 -1.25 -1.01 113.70 115.67 1m3j s SER 386 Ca -0.02 -0.55 -0.22 0.00 0.48 0.00 0.00 55.95 55.64 1m3j s SER 386 Cb -0.04 0.66 0.05 0.00 0.10 0.00 0.00 66.02 66.78 1m3j s SER 386 CO -0.00 -1.21 0.49 -0.89 0.98 0.00 0.00 173.24 172.60 1m3j s THR 387 N -3.73 0.03 0.19 2.02 2.01 -0.92 -2.58 115.64 112.66 1m3j s THR 387 Ca 0.11 -0.28 0.08 0.00 0.31 0.00 0.00 61.69 61.92 1m3j s THR 387 Cb -0.05 -0.87 -0.04 0.00 0.01 0.00 0.00 72.50 71.55 1m3j s THR 387 CO 0.06 -0.15 -0.01 -1.61 -0.69 0.00 0.00 174.62 172.22 1m3j s GLU 388 N -1.72 2.36 -0.06 4.92 2.02 -1.26 -2.10 118.70 122.87 1m3j s GLU 388 Ca -0.10 -1.16 0.02 0.00 0.02 0.00 0.00 54.97 53.76 1m3j s GLU 388 Cb -0.02 -2.32 0.02 0.00 0.10 0.00 0.00 34.13 31.91 1m3j s GLU 388 CO 0.04 0.44 -0.09 0.71 0.02 0.00 0.00 175.26 176.38 1m3j s TYR 389 N -1.80 1.19 -0.13 1.61 1.51 -0.87 -4.94 117.35 113.93 1m3j s TYR 389 Ca 0.28 -0.42 -0.14 0.00 -1.01 0.00 0.00 57.07 55.78 1m3j s TYR 389 Cb -0.09 -0.92 -0.05 0.00 -0.11 0.00 0.00 41.96 40.79 1m3j s TYR 389 CO 0.18 -0.25 0.33 0.45 -1.11 0.00 0.00 175.55 175.15 1m3j s SER 390 N 0.78 6.52 1.27 2.29 0.15 -1.26 -2.03 113.70 121.41 1m3j s SER 390 Ca -0.13 0.61 -0.16 0.00 0.70 0.00 0.00 55.95 56.97 1m3j s SER 390 Cb -0.15 -2.20 0.32 0.00 -1.71 0.00 0.00 66.02 62.28 1m3j s SER 390 CO 0.02 0.14 0.99 -0.54 1.20 0.00 0.00 173.24 175.04 1m3j s LYS 391 N 0.18 -1.74 0.14 5.44 1.02 -1.23 -4.63 119.74 118.93 1m3j s LYS 391 Ca 0.19 0.58 -0.24 0.00 0.02 0.00 0.00 55.97 56.52 1m3j s LYS 391 Cb -0.14 -1.48 0.07 0.00 -0.52 0.00 0.00 37.83 35.76 1m3j s LYS 391 CO 0.06 -4.20 0.72 0.20 -0.92 0.00 0.00 175.35 171.21 1m3j s GLY 392 N -2.70 -0.46 0.03 -3.33 0.00 -1.15 -4.51 107.32 95.21 1m3j s GLY 392 Ca 0.69 0.45 0.03 0.00 0.00 0.00 0.00 44.72 45.89 1m3j s GLY 392 CO 0.63 0.15 -0.09 -1.59 0.00 0.00 0.00 173.10 172.19 1m3j s LYS 393 N -3.58 0.62 -0.18 2.90 -2.85 -1.23 -1.12 119.74 114.31 1m3j s LYS 393 Ca 0.05 -0.66 -0.07 0.00 -1.00 0.00 0.00 55.97 54.29 1m3j s LYS 393 Cb -0.02 -0.51 -0.04 0.00 -2.06 0.00 0.00 37.83 35.20 1m3j s LYS 393 CO -0.07 0.12 0.05 0.42 0.10 0.00 0.00 175.35 175.97 1m3j s ILE 394 N -1.00 4.70 -0.14 3.79 1.01 -1.13 -2.21 121.20 126.22 1m3j s ILE 394 Ca -0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.53 1m3j s ILE 394 Cb -0.08 -3.11 -0.01 0.00 0.01 0.00 0.00 42.46 39.26 1m3j s ILE 394 CO 0.01 0.46 -0.12 0.20 0.00 0.00 0.00 174.94 175.49 1m3j s ASN 395 N 0.39 4.09 -0.18 3.58 -0.87 -0.99 -0.98 114.94 119.98 1m3j s ASN 395 Ca 0.02 -0.32 -0.03 0.00 -1.57 0.00 0.00 52.86 50.96 1m3j s ASN 395 Cb -0.13 -1.64 -0.02 0.00 -0.02 0.00 0.00 41.25 39.45 1m3j s ASN 395 CO 0.00 0.15 -0.06 -0.76 -2.57 0.00 0.00 177.10 173.86 1m3j s LEU 396 N 0.47 2.98 -0.36 0.60 1.43 -1.14 -0.28 118.68 122.38 1m3j s LEU 396 Ca -0.08 -0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 52.72 1m3j s LEU 396 Cb -0.16 -1.73 0.09 0.00 0.03 0.00 0.00 46.19 44.42 1m3j s LEU 396 CO 0.04 0.08 0.11 -0.62 0.23 0.00 0.00 176.35 176.19 1m3j s ASP 397 N 0.88 5.04 -0.79 2.29 3.68 -0.85 -4.12 116.67 122.79 1m3j s ASP 397 Ca -0.01 -1.81 -0.03 0.00 2.13 0.00 0.00 52.55 52.83 1m3j s ASP 397 Cb -0.15 -1.75 0.23 0.00 -1.45 0.00 0.00 42.92 39.81 1m3j s ASP 397 CO 0.01 -0.42 2.27 1.57 0.13 0.00 0.00 175.17 178.73 1m3j n HIS 398 N 4.54 2.47 -1.16 -5.34 -0.00 -1.25 -0.49 115.22 113.99 1m3j n HIS 398 Ca -0.05 -2.27 -0.21 0.00 -0.00 0.00 0.00 57.72 55.19 1m3j n HIS 398 Cb 0.42 -1.31 -0.12 0.00 -0.00 0.00 0.00 29.99 28.99 1m3j n HIS 398 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 1m3j n SER 399 N 0.17 6.37 -4.84 0.26 3.41 -1.08 0.20 113.62 118.11 1m3j n SER 399 Ca 0.52 -2.59 -0.33 0.00 -0.26 0.00 0.00 58.87 56.20 1m3j n SER 399 Cb 0.34 -1.44 -0.06 0.00 -0.26 0.00 0.00 64.21 62.79 1m3j n SER 399 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1m3j s GLY 400 N 1.83 2.09 -0.14 5.00 0.00 -1.26 -3.42 107.32 111.42 1m3j s GLY 400 Ca 0.67 -0.81 -0.01 0.00 0.00 0.00 0.00 44.72 44.56 1m3j s GLY 400 CO -0.04 -0.68 2.23 0.00 0.00 0.00 0.00 173.10 174.61 1m3j n ALA 401 N 1.15 4.80 -3.72 3.20 0.00 0.32 -4.36 120.51 121.91 1m3j n ALA 401 Ca -0.13 -0.97 0.08 0.00 0.00 0.00 0.00 53.44 52.42 1m3j n ALA 401 Cb 0.53 -1.34 0.02 0.00 0.00 0.00 0.00 19.45 18.65 1m3j n ALA 401 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1m3j n TYR 402 N 1.16 -1.08 -3.79 0.00 0.18 -1.26 -3.76 117.16 108.62 1m3j n TYR 402 Ca 0.18 -0.95 -0.33 0.00 1.88 0.00 0.00 57.90 58.68 1m3j n TYR 402 Cb 0.57 0.46 -0.05 0.00 -0.38 0.00 0.00 39.34 39.95 1m3j n TYR 402 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1m3j s VAL 403 N -2.15 5.29 0.09 -3.48 1.01 -1.26 -4.31 120.40 115.59 1m3j s VAL 403 Ca 0.19 -0.04 -0.14 0.00 0.00 0.00 0.00 61.98 61.99 1m3j s VAL 403 Cb -0.02 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.79 1m3j s VAL 403 CO 0.04 0.21 0.34 0.00 0.00 0.00 0.00 175.10 175.68 1m3j s ALA 404 N -1.46 -0.74 0.05 5.51 0.00 -0.56 -1.45 121.76 123.11 1m3j s ALA 404 Ca 0.33 -0.10 0.05 0.00 0.00 0.00 0.00 51.96 52.25 1m3j s ALA 404 Cb -0.13 0.51 -0.02 0.00 0.00 0.00 0.00 23.12 23.48 1m3j s ALA 404 CO 0.22 -0.53 -0.14 -0.65 0.00 0.00 0.00 175.76 174.65 1m3j s GLN 405 N -3.32 0.91 0.53 0.00 -0.21 -1.10 0.14 119.66 116.61 1m3j s GLN 405 Ca 0.00 -0.81 0.06 0.00 0.02 0.00 0.00 55.36 54.63 1m3j s GLN 405 Cb 0.01 -0.93 0.04 0.00 1.00 0.00 0.00 33.01 33.13 1m3j s GLN 405 CO -0.08 0.22 0.45 -0.06 -2.12 0.00 0.00 175.29 173.70 1m3j s PHE 406 N -0.95 1.74 -0.40 0.91 0.40 -1.26 -2.03 117.98 116.39 1m3j s PHE 406 Ca 0.01 -0.78 0.05 0.00 -0.60 0.00 0.00 56.93 55.61 1m3j s PHE 406 Cb -0.08 -1.99 0.17 0.00 0.51 0.00 0.00 43.02 41.63 1m3j s PHE 406 CO 0.02 -0.52 0.49 -2.00 0.70 0.00 0.00 175.22 173.91 1m3j s GLU 407 N -4.31 0.76 -0.27 0.44 2.12 0.85 -2.10 118.70 116.19 1m3j s GLU 407 Ca 0.40 -0.78 -0.10 0.00 0.36 0.00 0.00 54.97 54.85 1m3j s GLU 407 Cb -0.03 -0.43 -0.04 0.00 0.26 0.00 0.00 34.13 33.89 1m3j s GLU 407 CO 0.25 -1.22 0.15 0.08 -0.54 0.00 0.00 175.26 173.97 1m3j s VAL 408 N 1.41 4.96 -0.02 3.70 1.01 -1.26 -3.44 120.40 126.76 1m3j s VAL 408 Ca 0.19 0.05 -0.02 0.00 0.00 0.00 0.00 61.98 62.20 1m3j s VAL 408 Cb -0.09 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1m3j s VAL 408 CO -0.05 0.28 0.05 0.00 0.00 0.00 0.00 175.10 175.38 1m3j s ALA 409 N 1.71 -0.11 0.00 5.51 0.00 -1.04 -1.41 121.76 126.41 1m3j s ALA 409 Ca 0.07 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.15 1m3j s ALA 409 Cb -0.16 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 22.89 1m3j s ALA 409 CO 0.08 -0.02 0.00 -2.67 0.00 0.00 0.00 175.76 173.15 1m3j n TRP 410 N 3.03 -0.10 -3.82 0.00 2.14 0.04 -2.62 117.44 116.12 1m3j n TRP 410 Ca -0.12 0.00 -0.13 0.00 2.07 0.00 0.00 57.50 59.32 1m3j n TRP 410 Cb 0.60 0.00 -0.14 0.00 -0.81 0.00 0.00 31.31 30.96 1m3j n TRP 410 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1m3j s ASP 411 N -0.34 -0.06 -0.08 -0.67 -0.00 -0.49 -1.04 116.67 113.99 1m3j s ASP 411 Ca 0.00 0.15 -0.12 0.00 -0.00 0.00 0.00 52.55 52.59 1m3j s ASP 411 Cb 0.00 0.12 -0.05 0.00 -0.00 0.00 0.00 42.92 42.99 1m3j s ASP 411 CO 0.00 -0.06 0.28 -1.61 -0.00 0.00 0.00 175.17 173.77 1m3j s GLU 412 N 0.40 3.82 -0.03 8.23 2.02 0.37 -0.96 118.70 132.55 1m3j s GLU 412 Ca -0.03 0.13 -0.00 0.00 0.02 0.00 0.00 54.97 55.08 1m3j s GLU 412 Cb -0.04 -3.26 -0.04 0.00 0.10 0.00 0.00 34.13 30.89 1m3j s GLU 412 CO -0.01 0.62 0.02 0.54 0.02 0.00 0.00 175.26 176.44 1m3j s VAL 413 N -0.69 4.31 0.21 2.63 0.11 -0.42 -0.39 120.40 126.16 1m3j s VAL 413 Ca 0.18 -0.45 -0.10 0.00 -2.93 0.00 0.00 61.98 58.69 1m3j s VAL 413 Cb -0.14 -2.89 -0.01 0.00 -1.53 0.00 0.00 36.38 31.81 1m3j s VAL 413 CO 0.07 0.45 0.37 -0.94 -3.33 0.00 0.00 175.10 171.73 1m3j s SER 414 N -1.36 -0.03 -0.06 3.54 1.04 -1.19 -4.93 113.70 110.71 1m3j s SER 414 Ca 0.18 -0.95 0.02 0.00 0.48 0.00 0.00 55.95 55.68 1m3j s SER 414 Cb -0.12 0.51 0.01 0.00 0.10 0.00 0.00 66.02 66.53 1m3j s SER 414 CO 0.08 -1.02 -0.11 -0.31 0.98 0.00 0.00 173.24 172.86 1m3j s TYR 415 N -4.02 1.35 1.13 5.02 1.51 -1.26 -1.28 117.35 119.81 1m3j s TYR 415 Ca 0.22 -0.49 -0.19 0.00 -1.01 0.00 0.00 57.07 55.61 1m3j s TYR 415 Cb 0.02 -1.01 0.28 0.00 -0.11 0.00 0.00 41.96 41.14 1m3j s TYR 415 CO 0.06 -0.27 1.09 -0.40 -1.11 0.00 0.00 175.55 174.92 1m3j n ASP 416 N 3.87 -1.67 0.04 2.29 3.85 -0.99 -4.82 116.55 119.11 1m3j n ASP 416 Ca -0.23 -1.20 0.06 0.00 -0.71 0.00 0.00 54.79 52.71 1m3j n ASP 416 Cb 0.52 -0.96 0.27 0.00 -1.35 0.00 0.00 41.12 39.59 1m3j n ASP 416 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1m3j n LYS 417 N -4.52 0.05 0.00 0.11 5.02 -1.26 -1.18 118.16 116.38 1m3j n LYS 417 Ca 0.15 0.42 0.11 0.00 -2.02 0.00 0.00 58.31 56.97 1m3j n LYS 417 Cb 0.56 -1.63 0.06 0.00 -0.02 0.00 0.00 35.03 34.01 1m3j n LYS 417 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1m3j n GLU 418 N -1.73 0.72 -0.89 1.97 -0.58 -1.26 -4.93 120.64 113.94 1m3j n GLU 418 Ca 0.01 -0.56 0.00 0.00 -0.42 0.00 0.00 57.16 56.20 1m3j n GLU 418 Cb 0.10 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.48 1m3j n GLU 418 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1m3j n GLY 419 N 1.43 0.47 3.94 0.62 0.00 -0.32 -4.72 105.19 106.61 1m3j n GLY 419 Ca 0.08 -0.95 -0.24 0.00 0.00 0.00 0.00 46.02 44.91 1m3j n GLY 419 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1m3j s ASN 420 N -2.86 6.30 0.54 1.61 0.01 -1.26 -4.47 114.94 114.81 1m3j s ASN 420 Ca 0.00 0.47 -0.16 0.00 -0.71 0.00 0.00 52.86 52.46 1m3j s ASN 420 Cb 0.00 -2.04 -0.07 0.00 0.41 0.00 0.00 41.25 39.55 1m3j s ASN 420 CO 0.00 -0.29 1.01 -1.61 -1.51 0.00 0.00 177.10 174.70 1m3j s GLU 421 N -4.26 3.77 -0.30 -0.60 2.02 -1.26 -2.36 118.70 115.72 1m3j s GLU 421 Ca 0.40 0.99 -0.02 0.00 0.02 0.00 0.00 54.97 56.37 1m3j s GLU 421 Cb -0.10 -2.11 0.12 0.00 0.10 0.00 0.00 34.13 32.15 1m3j s GLU 421 CO 0.36 -0.42 0.24 0.08 0.02 0.00 0.00 175.26 175.53 1m3j s VAL 422 N -2.64 -0.26 -0.49 2.63 1.01 -0.40 -4.85 120.40 115.40 1m3j s VAL 422 Ca 0.60 -0.65 -0.29 0.00 0.00 0.00 0.00 61.98 61.63 1m3j s VAL 422 Cb -0.11 -0.97 0.03 0.00 0.00 0.00 0.00 36.38 35.32 1m3j s VAL 422 CO 0.35 -0.59 1.17 -0.76 0.00 0.00 0.00 175.10 175.27 1m3j s LEU 423 N 2.18 3.60 -0.27 3.92 1.43 -1.26 -3.16 118.68 125.11 1m3j s LEU 423 Ca 0.10 0.43 -0.17 0.00 -1.03 0.00 0.00 54.13 53.45 1m3j s LEU 423 Cb -0.15 -3.48 -0.03 0.00 0.03 0.00 0.00 46.19 42.56 1m3j s LEU 423 CO -0.32 -1.31 0.49 -0.89 0.23 0.00 0.00 176.35 174.55 1m3j s THR 424 N 4.63 5.08 -0.11 5.49 2.01 0.47 -4.89 115.64 128.34 1m3j s THR 424 Ca 0.48 0.76 -0.27 0.00 0.31 0.00 0.00 61.69 62.97 1m3j s THR 424 Cb -0.08 -3.82 -0.02 0.00 0.01 0.00 0.00 72.50 68.59 1m3j s THR 424 CO 0.31 0.06 0.91 -2.28 -0.69 0.00 0.00 174.62 172.93 1m3j s HIS 425 N 2.28 3.51 0.01 4.92 2.46 -1.26 0.14 115.29 127.35 1m3j s HIS 425 Ca 0.20 1.46 0.05 0.00 0.47 0.00 0.00 55.06 57.23 1m3j s HIS 425 Cb -0.16 -3.07 -0.01 0.00 -0.13 0.00 0.00 32.58 29.21 1m3j s HIS 425 CO 0.10 -0.16 -0.14 0.15 -2.47 0.00 0.00 174.74 172.21 1m3j s LYS 426 N 1.76 1.08 0.14 2.88 1.02 -0.21 -4.94 119.74 121.48 1m3j s LYS 426 Ca 0.44 -0.60 0.07 0.00 0.02 0.00 0.00 55.97 55.89 1m3j s LYS 426 Cb -0.18 -1.07 -0.04 0.00 -0.52 0.00 0.00 37.83 36.02 1m3j s LYS 426 CO 0.18 0.28 -0.15 0.95 -0.92 0.00 0.00 175.35 175.69 1m3j s THR 427 N -0.51 1.47 0.18 2.17 -4.23 -1.26 -0.78 115.64 112.68 1m3j s THR 427 Ca 0.04 -1.84 -0.30 0.00 -1.18 0.00 0.00 61.69 58.41 1m3j s THR 427 Cb -0.06 -1.68 -0.08 0.00 1.34 0.00 0.00 72.50 72.02 1m3j s THR 427 CO 0.00 -0.44 1.11 0.86 -0.54 0.00 0.00 174.62 175.61 1m3j s TRP 428 N -2.31 3.57 -1.29 3.99 -0.00 -0.50 -4.90 118.94 117.51 1m3j s TRP 428 Ca 0.13 1.58 0.11 0.00 -0.00 0.00 0.00 56.10 57.91 1m3j s TRP 428 Cb -0.04 -3.29 0.51 0.00 -0.00 0.00 0.00 33.47 30.65 1m3j s TRP 428 CO 0.04 -0.68 1.27 -0.25 -0.00 0.00 0.00 176.95 177.33 1m3j n ASP 429 N 2.39 0.00 -0.27 5.86 8.00 -1.26 -2.10 116.55 129.16 1m3j n ASP 429 Ca 0.03 0.25 0.14 0.00 0.71 0.00 0.00 54.79 55.92 1m3j n ASP 429 Cb 0.46 -0.36 0.48 0.00 -0.02 0.00 0.00 41.12 41.68 1m3j n ASP 429 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1m3j n GLY 430 N -0.39 -0.53 3.54 0.44 0.00 -1.26 -4.94 105.19 102.04 1m3j n GLY 430 Ca 0.04 -0.38 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 1m3j n GLY 430 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1m3j n ASN 431 N -0.51 0.07 -3.54 1.61 3.02 -0.89 -3.18 115.26 111.83 1m3j n ASN 431 Ca 0.15 0.86 -0.25 0.00 -0.03 0.00 0.00 54.58 55.31 1m3j n ASN 431 Cb 0.33 -1.27 0.05 0.00 -0.61 0.00 0.00 39.78 38.28 1m3j n ASN 431 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1m3j n TYR 432 N -1.25 -2.10 -3.66 3.10 0.53 -0.89 -4.98 117.16 107.91 1m3j n TYR 432 Ca 0.12 0.63 -0.07 0.00 -1.02 0.00 0.00 57.90 57.55 1m3j n TYR 432 Cb 0.44 -3.77 -0.09 0.00 -1.03 0.00 0.00 39.34 34.89 1m3j n TYR 432 CO 0.00 0.00 0.00 -0.65 -1.02 0.00 0.00 176.86 175.19 1m3j s GLN 433 N -5.44 0.38 0.24 -0.72 -0.21 -1.19 -5.04 119.66 107.69 1m3j s GLN 433 Ca 0.42 1.08 -0.29 0.00 0.02 0.00 0.00 55.36 56.59 1m3j s GLN 433 Cb -0.11 0.37 -0.15 0.00 1.00 0.00 0.00 33.01 34.12 1m3j s GLN 433 CO 0.81 -0.23 0.98 -0.25 -2.12 0.00 0.00 175.29 174.49 1m3j n ASP 434 N 5.24 0.94 -3.86 5.90 9.92 -1.26 -4.26 116.55 129.18 1m3j n ASP 434 Ca -0.11 1.16 -0.18 0.00 -0.53 0.00 0.00 54.79 55.13 1m3j n ASP 434 Cb 0.50 -1.22 -0.16 0.00 -0.64 0.00 0.00 41.12 39.60 1m3j n ASP 434 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1m3j s LYS 435 N -1.16 0.50 0.52 -1.24 -0.14 0.38 -4.93 119.74 113.66 1m3j s LYS 435 Ca 0.63 -0.01 0.08 0.00 -1.36 0.00 0.00 55.97 55.31 1m3j s LYS 435 Cb -0.78 -0.60 0.05 0.00 -1.68 0.00 0.00 37.83 34.82 1m3j s LYS 435 CO 0.57 -0.10 0.58 0.95 -0.76 0.00 0.00 175.35 176.60 1m3j s THR 436 N 0.89 2.18 -0.02 2.17 -4.23 -1.26 -1.50 115.64 113.86 1m3j s THR 436 Ca -0.10 -1.20 -0.02 0.00 -1.18 0.00 0.00 61.69 59.19 1m3j s THR 436 Cb -0.13 -2.38 -0.01 0.00 1.34 0.00 0.00 72.50 71.32 1m3j s THR 436 CO -0.01 0.00 0.10 0.00 -0.54 0.00 0.00 174.62 174.17 1m3j n ALA 437 N -1.94 -0.00 -2.55 3.99 0.00 -1.26 -3.29 120.51 115.45 1m3j n ALA 437 Ca 0.08 0.01 -0.01 0.00 0.00 0.00 0.00 53.44 53.52 1m3j n ALA 437 Cb 0.62 -0.10 -0.01 0.00 0.00 0.00 0.00 19.45 19.96 1m3j n ALA 437 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1m3j n HIS 438 N 0.34 -1.33 -4.06 0.00 -0.00 0.54 -4.96 115.22 105.75 1m3j n HIS 438 Ca 0.02 0.78 -0.26 0.00 -0.00 0.00 0.00 57.72 58.26 1m3j n HIS 438 Cb -0.00 -1.82 -0.04 0.00 -0.00 0.00 0.00 29.99 28.13 1m3j n HIS 438 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 1m3j s TYR 439 N -0.18 2.00 -0.28 1.57 6.04 -1.21 -4.90 117.35 120.40 1m3j s TYR 439 Ca -0.04 -0.77 -0.20 0.00 0.04 0.00 0.00 57.07 56.10 1m3j s TYR 439 Cb 0.00 -1.90 0.09 0.00 -1.04 0.00 0.00 41.96 39.11 1m3j s TYR 439 CO 0.12 -0.16 0.77 0.45 -1.54 0.00 0.00 175.55 175.18 1m3j s SER 440 N -4.11 -0.77 -0.11 4.32 0.15 -1.26 -3.77 113.70 108.15 1m3j s SER 440 Ca 0.32 1.35 -0.33 0.00 0.70 0.00 0.00 55.95 57.99 1m3j s SER 440 Cb -0.00 1.34 0.13 0.00 -1.71 0.00 0.00 66.02 65.78 1m3j s SER 440 CO 0.19 -0.22 1.17 -0.89 1.20 0.00 0.00 173.24 174.69 1m3j s THR 441 N 0.98 0.00 0.20 6.45 2.01 -1.26 -5.04 115.64 118.99 1m3j s THR 441 Ca -0.05 -0.09 0.06 0.00 0.31 0.00 0.00 61.69 61.93 1m3j s THR 441 Cb -0.05 -1.28 -0.05 0.00 0.01 0.00 0.00 72.50 71.14 1m3j s THR 441 CO -0.10 0.00 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.04 1m3j s VAL 442 N -2.56 1.44 -0.32 3.82 1.01 -1.26 -2.90 120.40 119.63 1m3j s VAL 442 Ca 0.10 -2.12 -0.02 0.00 0.00 0.00 0.00 61.98 59.94 1m3j s VAL 442 Cb 0.00 -2.10 0.12 0.00 0.00 0.00 0.00 36.38 34.40 1m3j s VAL 442 CO -0.05 -0.55 0.16 -0.63 0.00 0.00 0.00 175.10 174.03 1m3j s ILE 443 N -3.16 0.13 -0.44 2.22 1.01 -0.15 -4.92 121.20 115.89 1m3j s ILE 443 Ca 0.23 -1.24 -0.29 0.00 0.00 0.00 0.00 60.65 59.35 1m3j s ILE 443 Cb 0.02 -1.12 -0.09 0.00 0.01 0.00 0.00 42.46 41.29 1m3j s ILE 443 CO 0.06 -0.84 2.35 -2.65 0.00 0.00 0.00 174.94 173.87 1m3j n PRO 444 N 4.68 1.19 -3.61 2.79 -0.02 -1.26 -2.82 135.00 135.95 1m3j n PRO 444 Ca 0.02 0.19 -0.36 0.00 -2.02 0.00 0.00 63.50 61.33 1m3j n PRO 444 Cb 0.40 -3.02 -0.07 0.00 -0.02 0.00 0.00 33.50 30.78 1m3j n PRO 444 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1m3j s LEU 445 N 10.00 4.26 0.24 2.45 1.43 -0.27 -5.03 118.68 131.76 1m3j s LEU 445 Ca 1.05 0.47 -0.30 0.00 -1.03 0.00 0.00 54.13 54.32 1m3j s LEU 445 Cb -0.45 -2.30 -0.09 0.00 0.03 0.00 0.00 46.19 43.38 1m3j s LEU 445 CO 0.35 0.16 0.97 -1.61 0.23 0.00 0.00 176.35 176.45 1m3j s GLU 446 N 0.23 4.81 0.00 1.70 0.41 -1.26 -2.91 118.70 121.67 1m3j s GLU 446 Ca 0.15 1.55 0.00 0.00 -0.41 0.00 0.00 54.97 56.26 1m3j s GLU 446 Cb -0.13 -3.27 0.00 0.00 -1.78 0.00 0.00 34.13 28.95 1m3j s GLU 446 CO 0.03 0.45 0.33 0.00 -0.49 0.00 0.00 175.26 175.58 1m3j n ALA 447 N 1.51 0.48 -1.36 5.21 0.00 -1.26 -0.13 120.51 124.96 1m3j n ALA 447 Ca -0.02 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.35 1m3j n ALA 447 Cb 0.47 -0.36 0.20 0.00 0.00 0.00 0.00 19.45 19.77 1m3j n ALA 447 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1m3j n ASN 448 N -0.83 2.92 -4.75 0.00 6.94 -1.26 -4.57 115.26 113.71 1m3j n ASN 448 Ca 0.00 -3.67 -0.38 0.00 -0.02 0.00 0.00 54.58 50.51 1m3j n ASN 448 Cb 0.10 -0.67 -0.06 0.00 -2.36 0.00 0.00 39.78 36.78 1m3j n ASN 448 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1m3j s ALA 449 N -3.22 3.52 0.25 -2.53 0.00 0.81 -1.30 121.76 119.29 1m3j s ALA 449 Ca 0.47 -0.18 0.01 0.00 0.00 0.00 0.00 51.96 52.27 1m3j s ALA 449 Cb 0.42 -2.60 -0.03 0.00 0.00 0.00 0.00 23.12 20.90 1m3j s ALA 449 CO 0.03 0.11 0.21 1.03 0.00 0.00 0.00 175.76 177.14 1m3j s ARG 450 N 0.21 1.42 -1.51 0.00 3.00 -0.14 -4.82 118.95 117.11 1m3j s ARG 450 Ca 0.26 -1.74 -0.13 0.00 0.00 0.00 0.00 55.73 54.11 1m3j s ARG 450 Cb -0.16 0.30 0.08 0.00 0.00 0.00 0.00 34.95 35.17 1m3j s ARG 450 CO 0.11 -0.50 1.02 0.09 0.00 0.00 0.00 175.30 176.02 1m3j n ASN 451 N -0.73 -5.09 -4.60 0.23 5.03 -1.26 -1.39 115.26 107.45 1m3j n ASN 451 Ca 0.04 -0.74 -0.43 0.00 0.87 0.00 0.00 54.58 54.31 1m3j n ASN 451 Cb 0.64 -4.05 -0.03 0.00 -1.02 0.00 0.00 39.78 35.33 1m3j n ASN 451 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1m3j s ILE 452 N -3.30 3.55 -0.07 2.41 1.01 -1.25 -4.47 121.20 119.08 1m3j s ILE 452 Ca 0.66 0.57 0.01 0.00 0.00 0.00 0.00 60.65 61.89 1m3j s ILE 452 Cb -0.33 -3.73 0.02 0.00 0.01 0.00 0.00 42.46 38.43 1m3j s ILE 452 CO 0.82 -0.45 -0.09 0.00 0.00 0.00 0.00 174.94 175.21 1m3j s ARG 453 N 5.46 1.43 0.24 2.79 1.70 -1.08 0.32 118.95 129.82 1m3j s ARG 453 Ca 0.77 -0.30 0.07 0.00 -0.47 0.00 0.00 55.73 55.80 1m3j s ARG 453 Cb -0.22 -1.28 -0.04 0.00 -0.57 0.00 0.00 34.95 32.84 1m3j s ARG 453 CO 0.33 -0.05 0.15 0.42 -1.08 0.00 0.00 175.30 175.07 1m3j s ILE 454 N 0.92 4.26 -0.30 4.99 1.01 -1.02 -2.51 121.20 128.56 1m3j s ILE 454 Ca -0.10 -1.46 -0.16 0.00 0.00 0.00 0.00 60.65 58.93 1m3j s ILE 454 Cb -0.15 -3.28 0.18 0.00 0.01 0.00 0.00 42.46 39.22 1m3j s ILE 454 CO 0.01 -0.32 1.10 -0.75 0.00 0.00 0.00 174.94 174.98 1m3j s LYS 455 N -3.71 0.18 -0.21 2.79 2.20 -1.22 -2.22 119.74 117.54 1m3j s LYS 455 Ca 0.32 0.43 -0.03 0.00 -0.36 0.00 0.00 55.97 56.34 1m3j s LYS 455 Cb -0.08 0.26 0.00 0.00 -1.51 0.00 0.00 37.83 36.50 1m3j s LYS 455 CO 0.24 -0.09 -0.08 0.00 -0.36 0.00 0.00 175.35 175.06 1m3j s ALA 456 N 2.41 2.70 -0.18 3.13 0.00 -0.38 -0.10 121.76 129.34 1m3j s ALA 456 Ca -0.01 -1.20 -0.03 0.00 0.00 0.00 0.00 51.96 50.71 1m3j s ALA 456 Cb -0.05 -1.59 -0.02 0.00 0.00 0.00 0.00 23.12 21.46 1m3j s ALA 456 CO -0.16 -0.44 -0.05 0.50 0.00 0.00 0.00 175.76 175.61 1m3j s ARG 457 N 1.43 3.53 0.10 0.00 3.52 -0.86 -0.00 118.95 126.67 1m3j s ARG 457 Ca 0.05 -0.58 -0.31 0.00 -0.13 0.00 0.00 55.73 54.77 1m3j s ARG 457 Cb -0.14 -2.92 -0.07 0.00 -1.56 0.00 0.00 34.95 30.26 1m3j s ARG 457 CO -0.06 0.07 1.23 -2.00 -0.81 0.00 0.00 175.30 173.73 1m3j s GLU 458 N 0.79 4.43 -0.92 5.12 -6.30 -0.01 -2.73 118.70 119.09 1m3j s GLU 458 Ca -0.02 1.84 -0.08 0.00 -2.50 0.00 0.00 54.97 54.22 1m3j s GLU 458 Cb -0.15 -3.30 -0.16 0.00 0.00 0.00 0.00 34.13 30.52 1m3j s GLU 458 CO 0.02 -0.24 3.24 0.00 0.02 0.00 0.00 175.26 178.30 1m3j s THR 460 N 1.58 3.58 0.00 0.00 2.01 -1.26 -4.90 115.64 116.64 1m3j s THR 460 Ca 0.68 -2.83 0.00 0.00 0.31 0.00 0.00 61.69 59.85 1m3j s THR 460 Cb 0.24 -3.36 0.00 0.00 0.01 0.00 0.00 72.50 69.39 1m3j s THR 460 CO -0.04 -0.84 0.00 0.61 -0.69 0.00 0.00 174.62 173.66 1m3j n GLY 461 N 3.64 -0.41 0.12 4.40 0.00 -1.26 -4.66 105.19 107.02 1m3j n GLY 461 Ca 0.06 -1.39 -0.08 0.00 0.00 0.00 0.00 46.02 44.61 1m3j n GLY 461 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1m3j h LEU 462 N 0.00 0.09 0.00 0.99 6.46 -1.95 -3.48 115.31 117.42 1m3j h LEU 462 Ca 0.00 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.78 1m3j h LEU 462 Cb 0.00 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 39.95 1m3j h LEU 462 CO 0.00 0.09 0.06 0.00 -0.62 0.00 0.00 178.44 177.97 1m3j n ALA 463 N -2.26 -0.39 -0.97 1.25 0.00 -1.26 -5.08 120.51 111.80 1m3j n ALA 463 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1m3j n ALA 463 Cb 0.09 0.23 0.00 0.00 0.00 0.00 0.00 19.45 19.76 1m3j n ALA 463 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1m3j n TRP 464 N -0.12 0.00 0.00 0.00 -0.00 -1.26 -1.91 117.44 114.15 1m3j n TRP 464 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.48 1m3j n TRP 464 Cb 0.13 -0.02 0.00 0.00 -0.00 0.00 0.00 31.31 31.43 1m3j n TRP 464 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 177.69 176.84 1m3j n GLU 465 N -0.96 0.00 -0.42 5.87 0.00 -1.26 -1.25 120.64 122.63 1m3j n GLU 465 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 57.16 57.22 1m3j n GLU 465 Cb 0.00 -0.99 0.10 0.00 0.00 0.00 0.00 31.44 30.55 1m3j n GLU 465 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 1m3j n TRP 466 N -0.00 0.00 -4.30 -1.84 8.01 -0.80 -5.06 117.44 113.45 1m3j n TRP 466 Ca 0.00 -0.72 -0.25 0.00 -1.31 0.00 0.00 57.50 55.22 1m3j n TRP 466 Cb 0.00 -0.13 -0.08 0.00 -2.01 0.00 0.00 31.31 29.08 1m3j n TRP 466 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 1m3j s TRP 467 N -1.78 2.66 0.09 -5.99 0.51 -0.38 -4.57 118.94 109.48 1m3j s TRP 467 Ca 0.23 -0.22 -0.30 0.00 -2.12 0.00 0.00 56.10 53.69 1m3j s TRP 467 Cb 0.22 -1.23 -0.05 0.00 -0.81 0.00 0.00 33.47 31.60 1m3j s TRP 467 CO -0.01 0.58 1.01 0.50 -0.51 0.00 0.00 176.95 178.51 1m3j s ARG 468 N -3.29 4.63 -0.15 4.98 3.00 -1.23 -4.82 118.95 122.08 1m3j s ARG 468 Ca 0.29 1.51 -0.29 0.00 -1.00 0.00 0.00 55.73 56.23 1m3j s ARG 468 Cb -0.07 -3.38 -0.02 0.00 0.00 0.00 0.00 34.95 31.48 1m3j s ARG 468 CO 0.18 0.10 1.28 -0.51 0.00 0.00 0.00 175.30 176.34 1m3j s ASP 469 N 0.29 6.94 0.14 -2.12 -0.00 -1.26 -0.83 116.67 119.83 1m3j s ASP 469 Ca 0.49 1.74 0.23 0.00 -0.00 0.00 0.00 52.55 55.02 1m3j s ASP 469 Cb -0.24 -2.54 0.19 0.00 -0.00 0.00 0.00 42.92 40.33 1m3j s ASP 469 CO 0.30 -0.75 1.20 0.58 -0.00 0.00 0.00 175.17 176.49 1m3j h VAL 470 N 5.44 0.00 -1.31 -1.27 2.07 -0.78 -3.47 116.25 116.93 1m3j h VAL 470 Ca -0.28 -0.66 0.15 0.00 0.82 0.00 0.00 66.70 66.73 1m3j h VAL 470 Cb 1.11 1.18 -0.28 0.00 -1.52 0.00 0.00 31.29 31.79 1m3j h VAL 470 CO 0.96 0.00 0.72 -0.51 0.02 0.00 0.00 177.57 178.76 1m3j s ILE 471 N -3.24 0.00 -0.39 4.57 1.10 -0.90 -4.50 121.20 117.85 1m3j s ILE 471 Ca 0.04 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.18 1m3j s ILE 471 Cb 0.12 -1.00 0.19 0.00 0.15 0.00 0.00 42.46 41.92 1m3j s ILE 471 CO 0.75 0.00 0.85 -0.55 -2.11 0.00 0.00 174.94 173.88 1m3j s SER 472 N -0.49 -0.95 -0.24 4.50 0.15 -1.26 -1.25 113.70 114.15 1m3j s SER 472 Ca 0.05 -0.70 -0.14 0.00 0.70 0.00 0.00 55.95 55.85 1m3j s SER 472 Cb -0.03 1.23 -0.04 0.00 -1.71 0.00 0.00 66.02 65.47 1m3j s SER 472 CO -0.07 -0.08 0.34 -1.61 1.20 0.00 0.00 173.24 173.02 1m3j s GLU 473 N 1.56 4.07 -0.09 5.44 0.41 -0.94 -5.00 118.70 124.16 1m3j s GLU 473 Ca 0.19 0.03 -0.10 0.00 -0.41 0.00 0.00 54.97 54.68 1m3j s GLU 473 Cb 0.02 -3.60 -0.05 0.00 -1.78 0.00 0.00 34.13 28.72 1m3j s GLU 473 CO -0.10 -0.14 0.23 0.71 -0.49 0.00 0.00 175.26 175.48 1m3j s TYR 474 N 1.64 3.63 -1.29 1.61 4.12 -1.26 -2.42 117.35 123.37 1m3j s TYR 474 Ca 0.15 0.67 -0.01 0.00 0.02 0.00 0.00 57.07 57.90 1m3j s TYR 474 Cb -0.15 -2.07 0.00 0.00 -1.52 0.00 0.00 41.96 38.22 1m3j s TYR 474 CO 0.08 0.68 0.78 -0.25 0.02 0.00 0.00 175.55 176.87 1m3j n ASP 475 N 2.04 -1.58 -4.76 2.29 9.92 -1.03 -4.94 116.55 118.49 1m3j n ASP 475 Ca -0.18 -0.77 -0.36 0.00 -0.53 0.00 0.00 54.79 52.95 1m3j n ASP 475 Cb 0.54 -4.30 0.02 0.00 -0.64 0.00 0.00 41.12 36.74 1m3j n ASP 475 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1m3j s VAL 476 N -3.58 2.68 0.37 2.53 1.01 0.96 -4.79 120.40 119.58 1m3j s VAL 476 Ca 0.04 0.45 -0.25 0.00 0.00 0.00 0.00 61.98 62.22 1m3j s VAL 476 Cb -0.02 -3.19 -0.10 0.00 0.00 0.00 0.00 36.38 33.07 1m3j s VAL 476 CO 0.79 -0.07 1.00 -2.16 0.00 0.00 0.00 175.10 174.66 1m3j s PRO 477 N -3.17 4.35 -1.53 2.72 0.04 -1.26 -3.95 135.00 132.20 1m3j s PRO 477 Ca 0.74 1.40 -0.09 0.00 0.04 0.00 0.00 61.00 63.09 1m3j s PRO 477 Cb -0.31 -2.62 -0.02 0.00 0.04 0.00 0.00 34.50 31.59 1m3j s PRO 477 CO 0.34 0.05 2.74 -0.11 0.04 0.00 0.00 177.00 180.07 1m3j n LEU 478 N 0.15 8.42 0.00 -3.56 7.94 -1.26 -4.90 117.00 123.80 1m3j n LEU 478 Ca 0.04 -4.50 -0.26 0.00 -1.11 0.00 0.00 56.01 50.18 1m3j n LEU 478 Cb 0.50 -1.51 0.23 0.00 0.53 0.00 0.00 43.42 43.17 1m3j n LEU 478 CO 0.44 2.00 0.39 0.35 -1.11 0.00 0.00 177.39 179.46 1m3j n THR 479 N 3.17 0.00 -0.32 1.96 -2.24 -1.26 -4.71 114.28 110.88 1m3j n THR 479 Ca 0.72 -0.18 -0.04 0.00 -2.27 0.00 0.00 64.05 62.28 1m3j n THR 479 Cb 0.25 -1.00 0.08 0.00 -2.10 0.00 0.00 70.33 67.56 1m3j n THR 479 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 1m3j h ASN 480 N -2.99 1.04 -2.64 3.42 -0.73 -1.39 -3.36 115.58 108.93 1m3j h ASN 480 Ca -0.34 -0.07 -0.15 0.00 1.87 0.00 0.00 56.30 57.61 1m3j h ASN 480 Cb 1.10 -0.26 -0.30 0.00 0.27 0.00 0.00 38.32 39.13 1m3j h ASN 480 CO 0.21 0.80 -0.44 0.20 -0.37 0.00 0.00 177.43 177.83 1m3j s ASN 481 N -6.10 0.03 -0.60 1.15 0.01 -1.25 -3.47 114.94 104.72 1m3j s ASN 481 Ca -0.13 0.80 -0.12 0.00 -0.71 0.00 0.00 52.86 52.69 1m3j s ASN 481 Cb 0.16 1.06 0.15 0.00 0.41 0.00 0.00 41.25 43.04 1m3j s ASN 481 CO 0.81 -0.24 0.52 -0.63 -1.51 0.00 0.00 177.10 176.05 1m3j s ILE 482 N 2.53 4.89 -0.31 0.60 1.01 -0.94 -2.76 121.20 126.23 1m3j s ILE 482 Ca -0.00 -1.94 -0.08 0.00 0.00 0.00 0.00 60.65 58.63 1m3j s ILE 482 Cb -0.12 -4.13 0.01 0.00 0.01 0.00 0.00 42.46 38.23 1m3j s ILE 482 CO -0.11 -0.88 0.11 0.54 0.00 0.00 0.00 174.94 174.60 1m3j s ASN 483 N 2.74 5.30 -0.27 3.58 2.20 -1.12 -2.35 114.94 125.01 1m3j s ASN 483 Ca 0.09 -0.72 -0.10 0.00 -0.94 0.00 0.00 52.86 51.19 1m3j s ASN 483 Cb -0.23 -1.92 -0.04 0.00 -2.00 0.00 0.00 41.25 37.05 1m3j s ASN 483 CO -0.02 -0.22 0.16 -0.69 -2.94 0.00 0.00 177.10 173.39 1m3j s VAL 484 N 1.53 5.02 -0.24 3.54 1.01 0.61 -2.70 120.40 129.17 1m3j s VAL 484 Ca 0.03 0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.09 1m3j s VAL 484 Cb -0.17 -3.38 0.05 0.00 0.00 0.00 0.00 36.38 32.87 1m3j s VAL 484 CO 0.04 0.27 -0.11 -0.55 0.00 0.00 0.00 175.10 174.74 1m3j s SER 485 N 1.72 4.10 0.04 3.32 0.15 -0.96 -2.00 113.70 120.07 1m3j s SER 485 Ca 0.07 -1.22 0.00 0.00 0.70 0.00 0.00 55.95 55.50 1m3j s SER 485 Cb -0.16 -1.46 -0.04 0.00 -1.71 0.00 0.00 66.02 62.65 1m3j s SER 485 CO 0.09 -0.17 0.15 0.27 1.20 0.00 0.00 173.24 174.78 1m3j s ILE 486 N 1.19 5.05 0.14 6.45 -5.25 0.35 -2.62 121.20 126.52 1m3j s ILE 486 Ca -0.06 -0.46 -0.24 0.00 -0.99 0.00 0.00 60.65 58.90 1m3j s ILE 486 Cb -0.19 -3.41 0.07 0.00 2.95 0.00 0.00 42.46 41.88 1m3j s ILE 486 CO -0.07 0.20 0.65 -1.66 -1.79 0.00 0.00 174.94 172.28 1m3j s TRP 487 N -1.39 -0.50 -3.39 1.37 -2.14 0.61 -2.64 118.94 110.87 1m3j s TRP 487 Ca 0.30 0.29 0.00 0.00 2.66 0.00 0.00 56.10 59.35 1m3j s TRP 487 Cb -0.13 0.56 0.00 0.00 -3.10 0.00 0.00 33.47 30.81 1m3j s TRP 487 CO 0.22 -0.82 0.00 0.41 -2.66 0.00 0.00 176.95 174.11 1m3j n GLY 488 N -0.36 0.77 3.69 3.67 0.00 -1.22 0.16 105.19 111.89 1m3j n GLY 488 Ca -0.15 -2.03 -0.32 0.00 0.00 0.00 0.00 46.02 43.52 1m3j n GLY 488 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m3j s THR 489 N -1.50 4.15 0.33 2.61 -4.23 0.48 0.12 115.64 117.60 1m3j s THR 489 Ca 0.00 -0.69 0.13 0.00 -1.18 0.00 0.00 61.69 59.95 1m3j s THR 489 Cb 0.00 -2.89 0.32 0.00 1.34 0.00 0.00 72.50 71.28 1m3j s THR 489 CO 0.00 0.31 1.68 0.74 -0.54 0.00 0.00 174.62 176.80 1m3j h THR 490 N 3.33 0.35 0.13 3.99 2.02 -1.98 0.03 112.91 120.78 1m3j h THR 490 Ca -0.48 -0.13 -0.17 0.00 0.77 0.00 0.00 66.41 66.40 1m3j h THR 490 Cb 1.17 -0.05 0.02 0.00 -1.74 0.00 0.00 68.15 67.55 1m3j h THR 490 CO 0.58 0.07 -0.74 0.25 0.37 0.00 0.00 175.52 176.05 1m3j h LEU 491 N 0.37 0.41 -7.26 2.58 6.46 -1.94 -3.40 115.31 112.53 1m3j h LEU 491 Ca 0.70 -0.96 -0.65 0.00 -0.12 0.00 0.00 57.88 56.86 1m3j h LEU 491 Cb 1.54 -0.13 -0.40 0.00 -0.73 0.00 0.00 40.66 40.94 1m3j h LEU 491 CO -0.58 1.36 -0.48 -0.31 -0.62 0.00 0.00 178.44 177.80 1m3j s TYR 492 N -2.41 3.50 0.82 1.25 1.51 -0.10 -5.09 117.35 116.84 1m3j s TYR 492 Ca -0.14 -3.18 -0.12 0.00 -1.01 0.00 0.00 57.07 52.62 1m3j s TYR 492 Cb 0.01 -2.88 0.08 0.00 -0.11 0.00 0.00 41.96 39.05 1m3j s TYR 492 CO 0.81 -0.66 1.11 -2.14 -1.11 0.00 0.00 175.55 173.56 1m3j s PRO 493 N -0.97 1.88 -0.09 -1.71 0.02 -0.61 -0.39 135.00 133.13 1m3j s PRO 493 Ca 0.22 0.53 -0.19 0.00 0.02 0.00 0.00 61.00 61.59 1m3j s PRO 493 Cb -0.13 -1.90 0.04 0.00 0.02 0.00 0.00 34.50 32.53 1m3j s PRO 493 CO -0.10 -1.74 0.45 0.20 -0.33 0.00 0.00 177.00 175.49 1m3j s GLY 494 N -3.97 -0.32 -0.07 0.52 0.00 0.41 -4.82 107.32 99.07 1m3j s GLY 494 Ca 0.61 0.95 -0.31 0.00 0.00 0.00 0.00 44.72 45.97 1m3j s GLY 494 CO 0.54 0.72 0.76 -1.35 0.00 0.00 0.00 173.10 173.77 1m3j s SER 495 N -0.65 -0.58 0.30 1.64 1.04 -1.26 -0.29 113.70 113.90 1m3j s SER 495 Ca -0.07 0.62 -0.14 0.00 0.48 0.00 0.00 55.95 56.83 1m3j s SER 495 Cb -0.03 0.48 0.02 0.00 0.10 0.00 0.00 66.02 66.58 1m3j s SER 495 CO 0.04 -0.55 0.61 -0.94 0.98 0.00 0.00 173.24 173.38 1m3j s SER 496 N -1.20 0.02 -0.29 7.02 1.04 -1.08 -5.04 113.70 114.16 1m3j s SER 496 Ca -0.08 -0.96 -0.04 0.00 0.48 0.00 0.00 55.95 55.35 1m3j s SER 496 Cb -0.00 0.69 0.16 0.00 0.10 0.00 0.00 66.02 66.98 1m3j s SER 496 CO 0.07 -1.33 0.59 -0.51 0.98 0.00 0.00 173.24 173.04 1m3j s ILE 497 N -3.51 -0.96 0.28 -1.02 2.07 -1.26 -2.25 121.20 114.54 1m3j s ILE 497 Ca 0.19 0.00 0.06 0.00 -1.41 0.00 0.00 60.65 59.49 1m3j s ILE 497 Cb -0.03 -0.98 -0.03 0.00 0.13 0.00 0.00 42.46 41.56 1m3j s ILE 497 CO 0.10 -0.01 0.34 0.42 -1.91 0.00 0.00 174.94 173.89 1m3j s THR 498 N 2.84 4.53 0.18 4.00 -4.23 -1.10 -4.98 115.64 116.89 1m3j s THR 498 Ca 0.11 -1.14 0.07 0.00 -1.18 0.00 0.00 61.69 59.56 1m3j s THR 498 Cb -0.14 -3.54 -0.04 0.00 1.34 0.00 0.00 72.50 70.11 1m3j s THR 498 CO -0.20 -0.27 -0.15 -0.31 -0.54 0.00 0.00 174.62 173.15 1m3j s TYR 499 N -2.11 1.66 0.00 3.99 4.12 -1.26 -2.81 117.35 120.94 1m3j s TYR 499 Ca 0.37 -0.56 0.00 0.00 0.02 0.00 0.00 57.07 56.91 1m3j s TYR 499 Cb -0.08 -0.80 0.00 0.00 -1.52 0.00 0.00 41.96 39.56 1m3j s TYR 499 CO 0.28 0.30 0.24 0.09 0.02 0.00 0.00 175.55 176.48