#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m3i s SER 37 N 0.00 4.70 0.11 1.69 1.04 -1.26 -2.92 113.70 117.06 1m3i s SER 37 Ca 0.00 -1.21 -0.21 0.00 0.48 0.00 0.00 55.95 55.01 1m3i s SER 37 Cb 0.00 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.60 1m3i s SER 37 CO 0.00 -1.23 1.05 2.30 0.98 0.00 0.00 173.24 176.35 1m3i n ILE 38 N -1.92 -0.46 0.91 -1.02 -5.35 -1.26 -2.17 119.36 108.09 1m3i n ILE 38 Ca 0.02 1.66 0.09 0.00 -0.27 0.00 0.00 62.75 64.25 1m3i n ILE 38 Cb 0.64 -2.05 -0.10 0.00 -1.74 0.00 0.00 39.64 36.39 1m3i n ILE 38 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1m3i n ASP 39 N -4.86 1.05 0.00 7.28 10.43 -1.26 -4.29 116.55 124.90 1m3i n ASP 39 Ca 0.02 -1.02 -0.11 0.00 2.57 0.00 0.00 54.79 56.24 1m3i n ASP 39 Cb 0.18 0.93 -0.09 0.00 1.84 0.00 0.00 41.12 43.98 1m3i n ASP 39 CO 0.00 0.00 0.00 -1.28 -1.07 0.00 0.00 177.20 174.85 1m3i h SER 40 N 0.30 -0.09 -0.96 -2.24 0.87 -1.82 -2.41 113.55 107.22 1m3i h SER 40 Ca 0.00 -0.52 0.10 0.00 -1.23 0.00 0.00 61.79 60.14 1m3i h SER 40 Cb 0.49 0.02 -0.08 0.00 -0.44 0.00 0.00 62.40 62.39 1m3i h SER 40 CO 0.00 0.56 0.60 1.23 -0.53 0.00 0.00 176.83 178.69 1m3i h GLY 41 N -0.83 1.53 1.92 5.77 0.00 -1.68 0.10 103.07 109.88 1m3i h GLY 41 Ca -0.01 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1m3i h GLY 41 CO 0.02 0.19 0.00 1.39 0.00 0.00 0.00 176.54 178.14 1m3i n ILE 42 N -4.62 0.62 -0.10 2.60 5.41 -1.23 -3.89 119.36 118.14 1m3i n ILE 42 Ca 0.17 0.16 -0.09 0.00 1.00 0.00 0.00 62.75 63.98 1m3i n ILE 42 Cb 0.30 -0.82 -0.03 0.00 -0.71 0.00 0.00 39.64 38.37 1m3i n ILE 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1m3i h SER 43 N 0.00 -1.21 -1.58 4.38 0.02 -0.25 -3.41 113.55 111.49 1m3i h SER 43 Ca 0.00 0.19 -0.05 0.00 -0.84 0.00 0.00 61.79 61.09 1m3i h SER 43 Cb 0.31 0.54 -0.26 0.00 0.14 0.00 0.00 62.40 63.13 1m3i h SER 43 CO 0.00 -0.35 -0.39 -0.44 -1.14 0.00 0.00 176.83 174.51 1m3i s SER 44 N -5.03 -0.42 0.45 3.07 0.01 -1.25 -5.05 113.70 105.48 1m3i s SER 44 Ca -0.15 0.53 0.05 0.00 1.31 0.00 0.00 55.95 57.69 1m3i s SER 44 Cb 0.12 1.54 -0.04 0.00 0.21 0.00 0.00 66.02 67.85 1m3i s SER 44 CO 0.66 -0.28 0.08 -0.76 0.41 0.00 0.00 173.24 173.36 1m3i s LEU 45 N 2.67 2.75 -0.98 2.44 1.02 -1.26 -5.05 118.68 120.27 1m3i s LEU 45 Ca 0.15 -1.37 -0.14 0.00 0.02 0.00 0.00 54.13 52.79 1m3i s LEU 45 Cb -0.15 -1.01 0.21 0.00 0.02 0.00 0.00 46.19 45.26 1m3i s LEU 45 CO -0.18 -0.65 1.03 -0.55 0.02 0.00 0.00 176.35 176.03 1m3i s SER 46 N -3.85 6.92 -0.30 2.29 0.15 -1.26 -4.92 113.70 112.72 1m3i s SER 46 Ca 0.28 -2.82 -0.11 0.00 0.70 0.00 0.00 55.95 54.00 1m3i s SER 46 Cb 0.05 -2.28 0.16 0.00 -1.71 0.00 0.00 66.02 62.24 1m3i s SER 46 CO 0.15 -0.64 0.85 -0.72 1.20 0.00 0.00 173.24 174.08 1m3i s TYR 47 N 0.59 -0.99 0.11 3.44 -0.85 -1.26 -4.66 117.35 113.74 1m3i s TYR 47 Ca 0.28 1.48 -0.30 0.00 -0.52 0.00 0.00 57.07 58.01 1m3i s TYR 47 Cb -0.08 0.51 -0.06 0.00 0.38 0.00 0.00 41.96 42.71 1m3i s TYR 47 CO -0.08 -0.51 1.09 1.21 -1.52 0.00 0.00 175.55 175.75 1m3i s ASN 48 N 2.71 7.26 0.16 -0.18 3.04 -1.26 -4.92 114.94 121.75 1m3i s ASN 48 Ca 0.01 1.97 0.16 0.00 0.04 0.00 0.00 52.86 55.04 1m3i s ASN 48 Cb -0.10 -2.59 0.75 0.00 -1.54 0.00 0.00 41.25 37.77 1m3i s ASN 48 CO -0.18 -0.27 1.50 -2.11 -3.04 0.00 0.00 177.10 173.00 1m3i n ARG 49 N 3.06 0.10 0.00 0.43 1.85 -1.26 -2.73 116.66 118.11 1m3i n ARG 49 Ca 0.05 0.45 0.11 0.00 -1.00 0.00 0.00 57.85 57.46 1m3i n ARG 49 Cb 0.47 -1.73 0.03 0.00 -1.05 0.00 0.00 32.46 30.18 1m3i n ARG 49 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1m3i n ASN 50 N -1.92 0.96 0.00 2.89 3.02 -1.26 -4.54 115.26 114.41 1m3i n ASN 50 Ca 0.01 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.74 1m3i n ASN 50 Cb 0.12 0.68 0.00 0.00 -0.61 0.00 0.00 39.78 39.97 1m3i n ASN 50 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1m3i n GLU 51 N -1.30 0.40 0.19 3.52 1.02 -1.11 -4.83 120.64 118.52 1m3i n GLU 51 Ca 0.05 -0.57 0.06 0.00 -0.02 0.00 0.00 57.16 56.69 1m3i n GLU 51 Cb 0.35 -0.59 0.27 0.00 -0.02 0.00 0.00 31.44 31.45 1m3i n GLU 51 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 1m3i h VAL 52 N 2.14 0.72 -2.15 2.62 -1.51 -1.75 -3.37 116.25 112.96 1m3i h VAL 52 Ca 0.00 -1.58 -0.57 0.00 -1.23 0.00 0.00 66.70 63.31 1m3i h VAL 52 Cb 0.81 2.03 -0.39 0.00 -2.13 0.00 0.00 31.29 31.61 1m3i h VAL 52 CO 0.00 0.34 -1.00 -0.11 -1.23 0.00 0.00 177.57 175.57 1m3i n LEU 53 N -3.36 0.51 0.00 4.19 -0.00 -1.26 -4.42 117.00 112.66 1m3i n LEU 53 Ca 0.01 -4.72 0.00 0.00 -0.00 0.00 0.00 56.01 51.30 1m3i n LEU 53 Cb 0.55 0.42 0.00 0.00 -0.00 0.00 0.00 43.42 44.40 1m3i n LEU 53 CO 0.37 2.01 0.00 0.00 -0.00 0.00 0.00 177.39 179.76 1m3i n ALA 54 N 1.71 0.00 -3.13 1.96 0.00 -1.26 -2.94 120.51 116.84 1m3i n ALA 54 Ca 0.24 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.56 1m3i n ALA 54 Cb 0.50 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.84 1m3i n ALA 54 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1m3i s SER 55 N -0.72 -0.17 -0.24 0.00 0.15 0.16 -4.64 113.70 108.24 1m3i s SER 55 Ca 0.00 0.24 -0.10 0.00 0.70 0.00 0.00 55.95 56.79 1m3i s SER 55 Cb 0.00 0.38 -0.05 0.00 -1.71 0.00 0.00 66.02 64.65 1m3i s SER 55 CO 0.00 -0.21 0.15 0.20 1.20 0.00 0.00 173.24 174.58 1m3i s ASN 56 N -0.47 6.02 0.22 5.45 -0.87 -1.26 -4.52 114.94 119.52 1m3i s ASN 56 Ca -0.06 0.08 0.11 0.00 -1.57 0.00 0.00 52.86 51.42 1m3i s ASN 56 Cb -0.04 -2.09 -0.05 0.00 -0.02 0.00 0.00 41.25 39.06 1m3i s ASN 56 CO 0.01 0.06 -0.16 -0.83 -2.57 0.00 0.00 177.10 173.61 1m3i s GLY 57 N 1.11 1.76 0.03 0.66 0.00 -1.26 -5.03 107.32 104.58 1m3i s GLY 57 Ca 0.07 -1.66 -0.30 0.00 0.00 0.00 0.00 44.72 42.82 1m3i s GLY 57 CO 0.05 -1.71 1.30 0.51 0.00 0.00 0.00 173.10 173.24 1m3i s ASP 58 N -3.08 6.96 0.31 1.64 1.47 -1.26 -4.79 116.67 117.92 1m3i s ASP 58 Ca 0.26 2.06 0.09 0.00 1.18 0.00 0.00 52.55 56.14 1m3i s ASP 58 Cb -0.07 -2.57 -0.06 0.00 -0.34 0.00 0.00 42.92 39.88 1m3i s ASP 58 CO 0.14 -0.61 -0.12 -0.75 0.68 0.00 0.00 175.17 174.52 1m3i s LYS 59 N 1.75 1.70 -0.06 2.11 2.20 -1.26 -1.53 119.74 124.66 1m3i s LYS 59 Ca 0.61 -1.85 -0.30 0.00 -0.36 0.00 0.00 55.97 54.07 1m3i s LYS 59 Cb -0.30 -1.57 0.11 0.00 -1.51 0.00 0.00 37.83 34.56 1m3i s LYS 59 CO 0.27 0.17 0.95 -1.50 -0.36 0.00 0.00 175.35 174.87 1m3i s ILE 60 N -2.69 0.00 0.00 5.43 1.10 -1.26 -5.05 121.20 118.73 1m3i s ILE 60 Ca 0.31 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.45 1m3i s ILE 60 Cb 0.01 -1.00 0.00 0.00 0.15 0.00 0.00 42.46 41.62 1m3i s ILE 60 CO 0.15 0.00 0.00 1.21 -2.11 0.00 0.00 174.94 174.19 1m3i n GLU 61 N -0.04 0.00 -1.64 3.50 4.07 -1.26 -5.01 120.64 120.26 1m3i n GLU 61 Ca -0.08 0.00 -0.59 0.00 -0.06 0.00 0.00 57.16 56.43 1m3i n GLU 61 Cb 0.61 0.00 -0.08 0.00 -0.06 0.00 0.00 31.44 31.91 1m3i n GLU 61 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1m3i n SER 62 N 0.00 1.29 -3.25 4.31 7.64 -1.26 -4.97 113.62 117.38 1m3i n SER 62 Ca 0.00 1.14 -0.19 0.00 1.01 0.00 0.00 58.87 60.83 1m3i n SER 62 Cb 0.00 -1.03 -0.05 0.00 -1.01 0.00 0.00 64.21 62.12 1m3i n SER 62 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 1m3i n PHE 63 N 3.36 0.12 -3.58 1.43 1.16 -1.26 -5.13 117.46 113.56 1m3i n PHE 63 Ca 0.24 -1.91 -0.39 0.00 -1.87 0.00 0.00 57.45 53.52 1m3i n PHE 63 Cb 0.08 -0.01 -0.11 0.00 -1.61 0.00 0.00 39.48 37.83 1m3i n PHE 63 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1m3i s VAL 64 N -2.66 5.04 0.38 1.97 1.01 -1.26 -4.97 120.40 119.92 1m3i s VAL 64 Ca 0.15 -0.26 0.11 0.00 0.00 0.00 0.00 61.98 61.98 1m3i s VAL 64 Cb 0.01 -3.57 0.13 0.00 0.00 0.00 0.00 36.38 32.95 1m3i s VAL 64 CO 0.10 0.04 1.88 -0.65 0.00 0.00 0.00 175.10 176.47 1m3i h PRO 65 N 8.43 0.13 -1.72 2.72 0.11 -1.84 -3.18 132.00 136.65 1m3i h PRO 65 Ca -0.32 -0.04 0.08 0.00 0.11 0.00 0.00 66.00 65.83 1m3i h PRO 65 Cb 1.16 -0.01 -0.24 0.00 0.11 0.00 0.00 31.00 32.01 1m3i h PRO 65 CO 0.62 0.37 0.20 0.21 -0.21 0.00 0.00 178.00 179.19 1m3i s LYS 66 N -4.49 0.52 0.00 1.05 2.20 -1.26 -2.62 119.74 115.14 1m3i s LYS 66 Ca -0.04 0.93 0.01 0.00 -0.36 0.00 0.00 55.97 56.51 1m3i s LYS 66 Cb 0.15 0.17 -0.01 0.00 -1.51 0.00 0.00 37.83 36.63 1m3i s LYS 66 CO 0.73 -0.12 -0.05 -2.00 -0.36 0.00 0.00 175.35 173.56 1m3i s GLU 67 N 1.61 0.37 -0.10 4.03 2.12 0.02 -4.40 118.70 122.35 1m3i s GLU 67 Ca -0.09 -0.22 0.00 0.00 0.36 0.00 0.00 54.97 55.02 1m3i s GLU 67 Cb -0.05 -0.33 0.02 0.00 0.26 0.00 0.00 34.13 34.04 1m3i s GLU 67 CO -0.17 0.09 -0.08 0.20 -0.54 0.00 0.00 175.26 174.75 1m3i s GLY 68 N -0.27 0.80 0.15 -1.50 0.00 -1.26 -1.13 107.32 104.11 1m3i s GLY 68 Ca 0.00 -0.49 0.11 0.00 0.00 0.00 0.00 44.72 44.33 1m3i s GLY 68 CO -0.00 0.66 -0.25 -1.59 0.00 0.00 0.00 173.10 171.92 1m3i s LYS 69 N 1.47 1.41 -0.34 2.90 0.00 -0.65 -4.85 119.74 119.68 1m3i s LYS 69 Ca 0.00 -1.40 -0.14 0.00 0.00 0.00 0.00 55.97 54.43 1m3i s LYS 69 Cb -0.13 -1.79 -0.01 0.00 0.00 0.00 0.00 37.83 35.90 1m3i s LYS 69 CO -0.05 0.41 0.33 0.15 0.00 0.00 0.00 175.35 176.18 1m3i s LYS 70 N -2.31 3.53 -0.24 1.78 1.02 -1.26 -1.89 119.74 120.37 1m3i s LYS 70 Ca 0.16 -0.49 0.02 0.00 0.02 0.00 0.00 55.97 55.67 1m3i s LYS 70 Cb -0.09 -3.81 0.06 0.00 -0.52 0.00 0.00 37.83 33.47 1m3i s LYS 70 CO 0.07 -0.50 -0.10 0.00 -0.92 0.00 0.00 175.35 173.90 1m3i s ALA 71 N 1.93 2.31 0.00 5.17 0.00 -1.05 -4.98 121.76 125.14 1m3i s ALA 71 Ca 0.10 -1.55 0.00 0.00 0.00 0.00 0.00 51.96 50.51 1m3i s ALA 71 Cb -0.17 -1.48 0.00 0.00 0.00 0.00 0.00 23.12 21.47 1m3i s ALA 71 CO 0.11 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 175.18 1m3i n GLY 72 N 4.54 1.88 1.07 0.00 0.00 -1.26 -1.47 105.19 109.96 1m3i n GLY 72 Ca -0.14 -0.49 -0.03 0.00 0.00 0.00 0.00 46.02 45.36 1m3i n GLY 72 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1m3i n ASN 73 N -1.31 2.75 -3.78 1.61 6.94 -1.26 -4.80 115.26 115.42 1m3i n ASN 73 Ca 0.00 -2.24 -0.24 0.00 -0.02 0.00 0.00 54.58 52.08 1m3i n ASN 73 Cb 0.00 -0.55 -0.06 0.00 -2.36 0.00 0.00 39.78 36.81 1m3i n ASN 73 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1m3i n LYS 74 N 0.19 0.72 -3.15 -3.83 4.01 -0.54 -2.28 118.16 113.28 1m3i n LYS 74 Ca 0.09 -3.05 0.04 0.00 -0.51 0.00 0.00 58.31 54.87 1m3i n LYS 74 Cb 0.62 1.39 -0.00 0.00 -0.51 0.00 0.00 35.03 36.53 1m3i n LYS 74 CO 0.00 0.00 0.00 0.12 -1.11 0.00 0.00 177.40 176.41 1m3i s PHE 75 N -2.79 -1.62 0.19 2.13 5.36 0.17 -2.53 117.98 118.89 1m3i s PHE 75 Ca 0.13 0.86 -0.17 0.00 -0.96 0.00 0.00 56.93 56.79 1m3i s PHE 75 Cb 0.01 0.28 -0.08 0.00 -0.34 0.00 0.00 43.02 42.89 1m3i s PHE 75 CO 0.09 -0.96 0.64 0.42 -1.46 0.00 0.00 175.22 173.95 1m3i s ILE 76 N 2.73 4.71 -0.12 3.12 -1.09 -0.79 -2.27 121.20 127.48 1m3i s ILE 76 Ca 0.13 1.06 -0.00 0.00 -2.23 0.00 0.00 60.65 59.61 1m3i s ILE 76 Cb -0.08 -3.79 0.02 0.00 -1.58 0.00 0.00 42.46 37.03 1m3i s ILE 76 CO -0.23 0.22 -0.08 -0.69 -1.23 0.00 0.00 174.94 172.92 1m3i s VAL 77 N -1.50 1.10 0.14 2.92 1.01 -0.66 -1.63 120.40 121.76 1m3i s VAL 77 Ca 0.41 -0.34 0.11 0.00 0.00 0.00 0.00 61.98 62.16 1m3i s VAL 77 Cb -0.16 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1m3i s VAL 77 CO 0.20 0.38 -0.27 0.68 0.00 0.00 0.00 175.10 176.09 1m3i s VAL 78 N 1.68 2.28 -0.07 2.92 -7.23 -0.28 -1.45 120.40 118.24 1m3i s VAL 78 Ca 0.05 -1.78 0.05 0.00 -1.81 0.00 0.00 61.98 58.49 1m3i s VAL 78 Cb -0.13 -2.02 -0.00 0.00 0.56 0.00 0.00 36.38 34.79 1m3i s VAL 78 CO -0.09 0.07 -0.22 -1.61 -0.31 0.00 0.00 175.10 172.95 1m3i s GLU 79 N -2.12 2.52 -0.10 4.82 2.02 0.38 -0.80 118.70 125.43 1m3i s GLU 79 Ca 0.15 -0.79 0.01 0.00 0.02 0.00 0.00 54.97 54.35 1m3i s GLU 79 Cb -0.10 -2.03 -0.02 0.00 0.10 0.00 0.00 34.13 32.08 1m3i s GLU 79 CO 0.06 0.24 -0.11 1.03 0.02 0.00 0.00 175.26 176.50 1m3i s ARG 80 N 0.17 3.09 -0.12 1.61 0.52 -1.08 -0.29 118.95 122.85 1m3i s ARG 80 Ca -0.11 -0.65 -0.05 0.00 -0.52 0.00 0.00 55.73 54.41 1m3i s ARG 80 Cb -0.15 -2.59 0.06 0.00 0.52 0.00 0.00 34.95 32.79 1m3i s ARG 80 CO 0.06 0.40 0.25 -0.65 0.02 0.00 0.00 175.30 175.37 1m3i s GLN 81 N -0.11 0.14 -0.02 3.54 -0.21 0.06 -4.48 119.66 118.58 1m3i s GLN 81 Ca -0.01 0.70 -0.19 0.00 0.02 0.00 0.00 55.36 55.88 1m3i s GLN 81 Cb -0.14 -0.07 -0.05 0.00 1.00 0.00 0.00 33.01 33.75 1m3i s GLN 81 CO 0.03 -0.27 0.55 0.21 -2.12 0.00 0.00 175.29 173.69 1m3i s LYS 82 N 2.26 4.26 0.09 2.91 2.20 -1.26 0.91 119.74 131.10 1m3i s LYS 82 Ca 0.00 0.64 0.04 0.00 -0.36 0.00 0.00 55.97 56.29 1m3i s LYS 82 Cb -0.12 -3.33 -0.04 0.00 -1.51 0.00 0.00 37.83 32.83 1m3i s LYS 82 CO -0.08 0.40 0.04 1.03 -0.36 0.00 0.00 175.35 176.38 1m3i s ARG 83 N -0.26 2.71 -0.17 4.03 1.81 0.83 -4.90 118.95 123.00 1m3i s ARG 83 Ca 0.29 -0.77 0.01 0.00 -1.72 0.00 0.00 55.73 53.53 1m3i s ARG 83 Cb -0.18 -2.63 0.02 0.00 -0.45 0.00 0.00 34.95 31.72 1m3i s ARG 83 CO 0.16 0.55 -0.18 -1.12 -0.68 0.00 0.00 175.30 174.02 1m3i s SER 84 N -2.39 3.02 0.30 0.23 0.01 -1.26 -1.54 113.70 112.08 1m3i s SER 84 Ca 0.28 -0.61 0.08 0.00 1.31 0.00 0.00 55.95 57.01 1m3i s SER 84 Cb -0.12 -1.39 -0.04 0.00 0.21 0.00 0.00 66.02 64.68 1m3i s SER 84 CO 0.20 -0.02 0.12 -0.22 0.41 0.00 0.00 173.24 173.73 1m3i s LEU 85 N 1.35 3.36 -0.12 2.44 0.20 -1.18 -5.08 118.68 119.65 1m3i s LEU 85 Ca 0.05 -0.63 -0.04 0.00 0.69 0.00 0.00 54.13 54.20 1m3i s LEU 85 Cb -0.13 -1.87 0.06 0.00 -0.43 0.00 0.00 46.19 43.82 1m3i s LEU 85 CO -0.12 -0.18 0.20 -0.89 -0.29 0.00 0.00 176.35 175.07 1m3i s THR 86 N -2.34 -0.32 0.21 3.68 2.01 -1.26 -3.73 115.64 113.89 1m3i s THR 86 Ca 0.35 0.25 0.11 0.00 0.31 0.00 0.00 61.69 62.71 1m3i s THR 86 Cb -0.05 -0.40 -0.04 0.00 0.01 0.00 0.00 72.50 72.01 1m3i s THR 86 CO 0.23 0.08 -0.19 -0.89 -0.69 0.00 0.00 174.62 173.16 1m3i s THR 87 N 2.34 2.64 -0.45 -0.82 2.01 -0.74 -4.99 115.64 115.63 1m3i s THR 87 Ca 0.03 -1.99 0.05 0.00 0.31 0.00 0.00 61.69 60.09 1m3i s THR 87 Cb -0.13 -2.31 0.28 0.00 0.01 0.00 0.00 72.50 70.35 1m3i s THR 87 CO -0.08 -0.17 1.04 -1.20 -0.69 0.00 0.00 174.62 173.52 1m3i n SER 88 N 0.01 -2.42 -4.58 3.53 7.64 -1.26 -1.28 113.62 115.27 1m3i n SER 88 Ca -0.11 -3.14 -0.42 0.00 1.01 0.00 0.00 58.87 56.21 1m3i n SER 88 Cb 0.57 1.68 -0.02 0.00 -1.01 0.00 0.00 64.21 65.43 1m3i n SER 88 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1m3i s PRO 89 N 0.45 3.49 0.00 1.43 0.05 -1.24 -4.81 135.00 134.36 1m3i s PRO 89 Ca 0.27 0.30 0.00 0.00 0.05 0.00 0.00 61.00 61.62 1m3i s PRO 89 Cb 0.25 -4.03 0.00 0.00 0.05 0.00 0.00 34.50 30.77 1m3i s PRO 89 CO -0.16 -1.71 0.09 1.33 0.05 0.00 0.00 177.00 176.59 1m3i n VAL 90 N 6.71 0.00 -3.38 -0.36 0.24 -1.26 -3.39 118.33 116.89 1m3i n VAL 90 Ca 0.09 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.18 1m3i n VAL 90 Cb 0.49 -0.59 0.02 0.00 -1.47 0.00 0.00 33.84 32.28 1m3i n VAL 90 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1m3i s ASP 91 N -1.82 5.02 -0.15 -1.34 -1.08 -1.26 -4.44 116.67 111.60 1m3i s ASP 91 Ca 0.00 -0.90 -0.10 0.00 -0.52 0.00 0.00 52.55 51.03 1m3i s ASP 91 Cb 0.00 0.07 0.05 0.00 -1.46 0.00 0.00 42.92 41.58 1m3i s ASP 91 CO 0.00 -1.08 0.37 -0.63 0.52 0.00 0.00 175.17 174.35 1m3i s ILE 92 N -2.63 -0.02 0.25 4.11 1.01 0.14 -4.52 121.20 119.55 1m3i s ILE 92 Ca 0.50 0.06 -0.09 0.00 0.00 0.00 0.00 60.65 61.13 1m3i s ILE 92 Cb -0.05 -0.54 -0.07 0.00 0.01 0.00 0.00 42.46 41.81 1m3i s ILE 92 CO 0.31 0.03 0.56 -0.55 0.00 0.00 0.00 174.94 175.28 1m3i s SER 93 N 0.89 6.59 -0.12 3.58 0.15 -1.26 0.36 113.70 123.90 1m3i s SER 93 Ca -0.06 0.89 -0.09 0.00 0.70 0.00 0.00 55.95 57.40 1m3i s SER 93 Cb -0.06 -2.22 -0.04 0.00 -1.71 0.00 0.00 66.02 61.99 1m3i s SER 93 CO -0.07 -0.10 0.18 -0.51 1.20 0.00 0.00 173.24 173.93 1m3i s ILE 94 N -1.88 5.43 -0.05 6.45 1.10 -0.75 -4.86 121.20 126.64 1m3i s ILE 94 Ca 0.47 0.29 -0.02 0.00 -0.51 0.00 0.00 60.65 60.88 1m3i s ILE 94 Cb -0.11 -3.45 -0.01 0.00 0.15 0.00 0.00 42.46 39.04 1m3i s ILE 94 CO 0.23 0.58 -0.04 0.16 -2.11 0.00 0.00 174.94 173.77 1m3i h ILE 95 N 4.06 0.00 -2.47 2.00 3.07 -1.88 -3.41 117.51 118.88 1m3i h ILE 95 Ca -0.52 -0.43 -0.79 0.00 1.55 0.00 0.00 64.86 64.66 1m3i h ILE 95 Cb 1.22 0.00 -0.24 0.00 -0.27 0.00 0.00 36.82 37.52 1m3i h ILE 95 CO 0.61 0.00 1.14 0.47 -1.05 0.00 0.00 178.15 179.33 1m3i n ASP 96 N -3.24 6.08 -0.32 2.16 8.00 -1.26 -4.83 116.55 123.14 1m3i n ASP 96 Ca -0.01 -3.33 0.18 0.00 0.71 0.00 0.00 54.79 52.33 1m3i n ASP 96 Cb 0.05 -1.33 0.37 0.00 -0.02 0.00 0.00 41.12 40.20 1m3i n ASP 96 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1m3i h SER 97 N 5.50 0.15 1.85 -2.24 0.87 -1.80 1.68 113.55 119.57 1m3i h SER 97 Ca 0.26 0.21 0.00 0.00 -1.23 0.00 0.00 61.79 61.03 1m3i h SER 97 Cb 0.61 0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.82 1m3i h SER 97 CO 1.42 -0.19 0.00 -0.37 -0.53 0.00 0.00 176.83 177.16 1m3i h VAL 98 N 0.21 0.00 0.00 2.23 -1.51 -1.82 -3.12 116.25 112.25 1m3i h VAL 98 Ca 0.64 -0.90 0.00 0.00 -1.23 0.00 0.00 66.70 65.20 1m3i h VAL 98 Cb 1.39 1.90 0.00 0.00 -2.13 0.00 0.00 31.29 32.45 1m3i h VAL 98 CO -0.67 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 176.26 1m3i n ASN 99 N -3.02 0.58 -4.68 4.19 5.03 0.16 -5.04 115.26 112.49 1m3i n ASN 99 Ca 0.04 -1.26 -0.42 0.00 0.87 0.00 0.00 54.58 53.81 1m3i n ASN 99 Cb 0.50 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.23 1m3i n ASN 99 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1m3i s ASP 100 N -0.26 6.78 0.00 6.41 -1.08 0.52 -4.83 116.67 124.21 1m3i s ASP 100 Ca 0.00 2.14 0.00 0.00 -0.52 0.00 0.00 52.55 54.17 1m3i s ASP 100 Cb 0.00 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.91 1m3i s ASP 100 CO 0.00 -0.80 1.02 0.54 0.52 0.00 0.00 175.17 176.45 1m3i n ARG 101 N 6.04 0.71 -2.87 4.34 5.12 -1.26 -4.84 116.66 123.90 1m3i n ARG 101 Ca 0.15 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.65 1m3i n ARG 101 Cb 0.43 -1.14 -0.04 0.00 -1.16 0.00 0.00 32.46 30.55 1m3i n ARG 101 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1m3i s THR 102 N 0.41 4.91 0.10 0.55 -4.23 -1.26 -4.68 115.64 111.44 1m3i s THR 102 Ca 0.00 1.72 0.05 0.00 -1.18 0.00 0.00 61.69 62.28 1m3i s THR 102 Cb 0.00 -4.17 -0.04 0.00 1.34 0.00 0.00 72.50 69.63 1m3i s THR 102 CO 0.00 0.10 -0.12 -0.72 -0.54 0.00 0.00 174.62 173.34 1m3i s TYR 103 N 1.60 1.23 -0.07 3.99 -0.85 -1.26 -4.93 117.35 117.06 1m3i s TYR 103 Ca 0.42 -0.58 -0.30 0.00 -0.52 0.00 0.00 57.07 56.09 1m3i s TYR 103 Cb -0.18 -0.66 -0.05 0.00 0.38 0.00 0.00 41.96 41.46 1m3i s TYR 103 CO 0.17 0.07 1.52 -1.25 -1.52 0.00 0.00 175.55 174.55 1m3i s PRO 104 N -2.59 4.21 0.00 -3.49 0.04 -1.26 -2.58 135.00 129.33 1m3i s PRO 104 Ca 0.06 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.13 1m3i s PRO 104 Cb -0.05 -3.86 0.00 0.00 0.04 0.00 0.00 34.50 30.63 1m3i s PRO 104 CO 0.02 -0.77 0.00 0.41 0.04 0.00 0.00 177.00 176.70 1m3i n GLY 105 N 3.93 1.59 3.54 0.56 0.00 0.61 -4.77 105.19 110.65 1m3i n GLY 105 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 1m3i n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m3i n ALA 106 N -0.66 -0.52 -2.56 4.61 0.00 -1.07 -4.06 120.51 116.26 1m3i n ALA 106 Ca 0.00 0.09 -0.38 0.00 0.00 0.00 0.00 53.44 53.15 1m3i n ALA 106 Cb 0.00 -1.96 -0.06 0.00 0.00 0.00 0.00 19.45 17.43 1m3i n ALA 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1m3i s LEU 107 N -0.09 4.42 0.26 0.00 1.43 -1.26 -0.02 118.68 123.41 1m3i s LEU 107 Ca 0.68 0.90 0.01 0.00 -1.03 0.00 0.00 54.13 54.69 1m3i s LEU 107 Cb -0.50 -2.58 -0.04 0.00 0.03 0.00 0.00 46.19 43.10 1m3i s LEU 107 CO 0.54 0.25 0.12 -1.10 0.23 0.00 0.00 176.35 176.39 1m3i s GLN 108 N -0.65 1.41 -0.22 1.70 -0.21 0.33 -0.91 119.66 121.12 1m3i s GLN 108 Ca 0.23 -1.77 -0.04 0.00 0.02 0.00 0.00 55.36 53.80 1m3i s GLN 108 Cb -0.16 -0.07 -0.01 0.00 1.00 0.00 0.00 33.01 33.76 1m3i s GLN 108 CO 0.12 -0.37 -0.03 -0.51 -2.12 0.00 0.00 175.29 172.39 1m3i s LEU 109 N -3.29 3.01 -0.85 2.90 1.43 -0.91 -1.68 118.68 119.29 1m3i s LEU 109 Ca 0.38 -0.34 -0.17 0.00 -1.03 0.00 0.00 54.13 52.97 1m3i s LEU 109 Cb 0.07 -1.77 -0.12 0.00 0.03 0.00 0.00 46.19 44.40 1m3i s LEU 109 CO 0.15 -0.00 2.00 0.00 0.23 0.00 0.00 176.35 178.72 1m3i n ALA 110 N 4.68 3.84 -2.56 4.21 0.00 0.44 -4.49 120.51 126.64 1m3i n ALA 110 Ca -0.18 -2.97 -0.26 0.00 0.00 0.00 0.00 53.44 50.03 1m3i n ALA 110 Cb 0.51 -3.45 -0.09 0.00 0.00 0.00 0.00 19.45 16.43 1m3i n ALA 110 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1m3i s ASP 111 N 4.44 3.02 0.44 0.00 -4.77 -1.26 -4.26 116.67 114.28 1m3i s ASP 111 Ca 0.52 -1.61 0.18 0.00 -3.30 0.00 0.00 52.55 48.34 1m3i s ASP 111 Cb 0.13 0.37 1.12 0.00 -1.09 0.00 0.00 42.92 43.46 1m3i s ASP 111 CO 0.06 -0.84 1.90 0.11 0.70 0.00 0.00 175.17 177.10 1m3i h LYS 112 N 1.76 0.34 -0.71 2.11 1.57 -1.88 -0.89 116.57 118.87 1m3i h LYS 112 Ca -0.38 -0.02 0.12 0.00 -1.87 0.00 0.00 60.65 58.50 1m3i h LYS 112 Cb 1.28 -0.08 -0.08 0.00 0.08 0.00 0.00 32.23 33.42 1m3i h LYS 112 CO 0.63 0.22 0.29 0.00 -0.57 0.00 0.00 179.45 180.03 1m3i h ALA 113 N 1.63 0.97 -0.20 3.86 0.00 -1.90 0.41 119.26 124.03 1m3i h ALA 113 Ca 0.41 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.37 1m3i h ALA 113 Cb 1.06 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1m3i h ALA 113 CO -0.12 -0.17 -0.04 1.25 0.00 0.00 0.00 179.25 180.17 1m3i h LEU 114 N 0.47 0.39 -1.27 0.00 5.85 -1.30 0.02 115.31 119.46 1m3i h LEU 114 Ca 0.37 -0.35 0.15 0.00 0.84 0.00 0.00 57.88 58.89 1m3i h LEU 114 Cb 0.51 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.36 1m3i h LEU 114 CO -0.35 0.65 0.58 0.58 -0.34 0.00 0.00 178.44 179.56 1m3i h VAL 115 N 0.12 0.82 -0.01 1.05 2.07 -0.85 0.47 116.25 119.92 1m3i h VAL 115 Ca 0.05 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1m3i h VAL 115 Cb 0.47 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1m3i h VAL 115 CO 0.02 0.13 0.00 -0.62 0.02 0.00 0.00 177.57 177.11 1m3i n GLU 116 N -4.57 1.03 -1.00 1.57 1.02 0.13 -4.87 120.64 113.94 1m3i n GLU 116 Ca 0.18 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 1m3i n GLU 116 Cb 0.49 -1.10 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 1m3i n GLU 116 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1m3i n ASN 117 N -0.56 -2.60 -3.32 1.62 4.13 0.16 -4.97 115.26 109.73 1m3i n ASN 117 Ca 0.05 0.00 -0.26 0.00 1.68 0.00 0.00 54.58 56.05 1m3i n ASN 117 Cb 0.03 -0.43 -0.07 0.00 -1.54 0.00 0.00 39.78 37.76 1m3i n ASN 117 CO 0.00 0.00 0.00 -2.11 0.28 0.00 0.00 177.26 175.43 1m3i n ARG 118 N -2.87 1.87 -1.47 3.52 1.85 -0.03 -4.65 116.66 114.88 1m3i n ARG 118 Ca 0.00 -4.13 -0.37 0.00 -1.00 0.00 0.00 57.85 52.35 1m3i n ARG 118 Cb 0.00 -1.87 0.07 0.00 -1.05 0.00 0.00 32.46 29.61 1m3i n ARG 118 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1m3i n PRO 119 N 1.00 0.65 -3.06 2.89 -0.04 -1.23 -4.00 135.00 131.21 1m3i n PRO 119 Ca 0.27 0.27 -0.44 0.00 -0.04 0.00 0.00 63.50 63.55 1m3i n PRO 119 Cb 0.46 -2.14 -0.04 0.00 -0.04 0.00 0.00 33.50 31.73 1m3i n PRO 119 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1m3i s THR 120 N -1.69 4.73 -0.07 0.52 2.01 -1.26 -4.89 115.64 115.00 1m3i s THR 120 Ca 0.74 -0.93 -0.30 0.00 0.31 0.00 0.00 61.69 61.51 1m3i s THR 120 Cb -0.38 -4.54 -0.03 0.00 0.01 0.00 0.00 72.50 67.56 1m3i s THR 120 CO 0.49 -1.21 1.18 -0.63 -0.69 0.00 0.00 174.62 173.77 1m3i s ILE 121 N 2.91 4.31 -0.08 1.82 -1.09 -1.26 -2.14 121.20 125.67 1m3i s ILE 121 Ca 0.15 1.62 -0.21 0.00 -2.23 0.00 0.00 60.65 59.98 1m3i s ILE 121 Cb -0.22 -4.04 -0.04 0.00 -1.58 0.00 0.00 42.46 36.58 1m3i s ILE 121 CO 0.06 -0.01 0.59 -0.76 -1.23 0.00 0.00 174.94 173.60 1m3i s LEU 122 N 2.25 4.32 -0.38 2.97 1.43 -0.09 -4.99 118.68 124.20 1m3i s LEU 122 Ca 0.55 1.03 -0.05 0.00 -1.03 0.00 0.00 54.13 54.63 1m3i s LEU 122 Cb -0.24 -2.90 0.08 0.00 0.03 0.00 0.00 46.19 43.16 1m3i s LEU 122 CO 0.21 -0.03 0.16 -0.04 0.23 0.00 0.00 176.35 176.88 1m3i s MET 123 N 0.57 2.37 0.10 1.70 -1.94 -1.26 -4.48 119.30 116.36 1m3i s MET 123 Ca 0.32 -1.49 -0.04 0.00 -1.71 0.00 0.00 55.69 52.77 1m3i s MET 123 Cb -0.17 -3.53 -0.03 0.00 2.01 0.00 0.00 34.83 33.12 1m3i s MET 123 CO 0.15 -0.87 0.09 0.14 -0.01 0.00 0.00 175.02 174.51 1m3i s VAL 124 N 1.29 0.15 0.06 -6.03 -7.23 -1.26 -5.12 120.40 102.26 1m3i s VAL 124 Ca 0.02 -1.64 -0.31 0.00 -1.81 0.00 0.00 61.98 58.24 1m3i s VAL 124 Cb -0.22 -1.67 -0.07 0.00 0.56 0.00 0.00 36.38 34.98 1m3i s VAL 124 CO -0.01 -0.68 1.43 -0.75 -0.31 0.00 0.00 175.10 174.79 1m3i s LYS 125 N -3.95 4.29 0.13 4.82 2.20 -1.26 -4.95 119.74 121.02 1m3i s LYS 125 Ca 0.13 2.06 0.06 0.00 -0.36 0.00 0.00 55.97 57.85 1m3i s LYS 125 Cb 0.06 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 1m3i s LYS 125 CO -0.06 -0.54 -0.14 -0.98 -0.36 0.00 0.00 175.35 173.28 1m3i s ARG 126 N 1.90 1.05 0.89 4.03 1.70 -1.26 0.11 118.95 127.38 1m3i s ARG 126 Ca 0.65 -1.30 -0.12 0.00 -0.47 0.00 0.00 55.73 54.50 1m3i s ARG 126 Cb -0.35 -0.88 0.13 0.00 -0.57 0.00 0.00 34.95 33.27 1m3i s ARG 126 CO 0.29 0.16 1.10 0.15 -1.08 0.00 0.00 175.30 175.91 1m3i s LYS 127 N -2.90 1.28 0.41 3.89 1.02 1.03 -4.68 119.74 119.79 1m3i s LYS 127 Ca 0.11 0.72 -0.24 0.00 0.02 0.00 0.00 55.97 56.58 1m3i s LYS 127 Cb -0.04 -1.82 -0.09 0.00 -0.52 0.00 0.00 37.83 35.37 1m3i s LYS 127 CO 0.03 -2.20 1.10 -2.14 -0.92 0.00 0.00 175.35 171.22 1m3i s PRO 128 N -4.99 4.08 0.11 -1.68 0.02 -1.19 -4.54 135.00 126.80 1m3i s PRO 128 Ca 0.63 1.65 0.03 0.00 0.02 0.00 0.00 61.00 63.33 1m3i s PRO 128 Cb -0.17 -2.57 -0.04 0.00 0.02 0.00 0.00 34.50 31.73 1m3i s PRO 128 CO 0.56 -0.25 -0.09 -1.50 -0.33 0.00 0.00 177.00 175.40 1m3i s ILE 129 N -1.56 0.89 -0.19 2.83 2.07 0.27 -4.96 121.20 120.54 1m3i s ILE 129 Ca 0.58 -1.82 -0.08 0.00 -1.41 0.00 0.00 60.65 57.92 1m3i s ILE 129 Cb -0.26 -1.56 -0.04 0.00 0.13 0.00 0.00 42.46 40.73 1m3i s ILE 129 CO 0.32 -0.71 0.08 0.20 -1.91 0.00 0.00 174.94 172.92 1m3i s ASN 130 N -2.80 5.75 0.01 4.50 -0.87 -1.26 0.40 114.94 120.67 1m3i s ASN 130 Ca 0.10 0.10 -0.01 0.00 -1.57 0.00 0.00 52.86 51.48 1m3i s ASN 130 Cb 0.01 -2.00 -0.04 0.00 -0.02 0.00 0.00 41.25 39.21 1m3i s ASN 130 CO -0.02 0.16 0.11 -0.63 -2.57 0.00 0.00 177.10 174.16 1m3i s ILE 131 N 0.45 4.91 -0.06 0.60 1.09 0.68 -1.88 121.20 126.98 1m3i s ILE 131 Ca 0.04 -0.38 -0.01 0.00 -1.10 0.00 0.00 60.65 59.20 1m3i s ILE 131 Cb -0.12 -3.27 0.03 0.00 -1.06 0.00 0.00 42.46 38.03 1m3i s ILE 131 CO 0.00 0.31 0.02 0.20 -0.10 0.00 0.00 174.94 175.37 1m3i s ASN 132 N -1.88 1.43 0.11 3.58 -0.87 0.17 -1.61 114.94 115.88 1m3i s ASN 132 Ca 0.25 -0.04 -0.04 0.00 -1.57 0.00 0.00 52.86 51.46 1m3i s ASN 132 Cb -0.12 -0.36 -0.05 0.00 -0.02 0.00 0.00 41.25 40.70 1m3i s ASN 132 CO 0.16 -0.20 0.33 -0.51 -2.57 0.00 0.00 177.10 174.31 1m3i s ILE 133 N 1.98 5.22 -0.42 0.60 2.07 -1.23 -0.45 121.20 128.97 1m3i s ILE 133 Ca 0.04 -0.04 0.04 0.00 -1.41 0.00 0.00 60.65 59.29 1m3i s ILE 133 Cb -0.12 -3.62 0.48 0.00 0.13 0.00 0.00 42.46 39.32 1m3i s ILE 133 CO -0.04 0.09 1.56 -0.90 -1.91 0.00 0.00 174.94 173.74 1m3i n ASP 134 N 0.23 5.27 -4.74 4.50 3.85 -0.93 -4.84 116.55 119.90 1m3i n ASP 134 Ca -0.04 -3.77 -0.33 0.00 -0.71 0.00 0.00 54.79 49.95 1m3i n ASP 134 Cb 0.52 -0.64 0.09 0.00 -1.35 0.00 0.00 41.12 39.74 1m3i n ASP 134 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 1m3i s LEU 135 N -3.59 3.19 0.61 -2.12 1.43 -1.26 -4.84 118.68 112.09 1m3i s LEU 135 Ca 0.55 2.10 -0.17 0.00 -1.03 0.00 0.00 54.13 55.58 1m3i s LEU 135 Cb 0.45 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.08 1m3i s LEU 135 CO 0.02 -2.18 1.11 -2.16 0.23 0.00 0.00 176.35 173.36 1m3i s PRO 136 N -4.32 3.07 -1.27 1.29 0.04 -1.26 -4.14 135.00 128.41 1m3i s PRO 136 Ca 0.68 1.46 -0.12 0.00 0.04 0.00 0.00 61.00 63.06 1m3i s PRO 136 Cb -0.23 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 32.33 1m3i s PRO 136 CO 0.49 -1.05 0.61 0.41 0.04 0.00 0.00 177.00 177.50 1m3i n GLY 137 N -0.29 -0.61 0.81 0.56 0.00 -1.26 -4.90 105.19 99.50 1m3i n GLY 137 Ca 0.11 0.30 -0.00 0.00 0.00 0.00 0.00 46.02 46.42 1m3i n GLY 137 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1m3i n LEU 138 N -4.35 0.06 -4.77 0.99 7.94 -1.26 -5.08 117.00 110.53 1m3i n LEU 138 Ca -0.20 -1.39 -0.41 0.00 -1.11 0.00 0.00 56.01 52.90 1m3i n LEU 138 Cb 0.64 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.59 1m3i n LEU 138 CO 0.71 0.70 1.13 2.29 -1.11 0.00 0.00 177.39 181.11 1m3i n LYS 139 N 0.11 2.56 -3.08 1.96 2.85 -1.26 -1.37 118.16 119.93 1m3i n LYS 139 Ca -0.03 0.90 -0.22 0.00 -1.05 0.00 0.00 58.31 57.91 1m3i n LYS 139 Cb 0.75 -2.67 0.04 0.00 -0.65 0.00 0.00 35.03 32.50 1m3i n LYS 139 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1m3i n GLY 140 N 0.48 -0.49 0.00 2.58 0.00 -1.26 -4.68 105.19 101.81 1m3i n GLY 140 Ca 0.02 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1m3i n GLY 140 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1m3i n GLU 141 N -4.10 0.00 0.19 1.61 1.02 -0.96 -4.94 120.64 113.46 1m3i n GLU 141 Ca -0.09 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.18 1m3i n GLU 141 Cb 0.61 0.00 0.33 0.00 -0.02 0.00 0.00 31.44 32.36 1m3i n GLU 141 CO 0.00 0.00 0.00 -2.95 1.18 0.00 0.00 177.13 175.36 1m3i h ASN 142 N 0.00 0.00 -3.80 1.62 -1.07 -1.50 -3.46 115.58 107.37 1m3i h ASN 142 Ca 0.00 0.00 -0.48 0.00 0.07 0.00 0.00 56.30 55.89 1m3i h ASN 142 Cb 0.00 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.23 1m3i h ASN 142 CO 0.00 0.00 0.22 -0.44 0.07 0.00 0.00 177.43 177.28 1m3i s SER 143 N -5.50 7.03 0.04 6.14 0.01 -1.26 -3.48 113.70 116.67 1m3i s SER 143 Ca 0.07 1.55 -0.12 0.00 1.31 0.00 0.00 55.95 58.77 1m3i s SER 143 Cb 0.08 -2.48 0.01 0.00 0.21 0.00 0.00 66.02 63.85 1m3i s SER 143 CO 0.61 -0.14 0.25 -0.51 0.41 0.00 0.00 173.24 173.86 1m3i s ILE 144 N -1.81 0.09 -0.26 1.44 2.07 -0.63 -4.99 121.20 117.11 1m3i s ILE 144 Ca 0.52 -0.76 -0.05 0.00 -1.41 0.00 0.00 60.65 58.95 1m3i s ILE 144 Cb -0.14 -0.88 0.00 0.00 0.13 0.00 0.00 42.46 41.58 1m3i s ILE 144 CO 0.19 -0.42 0.01 -0.75 -1.91 0.00 0.00 174.94 172.06 1m3i s LYS 145 N -2.41 3.17 -0.26 3.50 2.20 -1.26 -0.23 119.74 124.45 1m3i s LYS 145 Ca -0.06 -0.78 -0.17 0.00 -0.36 0.00 0.00 55.97 54.59 1m3i s LYS 145 Cb -0.02 -3.17 -0.03 0.00 -1.51 0.00 0.00 37.83 33.10 1m3i s LYS 145 CO -0.03 -0.34 0.49 0.08 -0.36 0.00 0.00 175.35 175.19 1m3i s VAL 146 N 1.46 5.09 -0.03 4.02 1.01 0.16 -4.94 120.40 127.19 1m3i s VAL 146 Ca 0.03 0.83 -0.20 0.00 0.00 0.00 0.00 61.98 62.64 1m3i s VAL 146 Cb -0.16 -3.80 -0.12 0.00 0.00 0.00 0.00 36.38 32.30 1m3i s VAL 146 CO -0.01 0.11 0.84 0.44 0.00 0.00 0.00 175.10 176.48 1m3i h ASP 147 N 7.98 -0.44 -3.97 3.32 3.32 -1.92 0.78 116.42 125.49 1m3i h ASP 147 Ca -0.30 -0.09 -0.74 0.00 0.02 0.00 0.00 57.03 55.92 1m3i h ASP 147 Cb 1.15 0.11 -0.31 0.00 0.22 0.00 0.00 39.33 40.50 1m3i h ASP 147 CO 0.70 0.00 -0.15 -0.62 -1.72 0.00 0.00 179.24 177.46 1m3i s ASP 148 N -5.00 5.96 -0.53 6.45 3.68 -1.26 -3.20 116.67 122.76 1m3i s ASP 148 Ca -0.11 -2.75 -0.26 0.00 2.13 0.00 0.00 52.55 51.56 1m3i s ASP 148 Cb 0.01 -2.02 -0.08 0.00 -1.45 0.00 0.00 42.92 39.38 1m3i s ASP 148 CO 0.36 -0.47 2.38 -2.84 0.13 0.00 0.00 175.17 174.73 1m3i s PRO 149 N 0.09 2.06 0.23 4.34 0.02 -1.26 -4.58 135.00 135.90 1m3i s PRO 149 Ca 0.17 1.25 -0.02 0.00 0.02 0.00 0.00 61.00 62.42 1m3i s PRO 149 Cb -0.16 -4.60 -0.03 0.00 0.02 0.00 0.00 34.50 29.73 1m3i s PRO 149 CO -0.06 -3.40 0.23 0.95 -0.33 0.00 0.00 177.00 174.39 1m3i s THR 150 N 12.40 0.00 0.02 0.99 -4.23 -1.26 -4.96 115.64 118.59 1m3i s THR 150 Ca 0.95 -1.87 -0.08 0.00 -1.18 0.00 0.00 61.69 59.51 1m3i s THR 150 Cb -0.16 -2.46 -0.04 0.00 1.34 0.00 0.00 72.50 71.18 1m3i s THR 150 CO 0.23 0.00 1.12 0.22 -0.54 0.00 0.00 174.62 175.65 1m3i h TYR 151 N 2.47 -0.29 -0.70 3.99 3.20 -1.91 0.27 116.97 124.00 1m3i h TYR 151 Ca -0.32 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 61.69 1m3i h TYR 151 Cb 1.25 0.10 -0.11 0.00 1.54 0.00 0.00 36.73 39.51 1m3i h TYR 151 CO 0.60 -0.16 0.13 0.78 -1.64 0.00 0.00 178.16 177.87 1m3i h GLY 152 N -0.25 0.93 0.00 1.82 0.00 -1.96 0.27 103.07 103.87 1m3i h GLY 152 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1m3i h GLY 152 CO 0.02 -0.20 0.00 0.28 0.00 0.00 0.00 176.54 176.64 1m3i n LYS 153 N -5.18 0.00 -0.37 4.80 4.76 -1.18 -2.23 118.16 118.76 1m3i n LYS 153 Ca 0.13 0.46 0.29 0.00 -2.87 0.00 0.00 58.31 56.32 1m3i n LYS 153 Cb 0.43 -1.46 0.55 0.00 -1.84 0.00 0.00 35.03 32.71 1m3i n LYS 153 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1m3i h VAL 154 N 0.00 0.27 0.67 -0.18 2.07 -0.24 -0.09 116.25 118.75 1m3i h VAL 154 Ca 0.00 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 1m3i h VAL 154 Cb 0.00 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.77 1m3i h VAL 154 CO 0.00 0.04 -0.50 0.28 0.02 0.00 0.00 177.57 177.42 1m3i h SER 155 N 0.24 -1.30 -0.86 0.57 0.02 -0.35 -2.23 113.55 109.64 1m3i h SER 155 Ca 0.74 0.09 0.16 0.00 -0.84 0.00 0.00 61.79 61.94 1m3i h SER 155 Cb 2.00 0.40 -0.10 0.00 0.14 0.00 0.00 62.40 64.84 1m3i h SER 155 CO -0.48 -0.71 0.42 1.23 -1.14 0.00 0.00 176.83 176.15 1m3i h GLY 156 N -1.12 1.41 0.45 -3.77 0.00 -0.55 0.64 103.07 100.13 1m3i h GLY 156 Ca -0.09 -0.23 0.09 0.00 0.00 0.00 0.00 47.33 47.11 1m3i h GLY 156 CO 0.03 -0.09 0.33 0.00 0.00 0.00 0.00 176.54 176.82 1m3i h ALA 157 N 1.59 0.95 -0.08 3.60 0.00 -1.15 0.13 119.26 124.30 1m3i h ALA 157 Ca 0.48 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.44 1m3i h ALA 157 Cb 0.75 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1m3i h ALA 157 CO -0.40 -0.07 0.01 0.82 0.00 0.00 0.00 179.25 179.61 1m3i h ILE 158 N 0.57 1.22 -0.93 0.00 2.04 -0.46 -2.79 117.51 117.15 1m3i h ILE 158 Ca 0.34 -0.67 0.25 0.00 1.00 0.00 0.00 64.86 65.78 1m3i h ILE 158 Cb 0.37 1.52 -0.13 0.00 -0.74 0.00 0.00 36.82 37.84 1m3i h ILE 158 CO -0.28 0.19 0.43 0.44 0.00 0.00 0.00 178.15 178.93 1m3i h ASP 159 N -0.11 0.36 0.63 1.72 5.19 0.58 -0.88 116.42 123.91 1m3i h ASP 159 Ca 0.02 0.17 -0.03 0.00 -0.62 0.00 0.00 57.03 56.57 1m3i h ASP 159 Cb 0.29 0.14 0.01 0.00 0.18 0.00 0.00 39.33 39.95 1m3i h ASP 159 CO 0.00 -0.04 -0.31 -0.33 -3.12 0.00 0.00 179.24 175.44 1m3i h GLU 160 N 0.38 -0.82 -1.29 3.56 5.08 -0.59 -1.25 114.58 119.64 1m3i h GLU 160 Ca 0.61 0.06 0.39 0.00 -1.00 0.00 0.00 59.36 59.41 1m3i h GLU 160 Cb 1.22 0.19 -0.10 0.00 0.50 0.00 0.00 28.75 30.56 1m3i h GLU 160 CO -0.56 -0.55 0.86 -0.07 -1.00 0.00 0.00 179.01 177.69 1m3i h LEU 161 N -0.85 0.23 0.57 1.33 3.38 -1.00 1.15 115.31 120.12 1m3i h LEU 161 Ca -0.09 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1m3i h LEU 161 Cb 0.66 0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.47 1m3i h LEU 161 CO 0.14 -0.06 -0.28 0.58 0.09 0.00 0.00 178.44 178.92 1m3i h VAL 162 N 0.15 0.18 -0.85 1.22 2.07 -0.89 -0.21 116.25 117.92 1m3i h VAL 162 Ca 0.73 -0.41 0.10 0.00 0.82 0.00 0.00 66.70 67.94 1m3i h VAL 162 Cb 2.35 0.25 -0.06 0.00 -1.52 0.00 0.00 31.29 32.32 1m3i h VAL 162 CO -0.27 0.03 0.55 0.28 0.02 0.00 0.00 177.57 178.18 1m3i h SER 163 N -1.12 0.72 0.08 0.57 0.02 0.61 0.68 113.55 115.11 1m3i h SER 163 Ca -0.08 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 1m3i h SER 163 Cb 0.64 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.05 1m3i h SER 163 CO 0.13 0.42 -0.07 0.50 -1.14 0.00 0.00 176.83 176.67 1m3i h LYS 164 N 0.79 0.00 0.11 3.45 3.64 0.14 0.89 116.57 125.60 1m3i h LYS 164 Ca 0.40 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.60 1m3i h LYS 164 Cb 0.46 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1m3i h LYS 164 CO -0.16 0.07 -0.79 2.35 -2.27 0.00 0.00 179.45 178.64 1m3i h TRP 165 N 0.00 0.43 -0.27 1.91 7.01 0.20 -2.51 115.95 122.72 1m3i h TRP 165 Ca -0.00 -0.31 -0.02 0.00 2.11 0.00 0.00 58.89 60.67 1m3i h TRP 165 Cb 0.13 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.16 1m3i h TRP 165 CO 0.00 1.31 0.09 -0.91 -2.79 0.00 0.00 178.44 176.14 1m3i h ASN 166 N -0.48 0.34 0.20 2.65 2.35 0.56 0.27 115.58 121.46 1m3i h ASN 166 Ca -0.15 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.56 1m3i h ASN 166 Cb 1.55 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.84 1m3i h ASN 166 CO 0.10 0.33 -0.09 -0.08 -1.65 0.00 0.00 177.43 176.04 1m3i h GLU 167 N 0.38 -0.25 -0.35 0.81 4.57 0.70 -3.16 114.58 117.28 1m3i h GLU 167 Ca 0.10 0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.35 1m3i h GLU 167 Cb 0.11 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 1m3i h GLU 167 CO -0.01 0.15 0.24 -0.22 -1.18 0.00 0.00 179.01 177.99 1m3i h LYS 168 N -0.82 0.19 -3.94 1.92 3.64 -1.10 -3.35 116.57 113.12 1m3i h LYS 168 Ca -0.03 -0.01 -0.61 0.00 -1.27 0.00 0.00 60.65 58.73 1m3i h LYS 168 Cb 0.52 -0.04 -0.40 0.00 -0.41 0.00 0.00 32.23 31.89 1m3i h LYS 168 CO 0.04 0.13 -0.75 0.71 -2.27 0.00 0.00 179.45 177.31 1m3i s TYR 169 N -5.21 2.37 -0.43 1.91 1.51 0.91 -4.96 117.35 113.46 1m3i s TYR 169 Ca -0.06 -2.13 0.21 0.00 -1.01 0.00 0.00 57.07 54.08 1m3i s TYR 169 Cb 0.18 -2.09 -0.28 0.00 -0.11 0.00 0.00 41.96 39.66 1m3i s TYR 169 CO 0.71 -0.89 0.64 0.43 -1.11 0.00 0.00 175.55 175.33 1m3i n SER 170 N 4.66 0.51 0.29 2.29 7.64 -1.20 -4.39 113.62 123.41 1m3i n SER 170 Ca -0.01 -0.42 -0.16 0.00 1.01 0.00 0.00 58.87 59.29 1m3i n SER 170 Cb 0.42 1.56 -0.08 0.00 -1.01 0.00 0.00 64.21 65.10 1m3i n SER 170 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1m3i h SER 171 N 0.00 -0.73 -3.42 6.43 0.02 -1.93 -3.45 113.55 110.48 1m3i h SER 171 Ca 0.00 0.04 -0.51 0.00 -0.84 0.00 0.00 61.79 60.48 1m3i h SER 171 Cb 0.76 0.21 -0.17 0.00 0.14 0.00 0.00 62.40 63.34 1m3i h SER 171 CO 0.00 -0.47 -0.77 -0.89 -1.14 0.00 0.00 176.83 173.56 1m3i s THR 172 N -6.06 1.84 -0.01 -2.27 2.01 -1.26 -5.04 115.64 104.86 1m3i s THR 172 Ca -0.17 -1.99 0.01 0.00 0.31 0.00 0.00 61.69 59.85 1m3i s THR 172 Cb 0.05 -1.90 0.01 0.00 0.01 0.00 0.00 72.50 70.66 1m3i s THR 172 CO 0.63 -0.37 0.70 0.00 -0.69 0.00 0.00 174.62 174.89 1m3i n HIS 173 N 0.13 0.00 -4.08 4.92 1.44 -1.26 -4.93 115.22 111.43 1m3i n HIS 173 Ca -0.12 -0.09 -0.33 0.00 -2.01 0.00 0.00 57.72 55.18 1m3i n HIS 173 Cb 0.58 -0.02 -0.15 0.00 0.12 0.00 0.00 29.99 30.51 1m3i n HIS 173 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 1m3i s THR 174 N -0.22 2.17 0.07 0.61 -4.23 -1.26 0.22 115.64 113.00 1m3i s THR 174 Ca 0.01 -1.33 0.03 0.00 -1.18 0.00 0.00 61.69 59.22 1m3i s THR 174 Cb 0.01 -2.13 -0.04 0.00 1.34 0.00 0.00 72.50 71.68 1m3i s THR 174 CO 0.00 0.21 0.04 -0.76 -0.54 0.00 0.00 174.62 173.57 1m3i s LEU 175 N 1.19 3.64 -0.18 4.79 1.43 0.12 -4.88 118.68 124.79 1m3i s LEU 175 Ca -0.03 -0.06 -0.29 0.00 -1.03 0.00 0.00 54.13 52.72 1m3i s LEU 175 Cb -0.17 -2.30 -0.04 0.00 0.03 0.00 0.00 46.19 43.71 1m3i s LEU 175 CO -0.08 0.19 1.71 -2.84 0.23 0.00 0.00 176.35 175.56 1m3i s PRO 176 N -2.21 3.81 0.42 1.29 0.02 -1.26 -0.58 135.00 136.48 1m3i s PRO 176 Ca 0.26 1.84 -0.27 0.00 0.02 0.00 0.00 61.00 62.86 1m3i s PRO 176 Cb -0.12 -4.07 -0.09 0.00 0.02 0.00 0.00 34.50 30.23 1m3i s PRO 176 CO 0.19 -1.29 1.46 0.00 -0.33 0.00 0.00 177.00 177.02 1m3i s ALA 177 N 5.30 3.40 -0.37 -1.55 0.00 -0.26 -4.90 121.76 123.38 1m3i s ALA 177 Ca 0.76 1.52 -0.25 0.00 0.00 0.00 0.00 51.96 53.99 1m3i s ALA 177 Cb -0.28 -3.60 0.01 0.00 0.00 0.00 0.00 23.12 19.25 1m3i s ALA 177 CO 0.31 -1.14 0.88 1.03 0.00 0.00 0.00 175.76 176.84 1m3i s ARG 178 N -2.29 3.81 -0.04 0.00 0.52 0.39 -4.87 118.95 116.47 1m3i s ARG 178 Ca 0.57 0.48 -0.03 0.00 -0.52 0.00 0.00 55.73 56.23 1m3i s ARG 178 Cb -0.45 -3.81 -0.04 0.00 0.52 0.00 0.00 34.95 31.17 1m3i s ARG 178 CO 0.60 -0.91 0.15 0.99 0.02 0.00 0.00 175.30 176.14 1m3i s THR 179 N 3.34 5.31 -0.23 0.02 2.01 -1.26 0.91 115.64 125.74 1m3i s THR 179 Ca 0.36 -0.10 -0.01 0.00 0.31 0.00 0.00 61.69 62.24 1m3i s THR 179 Cb -0.12 -3.42 0.07 0.00 0.01 0.00 0.00 72.50 69.04 1m3i s THR 179 CO 0.18 0.42 0.02 -1.10 -0.69 0.00 0.00 174.62 173.45 1m3i s GLN 180 N -1.62 0.98 0.05 4.92 -0.21 0.23 -4.93 119.66 119.08 1m3i s GLN 180 Ca 0.23 -0.75 -0.21 0.00 0.02 0.00 0.00 55.36 54.65 1m3i s GLN 180 Cb -0.12 -2.26 -0.06 0.00 1.00 0.00 0.00 33.01 31.57 1m3i s GLN 180 CO 0.13 -0.70 0.61 -0.47 -2.12 0.00 0.00 175.29 172.75 1m3i s TYR 181 N 1.65 3.76 0.01 0.91 5.04 -1.26 -0.32 117.35 127.14 1m3i s TYR 181 Ca -0.00 1.29 -0.09 0.00 -2.44 0.00 0.00 57.07 55.83 1m3i s TYR 181 Cb -0.18 -2.59 0.00 0.00 0.35 0.00 0.00 41.96 39.54 1m3i s TYR 181 CO -0.11 0.46 0.17 -1.12 -1.34 0.00 0.00 175.55 173.61 1m3i s SER 182 N -0.63 0.01 -0.02 4.32 0.01 -0.55 -4.99 113.70 111.84 1m3i s SER 182 Ca 0.31 -0.22 -0.14 0.00 1.31 0.00 0.00 55.95 57.20 1m3i s SER 182 Cb -0.19 0.24 0.02 0.00 0.21 0.00 0.00 66.02 66.30 1m3i s SER 182 CO 0.19 -0.44 0.31 -1.83 0.41 0.00 0.00 173.24 171.88 1m3i s GLU 183 N -1.73 0.65 -0.29 12.44 -1.05 -1.26 -0.84 118.70 126.61 1m3i s GLU 183 Ca -0.12 -0.16 -0.25 0.00 -0.15 0.00 0.00 54.97 54.29 1m3i s GLU 183 Cb -0.05 0.29 0.16 0.00 -0.44 0.00 0.00 34.13 34.08 1m3i s GLU 183 CO 0.00 -0.17 1.24 0.45 0.95 0.00 0.00 175.26 177.73 1m3i s SER 184 N -1.24 -0.25 0.38 0.83 0.15 -1.04 -5.02 113.70 107.51 1m3i s SER 184 Ca -0.13 0.47 -0.25 0.00 0.70 0.00 0.00 55.95 56.75 1m3i s SER 184 Cb -0.05 0.48 -0.09 0.00 -1.71 0.00 0.00 66.02 64.64 1m3i s SER 184 CO 0.04 -0.09 1.03 -0.04 1.20 0.00 0.00 173.24 175.39 1m3i s MET 185 N 0.09 4.27 0.19 5.44 -1.94 -1.26 -2.17 119.30 123.92 1m3i s MET 185 Ca 0.05 1.49 -0.15 0.00 -1.71 0.00 0.00 55.69 55.37 1m3i s MET 185 Cb -0.05 -2.62 -0.07 0.00 2.01 0.00 0.00 34.83 34.10 1m3i s MET 185 CO -0.11 -0.04 0.60 0.08 -0.01 0.00 0.00 175.02 175.54 1m3i s VAL 186 N -1.63 4.79 0.00 -6.03 1.01 -0.27 -4.79 120.40 113.48 1m3i s VAL 186 Ca 0.56 0.89 0.00 0.00 0.00 0.00 0.00 61.98 63.43 1m3i s VAL 186 Cb -0.22 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.43 1m3i s VAL 186 CO 0.27 0.16 0.00 -1.22 0.00 0.00 0.00 175.10 174.31 1m3i n TYR 187 N 0.57 0.00 0.00 5.22 4.02 -1.26 -4.79 117.16 120.92 1m3i n TYR 187 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 1m3i n TYR 187 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.84 1m3i n TYR 187 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1m3i n SER 188 N 0.00 0.00 -0.11 7.72 3.41 -1.26 -4.75 113.62 118.63 1m3i n SER 188 Ca 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.56 1m3i n SER 188 Cb 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 63.97 1m3i n SER 188 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1m3i h LYS 189 N 0.00 0.10 -0.25 4.33 1.57 -1.98 -1.72 116.57 118.62 1m3i h LYS 189 Ca 0.00 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1m3i h LYS 189 Cb 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1m3i h LYS 189 CO 0.00 0.06 0.12 0.66 -0.57 0.00 0.00 179.45 179.72 1m3i h SER 190 N 0.10 0.33 0.38 0.86 4.64 -1.96 -1.91 113.55 115.99 1m3i h SER 190 Ca 0.19 -0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 1m3i h SER 190 Cb 0.26 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1m3i h SER 190 CO -0.32 0.37 -0.35 -0.61 -0.87 0.00 0.00 176.83 175.06 1m3i h GLN 191 N 0.27 -0.69 -0.98 4.77 -0.00 -1.78 -2.03 115.11 114.67 1m3i h GLN 191 Ca 0.09 0.05 0.01 0.00 -0.00 0.00 0.00 58.65 58.79 1m3i h GLN 191 Cb 0.13 0.16 -0.05 0.00 0.00 0.00 0.00 27.48 27.72 1m3i h GLN 191 CO -0.01 -0.46 0.65 0.97 0.00 0.00 0.00 178.83 179.98 1m3i h ILE 192 N -0.72 1.25 0.12 2.39 6.09 -1.41 -0.38 117.51 124.85 1m3i h ILE 192 Ca -0.05 -0.46 0.02 0.00 -1.37 0.00 0.00 64.86 63.00 1m3i h ILE 192 Cb 0.61 -0.19 -0.04 0.00 0.47 0.00 0.00 36.82 37.67 1m3i h ILE 192 CO -0.02 0.24 -0.41 -1.28 -3.07 0.00 0.00 178.15 173.61 1m3i h SER 193 N 1.33 -1.19 -0.60 2.19 0.87 -1.24 0.10 113.55 115.01 1m3i h SER 193 Ca 0.36 0.13 -0.05 0.00 -1.23 0.00 0.00 61.79 61.00 1m3i h SER 193 Cb -0.15 0.45 -0.03 0.00 -0.44 0.00 0.00 62.40 62.23 1m3i h SER 193 CO -0.08 -0.48 0.18 0.77 -0.53 0.00 0.00 176.83 176.69 1m3i h SER 194 N -0.64 0.88 -0.75 6.23 4.64 -1.24 0.18 113.55 122.84 1m3i h SER 194 Ca 0.02 -0.21 0.12 0.00 -0.47 0.00 0.00 61.79 61.25 1m3i h SER 194 Cb 0.67 -0.23 -0.08 0.00 -0.31 0.00 0.00 62.40 62.44 1m3i h SER 194 CO -0.23 0.86 0.35 0.00 -0.87 0.00 0.00 176.83 176.94 1m3i h ALA 195 N 1.05 1.07 -0.47 5.18 0.00 -0.49 -2.27 119.26 123.34 1m3i h ALA 195 Ca 0.19 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1m3i h ALA 195 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1m3i h ALA 195 CO -0.00 -0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.42 1m3i n LEU 196 N -4.91 3.34 -3.94 0.00 4.77 0.31 -4.97 117.00 111.60 1m3i n LEU 196 Ca 0.13 -2.05 -0.37 0.00 -0.03 0.00 0.00 56.01 53.69 1m3i n LEU 196 Cb 0.35 -0.33 0.01 0.00 -2.33 0.00 0.00 43.42 41.12 1m3i n LEU 196 CO 0.22 0.81 -0.17 -3.20 -1.33 0.00 0.00 177.39 173.72 1m3i n ASN 197 N 0.84 -3.57 -4.01 -1.43 4.05 0.53 -4.98 115.26 106.68 1m3i n ASN 197 Ca 0.16 -1.16 -0.08 0.00 0.45 0.00 0.00 54.58 53.96 1m3i n ASN 197 Cb 0.52 -2.48 -0.09 0.00 1.23 0.00 0.00 39.78 38.96 1m3i n ASN 197 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1m3i s VAL 198 N -3.64 0.18 -0.09 3.44 -7.23 -0.57 -4.64 120.40 107.85 1m3i s VAL 198 Ca 0.38 -1.49 -0.30 0.00 -1.81 0.00 0.00 61.98 58.76 1m3i s VAL 198 Cb -0.17 -1.27 -0.02 0.00 0.56 0.00 0.00 36.38 35.48 1m3i s VAL 198 CO 0.92 -0.82 1.12 0.21 -0.31 0.00 0.00 175.10 176.22 1m3i s ASN 199 N -2.65 7.13 0.23 4.85 3.84 -1.26 -4.54 114.94 122.54 1m3i s ASN 199 Ca 0.03 1.68 -0.13 0.00 0.21 0.00 0.00 52.86 54.64 1m3i s ASN 199 Cb 0.04 -2.56 0.29 0.00 -0.55 0.00 0.00 41.25 38.47 1m3i s ASN 199 CO -0.08 -0.54 1.60 0.00 -2.79 0.00 0.00 177.10 175.28 1m3i h ALA 200 N 7.34 0.42 -0.73 1.71 0.00 -1.91 0.31 119.26 126.40 1m3i h ALA 200 Ca -0.32 0.28 0.15 0.00 0.00 0.00 0.00 54.91 55.02 1m3i h ALA 200 Cb 1.15 0.62 -0.05 0.00 0.00 0.00 0.00 17.79 19.51 1m3i h ALA 200 CO 0.88 -0.45 0.49 0.87 0.00 0.00 0.00 179.25 181.04 1m3i h LYS 201 N -0.02 0.37 0.12 0.00 1.79 -1.96 -1.85 116.57 115.02 1m3i h LYS 201 Ca 0.35 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.79 1m3i h LYS 201 Cb 0.56 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.12 1m3i h LYS 201 CO -0.78 0.24 -0.06 0.28 -1.08 0.00 0.00 179.45 178.06 1m3i h VAL 202 N 0.38 0.95 0.19 0.50 2.07 -1.32 0.35 116.25 119.36 1m3i h VAL 202 Ca 0.35 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.59 1m3i h VAL 202 Cb 0.85 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 1m3i h VAL 202 CO -0.11 0.07 -0.13 -0.07 0.02 0.00 0.00 177.57 177.36 1m3i h LEU 203 N -0.29 -0.32 -2.16 2.57 3.38 -1.41 0.71 115.31 117.80 1m3i h LEU 203 Ca -0.02 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.04 1m3i h LEU 203 Cb 0.24 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1m3i h LEU 203 CO 0.03 -0.20 0.28 -0.08 0.09 0.00 0.00 178.44 178.56 1m3i h GLU 204 N -0.31 0.00 0.00 1.13 4.81 -1.25 0.50 114.58 119.46 1m3i h GLU 204 Ca -0.01 0.00 -0.38 0.00 -0.13 0.00 0.00 59.36 58.84 1m3i h GLU 204 Cb 0.27 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.59 1m3i h GLU 204 CO 0.01 0.00 -2.14 0.09 -0.73 0.00 0.00 179.01 176.23 1m3i n ASN 205 N -3.65 1.93 -0.03 1.04 4.13 0.10 -3.25 115.26 115.54 1m3i n ASN 205 Ca 0.03 0.36 -0.13 0.00 1.68 0.00 0.00 54.58 56.52 1m3i n ASN 205 Cb 0.41 -0.85 -0.11 0.00 -1.54 0.00 0.00 39.78 37.69 1m3i n ASN 205 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 1m3i h SER 206 N -1.00 -0.02 1.10 6.41 0.02 0.50 -3.35 113.55 117.21 1m3i h SER 206 Ca -0.58 -0.71 -0.16 0.00 -0.84 0.00 0.00 61.79 59.51 1m3i h SER 206 Cb 1.49 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 64.01 1m3i h SER 206 CO -0.35 0.72 -0.94 -0.07 -1.14 0.00 0.00 176.83 175.06 1m3i h LEU 207 N -0.80 0.00 -2.77 5.07 3.38 -0.24 -3.47 115.31 116.48 1m3i h LEU 207 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1m3i h LEU 207 Cb 0.73 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.55 1m3i h LEU 207 CO 0.00 0.69 -0.31 0.61 0.09 0.00 0.00 178.44 179.52 1m3i n GLY 208 N 1.32 -0.00 3.45 0.83 0.00 0.23 -4.97 105.19 106.05 1m3i n GLY 208 Ca -0.03 0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1m3i n GLY 208 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m3i s VAL 209 N -3.14 4.56 -1.10 1.61 1.01 -1.23 -4.96 120.40 117.15 1m3i s VAL 209 Ca 0.17 -0.38 -0.22 0.00 0.00 0.00 0.00 61.98 61.55 1m3i s VAL 209 Cb -0.02 -4.52 -0.09 0.00 0.00 0.00 0.00 36.38 31.74 1m3i s VAL 209 CO 0.30 -1.16 1.92 -0.67 0.00 0.00 0.00 175.10 175.49 1m3i n ASP 210 N 7.02 3.11 0.30 3.32 -0.08 -1.26 -4.68 116.55 124.27 1m3i n ASP 210 Ca -0.04 -2.71 0.18 0.00 -1.51 0.00 0.00 54.79 50.70 1m3i n ASP 210 Cb 0.45 -1.58 0.91 0.00 2.34 0.00 0.00 41.12 43.23 1m3i n ASP 210 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 1m3i h PHE 211 N 9.01 0.00 0.07 -0.67 -1.00 -1.99 -1.15 116.94 121.22 1m3i h PHE 211 Ca 0.29 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 61.07 1m3i h PHE 211 Cb 0.86 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.42 1m3i h PHE 211 CO 1.24 0.00 -0.03 -0.97 -1.61 0.00 0.00 178.31 176.94 1m3i h ASN 212 N 0.00 -0.08 -0.36 2.17 -1.24 -1.99 -1.72 115.58 112.37 1m3i h ASN 212 Ca 0.03 -0.43 0.05 0.00 0.71 0.00 0.00 56.30 56.66 1m3i h ASN 212 Cb 0.53 0.02 -0.05 0.00 0.73 0.00 0.00 38.32 39.55 1m3i h ASN 212 CO -0.00 0.41 0.07 0.00 -1.29 0.00 0.00 177.43 176.61 1m3i h ALA 213 N 0.29 0.37 -0.94 1.57 0.00 -1.62 0.10 119.26 119.03 1m3i h ALA 213 Ca -0.01 0.07 0.10 0.00 0.00 0.00 0.00 54.91 55.08 1m3i h ALA 213 Cb 0.50 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.31 1m3i h ALA 213 CO 0.02 -0.34 0.58 0.28 0.00 0.00 0.00 179.25 179.79 1m3i h VAL 214 N 0.18 0.94 0.45 0.00 2.07 -1.49 -0.44 116.25 117.96 1m3i h VAL 214 Ca 0.17 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1m3i h VAL 214 Cb 0.20 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 29.88 1m3i h VAL 214 CO -0.23 0.17 -0.22 0.00 0.02 0.00 0.00 177.57 177.32 1m3i h ALA 215 N 1.50 -0.60 0.00 1.67 0.00 -0.15 -2.44 119.26 119.24 1m3i h ALA 215 Ca 0.45 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1m3i h ALA 215 Cb 0.40 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1m3i h ALA 215 CO -0.25 -0.75 0.00 0.09 0.00 0.00 0.00 179.25 178.34 1m3i n ASN 216 N -5.28 0.00 -3.65 0.00 3.02 0.19 -4.82 115.26 104.72 1m3i n ASN 216 Ca -0.11 -0.59 -0.25 0.00 -0.03 0.00 0.00 54.58 53.60 1m3i n ASN 216 Cb 0.29 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.53 1m3i n ASN 216 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1m3i n ASN 217 N -0.73 -5.91 -0.00 6.41 2.85 -0.56 -4.88 115.26 112.44 1m3i n ASN 217 Ca 0.04 -0.59 0.06 0.00 -0.11 0.00 0.00 54.58 53.99 1m3i n ASN 217 Cb 0.02 -4.84 -0.08 0.00 1.24 0.00 0.00 39.78 36.12 1m3i n ASN 217 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 1m3i n GLU 218 N -4.92 2.01 -3.91 1.20 1.02 -0.28 -4.99 120.64 110.78 1m3i n GLU 218 Ca 0.00 -0.03 -0.11 0.00 -0.02 0.00 0.00 57.16 57.00 1m3i n GLU 218 Cb 0.56 -1.18 -0.12 0.00 -0.02 0.00 0.00 31.44 30.67 1m3i n GLU 218 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1m3i s LYS 219 N -2.45 0.20 -0.18 3.49 1.02 -1.22 -4.63 119.74 115.97 1m3i s LYS 219 Ca 0.02 -0.25 -0.03 0.00 0.02 0.00 0.00 55.97 55.73 1m3i s LYS 219 Cb 0.10 0.08 -0.02 0.00 -0.52 0.00 0.00 37.83 37.47 1m3i s LYS 219 CO 0.56 -0.04 -0.05 0.15 -0.92 0.00 0.00 175.35 175.06 1m3i s LYS 220 N -0.71 3.54 -0.03 1.68 -0.14 0.98 -4.29 119.74 120.76 1m3i s LYS 220 Ca -0.08 -0.57 0.02 0.00 -1.36 0.00 0.00 55.97 53.97 1m3i s LYS 220 Cb -0.05 -2.93 0.01 0.00 -1.68 0.00 0.00 37.83 33.19 1m3i s LYS 220 CO -0.00 0.08 -0.06 0.08 -0.76 0.00 0.00 175.35 174.68 1m3i s VAL 221 N 0.78 0.58 -0.10 3.17 1.01 -1.26 -0.65 120.40 123.94 1m3i s VAL 221 Ca -0.02 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 61.79 1m3i s VAL 221 Cb -0.15 -0.55 0.01 0.00 0.00 0.00 0.00 36.38 35.69 1m3i s VAL 221 CO 0.02 0.21 -0.20 -0.32 0.00 0.00 0.00 175.10 174.81 1m3i s MET 222 N 0.49 2.59 -0.10 2.72 1.75 0.16 -1.11 119.30 125.79 1m3i s MET 222 Ca -0.07 -0.71 0.01 0.00 -1.25 0.00 0.00 55.69 53.67 1m3i s MET 222 Cb -0.10 -2.02 -0.02 0.00 2.84 0.00 0.00 34.83 35.52 1m3i s MET 222 CO 0.00 0.09 -0.11 0.42 -0.65 0.00 0.00 175.02 174.77 1m3i s ILE 223 N 0.55 3.27 -0.11 10.11 1.01 -0.92 0.70 121.20 135.81 1m3i s ILE 223 Ca -0.15 -0.61 -0.02 0.00 0.00 0.00 0.00 60.65 59.87 1m3i s ILE 223 Cb -0.17 -2.35 -0.03 0.00 0.01 0.00 0.00 42.46 39.93 1m3i s ILE 223 CO 0.05 0.55 -0.04 -0.76 0.00 0.00 0.00 174.94 174.75 1m3i s LEU 224 N -0.19 3.32 -0.29 2.97 1.43 0.35 -2.51 118.68 123.76 1m3i s LEU 224 Ca 0.01 -0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.13 1m3i s LEU 224 Cb -0.13 -1.76 0.08 0.00 0.03 0.00 0.00 46.19 44.40 1m3i s LEU 224 CO 0.03 0.29 -0.04 0.00 0.23 0.00 0.00 176.35 176.87 1m3i s ALA 225 N -0.39 2.65 -0.76 4.21 0.00 -0.02 -1.01 121.76 126.43 1m3i s ALA 225 Ca 0.06 -2.06 -0.13 0.00 0.00 0.00 0.00 51.96 49.84 1m3i s ALA 225 Cb -0.12 -1.74 0.20 0.00 0.00 0.00 0.00 23.12 21.46 1m3i s ALA 225 CO 0.02 -1.41 0.69 0.71 0.00 0.00 0.00 175.76 175.77 1m3i s TYR 226 N 1.04 3.66 -0.32 0.00 1.51 0.57 -1.48 117.35 122.33 1m3i s TYR 226 Ca -0.00 -2.01 -0.29 0.00 -1.01 0.00 0.00 57.07 53.76 1m3i s TYR 226 Cb -0.19 -3.73 0.01 0.00 -0.11 0.00 0.00 41.96 37.94 1m3i s TYR 226 CO -0.07 -0.97 1.12 0.21 -1.11 0.00 0.00 175.55 174.73 1m3i s LYS 227 N 0.32 4.03 -0.40 -0.62 2.20 0.56 -0.88 119.74 124.96 1m3i s LYS 227 Ca 0.16 1.11 -0.08 0.00 -0.36 0.00 0.00 55.97 56.80 1m3i s LYS 227 Cb -0.14 -3.77 0.07 0.00 -1.51 0.00 0.00 37.83 32.49 1m3i s LYS 227 CO -0.07 -0.95 0.21 -0.65 -0.36 0.00 0.00 175.35 173.54 1m3i s GLN 228 N 3.77 2.52 -0.07 4.03 -0.21 0.16 0.77 119.66 130.63 1m3i s GLN 228 Ca 0.48 -1.45 -0.12 0.00 0.02 0.00 0.00 55.36 54.29 1m3i s GLN 228 Cb -0.13 -3.67 -0.05 0.00 1.00 0.00 0.00 33.01 30.16 1m3i s GLN 228 CO 0.17 -0.90 0.30 0.42 -2.12 0.00 0.00 175.29 173.16 1m3i s ILE 229 N 1.38 5.24 -0.26 1.08 1.01 0.26 -1.06 121.20 128.85 1m3i s ILE 229 Ca 0.02 0.58 -0.02 0.00 0.00 0.00 0.00 60.65 61.23 1m3i s ILE 229 Cb -0.22 -3.59 -0.15 0.00 0.01 0.00 0.00 42.46 38.50 1m3i s ILE 229 CO 0.01 0.55 -0.26 0.49 0.00 0.00 0.00 174.94 175.73 1m3i n PHE 230 N 2.26 0.00 -3.66 3.97 3.72 0.41 0.15 117.46 124.30 1m3i n PHE 230 Ca -0.15 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.22 1m3i n PHE 230 Cb 0.53 -0.99 -0.01 0.00 -0.94 0.00 0.00 39.48 38.07 1m3i n PHE 230 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 176.76 178.23 1m3i s TYR 231 N -2.51 -0.13 0.14 1.38 1.13 -1.22 -4.84 117.35 111.29 1m3i s TYR 231 Ca -0.36 -0.06 0.04 0.00 -1.41 0.00 0.00 57.07 55.27 1m3i s TYR 231 Cb 0.11 0.59 -0.04 0.00 -1.10 0.00 0.00 41.96 41.51 1m3i s TYR 231 CO 0.56 -0.56 -0.08 -0.08 -2.51 0.00 0.00 175.55 172.89 1m3i s THR 232 N -2.91 1.00 -0.06 -3.49 -1.32 -1.26 -1.29 115.64 106.31 1m3i s THR 232 Ca 0.12 -2.02 0.01 0.00 -1.21 0.00 0.00 61.69 58.59 1m3i s THR 232 Cb 0.01 -1.86 0.02 0.00 -1.51 0.00 0.00 72.50 69.15 1m3i s THR 232 CO -0.02 -0.73 -0.09 -0.69 -2.21 0.00 0.00 174.62 170.89 1m3i s VAL 233 N -3.43 0.88 0.01 5.08 1.01 -0.40 -2.19 120.40 121.36 1m3i s VAL 233 Ca 0.17 -0.31 0.07 0.00 0.00 0.00 0.00 61.98 61.91 1m3i s VAL 233 Cb 0.04 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 1m3i s VAL 233 CO -0.00 0.31 -0.20 -0.94 0.00 0.00 0.00 175.10 174.27 1m3i s SER 234 N 0.92 3.63 -0.29 3.32 1.04 0.40 -1.22 113.70 121.49 1m3i s SER 234 Ca -0.10 -0.41 -0.10 0.00 0.48 0.00 0.00 55.95 55.82 1m3i s SER 234 Cb -0.15 -0.57 -0.02 0.00 0.10 0.00 0.00 66.02 65.38 1m3i s SER 234 CO 0.01 0.29 0.15 0.00 0.98 0.00 0.00 173.24 174.66 1m3i s ALA 235 N -0.81 3.31 0.26 5.32 0.00 -0.62 -0.65 121.76 128.57 1m3i s ALA 235 Ca 0.13 -1.26 -0.29 0.00 0.00 0.00 0.00 51.96 50.54 1m3i s ALA 235 Cb -0.10 -2.35 -0.15 0.00 0.00 0.00 0.00 23.12 20.52 1m3i s ALA 235 CO 0.03 -0.73 0.96 -0.25 0.00 0.00 0.00 175.76 175.76 1m3i n ASP 236 N 4.99 0.93 -4.70 0.00 8.00 -0.79 -4.80 116.55 120.18 1m3i n ASP 236 Ca -0.14 1.17 -0.42 0.00 0.71 0.00 0.00 54.79 56.10 1m3i n ASP 236 Cb 0.50 -1.23 -0.03 0.00 -0.02 0.00 0.00 41.12 40.34 1m3i n ASP 236 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1m3i s LEU 237 N 0.85 4.34 0.32 0.64 1.43 -1.26 -4.82 118.68 120.17 1m3i s LEU 237 Ca 0.62 1.59 -0.27 0.00 -1.03 0.00 0.00 54.13 55.03 1m3i s LEU 237 Cb -0.76 -3.52 -0.10 0.00 0.03 0.00 0.00 46.19 41.85 1m3i s LEU 237 CO 0.58 -0.29 0.98 -2.16 0.23 0.00 0.00 176.35 175.69 1m3i s PRO 238 N 1.23 4.56 0.32 1.29 0.04 -1.26 -4.95 135.00 136.23 1m3i s PRO 238 Ca 0.50 1.44 0.03 0.00 0.04 0.00 0.00 61.00 63.00 1m3i s PRO 238 Cb -0.20 -2.87 0.61 0.00 0.04 0.00 0.00 34.50 32.08 1m3i s PRO 238 CO 0.25 0.23 1.92 -0.22 0.04 0.00 0.00 177.00 179.22 1m3i h LYS 239 N 3.27 0.90 -4.26 4.56 1.63 -1.98 -3.43 116.57 117.25 1m3i h LYS 239 Ca -0.47 -0.05 -0.17 0.00 -0.85 0.00 0.00 60.65 59.11 1m3i h LYS 239 Cb 1.20 -0.20 -0.18 0.00 -0.60 0.00 0.00 32.23 32.45 1m3i h LYS 239 CO 0.65 0.60 -0.70 -0.80 -3.45 0.00 0.00 179.45 175.75 1m3i s ASN 240 N -6.04 0.56 0.31 4.20 0.01 -1.26 -5.05 114.94 107.67 1m3i s ASN 240 Ca -0.11 -0.79 0.08 0.00 -0.71 0.00 0.00 52.86 51.33 1m3i s ASN 240 Cb 0.20 0.13 0.83 0.00 0.41 0.00 0.00 41.25 42.82 1m3i s ASN 240 CO 0.79 -0.43 1.74 -0.65 -1.51 0.00 0.00 177.10 177.04 1m3i h PRO 241 N 3.77 0.60 -0.77 -0.60 0.11 -1.84 -2.35 132.00 130.92 1m3i h PRO 241 Ca -0.34 -0.04 0.17 0.00 0.11 0.00 0.00 66.00 65.90 1m3i h PRO 241 Cb 1.17 -0.14 -0.11 0.00 0.11 0.00 0.00 31.00 32.04 1m3i h PRO 241 CO 0.55 0.40 0.25 0.66 -0.21 0.00 0.00 178.00 179.65 1m3i h SER 242 N 0.62 0.14 0.00 -2.05 4.64 -1.90 -1.14 113.55 113.86 1m3i h SER 242 Ca 0.62 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 62.08 1m3i h SER 242 Cb 1.12 0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1m3i h SER 242 CO -0.45 0.01 0.28 0.47 -0.87 0.00 0.00 176.83 176.26 1m3i n ASP 243 N -5.10 0.26 -0.09 4.97 8.00 -0.88 -2.03 116.55 121.69 1m3i n ASP 243 Ca 0.16 0.50 -0.10 0.00 0.71 0.00 0.00 54.79 56.06 1m3i n ASP 243 Cb 0.48 -0.46 -0.04 0.00 -0.02 0.00 0.00 41.12 41.09 1m3i n ASP 243 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1m3i n LEU 244 N -1.88 1.88 -4.76 0.64 4.77 -0.43 -4.46 117.00 112.75 1m3i n LEU 244 Ca -0.01 0.47 -0.29 0.00 -0.03 0.00 0.00 56.01 56.15 1m3i n LEU 244 Cb 0.29 -0.83 0.13 0.00 -2.33 0.00 0.00 43.42 40.69 1m3i n LEU 244 CO 0.05 -0.24 0.69 -0.36 -1.33 0.00 0.00 177.39 176.20 1m3i s PHE 245 N -2.53 2.51 0.79 -1.77 0.40 -0.86 0.34 117.98 116.86 1m3i s PHE 245 Ca -0.24 1.06 -0.06 0.00 -0.60 0.00 0.00 56.93 57.10 1m3i s PHE 245 Cb 0.04 -3.23 0.14 0.00 0.51 0.00 0.00 43.02 40.48 1m3i s PHE 245 CO 0.36 -2.26 1.09 0.34 0.70 0.00 0.00 175.22 175.45 1m3i s ASP 246 N -3.77 4.03 0.14 1.36 2.15 0.12 -3.57 116.67 117.13 1m3i s ASP 246 Ca 0.63 -0.11 -0.04 0.00 0.43 0.00 0.00 52.55 53.46 1m3i s ASP 246 Cb -0.16 -0.20 -0.07 0.00 -0.30 0.00 0.00 42.92 42.20 1m3i s ASP 246 CO 0.55 -2.09 1.33 0.44 -0.17 0.00 0.00 175.17 175.23 1m3i h ASP 247 N -0.85 0.54 0.20 -0.34 3.32 -1.93 -3.20 116.42 114.16 1m3i h ASP 247 Ca -0.39 -0.41 -0.00 0.00 0.02 0.00 0.00 57.03 56.24 1m3i h ASP 247 Cb 1.26 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.65 1m3i h ASP 247 CO 0.41 1.20 -0.01 0.77 -1.72 0.00 0.00 179.24 179.89 1m3i h SER 248 N 0.26 0.00 -3.40 6.45 4.64 -1.95 -3.42 113.55 116.13 1m3i h SER 248 Ca -0.07 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.70 1m3i h SER 248 Cb 1.51 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.56 1m3i h SER 248 CO 0.16 0.01 0.18 -0.69 -0.87 0.00 0.00 176.83 175.62 1m3i s VAL 249 N -4.15 4.90 0.42 0.95 1.01 -1.21 -5.07 120.40 117.24 1m3i s VAL 249 Ca -0.04 1.65 0.07 0.00 0.00 0.00 0.00 61.98 63.66 1m3i s VAL 249 Cb 0.13 -4.13 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 1m3i s VAL 249 CO 0.47 0.27 0.12 0.42 0.00 0.00 0.00 175.10 176.38 1m3i s THR 250 N 0.55 2.14 0.54 3.92 -4.23 -1.26 -4.55 115.64 112.76 1m3i s THR 250 Ca 0.41 -1.81 0.24 0.00 -1.18 0.00 0.00 61.69 59.34 1m3i s THR 250 Cb -0.19 -2.96 0.31 0.00 1.34 0.00 0.00 72.50 71.00 1m3i s THR 250 CO 0.22 0.00 2.19 0.15 -0.54 0.00 0.00 174.62 176.64 1m3i h PHE 251 N 1.54 0.00 0.00 3.99 3.57 -1.64 -0.70 116.94 123.69 1m3i h PHE 251 Ca -0.43 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.07 1m3i h PHE 251 Cb 1.25 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.99 1m3i h PHE 251 CO 0.70 0.02 0.00 -0.91 -2.23 0.00 0.00 178.31 175.90 1m3i h ASN 252 N 0.00 0.00 0.32 0.41 2.35 -1.90 0.41 115.58 117.17 1m3i h ASN 252 Ca -0.00 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.44 1m3i h ASN 252 Cb 0.05 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.45 1m3i h ASN 252 CO 0.00 0.00 -1.34 0.44 -1.65 0.00 0.00 177.43 174.89 1m3i h ASP 253 N 0.00 0.74 0.03 5.81 3.32 -1.50 -2.82 116.42 122.00 1m3i h ASP 253 Ca 0.00 -0.75 -0.04 0.00 0.02 0.00 0.00 57.03 56.25 1m3i h ASP 253 Cb 0.69 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1m3i h ASP 253 CO 0.00 1.58 -0.19 -0.07 -1.72 0.00 0.00 179.24 178.84 1m3i h LEU 254 N 0.17 0.12 0.00 1.55 3.38 -1.39 -2.84 115.31 116.29 1m3i h LEU 254 Ca -0.20 -0.94 0.00 0.00 0.09 0.00 0.00 57.88 56.83 1m3i h LEU 254 Cb 2.03 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.74 1m3i h LEU 254 CO 0.24 1.05 0.00 1.17 0.09 0.00 0.00 178.44 180.99 1m3i n LYS 255 N -4.51 0.03 -0.11 1.13 4.81 0.14 -1.23 118.16 118.42 1m3i n LYS 255 Ca -0.11 0.30 -0.22 0.00 -0.87 0.00 0.00 58.31 57.41 1m3i n LYS 255 Cb 0.54 -1.50 -0.10 0.00 0.02 0.00 0.00 35.03 33.99 1m3i n LYS 255 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1m3i n GLN 256 N -1.32 0.56 0.07 1.64 0.00 -1.06 -4.25 117.38 113.01 1m3i n GLN 256 Ca 0.01 0.47 0.18 0.00 -0.00 0.00 0.00 57.00 57.66 1m3i n GLN 256 Cb 0.02 -1.66 0.70 0.00 0.00 0.00 0.00 30.24 29.31 1m3i n GLN 256 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 1m3i h LYS 257 N -1.00 0.00 0.00 3.69 1.79 -1.13 -3.43 116.57 116.49 1m3i h LYS 257 Ca -0.41 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.06 1m3i h LYS 257 Cb 1.32 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.97 1m3i h LYS 257 CO -0.25 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.53 1m3i n GLY 258 N -1.59 -0.51 3.55 3.86 0.00 -1.06 -5.10 105.19 104.34 1m3i n GLY 258 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1m3i n GLY 258 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m3i s VAL 259 N 0.00 3.47 0.09 1.61 1.01 -0.36 -4.43 120.40 121.78 1m3i s VAL 259 Ca 0.00 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.16 1m3i s VAL 259 Cb 0.00 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 32.16 1m3i s VAL 259 CO 0.00 -1.17 0.06 -1.54 0.00 0.00 0.00 175.10 172.45 1m3i n SER 260 N 11.96 0.09 0.27 3.32 3.41 -1.23 -3.91 113.62 127.52 1m3i n SER 260 Ca 0.18 -1.55 0.15 0.00 -0.26 0.00 0.00 58.87 57.40 1m3i n SER 260 Cb 0.51 0.38 0.69 0.00 -0.26 0.00 0.00 64.21 65.53 1m3i n SER 260 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1m3i h ASN 261 N 0.49 0.00 0.80 4.04 2.35 -1.91 -2.09 115.58 119.26 1m3i h ASN 261 Ca -0.06 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.61 1m3i h ASN 261 Cb 0.30 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 1m3i h ASN 261 CO 0.09 0.09 -1.25 -0.62 -1.65 0.00 0.00 177.43 174.09 1m3i n GLU 262 N -3.31 0.62 -2.90 0.81 4.71 -1.26 -4.44 120.64 114.86 1m3i n GLU 262 Ca -0.01 0.14 -0.20 0.00 -0.01 0.00 0.00 57.16 57.09 1m3i n GLU 262 Cb 0.30 -1.80 -0.02 0.00 -1.01 0.00 0.00 31.44 28.92 1m3i n GLU 262 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1m3i n ALA 263 N -2.28 3.49 -1.59 0.62 0.00 -0.98 -4.52 120.51 115.24 1m3i n ALA 263 Ca -0.05 -3.84 -0.48 0.00 0.00 0.00 0.00 53.44 49.07 1m3i n ALA 263 Cb 0.68 -0.82 -0.04 0.00 0.00 0.00 0.00 19.45 19.27 1m3i n ALA 263 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1m3i n PRO 264 N -0.05 1.29 -1.66 0.00 -0.02 -0.82 -3.54 135.00 130.20 1m3i n PRO 264 Ca 0.25 0.46 -0.30 0.00 -2.02 0.00 0.00 63.50 61.89 1m3i n PRO 264 Cb 0.62 -1.98 0.07 0.00 -0.02 0.00 0.00 33.50 32.19 1m3i n PRO 264 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1m3i s PRO 265 N -0.35 2.53 0.25 0.52 0.04 -1.26 -0.42 135.00 136.30 1m3i s PRO 265 Ca 0.73 0.66 -0.21 0.00 0.04 0.00 0.00 61.00 62.22 1m3i s PRO 265 Cb -0.83 -1.97 0.05 0.00 0.04 0.00 0.00 34.50 31.80 1m3i s PRO 265 CO 0.52 -1.32 0.86 -0.48 0.04 0.00 0.00 177.00 176.62 1m3i s LEU 266 N -5.60 -0.14 0.01 -3.56 0.05 -0.67 -2.26 118.68 106.51 1m3i s LEU 266 Ca 0.59 -0.66 0.03 0.00 0.05 0.00 0.00 54.13 54.14 1m3i s LEU 266 Cb -0.13 2.48 -0.01 0.00 -2.05 0.00 0.00 46.19 46.48 1m3i s LEU 266 CO 0.54 -1.23 -0.10 -0.32 -0.55 0.00 0.00 176.35 174.69 1m3i s MET 267 N -3.15 0.73 -0.15 1.48 1.75 -0.17 -0.51 119.30 119.27 1m3i s MET 267 Ca 0.14 -0.51 -0.29 0.00 -1.25 0.00 0.00 55.69 53.78 1m3i s MET 267 Cb -0.04 -0.68 -0.04 0.00 2.84 0.00 0.00 34.83 36.91 1m3i s MET 267 CO 0.06 0.17 1.71 0.08 -0.65 0.00 0.00 175.02 176.39 1m3i s VAL 268 N -0.58 3.55 -0.13 10.11 1.01 0.97 -1.44 120.40 133.90 1m3i s VAL 268 Ca 0.01 0.63 0.19 0.00 0.00 0.00 0.00 61.98 62.81 1m3i s VAL 268 Cb -0.06 -3.52 -0.26 0.00 0.00 0.00 0.00 36.38 32.54 1m3i s VAL 268 CO 0.00 -0.18 0.37 -1.54 0.00 0.00 0.00 175.10 173.75 1m3i n SER 269 N 8.31 0.17 -3.88 3.32 3.41 -0.85 0.22 113.62 124.33 1m3i n SER 269 Ca 0.19 0.08 -0.11 0.00 -0.26 0.00 0.00 58.87 58.77 1m3i n SER 269 Cb 0.44 1.18 -0.12 0.00 -0.26 0.00 0.00 64.21 65.45 1m3i n SER 269 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1m3i s ASN 270 N -5.21 0.02 -0.16 4.04 0.01 -1.05 -1.59 114.94 111.00 1m3i s ASN 270 Ca -0.08 -0.09 -0.04 0.00 -0.71 0.00 0.00 52.86 51.94 1m3i s ASN 270 Cb 0.09 0.16 0.07 0.00 0.41 0.00 0.00 41.25 41.98 1m3i s ASN 270 CO 0.85 -0.17 0.17 -0.69 -1.51 0.00 0.00 177.10 175.75 1m3i s VAL 271 N -0.66 -0.24 0.14 1.60 1.01 -0.36 -2.38 120.40 119.51 1m3i s VAL 271 Ca -0.07 0.01 -0.23 0.00 0.00 0.00 0.00 61.98 61.69 1m3i s VAL 271 Cb -0.05 -0.54 -0.08 0.00 0.00 0.00 0.00 36.38 35.72 1m3i s VAL 271 CO 0.00 -0.12 0.70 0.00 0.00 0.00 0.00 175.10 175.68 1m3i s ALA 272 N 2.27 3.50 -0.03 5.51 0.00 -0.42 -1.28 121.76 131.30 1m3i s ALA 272 Ca 0.05 0.23 0.07 0.00 0.00 0.00 0.00 51.96 52.30 1m3i s ALA 272 Cb -0.15 -2.83 -0.01 0.00 0.00 0.00 0.00 23.12 20.13 1m3i s ALA 272 CO -0.09 0.33 -0.23 0.71 0.00 0.00 0.00 175.76 176.48 1m3i s TYR 273 N -1.17 2.17 0.00 0.00 1.51 -0.41 0.37 117.35 119.82 1m3i s TYR 273 Ca 0.34 -0.49 0.00 0.00 -1.01 0.00 0.00 57.07 55.91 1m3i s TYR 273 Cb -0.21 -1.41 0.00 0.00 -0.11 0.00 0.00 41.96 40.23 1m3i s TYR 273 CO 0.23 -0.09 0.00 0.41 -1.11 0.00 0.00 175.55 174.99 1m3i n GLY 274 N 2.67 -0.16 3.67 0.71 0.00 -0.22 -0.45 105.19 111.42 1m3i n GLY 274 Ca -0.16 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.51 1m3i n GLY 274 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1m3i s ARG 275 N 0.00 1.58 -0.11 1.61 1.70 -0.22 -0.15 118.95 123.36 1m3i s ARG 275 Ca 0.00 -0.90 -0.00 0.00 -0.47 0.00 0.00 55.73 54.35 1m3i s ARG 275 Cb 0.00 0.57 0.02 0.00 -0.57 0.00 0.00 34.95 34.97 1m3i s ARG 275 CO 0.00 -0.70 -0.07 0.99 -1.08 0.00 0.00 175.30 174.44 1m3i s THR 276 N -3.89 0.95 -0.12 4.99 2.01 0.77 0.37 115.64 120.72 1m3i s THR 276 Ca 0.10 -0.24 -0.16 0.00 0.31 0.00 0.00 61.69 61.70 1m3i s THR 276 Cb -0.03 -0.98 -0.05 0.00 0.01 0.00 0.00 72.50 71.45 1m3i s THR 276 CO 0.01 0.35 0.38 -0.63 -0.69 0.00 0.00 174.62 174.05 1m3i s ILE 277 N 1.70 5.22 -0.18 1.82 1.01 -0.06 -1.98 121.20 128.74 1m3i s ILE 277 Ca 0.04 0.75 0.00 0.00 0.00 0.00 0.00 60.65 61.44 1m3i s ILE 277 Cb -0.13 -3.71 0.01 0.00 0.01 0.00 0.00 42.46 38.64 1m3i s ILE 277 CO -0.07 0.40 -0.16 -0.31 0.00 0.00 0.00 174.94 174.79 1m3i s TYR 278 N 0.24 2.80 -0.09 3.97 1.51 -1.16 -0.32 117.35 124.31 1m3i s TYR 278 Ca 0.21 -1.36 0.02 0.00 -1.01 0.00 0.00 57.07 54.93 1m3i s TYR 278 Cb -0.14 -1.93 -0.02 0.00 -0.11 0.00 0.00 41.96 39.75 1m3i s TYR 278 CO 0.08 -0.67 -0.14 0.08 -1.11 0.00 0.00 175.55 173.79 1m3i s VAL 279 N 1.17 3.05 -0.10 0.71 1.01 -0.18 -2.30 120.40 123.75 1m3i s VAL 279 Ca 0.02 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.34 1m3i s VAL 279 Cb -0.14 -2.24 -0.00 0.00 0.00 0.00 0.00 36.38 34.00 1m3i s VAL 279 CO -0.07 0.56 -0.23 -0.75 0.00 0.00 0.00 175.10 174.61 1m3i s LYS 280 N -0.17 3.02 -0.25 2.72 2.20 -0.34 0.13 119.74 127.05 1m3i s LYS 280 Ca -0.00 -0.85 -0.01 0.00 -0.36 0.00 0.00 55.97 54.75 1m3i s LYS 280 Cb -0.13 -2.33 0.03 0.00 -1.51 0.00 0.00 37.83 33.89 1m3i s LYS 280 CO 0.03 0.22 -0.08 -0.51 -0.36 0.00 0.00 175.35 174.66 1m3i s LEU 281 N 0.25 3.19 -0.02 5.43 1.02 0.22 -0.50 118.68 128.28 1m3i s LEU 281 Ca -0.15 -0.97 0.04 0.00 0.02 0.00 0.00 54.13 53.08 1m3i s LEU 281 Cb -0.17 -1.63 -0.01 0.00 0.02 0.00 0.00 46.19 44.40 1m3i s LEU 281 CO 0.08 -0.14 -0.15 -1.83 0.02 0.00 0.00 176.35 174.33 1m3i s GLU 282 N 1.28 1.25 0.06 1.70 -1.05 0.71 0.36 118.70 123.01 1m3i s GLU 282 Ca -0.01 -0.53 -0.04 0.00 -0.15 0.00 0.00 54.97 54.24 1m3i s GLU 282 Cb -0.17 -1.19 -0.03 0.00 -0.44 0.00 0.00 34.13 32.30 1m3i s GLU 282 CO -0.05 0.30 0.04 -0.08 0.95 0.00 0.00 175.26 176.42 1m3i s THR 283 N -0.28 0.19 -0.29 1.83 -1.32 0.18 0.73 115.64 116.68 1m3i s THR 283 Ca 0.04 -1.55 0.21 0.00 -1.21 0.00 0.00 61.69 59.19 1m3i s THR 283 Cb -0.06 -1.39 -0.31 0.00 -1.51 0.00 0.00 72.50 69.23 1m3i s THR 283 CO -0.00 -0.86 0.59 0.35 -2.21 0.00 0.00 174.62 172.49 1m3i n THR 284 N 0.15 0.00 -1.66 5.08 -2.24 -1.23 -0.01 114.28 114.37 1m3i n THR 284 Ca -0.15 -0.36 -0.46 0.00 -2.27 0.00 0.00 64.05 60.81 1m3i n THR 284 Cb 0.61 0.27 -0.04 0.00 -2.10 0.00 0.00 70.33 69.08 1m3i n THR 284 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1m3i n SER 285 N -2.05 2.80 -0.71 3.42 2.88 -1.26 -4.79 113.62 113.91 1m3i n SER 285 Ca -0.02 1.11 0.10 0.00 -1.33 0.00 0.00 58.87 58.74 1m3i n SER 285 Cb 0.50 -1.41 0.32 0.00 -0.75 0.00 0.00 64.21 62.87 1m3i n SER 285 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1m3i n SER 286 N 2.73 2.12 -4.56 -3.46 7.64 -1.26 -4.79 113.62 112.04 1m3i n SER 286 Ca 0.14 -1.80 -0.33 0.00 1.01 0.00 0.00 58.87 57.90 1m3i n SER 286 Cb 0.29 -0.15 0.13 0.00 -1.01 0.00 0.00 64.21 63.48 1m3i n SER 286 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1m3i n SER 287 N 0.62 -0.58 -0.14 6.43 2.88 -1.26 -4.19 113.62 117.38 1m3i n SER 287 Ca 0.17 0.44 0.12 0.00 -1.33 0.00 0.00 58.87 58.27 1m3i n SER 287 Cb 0.39 -1.36 0.27 0.00 -0.75 0.00 0.00 64.21 62.76 1m3i n SER 287 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1m3i n LYS 288 N -2.73 0.44 -0.49 -1.46 2.85 -1.26 -3.89 118.16 111.63 1m3i n LYS 288 Ca 0.10 -0.28 0.10 0.00 -1.05 0.00 0.00 58.31 57.18 1m3i n LYS 288 Cb 0.52 -1.49 0.33 0.00 -0.65 0.00 0.00 35.03 33.73 1m3i n LYS 288 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1m3i n ASP 289 N -1.04 4.18 0.27 -5.58 10.43 -1.26 -4.51 116.55 119.04 1m3i n ASP 289 Ca 0.09 -2.24 -0.16 0.00 2.57 0.00 0.00 54.79 55.04 1m3i n ASP 289 Cb 0.35 -0.52 -0.08 0.00 1.84 0.00 0.00 41.12 42.71 1m3i n ASP 289 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 1m3i h VAL 290 N 3.95 0.31 0.02 2.53 2.07 -1.95 0.40 116.25 123.59 1m3i h VAL 290 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1m3i h VAL 290 Cb 1.19 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.22 1m3i h VAL 290 CO 0.13 0.00 -0.50 -0.61 0.02 0.00 0.00 177.57 176.61 1m3i h GLN 291 N -0.77 -0.63 -0.91 1.57 4.15 -1.90 0.61 115.11 117.22 1m3i h GLN 291 Ca -0.05 0.04 0.17 0.00 0.77 0.00 0.00 58.65 59.59 1m3i h GLN 291 Cb 0.66 0.14 -0.07 0.00 0.21 0.00 0.00 27.48 28.42 1m3i h GLN 291 CO 0.01 -0.42 0.59 0.00 -1.93 0.00 0.00 178.83 177.08 1m3i h ALA 292 N -0.30 1.96 0.08 3.38 0.00 -1.82 0.12 119.26 122.67 1m3i h ALA 292 Ca 0.02 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1m3i h ALA 292 Cb 0.71 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1m3i h ALA 292 CO -0.34 -0.23 -0.04 0.00 0.00 0.00 0.00 179.25 178.64 1m3i h ALA 293 N 1.61 -0.10 -0.01 0.00 0.00 0.19 -1.35 119.26 119.60 1m3i h ALA 293 Ca 0.47 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.24 1m3i h ALA 293 Cb 0.92 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 1m3i h ALA 293 CO -0.22 -0.38 -0.25 0.74 0.00 0.00 0.00 179.25 179.14 1m3i h PHE 294 N -0.45 -0.66 -0.31 0.00 0.05 0.16 -1.01 116.94 114.71 1m3i h PHE 294 Ca -0.01 0.02 0.07 0.00 3.82 0.00 0.00 57.97 61.87 1m3i h PHE 294 Cb 0.39 0.30 -0.07 0.00 2.00 0.00 0.00 35.95 38.56 1m3i h PHE 294 CO 0.04 -0.34 -0.15 0.87 -0.18 0.00 0.00 178.31 178.56 1m3i h LYS 295 N -0.38 -0.10 -0.92 1.51 1.57 -0.84 0.35 116.57 117.76 1m3i h LYS 295 Ca 0.06 0.01 0.26 0.00 -1.87 0.00 0.00 60.65 59.11 1m3i h LYS 295 Cb 0.47 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.76 1m3i h LYS 295 CO -0.23 -0.06 0.66 0.00 -0.57 0.00 0.00 179.45 179.25 1m3i h ALA 296 N 1.14 2.80 0.08 3.86 0.00 -0.59 -0.30 119.26 126.25 1m3i h ALA 296 Ca 0.16 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1m3i h ALA 296 Cb 0.34 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1m3i h ALA 296 CO -0.37 -1.07 -0.04 1.25 0.00 0.00 0.00 179.25 179.02 1m3i h LEU 297 N 0.04 -0.09 0.36 0.00 5.85 0.98 0.13 115.31 122.57 1m3i h LEU 297 Ca 0.45 -0.47 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1m3i h LEU 297 Cb 1.71 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.75 1m3i h LEU 297 CO -0.03 0.46 -0.29 0.40 -0.34 0.00 0.00 178.44 178.64 1m3i h ILE 298 N -0.70 0.39 -0.07 4.05 2.04 -0.17 -3.29 117.51 119.76 1m3i h ILE 298 Ca -0.01 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.82 1m3i h ILE 298 Cb 0.56 0.39 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1m3i h ILE 298 CO 0.02 0.00 -0.08 0.11 0.00 0.00 0.00 178.15 178.20 1m3i h LYS 299 N -0.66 0.18 -0.46 2.37 6.56 -1.25 -3.49 116.57 119.82 1m3i h LYS 299 Ca -0.03 -0.10 -0.20 0.00 -1.06 0.00 0.00 60.65 59.27 1m3i h LYS 299 Cb 0.58 0.00 -0.08 0.00 -0.57 0.00 0.00 32.23 32.16 1m3i h LYS 299 CO -0.02 0.62 -0.18 0.27 -2.06 0.00 0.00 179.45 178.09 1m3i n ASN 300 N -4.70 -4.51 -4.94 0.86 6.94 0.44 -5.06 115.26 104.29 1m3i n ASN 300 Ca -0.07 0.24 -0.24 0.00 -0.02 0.00 0.00 54.58 54.48 1m3i n ASN 300 Cb 0.31 -2.86 -0.02 0.00 -2.36 0.00 0.00 39.78 34.85 1m3i n ASN 300 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1m3i s THR 301 N -2.24 5.13 -0.03 5.53 2.01 -1.26 -4.99 115.64 119.80 1m3i s THR 301 Ca 0.00 -0.48 -0.40 0.00 0.31 0.00 0.00 61.69 61.12 1m3i s THR 301 Cb 0.00 -3.83 -0.19 0.00 0.01 0.00 0.00 72.50 68.48 1m3i s THR 301 CO 0.00 -0.46 1.19 0.47 -0.69 0.00 0.00 174.62 175.14 1m3i n ASP 302 N -1.51 0.53 -4.68 3.53 9.92 -1.26 -4.98 116.55 118.10 1m3i n ASP 302 Ca -0.05 1.15 -0.24 0.00 -0.53 0.00 0.00 54.79 55.12 1m3i n ASP 302 Cb 0.56 -0.98 -0.08 0.00 -0.64 0.00 0.00 41.12 39.98 1m3i n ASP 302 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1m3i s ILE 303 N 0.47 2.80 0.09 0.53 2.07 -1.26 -5.10 121.20 120.80 1m3i s ILE 303 Ca 0.91 -1.85 -0.18 0.00 -1.41 0.00 0.00 60.65 58.12 1m3i s ILE 303 Cb -1.22 -2.88 -0.04 0.00 0.13 0.00 0.00 42.46 38.45 1m3i s ILE 303 CO 0.57 -0.19 1.31 0.50 -1.91 0.00 0.00 174.94 175.22 1m3i h LYS 304 N 1.69 -0.04 -2.21 3.50 1.63 -1.96 -3.26 116.57 115.92 1m3i h LYS 304 Ca -0.43 0.00 -0.64 0.00 -0.85 0.00 0.00 60.65 58.73 1m3i h LYS 304 Cb 1.25 0.01 -0.39 0.00 -0.60 0.00 0.00 32.23 32.51 1m3i h LYS 304 CO 0.65 -0.03 -0.26 0.09 -3.45 0.00 0.00 179.45 176.45 1m3i n ASN 305 N -4.26 5.18 -0.27 4.20 3.02 -1.26 -4.93 115.26 116.94 1m3i n ASN 305 Ca 0.01 -3.70 0.33 0.00 -0.03 0.00 0.00 54.58 51.19 1m3i n ASN 305 Cb 0.16 -0.69 0.74 0.00 -0.61 0.00 0.00 39.78 39.37 1m3i n ASN 305 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1m3i h SER 306 N 3.20 0.00 0.10 6.41 0.02 -2.01 -3.19 113.55 118.07 1m3i h SER 306 Ca 0.24 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1m3i h SER 306 Cb 0.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 1m3i h SER 306 CO 0.91 0.00 -0.05 -0.61 -1.14 0.00 0.00 176.83 175.95 1m3i h GLN 307 N 0.00 -0.12 -0.94 3.45 5.75 -1.93 -3.15 115.11 118.17 1m3i h GLN 307 Ca 0.51 0.01 0.15 0.00 -0.15 0.00 0.00 58.65 59.17 1m3i h GLN 307 Cb 2.12 0.03 -0.08 0.00 1.07 0.00 0.00 27.48 30.61 1m3i h GLN 307 CO -0.01 -0.08 0.60 -0.56 -2.65 0.00 0.00 178.83 176.13 1m3i h GLN 308 N -0.15 0.74 -0.15 1.69 3.07 -2.01 -1.76 115.11 116.55 1m3i h GLN 308 Ca -0.01 -0.04 0.05 0.00 0.09 0.00 0.00 58.65 58.73 1m3i h GLN 308 Cb 0.10 -0.17 -0.07 0.00 0.08 0.00 0.00 27.48 27.42 1m3i h GLN 308 CO 0.02 0.49 -0.39 1.88 0.09 0.00 0.00 178.83 180.92 1m3i h TYR 309 N 0.76 -1.12 -0.93 0.06 0.05 -1.64 -0.57 116.97 113.59 1m3i h TYR 309 Ca 0.49 0.05 0.26 0.00 0.05 0.00 0.00 58.73 59.58 1m3i h TYR 309 Cb 0.73 0.51 -0.16 0.00 1.01 0.00 0.00 36.73 38.82 1m3i h TYR 309 CO -0.00 -0.45 0.15 -0.22 -1.05 0.00 0.00 178.16 176.58 1m3i h LYS 310 N -0.46 0.09 -0.81 4.88 3.11 -1.27 1.13 116.57 123.25 1m3i h LYS 310 Ca 0.09 -0.01 0.02 0.00 -2.81 0.00 0.00 60.65 57.94 1m3i h LYS 310 Cb 0.60 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 31.77 1m3i h LYS 310 CO -0.40 0.06 0.54 -0.44 -2.81 0.00 0.00 179.45 176.40 1m3i h ASP 311 N 0.09 0.90 -0.22 4.20 5.19 -1.12 -0.75 116.42 124.71 1m3i h ASP 311 Ca 0.59 -0.02 -0.09 0.00 -0.62 0.00 0.00 57.03 56.89 1m3i h ASP 311 Cb 1.23 -0.22 -0.00 0.00 0.18 0.00 0.00 39.33 40.52 1m3i h ASP 311 CO -0.79 0.64 -0.21 0.40 -3.12 0.00 0.00 179.24 176.17 1m3i h ILE 312 N 1.06 1.32 -0.77 0.35 2.04 0.18 -2.35 117.51 119.33 1m3i h ILE 312 Ca 0.31 -1.36 0.07 0.00 1.00 0.00 0.00 64.86 64.87 1m3i h ILE 312 Cb -0.05 1.72 -0.06 0.00 -0.74 0.00 0.00 36.82 37.69 1m3i h ILE 312 CO -0.08 0.42 0.45 1.88 0.00 0.00 0.00 178.15 180.82 1m3i h TYR 313 N 0.21 0.82 0.00 1.37 0.99 -0.25 0.51 116.97 120.63 1m3i h TYR 313 Ca 0.04 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.78 1m3i h TYR 313 Cb 0.75 -0.26 -0.00 0.00 1.00 0.00 0.00 36.73 38.22 1m3i h TYR 313 CO 0.08 0.39 -0.07 0.93 -0.00 0.00 0.00 178.16 179.49 1m3i h GLU 314 N 0.81 0.00 -0.71 4.88 5.08 -1.13 -2.24 114.58 121.27 1m3i h GLU 314 Ca 0.35 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 58.22 1m3i h GLU 314 Cb 0.22 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 29.16 1m3i h GLU 314 CO -0.19 0.07 -0.20 -1.71 -1.00 0.00 0.00 179.01 175.98 1m3i n ASN 315 N -3.25 4.99 -4.19 1.42 5.15 0.14 -5.01 115.26 114.52 1m3i n ASN 315 Ca -0.00 -3.77 -0.11 0.00 -0.60 0.00 0.00 54.58 50.09 1m3i n ASN 315 Cb 0.30 -0.58 -0.10 0.00 -0.53 0.00 0.00 39.78 38.87 1m3i n ASN 315 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1m3i s SER 316 N -2.88 1.04 0.01 1.20 0.15 0.11 -3.49 113.70 109.85 1m3i s SER 316 Ca 0.53 -1.08 -0.01 0.00 0.70 0.00 0.00 55.95 56.09 1m3i s SER 316 Cb 0.44 0.13 -0.01 0.00 -1.71 0.00 0.00 66.02 64.86 1m3i s SER 316 CO 0.01 -0.53 -0.01 -0.44 1.20 0.00 0.00 173.24 173.47 1m3i s SER 317 N -3.08 0.18 0.12 5.45 0.01 0.22 -4.76 113.70 111.85 1m3i s SER 317 Ca 0.17 -0.39 0.08 0.00 1.31 0.00 0.00 55.95 57.13 1m3i s SER 317 Cb 0.06 0.10 -0.04 0.00 0.21 0.00 0.00 66.02 66.35 1m3i s SER 317 CO -0.02 -0.25 -0.21 -0.36 0.41 0.00 0.00 173.24 172.82 1m3i s PHE 318 N -1.20 1.83 0.01 2.43 0.40 -0.76 -0.21 117.98 120.49 1m3i s PHE 318 Ca -0.13 -0.43 0.05 0.00 -0.60 0.00 0.00 56.93 55.82 1m3i s PHE 318 Cb -0.08 -0.98 -0.02 0.00 0.51 0.00 0.00 43.02 42.45 1m3i s PHE 318 CO -0.01 0.25 -0.16 0.99 0.70 0.00 0.00 175.22 176.99 1m3i s THR 319 N -1.39 1.26 -0.28 0.64 2.01 0.35 -2.26 115.64 115.96 1m3i s THR 319 Ca 0.09 -0.84 -0.03 0.00 0.31 0.00 0.00 61.69 61.22 1m3i s THR 319 Cb -0.09 -1.08 0.11 0.00 0.01 0.00 0.00 72.50 71.45 1m3i s THR 319 CO 0.05 0.22 0.18 0.00 -0.69 0.00 0.00 174.62 174.38 1m3i s ALA 320 N -0.57 0.30 -0.24 7.40 0.00 0.24 -1.20 121.76 127.68 1m3i s ALA 320 Ca 0.05 -0.81 -0.02 0.00 0.00 0.00 0.00 51.96 51.18 1m3i s ALA 320 Cb -0.07 -1.48 0.02 0.00 0.00 0.00 0.00 23.12 21.59 1m3i s ALA 320 CO 0.00 -1.64 -0.06 0.14 0.00 0.00 0.00 175.76 174.21 1m3i s VAL 321 N 2.18 2.93 -0.71 0.00 -7.23 -0.97 0.48 120.40 117.07 1m3i s VAL 321 Ca 0.09 -0.95 -0.27 0.00 -1.81 0.00 0.00 61.98 59.04 1m3i s VAL 321 Cb -0.15 -2.46 0.02 0.00 0.56 0.00 0.00 36.38 34.35 1m3i s VAL 321 CO -0.34 0.23 1.38 -0.69 -0.31 0.00 0.00 175.10 175.38 1m3i s VAL 322 N 1.35 3.66 -0.26 1.32 1.01 -0.75 -2.97 120.40 123.77 1m3i s VAL 322 Ca 0.01 0.39 -0.04 0.00 0.00 0.00 0.00 61.98 62.34 1m3i s VAL 322 Cb -0.16 -4.73 0.01 0.00 0.00 0.00 0.00 36.38 31.50 1m3i s VAL 322 CO -0.05 -1.66 -0.01 -0.22 0.00 0.00 0.00 175.10 173.17 1m3i s LEU 323 N 6.31 3.36 0.00 3.92 0.20 -0.84 -4.20 118.68 127.44 1m3i s LEU 323 Ca 0.41 -0.70 0.00 0.00 0.69 0.00 0.00 54.13 54.53 1m3i s LEU 323 Cb -0.09 -1.76 0.00 0.00 -0.43 0.00 0.00 46.19 43.91 1m3i s LEU 323 CO 0.16 -0.12 0.00 0.61 -0.29 0.00 0.00 176.35 176.71 1m3i n GLY 324 N 4.77 0.30 3.38 7.98 0.00 -1.26 -0.16 105.19 120.20 1m3i n GLY 324 Ca -0.16 -0.17 -0.20 0.00 0.00 0.00 0.00 46.02 45.49 1m3i n GLY 324 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1m3i s GLY 325 N 0.00 2.04 -1.35 -0.02 0.00 0.79 -3.97 107.32 104.81 1m3i s GLY 325 Ca 0.00 -1.78 -0.07 0.00 0.00 0.00 0.00 44.72 42.87 1m3i s GLY 325 CO 0.00 -1.68 0.47 1.22 0.00 0.00 0.00 173.10 173.11 1m3i n ASP 326 N -0.77 -4.52 -3.21 1.64 9.92 -1.26 -4.51 116.55 113.84 1m3i n ASP 326 Ca -0.01 -0.29 -0.09 0.00 -0.53 0.00 0.00 54.79 53.87 1m3i n ASP 326 Cb 0.66 -3.71 0.01 0.00 -0.64 0.00 0.00 41.12 37.43 1m3i n ASP 326 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1m3i s ALA 327 N -2.98 -0.79 0.01 2.24 0.00 -1.26 -5.10 121.76 113.88 1m3i s ALA 327 Ca 0.32 -0.67 -0.21 0.00 0.00 0.00 0.00 51.96 51.40 1m3i s ALA 327 Cb -0.16 0.75 -0.05 0.00 0.00 0.00 0.00 23.12 23.65 1m3i s ALA 327 CO 0.40 -0.99 0.63 -1.14 0.00 0.00 0.00 175.76 174.66 1m3i s GLN 328 N -2.81 4.35 0.34 0.00 0.74 -1.26 -5.02 119.66 116.00 1m3i s GLN 328 Ca 0.15 0.80 -0.28 0.00 0.05 0.00 0.00 55.36 56.08 1m3i s GLN 328 Cb -0.05 -3.34 -0.12 0.00 1.10 0.00 0.00 33.01 30.60 1m3i s GLN 328 CO 0.11 0.36 1.30 0.39 -0.55 0.00 0.00 175.29 176.90 1m3i n GLU 329 N 2.69 2.15 -1.49 1.67 -0.58 -1.26 -1.72 120.64 122.10 1m3i n GLU 329 Ca -0.06 0.75 -0.13 0.00 -0.42 0.00 0.00 57.16 57.30 1m3i n GLU 329 Cb 0.51 -2.34 -0.05 0.00 -0.57 0.00 0.00 31.44 28.99 1m3i n GLU 329 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1m3i n HIS 330 N 0.34 -0.08 -1.68 -0.32 8.25 -1.26 -4.92 115.22 115.54 1m3i n HIS 330 Ca 0.05 0.00 -0.46 0.00 -0.26 0.00 0.00 57.72 57.04 1m3i n HIS 330 Cb 0.36 -2.40 -0.04 0.00 1.12 0.00 0.00 29.99 29.03 1m3i n HIS 330 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1m3i n ASN 331 N -0.12 3.60 -3.83 0.41 2.85 -0.70 -4.95 115.26 112.51 1m3i n ASN 331 Ca -0.13 0.97 -0.12 0.00 -0.11 0.00 0.00 54.58 55.19 1m3i n ASN 331 Cb 0.45 -1.42 -0.12 0.00 1.24 0.00 0.00 39.78 39.92 1m3i n ASN 331 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1m3i s LYS 332 N 3.67 0.21 -0.04 1.20 2.20 -1.26 -1.81 119.74 123.91 1m3i s LYS 332 Ca 0.90 0.10 -0.02 0.00 -0.36 0.00 0.00 55.97 56.58 1m3i s LYS 332 Cb -0.62 0.10 0.03 0.00 -1.51 0.00 0.00 37.83 35.82 1m3i s LYS 332 CO 0.47 -0.03 0.04 0.08 -0.36 0.00 0.00 175.35 175.55 1m3i s VAL 333 N -0.16 -0.01 -0.11 4.02 1.01 0.18 -4.96 120.40 120.36 1m3i s VAL 333 Ca -0.02 0.34 -0.00 0.00 0.00 0.00 0.00 61.98 62.29 1m3i s VAL 333 Cb -0.02 -0.22 0.02 0.00 0.00 0.00 0.00 36.38 36.17 1m3i s VAL 333 CO 0.00 0.18 -0.08 -0.69 0.00 0.00 0.00 175.10 174.52 1m3i s VAL 334 N 1.98 1.02 0.25 2.92 1.01 -1.26 0.80 120.40 127.13 1m3i s VAL 334 Ca 0.03 -0.29 -0.09 0.00 0.00 0.00 0.00 61.98 61.63 1m3i s VAL 334 Cb -0.12 -1.04 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 1m3i s VAL 334 CO -0.03 0.37 0.41 -0.89 0.00 0.00 0.00 175.10 174.96 1m3i s THR 335 N 1.69 0.00 -1.01 3.92 2.01 -0.96 -4.99 115.64 116.30 1m3i s THR 335 Ca 0.05 -1.55 0.22 0.00 0.31 0.00 0.00 61.69 60.72 1m3i s THR 335 Cb -0.13 -2.33 -0.16 0.00 0.01 0.00 0.00 72.50 69.90 1m3i s THR 335 CO -0.08 0.00 1.06 0.29 -0.69 0.00 0.00 174.62 175.20 1m3i n LYS 336 N -0.38 0.01 -3.23 4.92 5.02 -1.26 -1.83 118.16 121.41 1m3i n LYS 336 Ca -0.01 -0.01 -0.44 0.00 -2.02 0.00 0.00 58.31 55.84 1m3i n LYS 336 Cb 0.63 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.07 1m3i n LYS 336 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1m3i s ASP 337 N -2.99 6.20 0.55 4.39 -1.08 -1.26 -4.93 116.67 117.54 1m3i s ASP 337 Ca 0.09 -0.98 0.33 0.00 -0.52 0.00 0.00 52.55 51.47 1m3i s ASP 337 Cb 0.16 -2.26 1.47 0.00 -1.46 0.00 0.00 42.92 40.84 1m3i s ASP 337 CO 0.82 -0.80 2.03 0.15 0.52 0.00 0.00 175.17 177.88 1m3i h PHE 338 N 8.91 0.00 -0.81 -5.34 3.57 -2.00 -2.44 116.94 118.83 1m3i h PHE 338 Ca -0.28 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.22 1m3i h PHE 338 Cb 1.10 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.80 1m3i h PHE 338 CO 0.71 0.06 0.49 -0.44 -2.23 0.00 0.00 178.31 176.90 1m3i h ASP 339 N 0.00 0.97 -0.21 0.41 3.45 -1.97 0.21 116.42 119.28 1m3i h ASP 339 Ca -0.00 -0.06 0.06 0.00 0.43 0.00 0.00 57.03 57.46 1m3i h ASP 339 Cb 0.44 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 38.96 1m3i h ASP 339 CO 0.01 0.74 0.22 -0.33 -1.57 0.00 0.00 179.24 178.31 1m3i h GLU 340 N 1.11 0.00 0.00 3.56 4.39 -1.86 1.11 114.58 122.88 1m3i h GLU 340 Ca 0.29 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.79 1m3i h GLU 340 Cb -0.05 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.57 1m3i h GLU 340 CO -0.06 0.00 -1.00 0.82 -1.16 0.00 0.00 179.01 177.61 1m3i h ILE 341 N 0.00 1.42 -0.47 3.13 1.08 -0.73 -3.10 117.51 118.84 1m3i h ILE 341 Ca 0.10 -3.08 -0.12 0.00 -0.39 0.00 0.00 64.86 61.38 1m3i h ILE 341 Cb 0.54 2.70 -0.01 0.00 -3.07 0.00 0.00 36.82 36.98 1m3i h ILE 341 CO -0.00 0.81 -0.15 0.03 -0.69 0.00 0.00 178.15 178.14 1m3i h ARG 342 N 0.00 0.94 0.28 2.37 3.08 0.28 -2.99 114.38 118.34 1m3i h ARG 342 Ca -0.05 -0.38 -0.01 0.00 0.07 0.00 0.00 59.98 59.61 1m3i h ARG 342 Cb 1.72 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.73 1m3i h ARG 342 CO 0.11 1.04 -0.14 -0.22 -1.07 0.00 0.00 179.97 179.69 1m3i h LYS 343 N 0.78 -0.36 -1.15 0.04 3.64 -0.98 0.13 116.57 118.67 1m3i h LYS 343 Ca 0.11 0.02 0.33 0.00 -1.27 0.00 0.00 60.65 59.85 1m3i h LYS 343 Cb 0.72 0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.57 1m3i h LYS 343 CO 0.05 -0.21 0.82 0.28 -2.27 0.00 0.00 179.45 178.12 1m3i h VAL 344 N -0.42 0.43 0.00 2.00 2.07 -1.50 0.52 116.25 119.35 1m3i h VAL 344 Ca -0.04 -0.01 -0.07 0.00 0.82 0.00 0.00 66.70 67.40 1m3i h VAL 344 Cb 0.32 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1m3i h VAL 344 CO 0.06 0.01 -0.39 0.40 0.02 0.00 0.00 177.57 177.67 1m3i h ILE 345 N 0.03 1.48 -0.43 4.57 2.04 -1.23 -3.21 117.51 120.75 1m3i h ILE 345 Ca 0.55 -2.26 0.07 0.00 1.00 0.00 0.00 64.86 64.22 1m3i h ILE 345 Cb 2.15 2.95 -0.06 0.00 -0.74 0.00 0.00 36.82 41.13 1m3i h ILE 345 CO -0.03 0.50 0.10 0.50 0.00 0.00 0.00 178.15 179.22 1m3i h LYS 346 N -1.00 0.23 -0.31 2.37 3.64 0.14 -1.69 116.57 119.95 1m3i h LYS 346 Ca -0.11 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.27 1m3i h LYS 346 Cb 1.07 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.82 1m3i h LYS 346 CO -0.06 0.15 0.21 -0.44 -2.27 0.00 0.00 179.45 177.04 1m3i h ASP 347 N 0.24 0.35 -0.61 4.20 5.19 -0.23 -2.07 116.42 123.48 1m3i h ASP 347 Ca 0.21 -0.01 -0.28 0.00 -0.62 0.00 0.00 57.03 56.33 1m3i h ASP 347 Cb 0.25 -0.09 -0.17 0.00 0.18 0.00 0.00 39.33 39.51 1m3i h ASP 347 CO -0.26 0.25 0.35 0.59 -3.12 0.00 0.00 179.24 177.05 1m3i n ASN 348 N -4.49 3.63 0.19 6.45 5.03 -0.64 -4.23 115.26 121.20 1m3i n ASN 348 Ca 0.02 -2.98 0.12 0.00 0.87 0.00 0.00 54.58 52.61 1m3i n ASN 348 Cb 0.08 -0.71 0.19 0.00 -1.02 0.00 0.00 39.78 38.33 1m3i n ASN 348 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1m3i h ALA 349 N 1.73 0.96 -3.61 5.41 0.00 -1.27 -3.46 119.26 119.01 1m3i h ALA 349 Ca 0.34 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.63 1m3i h ALA 349 Cb 2.10 0.00 -0.21 0.00 0.00 0.00 0.00 17.79 19.68 1m3i h ALA 349 CO 0.66 0.00 -0.84 0.99 0.00 0.00 0.00 179.25 180.06 1m3i s THR 350 N -3.20 2.04 0.04 0.00 2.01 -1.26 -1.11 115.64 114.16 1m3i s THR 350 Ca 0.07 -1.74 0.04 0.00 0.31 0.00 0.00 61.69 60.37 1m3i s THR 350 Cb 0.07 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.70 1m3i s THR 350 CO 0.67 -0.04 -0.12 0.72 -0.69 0.00 0.00 174.62 175.16 1m3i s PHE 351 N -1.29 1.02 -0.16 4.92 -0.12 0.25 -4.78 117.98 117.82 1m3i s PHE 351 Ca 0.13 -0.38 -0.12 0.00 -0.05 0.00 0.00 56.93 56.51 1m3i s PHE 351 Cb -0.09 -0.60 -0.05 0.00 -0.63 0.00 0.00 43.02 41.65 1m3i s PHE 351 CO 0.06 0.01 0.24 0.45 -0.05 0.00 0.00 175.22 175.92 1m3i s SER 352 N -1.24 6.39 0.47 1.98 0.15 -1.26 0.15 113.70 120.33 1m3i s SER 352 Ca -0.02 0.45 0.31 0.00 0.70 0.00 0.00 55.95 57.39 1m3i s SER 352 Cb -0.08 -2.15 1.30 0.00 -1.71 0.00 0.00 66.02 63.38 1m3i s SER 352 CO 0.01 0.17 1.92 0.71 1.20 0.00 0.00 173.24 177.25 1m3i h THR 353 N 4.55 0.00 -0.48 6.45 1.35 0.22 -1.83 112.91 123.17 1m3i h THR 353 Ca -0.43 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 1m3i h THR 353 Cb 1.17 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 1m3i h THR 353 CO 0.73 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 176.29 1m3i n LYS 354 N -2.85 2.90 -4.41 4.72 5.02 -1.25 -4.90 118.16 117.38 1m3i n LYS 354 Ca 0.01 -2.05 -0.26 0.00 -2.02 0.00 0.00 58.31 53.99 1m3i n LYS 354 Cb 0.27 -1.69 -0.11 0.00 -0.02 0.00 0.00 35.03 33.49 1m3i n LYS 354 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1m3i s ASN 355 N -0.81 3.63 -0.09 4.39 -0.87 -0.69 -5.11 114.94 115.39 1m3i s ASN 355 Ca 0.37 -0.86 -0.30 0.00 -1.57 0.00 0.00 52.86 50.51 1m3i s ASN 355 Cb 0.23 -0.35 -0.04 0.00 -0.02 0.00 0.00 41.25 41.08 1m3i s ASN 355 CO 0.19 0.10 1.40 -2.16 -2.57 0.00 0.00 177.10 174.05 1m3i s PRO 356 N -2.92 4.24 -0.17 -0.60 0.04 -1.26 -4.94 135.00 129.38 1m3i s PRO 356 Ca 0.24 1.88 -0.08 0.00 0.04 0.00 0.00 61.00 63.07 1m3i s PRO 356 Cb -0.07 -3.78 -0.04 0.00 0.04 0.00 0.00 34.50 30.65 1m3i s PRO 356 CO 0.12 -0.70 0.10 0.00 0.04 0.00 0.00 177.00 176.56 1m3i s ALA 357 N 3.35 3.60 0.27 8.56 0.00 -1.26 -4.08 121.76 132.20 1m3i s ALA 357 Ca 0.62 -0.71 0.09 0.00 0.00 0.00 0.00 51.96 51.96 1m3i s ALA 357 Cb -0.27 -1.99 -0.04 0.00 0.00 0.00 0.00 23.12 20.82 1m3i s ALA 357 CO 0.22 0.29 0.06 0.71 0.00 0.00 0.00 175.76 177.04 1m3i s TYR 358 N -0.01 2.80 0.39 0.00 4.12 -1.26 -4.88 117.35 118.51 1m3i s TYR 358 Ca 0.08 -0.21 -0.27 0.00 0.02 0.00 0.00 57.07 56.70 1m3i s TYR 358 Cb -0.12 -1.28 -0.09 0.00 -1.52 0.00 0.00 41.96 38.95 1m3i s TYR 358 CO 0.00 0.57 1.31 -1.25 0.02 0.00 0.00 175.55 176.20 1m3i s PRO 359 N -3.73 4.05 -0.06 -1.71 0.04 -1.18 -1.05 135.00 131.37 1m3i s PRO 359 Ca 0.32 2.17 -0.01 0.00 0.04 0.00 0.00 61.00 63.53 1m3i s PRO 359 Cb -0.06 -2.82 -0.03 0.00 0.04 0.00 0.00 34.50 31.62 1m3i s PRO 359 CO 0.21 -0.43 -0.06 -0.89 0.04 0.00 0.00 177.00 175.88 1m3i n ILE 360 N 0.27 0.32 -3.83 0.56 2.08 0.16 -4.26 119.36 114.66 1m3i n ILE 360 Ca 0.03 -0.11 -0.07 0.00 0.56 0.00 0.00 62.75 63.16 1m3i n ILE 360 Cb 0.43 -0.95 -0.00 0.00 -0.75 0.00 0.00 39.64 38.37 1m3i n ILE 360 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1m3i s SER 361 N -4.81 -0.15 0.10 4.38 1.04 -1.23 -1.81 113.70 111.22 1m3i s SER 361 Ca -0.08 -0.77 -0.25 0.00 0.48 0.00 0.00 55.95 55.33 1m3i s SER 361 Cb 0.02 0.73 0.08 0.00 0.10 0.00 0.00 66.02 66.95 1m3i s SER 361 CO 0.12 -1.40 0.69 -0.72 0.98 0.00 0.00 173.24 172.91 1m3i s TYR 362 N -3.21 -0.49 -0.01 5.02 -0.85 0.16 -1.30 117.35 116.66 1m3i s TYR 362 Ca 0.13 0.35 0.07 0.00 -0.52 0.00 0.00 57.07 57.11 1m3i s TYR 362 Cb -0.05 0.54 -0.02 0.00 0.38 0.00 0.00 41.96 42.81 1m3i s TYR 362 CO 0.08 -0.75 -0.23 0.95 -1.52 0.00 0.00 175.55 174.08 1m3i s THR 363 N -3.39 2.29 0.48 -3.49 -4.23 -1.00 0.28 115.64 106.58 1m3i s THR 363 Ca 0.01 -1.08 0.07 0.00 -1.18 0.00 0.00 61.69 59.51 1m3i s THR 363 Cb -0.01 -1.84 0.01 0.00 1.34 0.00 0.00 72.50 72.00 1m3i s THR 363 CO -0.10 0.54 0.42 -0.44 -0.54 0.00 0.00 174.62 174.50 1m3i s SER 364 N -0.77 4.85 -0.06 3.99 0.01 -1.26 -2.01 113.70 118.45 1m3i s SER 364 Ca 0.11 -0.97 -0.02 0.00 1.31 0.00 0.00 55.95 56.37 1m3i s SER 364 Cb -0.10 -0.08 0.04 0.00 0.21 0.00 0.00 66.02 66.09 1m3i s SER 364 CO 0.00 -0.90 0.12 -0.69 0.41 0.00 0.00 173.24 172.18 1m3i s VAL 365 N -2.62 -0.14 0.19 3.43 1.01 -0.52 -1.20 120.40 120.54 1m3i s VAL 365 Ca 0.44 0.30 -0.32 0.00 0.00 0.00 0.00 61.98 62.40 1m3i s VAL 365 Cb -0.03 -0.22 -0.11 0.00 0.00 0.00 0.00 36.38 36.02 1m3i s VAL 365 CO 0.26 0.12 1.74 -0.36 0.00 0.00 0.00 175.10 176.86 1m3i s PHE 366 N 1.77 2.74 0.17 5.22 0.40 0.13 -1.00 117.98 127.41 1m3i s PHE 366 Ca -0.02 0.27 -0.14 0.00 -0.60 0.00 0.00 56.93 56.44 1m3i s PHE 366 Cb -0.12 -4.14 0.12 0.00 0.51 0.00 0.00 43.02 39.39 1m3i s PHE 366 CO -0.05 -4.40 1.77 -0.07 0.70 0.00 0.00 175.22 173.17 1m3i h LEU 367 N 7.23 0.27 0.00 -0.37 3.38 -1.78 0.73 115.31 124.77 1m3i h LEU 367 Ca -0.44 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1m3i h LEU 367 Cb 1.20 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1m3i h LEU 367 CO 0.95 0.19 0.00 1.17 0.09 0.00 0.00 178.44 180.84 1m3i n LYS 368 N -4.94 0.00 -0.15 1.13 4.81 -1.26 -3.67 118.16 114.07 1m3i n LYS 368 Ca 0.03 0.31 0.09 0.00 -0.87 0.00 0.00 58.31 57.88 1m3i n LYS 368 Cb 0.14 -1.08 0.28 0.00 0.02 0.00 0.00 35.03 34.39 1m3i n LYS 368 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1m3i n ASP 369 N -1.00 2.12 -1.77 3.14 5.75 -1.25 -4.92 116.55 118.61 1m3i n ASP 369 Ca 0.00 -1.87 -0.21 0.00 -0.01 0.00 0.00 54.79 52.71 1m3i n ASP 369 Cb 0.00 -0.20 -0.07 0.00 -1.03 0.00 0.00 41.12 39.82 1m3i n ASP 369 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1m3i n ASN 370 N 0.63 -5.60 -4.79 -1.12 5.03 0.25 -4.96 115.26 104.69 1m3i n ASN 370 Ca 0.16 0.40 -0.38 0.00 0.87 0.00 0.00 54.58 55.63 1m3i n ASN 370 Cb 0.37 -4.87 -0.06 0.00 -1.02 0.00 0.00 39.78 34.20 1m3i n ASN 370 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1m3i s SER 371 N -2.62 7.26 0.29 6.41 1.04 -1.24 -4.67 113.70 120.16 1m3i s SER 371 Ca 0.00 1.61 -0.29 0.00 0.48 0.00 0.00 55.95 57.75 1m3i s SER 371 Cb 0.00 -2.49 -0.10 0.00 0.10 0.00 0.00 66.02 63.53 1m3i s SER 371 CO 0.00 0.08 1.33 -0.69 0.98 0.00 0.00 173.24 174.94 1m3i s VAL 372 N -1.40 2.81 0.27 5.02 1.01 -1.26 0.22 120.40 127.06 1m3i s VAL 372 Ca 0.42 0.75 -0.23 0.00 0.00 0.00 0.00 61.98 62.93 1m3i s VAL 372 Cb -0.20 -3.48 -0.09 0.00 0.00 0.00 0.00 36.38 32.61 1m3i s VAL 372 CO 0.24 0.15 0.83 0.00 0.00 0.00 0.00 175.10 176.32 1m3i s ALA 373 N -0.66 3.32 -0.19 5.51 0.00 -0.34 -4.84 121.76 124.56 1m3i s ALA 373 Ca 0.53 0.34 -0.05 0.00 0.00 0.00 0.00 51.96 52.77 1m3i s ALA 373 Cb -0.39 -2.99 0.07 0.00 0.00 0.00 0.00 23.12 19.80 1m3i s ALA 373 CO 0.48 0.25 0.09 0.00 0.00 0.00 0.00 175.76 176.59 1m3i s ALA 374 N -1.57 0.48 0.97 0.00 0.00 -1.26 -4.16 121.76 116.22 1m3i s ALA 374 Ca 0.46 -0.44 -0.12 0.00 0.00 0.00 0.00 51.96 51.86 1m3i s ALA 374 Cb -0.18 -1.09 0.09 0.00 0.00 0.00 0.00 23.12 21.94 1m3i s ALA 374 CO 0.22 -1.24 0.63 1.55 0.00 0.00 0.00 175.76 176.91 1m3i n VAL 375 N 5.26 0.00 -4.42 0.00 3.14 -1.22 -4.83 118.33 116.26 1m3i n VAL 375 Ca -0.07 -0.16 -0.20 0.00 -2.96 0.00 0.00 64.34 60.96 1m3i n VAL 375 Cb 0.48 -0.75 -0.14 0.00 -1.06 0.00 0.00 33.84 32.36 1m3i n VAL 375 CO 0.00 0.00 0.00 -1.00 -6.46 0.00 0.00 176.83 169.37 1m3i s HIS 376 N -2.46 1.04 0.07 1.45 3.76 -1.15 -3.71 115.29 114.29 1m3i s HIS 376 Ca 0.60 -0.25 -0.08 0.00 -0.15 0.00 0.00 55.06 55.19 1m3i s HIS 376 Cb -0.21 -0.65 -0.01 0.00 1.11 0.00 0.00 32.58 32.82 1m3i s HIS 376 CO 0.64 -0.00 0.15 1.21 -0.85 0.00 0.00 174.74 175.89 1m3i s ASN 377 N -0.59 0.16 -0.43 1.40 3.04 -0.40 0.37 114.94 118.50 1m3i s ASN 377 Ca 0.03 -0.65 0.02 0.00 0.04 0.00 0.00 52.86 52.30 1m3i s ASN 377 Cb -0.06 0.31 0.24 0.00 -1.54 0.00 0.00 41.25 40.20 1m3i s ASN 377 CO 0.00 -0.67 1.01 1.17 -3.04 0.00 0.00 177.10 175.56 1m3i n LYS 378 N 0.12 0.47 -3.26 0.43 0.00 -1.26 -1.78 118.16 112.87 1m3i n LYS 378 Ca -0.16 -1.33 -0.25 0.00 0.00 0.00 0.00 58.31 56.57 1m3i n LYS 378 Cb 0.61 -0.90 -0.01 0.00 0.00 0.00 0.00 35.03 34.73 1m3i n LYS 378 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 1m3i s THR 379 N 0.55 5.07 0.04 3.15 -1.32 -1.24 -4.49 115.64 117.39 1m3i s THR 379 Ca 0.29 -0.30 0.06 0.00 -1.21 0.00 0.00 61.69 60.53 1m3i s THR 379 Cb 0.18 -3.85 -0.03 0.00 -1.51 0.00 0.00 72.50 67.29 1m3i s THR 379 CO -0.16 -0.58 -0.15 -1.81 -2.21 0.00 0.00 174.62 169.71 1m3i s ASP 380 N -3.95 4.01 -0.05 8.08 -0.00 -0.58 -3.07 116.67 121.11 1m3i s ASP 380 Ca 0.42 -0.36 -0.13 0.00 -0.00 0.00 0.00 52.55 52.47 1m3i s ASP 380 Cb -0.10 -0.73 0.02 0.00 -0.00 0.00 0.00 42.92 42.12 1m3i s ASP 380 CO 0.37 0.26 0.30 -0.72 -0.00 0.00 0.00 175.17 175.37 1m3i s TYR 381 N -0.96 -0.22 -0.32 4.23 -0.85 -0.59 -4.77 117.35 113.88 1m3i s TYR 381 Ca 0.16 0.44 -0.01 0.00 -0.52 0.00 0.00 57.07 57.13 1m3i s TYR 381 Cb -0.11 0.09 0.06 0.00 0.38 0.00 0.00 41.96 42.39 1m3i s TYR 381 CO 0.06 -0.31 0.02 -1.50 -1.52 0.00 0.00 175.55 172.31 1m3i s ILE 382 N -0.82 2.96 0.33 -3.49 2.07 -1.26 0.29 121.20 121.27 1m3i s ILE 382 Ca -0.09 -1.54 -0.29 0.00 -1.41 0.00 0.00 60.65 57.33 1m3i s ILE 382 Cb -0.04 -2.77 -0.10 0.00 0.13 0.00 0.00 42.46 39.67 1m3i s ILE 382 CO 0.03 -0.21 1.36 -1.61 -1.91 0.00 0.00 174.94 172.60 1m3i s GLU 383 N 1.21 4.30 -0.07 3.50 2.02 0.26 -4.72 118.70 125.20 1m3i s GLU 383 Ca -0.03 2.29 0.02 0.00 0.02 0.00 0.00 54.97 57.27 1m3i s GLU 383 Cb -0.20 -3.06 0.02 0.00 0.10 0.00 0.00 34.13 30.99 1m3i s GLU 383 CO -0.02 -0.28 -0.10 0.95 0.02 0.00 0.00 175.26 175.83 1m3i s THR 384 N -0.98 1.03 -0.17 3.63 -4.23 -1.26 -0.76 115.64 112.90 1m3i s THR 384 Ca 0.51 -0.39 -0.08 0.00 -1.18 0.00 0.00 61.69 60.55 1m3i s THR 384 Cb -0.41 -0.97 -0.05 0.00 1.34 0.00 0.00 72.50 72.41 1m3i s THR 384 CO 0.53 0.34 0.13 0.42 -0.54 0.00 0.00 174.62 175.50 1m3i s THR 385 N 0.91 5.38 0.24 3.99 -4.23 0.61 -4.91 115.64 117.63 1m3i s THR 385 Ca -0.10 0.17 0.10 0.00 -1.18 0.00 0.00 61.69 60.68 1m3i s THR 385 Cb -0.15 -3.40 -0.04 0.00 1.34 0.00 0.00 72.50 70.24 1m3i s THR 385 CO 0.01 0.51 -0.11 -0.55 -0.54 0.00 0.00 174.62 173.94 1m3i s SER 386 N -0.19 4.09 -0.28 3.99 0.15 -1.26 -0.47 113.70 119.74 1m3i s SER 386 Ca 0.10 -0.75 0.01 0.00 0.70 0.00 0.00 55.95 56.01 1m3i s SER 386 Cb -0.11 -0.60 0.16 0.00 -1.71 0.00 0.00 66.02 63.76 1m3i s SER 386 CO 0.00 0.05 0.47 0.42 1.20 0.00 0.00 173.24 175.39 1m3i s THR 387 N -2.13 -0.76 0.51 6.45 -4.23 -0.53 -4.68 115.64 110.27 1m3i s THR 387 Ca 0.28 -0.12 -0.19 0.00 -1.18 0.00 0.00 61.69 60.48 1m3i s THR 387 Cb -0.07 -0.94 -0.07 0.00 1.34 0.00 0.00 72.50 72.76 1m3i s THR 387 CO 0.16 -0.13 1.06 -0.70 -0.54 0.00 0.00 174.62 174.47 1m3i s GLU 388 N 2.66 3.64 -0.04 3.99 2.12 -1.26 -1.66 118.70 128.15 1m3i s GLU 388 Ca 0.13 1.40 -0.03 0.00 0.36 0.00 0.00 54.97 56.83 1m3i s GLU 388 Cb -0.13 -2.07 0.01 0.00 0.26 0.00 0.00 34.13 32.20 1m3i s GLU 388 CO -0.23 -0.57 0.09 0.71 -0.54 0.00 0.00 175.26 174.72 1m3i s TYR 389 N -1.99 -0.10 0.35 5.30 1.51 -0.96 -4.94 117.35 116.51 1m3i s TYR 389 Ca 0.68 0.26 0.08 0.00 -1.01 0.00 0.00 57.07 57.08 1m3i s TYR 389 Cb -0.18 0.02 -0.04 0.00 -0.11 0.00 0.00 41.96 41.65 1m3i s TYR 389 CO 0.23 -0.06 0.14 0.45 -1.11 0.00 0.00 175.55 175.21 1m3i s SER 390 N 0.12 4.62 0.46 2.29 0.15 -1.26 0.44 113.70 120.52 1m3i s SER 390 Ca -0.01 -0.83 -0.10 0.00 0.70 0.00 0.00 55.95 55.71 1m3i s SER 390 Cb -0.01 -0.67 -0.06 0.00 -1.71 0.00 0.00 66.02 63.56 1m3i s SER 390 CO -0.00 -0.34 0.83 -0.54 1.20 0.00 0.00 173.24 174.39 1m3i s LYS 391 N -3.85 3.73 0.27 5.44 1.02 -0.97 -4.20 119.74 121.18 1m3i s LYS 391 Ca 0.38 0.51 -0.04 0.00 0.02 0.00 0.00 55.97 56.83 1m3i s LYS 391 Cb -0.01 -2.32 0.02 0.00 -0.52 0.00 0.00 37.83 34.99 1m3i s LYS 391 CO 0.23 -0.16 0.43 0.41 -0.92 0.00 0.00 175.35 175.34 1m3i n GLY 392 N -1.69 2.00 3.25 -3.33 0.00 -1.05 -4.55 105.19 99.82 1m3i n GLY 392 Ca 0.03 -1.43 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 1m3i n GLY 392 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1m3i s LYS 393 N -2.41 0.59 -0.29 1.61 0.00 -0.99 0.01 119.74 118.26 1m3i s LYS 393 Ca 0.18 0.04 -0.17 0.00 0.00 0.00 0.00 55.97 56.02 1m3i s LYS 393 Cb -0.02 0.27 -0.02 0.00 0.00 0.00 0.00 37.83 38.06 1m3i s LYS 393 CO 0.13 -0.14 0.47 0.42 0.00 0.00 0.00 175.35 176.23 1m3i s ILE 394 N -0.82 5.09 -0.25 3.79 1.01 0.40 -1.45 121.20 128.96 1m3i s ILE 394 Ca -0.09 0.61 -0.09 0.00 0.00 0.00 0.00 60.65 61.07 1m3i s ILE 394 Cb -0.04 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 1m3i s ILE 394 CO 0.03 0.01 0.13 0.20 0.00 0.00 0.00 174.94 175.32 1m3i s ASN 395 N 1.64 5.70 -0.09 3.58 0.02 0.84 0.07 114.94 126.69 1m3i s ASN 395 Ca 0.18 -0.05 -0.02 0.00 -1.02 0.00 0.00 52.86 51.95 1m3i s ASN 395 Cb -0.16 -2.04 -0.03 0.00 0.02 0.00 0.00 41.25 39.04 1m3i s ASN 395 CO 0.11 -0.00 0.00 -0.76 0.02 0.00 0.00 177.10 176.46 1m3i s LEU 396 N 1.47 3.56 -0.06 0.60 1.43 -0.53 -0.77 118.68 124.38 1m3i s LEU 396 Ca 0.06 0.12 -0.02 0.00 -1.03 0.00 0.00 54.13 53.26 1m3i s LEU 396 Cb -0.15 -1.82 0.04 0.00 0.03 0.00 0.00 46.19 44.29 1m3i s LEU 396 CO 0.07 0.36 0.10 -0.62 0.23 0.00 0.00 176.35 176.48 1m3i s ASP 397 N -0.75 0.89 -0.11 2.29 -1.08 -0.66 -1.94 116.67 115.31 1m3i s ASP 397 Ca 0.12 0.18 0.03 0.00 -0.52 0.00 0.00 52.55 52.36 1m3i s ASP 397 Cb -0.12 0.04 -0.01 0.00 -1.46 0.00 0.00 42.92 41.37 1m3i s ASP 397 CO 0.02 -0.24 -0.20 -2.28 0.52 0.00 0.00 175.17 173.00 1m3i s HIS 398 N 2.12 2.65 0.00 -5.34 5.65 0.13 -0.75 115.29 119.75 1m3i s HIS 398 Ca 0.03 -0.85 0.00 0.00 0.25 0.00 0.00 55.06 54.49 1m3i s HIS 398 Cb -0.12 -1.75 0.00 0.00 -1.18 0.00 0.00 32.58 29.53 1m3i s HIS 398 CO -0.04 -0.31 0.71 -1.13 -0.65 0.00 0.00 174.74 173.32 1m3i n SER 399 N 3.46 0.00 -4.80 9.88 3.41 -0.80 -1.18 113.62 123.58 1m3i n SER 399 Ca -0.19 -1.50 -0.32 0.00 -0.26 0.00 0.00 58.87 56.60 1m3i n SER 399 Cb 0.53 -0.10 0.03 0.00 -0.26 0.00 0.00 64.21 64.41 1m3i n SER 399 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1m3i s GLY 400 N -0.50 1.98 -1.36 5.00 0.00 -1.25 -4.61 107.32 106.59 1m3i s GLY 400 Ca 0.00 0.31 -0.07 0.00 0.00 0.00 0.00 44.72 44.96 1m3i s GLY 400 CO 0.00 0.63 2.38 0.00 0.00 0.00 0.00 173.10 176.11 1m3i n ALA 401 N -2.43 6.67 -3.80 3.20 0.00 0.11 -4.43 120.51 119.84 1m3i n ALA 401 Ca 0.08 -4.04 -0.03 0.00 0.00 0.00 0.00 53.44 49.45 1m3i n ALA 401 Cb 0.53 -2.90 0.00 0.00 0.00 0.00 0.00 19.45 17.08 1m3i n ALA 401 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1m3i s TYR 402 N -0.40 -0.04 -0.01 0.00 -0.85 -1.26 -4.18 117.35 110.61 1m3i s TYR 402 Ca 0.54 -0.30 -0.09 0.00 -0.52 0.00 0.00 57.07 56.70 1m3i s TYR 402 Cb 0.17 0.66 -0.05 0.00 0.38 0.00 0.00 41.96 43.12 1m3i s TYR 402 CO -0.07 -0.84 0.30 0.08 -1.52 0.00 0.00 175.55 173.49 1m3i s VAL 403 N -2.76 5.25 0.07 -3.49 1.01 -1.26 -4.61 120.40 114.60 1m3i s VAL 403 Ca 0.16 0.38 -0.03 0.00 0.00 0.00 0.00 61.98 62.49 1m3i s VAL 403 Cb -0.01 -3.58 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 1m3i s VAL 403 CO 0.03 0.45 0.05 0.00 0.00 0.00 0.00 175.10 175.63 1m3i s ALA 404 N -1.21 0.32 0.01 5.51 0.00 -0.74 -1.25 121.76 124.40 1m3i s ALA 404 Ca 0.25 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 51.17 1m3i s ALA 404 Cb -0.14 0.40 -0.01 0.00 0.00 0.00 0.00 23.12 23.37 1m3i s ALA 404 CO 0.13 -0.43 -0.07 -0.65 0.00 0.00 0.00 175.76 174.75 1m3i s GLN 405 N -3.92 0.51 0.26 0.00 -0.21 -0.79 -0.76 119.66 114.77 1m3i s GLN 405 Ca 0.08 -0.35 0.08 0.00 0.02 0.00 0.00 55.36 55.19 1m3i s GLN 405 Cb 0.07 -0.45 -0.04 0.00 1.00 0.00 0.00 33.01 33.59 1m3i s GLN 405 CO -0.09 0.12 0.15 -0.06 -2.12 0.00 0.00 175.29 173.29 1m3i s PHE 406 N -0.43 2.98 -0.35 0.91 0.40 -1.26 -0.76 117.98 119.47 1m3i s PHE 406 Ca -0.00 -0.16 0.00 0.00 -0.60 0.00 0.00 56.93 56.17 1m3i s PHE 406 Cb -0.04 -1.38 0.14 0.00 0.51 0.00 0.00 43.02 42.25 1m3i s PHE 406 CO -0.00 0.52 0.21 -2.00 0.70 0.00 0.00 175.22 174.65 1m3i s GLU 407 N -3.81 0.55 -0.19 0.44 2.12 0.21 -0.96 118.70 117.06 1m3i s GLU 407 Ca 0.33 -1.33 -0.05 0.00 0.36 0.00 0.00 54.97 54.28 1m3i s GLU 407 Cb -0.07 -1.30 -0.03 0.00 0.26 0.00 0.00 34.13 32.99 1m3i s GLU 407 CO 0.24 -1.21 0.00 0.08 -0.54 0.00 0.00 175.26 173.83 1m3i s VAL 408 N 1.07 4.01 0.12 3.70 1.01 -1.26 -2.04 120.40 127.01 1m3i s VAL 408 Ca 0.18 -0.30 -0.11 0.00 0.00 0.00 0.00 61.98 61.75 1m3i s VAL 408 Cb -0.23 -2.81 0.01 0.00 0.00 0.00 0.00 36.38 33.35 1m3i s VAL 408 CO 0.01 0.44 0.29 0.00 0.00 0.00 0.00 175.10 175.83 1m3i s ALA 409 N 0.90 -0.37 0.21 5.51 0.00 -0.80 -1.15 121.76 126.06 1m3i s ALA 409 Ca 0.01 -0.54 -0.20 0.00 0.00 0.00 0.00 51.96 51.23 1m3i s ALA 409 Cb -0.14 0.66 0.07 0.00 0.00 0.00 0.00 23.12 23.71 1m3i s ALA 409 CO 0.02 -0.60 0.98 -2.67 0.00 0.00 0.00 175.76 173.49 1m3i n TRP 410 N -0.16 -1.51 -4.43 0.00 2.14 -0.64 -0.94 117.44 111.91 1m3i n TRP 410 Ca -0.13 -1.34 -0.22 0.00 2.07 0.00 0.00 57.50 57.88 1m3i n TRP 410 Cb 0.63 0.66 -0.10 0.00 -0.81 0.00 0.00 31.31 31.69 1m3i n TRP 410 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1m3i s ASP 411 N -3.34 3.28 -0.18 -0.67 -0.00 0.84 -0.82 116.67 115.78 1m3i s ASP 411 Ca 0.21 -1.03 0.01 0.00 -0.00 0.00 0.00 52.55 51.74 1m3i s ASP 411 Cb -0.03 -0.25 0.03 0.00 -0.00 0.00 0.00 42.92 42.66 1m3i s ASP 411 CO 0.06 -0.03 -0.18 -1.61 -0.00 0.00 0.00 175.17 173.42 1m3i s GLU 412 N -3.55 2.74 0.11 8.23 2.02 0.68 0.09 118.70 129.02 1m3i s GLU 412 Ca 0.28 -0.82 -0.24 0.00 0.02 0.00 0.00 54.97 54.20 1m3i s GLU 412 Cb -0.04 -2.50 -0.07 0.00 0.10 0.00 0.00 34.13 31.62 1m3i s GLU 412 CO 0.13 -0.26 0.73 0.54 0.02 0.00 0.00 175.26 176.42 1m3i s VAL 413 N 1.32 4.55 0.05 2.63 0.11 -0.11 -1.26 120.40 127.69 1m3i s VAL 413 Ca 0.03 1.58 0.00 0.00 -2.93 0.00 0.00 61.98 60.67 1m3i s VAL 413 Cb -0.14 -4.08 -0.03 0.00 -1.53 0.00 0.00 36.38 30.60 1m3i s VAL 413 CO -0.12 0.48 -0.04 -0.44 -3.33 0.00 0.00 175.10 171.65 1m3i s SER 414 N -0.81 0.62 -0.09 3.54 0.01 0.66 -4.94 113.70 112.70 1m3i s SER 414 Ca 0.35 -0.83 0.03 0.00 1.31 0.00 0.00 55.95 56.81 1m3i s SER 414 Cb -0.22 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.15 1m3i s SER 414 CO 0.24 -0.46 -0.20 -0.31 0.41 0.00 0.00 173.24 172.92 1m3i s TYR 415 N -3.00 2.20 0.00 2.43 1.51 -1.26 0.18 117.35 119.42 1m3i s TYR 415 Ca 0.01 -0.89 0.00 0.00 -1.01 0.00 0.00 57.07 55.17 1m3i s TYR 415 Cb 0.01 -1.50 0.00 0.00 -0.11 0.00 0.00 41.96 40.36 1m3i s TYR 415 CO -0.06 -0.38 0.00 -0.40 -1.11 0.00 0.00 175.55 173.60 1m3i n ASP 416 N 3.65 -0.14 0.16 2.29 5.68 -0.93 -4.87 116.55 122.38 1m3i n ASP 416 Ca -0.20 -0.45 0.03 0.00 -0.50 0.00 0.00 54.79 53.67 1m3i n ASP 416 Cb 0.52 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.71 1m3i n ASP 416 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1m3i h LYS 417 N 0.00 0.00 -0.10 0.11 1.57 -1.95 -2.83 116.57 113.36 1m3i h LYS 417 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1m3i h LYS 417 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1m3i h LYS 417 CO 0.00 0.47 0.00 0.39 -0.57 0.00 0.00 179.45 179.74 1m3i n GLU 418 N -3.45 1.50 -2.98 3.15 -0.58 -1.26 -4.85 120.64 112.17 1m3i n GLU 418 Ca 0.00 -0.75 -0.11 0.00 -0.42 0.00 0.00 57.16 55.88 1m3i n GLU 418 Cb 0.61 -1.38 0.04 0.00 -0.57 0.00 0.00 31.44 30.14 1m3i n GLU 418 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1m3i n GLY 419 N 1.04 0.20 3.65 0.62 0.00 -1.07 -4.71 105.19 104.92 1m3i n GLY 419 Ca 0.16 -0.22 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 1m3i n GLY 419 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1m3i s ASN 420 N -3.23 5.03 0.08 1.61 0.01 -1.26 -4.61 114.94 112.57 1m3i s ASN 420 Ca 0.24 0.06 -0.31 0.00 -0.71 0.00 0.00 52.86 52.14 1m3i s ASN 420 Cb -0.11 -1.35 -0.08 0.00 0.41 0.00 0.00 41.25 40.12 1m3i s ASN 420 CO 0.35 0.35 1.56 -0.70 -1.51 0.00 0.00 177.10 177.16 1m3i s GLU 421 N -1.02 4.23 -0.26 -0.60 2.12 -1.26 -2.20 118.70 119.71 1m3i s GLU 421 Ca 0.14 2.25 0.02 0.00 0.36 0.00 0.00 54.97 57.74 1m3i s GLU 421 Cb -0.11 -3.46 0.05 0.00 0.26 0.00 0.00 34.13 30.87 1m3i s GLU 421 CO 0.04 -0.65 -0.09 0.08 -0.54 0.00 0.00 175.26 174.10 1m3i s VAL 422 N 2.11 2.34 -0.42 3.70 1.01 0.48 -4.95 120.40 124.67 1m3i s VAL 422 Ca 0.70 -1.53 -0.18 0.00 0.00 0.00 0.00 61.98 60.98 1m3i s VAL 422 Cb -0.39 -2.34 0.02 0.00 0.00 0.00 0.00 36.38 33.67 1m3i s VAL 422 CO 0.31 -0.00 0.47 -0.76 0.00 0.00 0.00 175.10 175.11 1m3i s LEU 423 N 1.15 4.80 -0.26 3.92 1.43 -1.26 -0.25 118.68 128.22 1m3i s LEU 423 Ca -0.07 -0.62 -0.15 0.00 -1.03 0.00 0.00 54.13 52.27 1m3i s LEU 423 Cb -0.19 -2.44 -0.04 0.00 0.03 0.00 0.00 46.19 43.55 1m3i s LEU 423 CO -0.05 -0.61 0.36 -0.89 0.23 0.00 0.00 176.35 175.40 1m3i s THR 424 N 2.24 5.19 0.47 5.49 2.01 -0.39 -4.91 115.64 125.74 1m3i s THR 424 Ca 0.14 0.57 -0.20 0.00 0.31 0.00 0.00 61.69 62.50 1m3i s THR 424 Cb -0.17 -3.69 -0.09 0.00 0.01 0.00 0.00 72.50 68.56 1m3i s THR 424 CO 0.14 0.18 1.00 -2.28 -0.69 0.00 0.00 174.62 172.98 1m3i s HIS 425 N 1.89 3.16 0.01 4.92 2.46 -1.26 -0.23 115.29 126.23 1m3i s HIS 425 Ca 0.15 1.58 -0.07 0.00 0.47 0.00 0.00 55.06 57.19 1m3i s HIS 425 Cb -0.15 -2.95 -0.00 0.00 -0.13 0.00 0.00 32.58 29.34 1m3i s HIS 425 CO 0.09 -0.52 0.13 0.15 -2.47 0.00 0.00 174.74 172.13 1m3i s LYS 426 N -3.33 0.52 -0.01 2.88 -0.14 -0.00 -4.89 119.74 114.76 1m3i s LYS 426 Ca 0.64 -0.49 -0.10 0.00 -1.36 0.00 0.00 55.97 54.66 1m3i s LYS 426 Cb -0.13 0.21 0.01 0.00 -1.68 0.00 0.00 37.83 36.25 1m3i s LYS 426 CO 0.19 -0.13 0.22 0.95 -0.76 0.00 0.00 175.35 175.82 1m3i s THR 427 N -1.71 0.06 0.31 2.17 -4.23 -1.26 -1.62 115.64 109.36 1m3i s THR 427 Ca -0.12 -0.53 -0.28 0.00 -1.18 0.00 0.00 61.69 59.58 1m3i s THR 427 Cb -0.06 -0.50 -0.09 0.00 1.34 0.00 0.00 72.50 73.19 1m3i s THR 427 CO 0.00 -0.29 1.07 0.86 -0.54 0.00 0.00 174.62 175.71 1m3i s TRP 428 N -1.20 3.55 -0.64 3.99 -0.00 -0.30 -4.94 118.94 119.40 1m3i s TRP 428 Ca -0.13 1.71 0.26 0.00 -0.00 0.00 0.00 56.10 57.94 1m3i s TRP 428 Cb -0.06 -3.20 0.83 0.00 -0.00 0.00 0.00 33.47 31.03 1m3i s TRP 428 CO 0.02 -0.44 1.76 0.38 -0.00 0.00 0.00 176.95 178.67 1m3i h ASP 429 N 3.50 0.00 -0.02 5.86 2.03 -2.01 -2.79 116.42 123.00 1m3i h ASP 429 Ca -0.47 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.83 1m3i h ASP 429 Cb 1.21 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.71 1m3i h ASP 429 CO 0.66 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 179.48 1m3i n GLY 430 N 0.99 -0.85 3.77 7.15 0.00 -1.26 -4.86 105.19 110.13 1m3i n GLY 430 Ca 0.05 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 1m3i n GLY 430 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1m3i n ASN 431 N -0.69 3.73 -3.56 1.61 4.13 -1.05 -2.64 115.26 116.78 1m3i n ASN 431 Ca 0.16 1.23 -0.26 0.00 1.68 0.00 0.00 54.58 57.39 1m3i n ASN 431 Cb 0.10 -1.61 0.05 0.00 -1.54 0.00 0.00 39.78 36.78 1m3i n ASN 431 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1m3i n TYR 432 N 0.42 -2.41 -4.15 3.10 0.53 -0.13 -4.93 117.16 109.58 1m3i n TYR 432 Ca 0.01 0.83 -0.26 0.00 -1.02 0.00 0.00 57.90 57.46 1m3i n TYR 432 Cb 0.39 -4.39 -0.17 0.00 -1.03 0.00 0.00 39.34 34.14 1m3i n TYR 432 CO 0.00 0.00 0.00 -0.65 -1.02 0.00 0.00 176.86 175.19 1m3i s GLN 433 N -6.27 1.67 0.12 -0.72 -0.21 -1.08 -4.98 119.66 108.19 1m3i s GLN 433 Ca 0.54 -0.34 -0.35 0.00 0.02 0.00 0.00 55.36 55.23 1m3i s GLN 433 Cb -0.25 -1.58 -0.17 0.00 1.00 0.00 0.00 33.01 32.00 1m3i s GLN 433 CO 0.67 -0.16 1.19 -0.25 -2.12 0.00 0.00 175.29 174.61 1m3i n ASP 434 N 4.54 1.15 -3.97 5.90 8.00 -1.26 -4.55 116.55 126.36 1m3i n ASP 434 Ca -0.17 1.14 -0.16 0.00 0.71 0.00 0.00 54.79 56.31 1m3i n ASP 434 Cb 0.51 -1.15 -0.14 0.00 -0.02 0.00 0.00 41.12 40.31 1m3i n ASP 434 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1m3i s LYS 435 N -0.03 0.45 0.00 -1.24 -0.14 0.06 -4.95 119.74 113.90 1m3i s LYS 435 Ca 0.79 -0.23 0.00 0.00 -1.36 0.00 0.00 55.97 55.17 1m3i s LYS 435 Cb -0.95 -0.42 0.00 0.00 -1.68 0.00 0.00 37.83 34.78 1m3i s LYS 435 CO 0.51 0.11 0.00 0.25 -0.76 0.00 0.00 175.35 175.46 1m3i n THR 436 N 2.85 0.00 0.00 2.17 -2.24 -1.26 -1.80 114.28 114.00 1m3i n THR 436 Ca -0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1m3i n THR 436 Cb 0.58 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1m3i n THR 436 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1m3i n ALA 437 N -3.00 0.00 -3.30 6.98 0.00 -1.26 -2.93 120.51 117.00 1m3i n ALA 437 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1m3i n ALA 437 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 1m3i n ALA 437 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1m3i n HIS 438 N 0.00 -0.96 -4.93 0.00 -0.00 -0.76 -4.99 115.22 103.57 1m3i n HIS 438 Ca 0.00 0.40 -0.33 0.00 -0.00 0.00 0.00 57.72 57.80 1m3i n HIS 438 Cb 0.00 -1.29 -0.15 0.00 -0.00 0.00 0.00 29.99 28.55 1m3i n HIS 438 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 1m3i s TYR 439 N -1.16 2.70 0.27 1.57 6.14 -0.32 -4.94 117.35 121.61 1m3i s TYR 439 Ca 0.13 -0.64 0.07 0.00 0.64 0.00 0.00 57.07 57.27 1m3i s TYR 439 Cb -0.01 -1.76 -0.06 0.00 0.42 0.00 0.00 41.96 40.55 1m3i s TYR 439 CO 0.31 -0.18 -0.09 -1.12 0.64 0.00 0.00 175.55 175.11 1m3i s SER 440 N 0.11 2.89 -0.16 4.32 0.01 -1.26 -0.69 113.70 118.91 1m3i s SER 440 Ca -0.08 -1.15 -0.35 0.00 1.31 0.00 0.00 55.95 55.68 1m3i s SER 440 Cb -0.15 -0.19 0.14 0.00 0.21 0.00 0.00 66.02 66.03 1m3i s SER 440 CO 0.05 -0.27 1.35 0.28 0.41 0.00 0.00 173.24 175.05 1m3i s THR 441 N -2.93 0.00 -0.06 1.44 -1.32 -0.82 -4.97 115.64 106.98 1m3i s THR 441 Ca 0.29 -0.05 -0.01 0.00 -1.21 0.00 0.00 61.69 60.71 1m3i s THR 441 Cb 0.02 -1.49 0.03 0.00 -1.51 0.00 0.00 72.50 69.55 1m3i s THR 441 CO 0.12 0.00 -0.00 -0.69 -2.21 0.00 0.00 174.62 171.84 1m3i s VAL 442 N -2.19 0.33 -0.30 5.08 1.01 -1.26 -1.46 120.40 121.62 1m3i s VAL 442 Ca 0.13 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.15 1m3i s VAL 442 Cb 0.03 -0.47 0.02 0.00 0.00 0.00 0.00 36.38 35.96 1m3i s VAL 442 CO -0.04 0.23 0.08 -0.63 0.00 0.00 0.00 175.10 174.74 1m3i s ILE 443 N 1.70 3.86 0.22 2.22 1.01 0.11 -4.94 121.20 125.38 1m3i s ILE 443 Ca 0.00 -0.83 -0.18 0.00 0.00 0.00 0.00 60.65 59.65 1m3i s ILE 443 Cb -0.13 -3.04 -0.08 0.00 0.01 0.00 0.00 42.46 39.22 1m3i s ILE 443 CO -0.04 0.02 0.69 -2.16 0.00 0.00 0.00 174.94 173.45 1m3i s PRO 444 N 1.47 4.15 -0.03 2.79 0.04 -1.26 0.15 135.00 142.30 1m3i s PRO 444 Ca 0.01 0.75 0.04 0.00 0.04 0.00 0.00 61.00 61.84 1m3i s PRO 444 Cb -0.18 -2.82 -0.00 0.00 0.04 0.00 0.00 34.50 31.54 1m3i s PRO 444 CO 0.02 0.37 -0.13 -0.51 0.04 0.00 0.00 177.00 176.79 1m3i s LEU 445 N -2.15 1.89 0.65 -3.56 1.43 0.10 -4.93 118.68 112.12 1m3i s LEU 445 Ca 0.44 -0.27 -0.17 0.00 -1.03 0.00 0.00 54.13 53.09 1m3i s LEU 445 Cb -0.15 -0.76 -0.00 0.00 0.03 0.00 0.00 46.19 45.30 1m3i s LEU 445 CO 0.20 0.12 1.25 -1.61 0.23 0.00 0.00 176.35 176.54 1m3i s GLU 446 N 0.02 2.56 0.03 1.70 0.41 -1.26 -2.53 118.70 119.64 1m3i s GLU 446 Ca -0.02 1.92 0.02 0.00 -0.41 0.00 0.00 54.97 56.48 1m3i s GLU 446 Cb -0.09 -1.87 0.12 0.00 -1.78 0.00 0.00 34.13 30.51 1m3i s GLU 446 CO 0.01 -1.55 1.06 0.00 -0.49 0.00 0.00 175.26 174.29 1m3i n ALA 447 N -2.03 0.99 -1.50 5.21 0.00 -1.26 -2.16 120.51 119.76 1m3i n ALA 447 Ca 0.15 0.02 -0.27 0.00 0.00 0.00 0.00 53.44 53.34 1m3i n ALA 447 Cb 0.49 -1.02 0.10 0.00 0.00 0.00 0.00 19.45 19.02 1m3i n ALA 447 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1m3i n ASN 448 N -1.57 5.78 -4.67 0.00 6.94 -1.26 -4.53 115.26 115.95 1m3i n ASN 448 Ca -0.00 -3.76 -0.38 0.00 -0.02 0.00 0.00 54.58 50.42 1m3i n ASN 448 Cb 0.01 -0.76 -0.08 0.00 -2.36 0.00 0.00 39.78 36.59 1m3i n ASN 448 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1m3i s ALA 449 N -3.62 3.56 0.35 -2.53 0.00 -0.92 -0.93 121.76 117.67 1m3i s ALA 449 Ca 0.58 -0.56 0.05 0.00 0.00 0.00 0.00 51.96 52.02 1m3i s ALA 449 Cb 0.47 -2.61 -0.07 0.00 0.00 0.00 0.00 23.12 20.91 1m3i s ALA 449 CO 0.02 -0.30 0.05 1.03 0.00 0.00 0.00 175.76 176.56 1m3i s ARG 450 N 1.30 1.74 -1.25 0.00 3.00 0.11 -4.71 118.95 119.14 1m3i s ARG 450 Ca 0.18 -1.97 -0.21 0.00 0.00 0.00 0.00 55.73 53.73 1m3i s ARG 450 Cb -0.15 -1.06 0.01 0.00 0.00 0.00 0.00 34.95 33.75 1m3i s ARG 450 CO 0.08 -0.16 0.62 0.09 0.00 0.00 0.00 175.30 175.93 1m3i n ASN 451 N -0.77 -3.48 -4.66 0.23 5.03 -1.26 -0.11 115.26 110.24 1m3i n ASN 451 Ca -0.03 -1.15 -0.42 0.00 0.87 0.00 0.00 54.58 53.85 1m3i n ASN 451 Cb 0.67 -2.49 -0.04 0.00 -1.02 0.00 0.00 39.78 36.90 1m3i n ASN 451 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1m3i s ILE 452 N -3.66 4.84 -0.04 2.41 1.01 -1.25 -4.07 121.20 120.44 1m3i s ILE 452 Ca 0.37 1.65 0.06 0.00 0.00 0.00 0.00 60.65 62.73 1m3i s ILE 452 Cb -0.17 -4.15 -0.01 0.00 0.01 0.00 0.00 42.46 38.14 1m3i s ILE 452 CO 0.92 -0.03 -0.22 0.00 0.00 0.00 0.00 174.94 175.61 1m3i s ARG 453 N 2.51 2.10 -0.08 2.79 1.70 -0.11 0.25 118.95 128.10 1m3i s ARG 453 Ca 0.38 -0.79 0.02 0.00 -0.47 0.00 0.00 55.73 54.86 1m3i s ARG 453 Cb -0.16 -1.86 0.02 0.00 -0.57 0.00 0.00 34.95 32.38 1m3i s ARG 453 CO 0.10 0.37 -0.11 0.42 -1.08 0.00 0.00 175.30 175.00 1m3i s ILE 454 N -0.22 1.14 -0.01 4.99 1.01 -0.11 -1.91 121.20 126.09 1m3i s ILE 454 Ca 0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 60.65 60.18 1m3i s ILE 454 Cb -0.11 -1.07 -0.00 0.00 0.01 0.00 0.00 42.46 41.29 1m3i s ILE 454 CO 0.02 0.36 0.07 -0.75 0.00 0.00 0.00 174.94 174.64 1m3i s LYS 455 N 0.96 0.25 -0.02 2.79 2.20 -0.87 -0.37 119.74 124.68 1m3i s LYS 455 Ca -0.09 -0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.34 1m3i s LYS 455 Cb -0.15 0.10 0.01 0.00 -1.51 0.00 0.00 37.83 36.28 1m3i s LYS 455 CO 0.00 -0.05 -0.03 0.00 -0.36 0.00 0.00 175.35 174.91 1m3i s ALA 456 N -0.70 0.44 0.01 3.13 0.00 -0.22 0.66 121.76 125.08 1m3i s ALA 456 Ca -0.08 -0.07 0.08 0.00 0.00 0.00 0.00 51.96 51.90 1m3i s ALA 456 Cb -0.05 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 1m3i s ALA 456 CO 0.00 0.03 -0.25 0.50 0.00 0.00 0.00 175.76 176.04 1m3i s ARG 457 N 0.42 1.99 0.05 0.00 6.06 0.06 -0.71 118.95 126.83 1m3i s ARG 457 Ca -0.05 -1.00 -0.22 0.00 -2.50 0.00 0.00 55.73 51.96 1m3i s ARG 457 Cb -0.08 -2.04 -0.06 0.00 0.06 0.00 0.00 34.95 32.83 1m3i s ARG 457 CO -0.00 0.54 0.67 -2.00 -2.50 0.00 0.00 175.30 172.01 1m3i s GLU 458 N -0.95 4.39 -1.24 5.12 -6.30 -0.89 -1.88 118.70 116.96 1m3i s GLU 458 Ca 0.11 0.90 -0.12 0.00 -2.50 0.00 0.00 54.97 53.37 1m3i s GLU 458 Cb -0.10 -3.32 0.17 0.00 0.00 0.00 0.00 34.13 30.88 1m3i s GLU 458 CO 0.01 0.41 1.60 0.00 0.02 0.00 0.00 175.26 177.30 1m3i s THR 460 N 1.01 0.22 -5.00 0.00 2.01 -1.26 -4.82 115.64 107.81 1m3i s THR 460 Ca 0.41 -0.89 0.00 0.00 0.31 0.00 0.00 61.69 61.52 1m3i s THR 460 Cb 0.02 -1.15 0.00 0.00 0.01 0.00 0.00 72.50 71.38 1m3i s THR 460 CO 0.00 -0.66 0.00 0.61 -0.69 0.00 0.00 174.62 173.88 1m3i n GLY 461 N 5.13 -0.03 0.28 4.40 0.00 -1.26 -4.72 105.19 108.99 1m3i n GLY 461 Ca -0.05 -1.76 -0.10 0.00 0.00 0.00 0.00 46.02 44.10 1m3i n GLY 461 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1m3i h LEU 462 N 0.00 -0.78 0.00 0.99 5.85 -1.98 -3.48 115.31 115.90 1m3i h LEU 462 Ca 0.00 0.06 -0.16 0.00 0.84 0.00 0.00 57.88 58.62 1m3i h LEU 462 Cb 0.00 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 1m3i h LEU 462 CO 0.00 -0.38 -0.00 0.00 -0.34 0.00 0.00 178.44 177.72 1m3i n ALA 463 N -2.56 -0.67 -0.30 1.25 0.00 -1.26 -5.05 120.51 111.91 1m3i n ALA 463 Ca -0.07 -1.21 0.02 0.00 0.00 0.00 0.00 53.44 52.18 1m3i n ALA 463 Cb 0.26 0.98 0.09 0.00 0.00 0.00 0.00 19.45 20.78 1m3i n ALA 463 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1m3i h TRP 464 N 1.81 -0.58 0.00 0.00 2.91 -1.97 0.23 115.95 118.36 1m3i h TRP 464 Ca -0.24 0.08 0.00 0.00 1.13 0.00 0.00 58.89 59.86 1m3i h TRP 464 Cb 0.98 0.38 0.00 0.00 -0.51 0.00 0.00 29.16 30.01 1m3i h TRP 464 CO 0.00 -0.37 0.00 -0.85 -1.03 0.00 0.00 178.44 176.19 1m3i n GLU 465 N -5.53 0.32 -0.42 2.65 0.00 -1.26 -2.42 120.64 113.98 1m3i n GLU 465 Ca 0.12 0.06 0.06 0.00 0.00 0.00 0.00 57.16 57.40 1m3i n GLU 465 Cb 0.42 -1.50 0.11 0.00 0.00 0.00 0.00 31.44 30.47 1m3i n GLU 465 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 1m3i n TRP 466 N -1.10 0.00 -4.06 -1.84 8.01 0.78 -5.05 117.44 114.17 1m3i n TRP 466 Ca 0.08 -0.79 -0.30 0.00 -1.31 0.00 0.00 57.50 55.19 1m3i n TRP 466 Cb 0.06 -0.14 -0.07 0.00 -2.01 0.00 0.00 31.31 29.16 1m3i n TRP 466 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 1m3i s TRP 467 N -1.92 3.17 0.67 -5.99 0.51 -1.02 -4.68 118.94 109.67 1m3i s TRP 467 Ca 0.25 0.06 -0.14 0.00 -2.12 0.00 0.00 56.10 54.15 1m3i s TRP 467 Cb 0.24 -1.60 0.00 0.00 -0.81 0.00 0.00 33.47 31.30 1m3i s TRP 467 CO -0.02 0.52 1.10 -0.98 -0.51 0.00 0.00 176.95 177.06 1m3i s ARG 468 N -2.44 2.78 -0.08 4.98 1.70 -1.26 -4.86 118.95 119.78 1m3i s ARG 468 Ca 0.29 1.33 -0.16 0.00 -0.47 0.00 0.00 55.73 56.72 1m3i s ARG 468 Cb -0.12 -1.95 -0.05 0.00 -0.57 0.00 0.00 34.95 32.26 1m3i s ARG 468 CO 0.22 -1.26 0.42 -0.51 -1.08 0.00 0.00 175.30 173.09 1m3i s ASP 469 N -2.75 6.70 -0.15 -2.89 -0.00 -1.26 -2.10 116.67 114.21 1m3i s ASP 469 Ca 0.66 0.83 0.18 0.00 -0.00 0.00 0.00 52.55 54.21 1m3i s ASP 469 Cb -0.19 -2.26 -0.25 0.00 -0.00 0.00 0.00 42.92 40.22 1m3i s ASP 469 CO 0.43 0.14 0.22 0.52 -0.00 0.00 0.00 175.17 176.48 1m3i n VAL 470 N 2.94 1.24 -3.65 -1.27 0.31 0.11 -4.91 118.33 113.10 1m3i n VAL 470 Ca -0.10 -0.80 -0.12 0.00 -0.01 0.00 0.00 64.34 63.30 1m3i n VAL 470 Cb 0.52 -0.48 -0.08 0.00 -0.91 0.00 0.00 33.84 32.89 1m3i n VAL 470 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 1m3i s ILE 471 N -2.64 -0.00 -0.37 2.52 2.07 -1.17 -4.33 121.20 117.28 1m3i s ILE 471 Ca -0.09 0.01 0.03 0.00 -1.41 0.00 0.00 60.65 59.18 1m3i s ILE 471 Cb 0.07 -0.91 0.15 0.00 0.13 0.00 0.00 42.46 41.91 1m3i s ILE 471 CO 0.84 0.00 0.35 -0.55 -1.91 0.00 0.00 174.94 173.67 1m3i s SER 472 N 0.76 1.42 -0.14 4.50 0.15 -1.26 -1.06 113.70 118.06 1m3i s SER 472 Ca -0.03 -1.65 -0.04 0.00 0.70 0.00 0.00 55.95 54.93 1m3i s SER 472 Cb -0.05 0.43 -0.03 0.00 -1.71 0.00 0.00 66.02 64.66 1m3i s SER 472 CO -0.06 -0.27 -0.02 -1.61 1.20 0.00 0.00 173.24 172.49 1m3i s GLU 473 N 1.39 3.58 0.06 5.44 0.41 0.50 -5.00 118.70 125.08 1m3i s GLU 473 Ca 0.17 -0.47 0.06 0.00 -0.41 0.00 0.00 54.97 54.32 1m3i s GLU 473 Cb -0.16 -2.93 -0.04 0.00 -1.78 0.00 0.00 34.13 29.22 1m3i s GLU 473 CO -0.03 0.34 -0.12 0.71 -0.49 0.00 0.00 175.26 175.67 1m3i s TYR 474 N 0.11 2.72 -1.16 1.61 1.51 -1.26 -0.93 117.35 119.95 1m3i s TYR 474 Ca 0.00 -0.16 -0.22 0.00 -1.01 0.00 0.00 57.07 55.68 1m3i s TYR 474 Cb -0.13 -1.49 -0.00 0.00 -0.11 0.00 0.00 41.96 40.23 1m3i s TYR 474 CO 0.02 0.36 0.77 -0.25 -1.11 0.00 0.00 175.55 175.34 1m3i n ASP 475 N 1.19 -4.96 -4.74 2.29 8.00 -0.57 -4.90 116.55 112.86 1m3i n ASP 475 Ca -0.15 -1.06 -0.41 0.00 0.71 0.00 0.00 54.79 53.89 1m3i n ASP 475 Cb 0.52 -3.13 -0.04 0.00 -0.02 0.00 0.00 41.12 38.45 1m3i n ASP 475 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1m3i s VAL 476 N -3.49 3.90 -0.10 2.53 1.01 0.69 -4.80 120.40 120.15 1m3i s VAL 476 Ca 0.46 1.73 -0.30 0.00 0.00 0.00 0.00 61.98 63.88 1m3i s VAL 476 Cb -0.18 -4.10 -0.02 0.00 0.00 0.00 0.00 36.38 32.08 1m3i s VAL 476 CO 0.88 0.34 1.07 -2.16 0.00 0.00 0.00 175.10 175.23 1m3i s PRO 477 N -0.69 4.39 -0.07 2.72 0.04 -1.26 -3.83 135.00 136.30 1m3i s PRO 477 Ca 0.47 1.48 -0.33 0.00 0.04 0.00 0.00 61.00 62.66 1m3i s PRO 477 Cb -0.29 -3.55 -0.11 0.00 0.04 0.00 0.00 34.50 30.60 1m3i s PRO 477 CO 0.35 -0.37 1.94 -0.11 0.04 0.00 0.00 177.00 178.85 1m3i n LEU 478 N 5.14 3.60 -4.28 -3.56 7.94 -1.26 -4.96 117.00 119.61 1m3i n LEU 478 Ca 0.10 0.89 -0.17 0.00 -1.11 0.00 0.00 56.01 55.71 1m3i n LEU 478 Cb 0.48 -1.42 -0.09 0.00 0.53 0.00 0.00 43.42 42.92 1m3i n LEU 478 CO 0.53 -0.04 -0.17 0.42 -1.11 0.00 0.00 177.39 177.02 1m3i s THR 479 N 4.57 0.10 0.25 1.96 -4.23 -1.26 -5.02 115.64 112.01 1m3i s THR 479 Ca 0.93 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 59.38 1m3i s THR 479 Cb -0.61 -2.50 0.25 0.00 1.34 0.00 0.00 72.50 70.99 1m3i s THR 479 CO 0.48 0.00 1.92 0.78 -0.54 0.00 0.00 174.62 177.26 1m3i h ASN 480 N 2.29 1.11 -2.96 3.99 2.35 -1.65 -3.32 115.58 117.40 1m3i h ASN 480 Ca -0.31 -0.02 -0.34 0.00 -0.55 0.00 0.00 56.30 55.08 1m3i h ASN 480 Cb 1.24 -0.27 -0.37 0.00 0.05 0.00 0.00 38.32 38.97 1m3i h ASN 480 CO 0.46 0.79 -0.66 0.20 -1.65 0.00 0.00 177.43 176.56 1m3i s ASN 481 N -6.05 1.24 -0.44 5.81 0.01 -1.17 -2.35 114.94 111.99 1m3i s ASN 481 Ca -0.13 -0.01 -0.12 0.00 -0.71 0.00 0.00 52.86 51.90 1m3i s ASN 481 Cb 0.18 0.17 0.07 0.00 0.41 0.00 0.00 41.25 42.09 1m3i s ASN 481 CO 0.82 -0.29 0.32 -0.63 -1.51 0.00 0.00 177.10 175.81 1m3i s ILE 482 N 2.26 4.67 -0.56 0.60 1.01 -0.53 -1.11 121.20 127.54 1m3i s ILE 482 Ca 0.04 -1.24 -0.19 0.00 0.00 0.00 0.00 60.65 59.26 1m3i s ILE 482 Cb -0.14 -3.82 0.09 0.00 0.01 0.00 0.00 42.46 38.60 1m3i s ILE 482 CO -0.08 -0.53 0.68 0.20 0.00 0.00 0.00 174.94 175.21 1m3i s ASN 483 N 2.32 6.19 -0.12 3.58 0.02 0.13 -0.12 114.94 126.95 1m3i s ASN 483 Ca 0.03 -1.27 -0.04 0.00 -1.02 0.00 0.00 52.86 50.57 1m3i s ASN 483 Cb -0.23 -2.30 -0.03 0.00 0.02 0.00 0.00 41.25 38.70 1m3i s ASN 483 CO 0.04 -1.04 0.02 -0.69 0.02 0.00 0.00 177.10 175.45 1m3i s VAL 484 N 2.66 4.45 -0.20 1.60 1.01 0.05 0.12 120.40 130.08 1m3i s VAL 484 Ca 0.12 -0.18 -0.10 0.00 0.00 0.00 0.00 61.98 61.82 1m3i s VAL 484 Cb -0.23 -2.91 0.07 0.00 0.00 0.00 0.00 36.38 33.31 1m3i s VAL 484 CO 0.08 0.56 0.47 -0.94 0.00 0.00 0.00 175.10 175.28 1m3i s SER 485 N -0.48 -0.58 0.17 3.32 1.04 -0.48 -1.65 113.70 115.03 1m3i s SER 485 Ca 0.09 1.05 0.06 0.00 0.48 0.00 0.00 55.95 57.64 1m3i s SER 485 Cb -0.12 1.04 -0.04 0.00 0.10 0.00 0.00 66.02 67.00 1m3i s SER 485 CO 0.02 -0.21 0.05 0.27 0.98 0.00 0.00 173.24 174.35 1m3i s ILE 486 N 1.70 4.00 0.00 -1.02 -4.36 0.07 -1.13 121.20 120.46 1m3i s ILE 486 Ca -0.08 -1.29 0.00 0.00 -0.26 0.00 0.00 60.65 59.02 1m3i s ILE 486 Cb -0.08 -3.02 0.00 0.00 1.25 0.00 0.00 42.46 40.61 1m3i s ILE 486 CO -0.14 -0.10 0.00 -2.67 0.24 0.00 0.00 174.94 172.26 1m3i n TRP 487 N -0.17 0.00 -2.89 1.37 2.14 -0.09 -1.91 117.44 115.88 1m3i n TRP 487 Ca -0.09 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.48 1m3i n TRP 487 Cb 0.55 0.00 0.00 0.00 -0.81 0.00 0.00 31.31 31.05 1m3i n TRP 487 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1m3i n GLY 488 N 0.00 -1.75 3.73 -1.67 0.00 -1.26 -0.75 105.19 103.49 1m3i n GLY 488 Ca 0.00 -1.54 -0.26 0.00 0.00 0.00 0.00 46.02 44.21 1m3i n GLY 488 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m3i s THR 489 N 0.00 2.05 0.22 2.61 -4.23 -0.62 -0.71 115.64 114.95 1m3i s THR 489 Ca 0.00 -1.78 -0.08 0.00 -1.18 0.00 0.00 61.69 58.65 1m3i s THR 489 Cb 0.00 -2.83 0.15 0.00 1.34 0.00 0.00 72.50 71.17 1m3i s THR 489 CO 0.00 0.00 1.79 0.74 -0.54 0.00 0.00 174.62 176.61 1m3i h THR 490 N 1.43 0.92 0.01 3.99 2.02 -1.94 -0.02 112.91 119.31 1m3i h THR 490 Ca -0.43 -0.22 -0.19 0.00 0.77 0.00 0.00 66.41 66.34 1m3i h THR 490 Cb 1.26 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 1m3i h THR 490 CO 0.72 0.12 -0.89 -0.07 0.37 0.00 0.00 175.52 175.77 1m3i h LEU 491 N 0.64 0.16 -6.13 2.58 3.38 -1.95 -3.37 115.31 110.62 1m3i h LEU 491 Ca 0.32 -0.14 -0.58 0.00 0.09 0.00 0.00 57.88 57.57 1m3i h LEU 491 Cb 0.26 -0.05 -0.41 0.00 0.09 0.00 0.00 40.66 40.55 1m3i h LEU 491 CO -0.22 0.96 -0.83 -1.22 0.09 0.00 0.00 178.44 177.23 1m3i n TYR 492 N -3.60 1.77 -1.93 1.13 4.02 -0.84 -5.10 117.16 112.61 1m3i n TYR 492 Ca -0.03 -3.88 -0.32 0.00 -0.01 0.00 0.00 57.90 53.66 1m3i n TYR 492 Cb 0.82 -0.45 0.02 0.00 -0.02 0.00 0.00 39.34 39.71 1m3i n TYR 492 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 1m3i s PRO 493 N -1.83 3.27 0.27 -0.72 0.02 -0.08 -1.59 135.00 134.33 1m3i s PRO 493 Ca 0.37 1.10 0.02 0.00 0.02 0.00 0.00 61.00 62.52 1m3i s PRO 493 Cb 0.15 -2.03 -0.04 0.00 0.02 0.00 0.00 34.50 32.60 1m3i s PRO 493 CO -0.06 -0.84 0.17 0.20 -0.33 0.00 0.00 177.00 176.14 1m3i s GLY 494 N -3.14 1.86 -0.21 0.52 0.00 0.07 -4.86 107.32 101.57 1m3i s GLY 494 Ca 0.61 -1.81 -0.35 0.00 0.00 0.00 0.00 44.72 43.17 1m3i s GLY 494 CO 0.42 -1.49 1.24 -1.35 0.00 0.00 0.00 173.10 171.92 1m3i s SER 495 N -3.29 -0.12 0.04 1.64 1.04 -1.26 -0.92 113.70 110.84 1m3i s SER 495 Ca 0.38 0.01 -0.23 0.00 0.48 0.00 0.00 55.95 56.59 1m3i s SER 495 Cb 0.05 0.12 0.05 0.00 0.10 0.00 0.00 66.02 66.35 1m3i s SER 495 CO 0.17 -0.19 0.52 -0.94 0.98 0.00 0.00 173.24 173.79 1m3i s SER 496 N -2.08 -0.44 -0.06 7.02 1.04 -0.28 -4.99 113.70 113.91 1m3i s SER 496 Ca 0.10 0.20 0.01 0.00 0.48 0.00 0.00 55.95 56.73 1m3i s SER 496 Cb -0.01 0.49 0.02 0.00 0.10 0.00 0.00 66.02 66.62 1m3i s SER 496 CO -0.04 -0.70 -0.05 -0.51 0.98 0.00 0.00 173.24 172.92 1m3i s ILE 497 N -2.34 0.61 0.28 -1.02 2.07 -1.25 -1.39 121.20 118.16 1m3i s ILE 497 Ca -0.06 -0.12 0.06 0.00 -1.41 0.00 0.00 60.65 59.12 1m3i s ILE 497 Cb -0.01 -0.65 -0.06 0.00 0.13 0.00 0.00 42.46 41.88 1m3i s ILE 497 CO -0.01 0.26 -0.05 -0.89 -1.91 0.00 0.00 174.94 172.34 1m3i s THR 498 N 1.17 1.59 0.25 4.00 2.01 0.12 -4.94 115.64 119.83 1m3i s THR 498 Ca -0.07 -2.11 0.07 0.00 0.31 0.00 0.00 61.69 59.89 1m3i s THR 498 Cb -0.14 -2.46 -0.05 0.00 0.01 0.00 0.00 72.50 69.85 1m3i s THR 498 CO -0.01 -0.28 -0.09 -0.31 -0.69 0.00 0.00 174.62 173.23 1m3i s TYR 499 N -3.05 1.85 0.00 4.92 1.51 -1.26 0.21 117.35 121.53 1m3i s TYR 499 Ca 0.30 -0.65 0.00 0.00 -1.01 0.00 0.00 57.07 55.71 1m3i s TYR 499 Cb 0.04 -0.98 0.00 0.00 -0.11 0.00 0.00 41.96 40.92 1m3i s TYR 499 CO 0.12 0.31 0.00 0.09 -1.11 0.00 0.00 175.55 174.96