#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 4.98 0.00 2.61 0.15 -1.26 -1.46 113.70 118.73 1m3i s SER 37 Ca 0.00 -0.19 0.00 0.00 0.70 0.00 0.00 55.95 56.46 1m3i s SER 37 Cb 0.00 -1.17 0.00 0.00 -1.71 0.00 0.00 66.02 63.14 1m3i s SER 37 CO 0.00 0.18 0.14 -0.38 1.20 0.00 0.00 173.24 174.37 1m3i n ILE 38 N 0.58 0.00 1.72 6.45 5.41 -1.26 0.83 119.36 133.09 1m3i n ILE 38 Ca -0.11 0.22 0.08 0.00 1.00 0.00 0.00 62.75 63.94 1m3i n ILE 38 Cb 0.52 -0.30 0.40 0.00 -0.71 0.00 0.00 39.64 39.56 1m3i n ILE 38 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1m3i n ASP 39 N -1.74 0.57 0.03 4.38 10.43 -1.26 -3.50 116.55 125.46 1m3i n ASP 39 Ca 0.00 -1.61 -0.03 0.00 2.57 0.00 0.00 54.79 55.72 1m3i n ASP 39 Cb 0.00 -0.04 -0.01 0.00 1.84 0.00 0.00 41.12 42.90 1m3i n ASP 39 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 1m3i h SER 40 N 0.73 -0.16 -0.01 -2.24 0.02 0.04 -3.32 113.55 108.62 1m3i h SER 40 Ca 0.00 0.01 -0.23 0.00 -0.84 0.00 0.00 61.79 60.73 1m3i h SER 40 Cb 0.16 0.04 0.01 0.00 0.14 0.00 0.00 62.40 62.75 1m3i h SER 40 CO 0.00 0.30 -0.85 1.23 -1.14 0.00 0.00 176.83 176.37 1m3i h GLY 41 N -1.01 0.75 0.04 -3.77 0.00 -1.69 -3.34 103.07 94.04 1m3i h GLY 41 Ca -0.02 -1.14 0.17 0.00 0.00 0.00 0.00 47.33 46.34 1m3i h GLY 41 CO 0.03 1.01 0.37 -2.22 0.00 0.00 0.00 176.54 175.73 1m3i h ILE 42 N 0.44 0.61 -0.23 2.60 2.04 -1.74 -2.20 117.51 119.03 1m3i h ILE 42 Ca -0.07 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1m3i h ILE 42 Cb 1.48 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 1m3i h ILE 42 CO 0.17 0.09 0.00 -1.54 0.00 0.00 0.00 178.15 176.86 1m3i n SER 43 N -4.98 1.55 -0.95 1.72 3.41 -1.25 -3.86 113.62 109.26 1m3i n SER 43 Ca 0.18 -2.07 0.03 0.00 -0.26 0.00 0.00 58.87 56.75 1m3i n SER 43 Cb 0.51 -0.25 0.03 0.00 -0.26 0.00 0.00 64.21 64.23 1m3i n SER 43 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1m3i n SER 44 N 0.20 0.68 -4.89 4.04 7.64 -0.83 -5.10 113.62 115.35 1m3i n SER 44 Ca 0.08 -2.16 -0.29 0.00 1.01 0.00 0.00 58.87 57.51 1m3i n SER 44 Cb 0.28 -0.28 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 1m3i n SER 44 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1m3i s LEU 45 N -0.32 3.25 -0.72 -3.43 1.43 -1.22 -5.05 118.68 112.62 1m3i s LEU 45 Ca 0.19 1.13 0.05 0.00 -1.03 0.00 0.00 54.13 54.47 1m3i s LEU 45 Cb 0.22 -4.06 0.18 0.00 0.03 0.00 0.00 46.19 42.56 1m3i s LEU 45 CO -0.08 -0.94 0.56 -1.54 0.23 0.00 0.00 176.35 174.58 1m3i n SER 46 N -2.67 3.24 -3.99 2.29 3.41 -1.26 -5.05 113.62 109.59 1m3i n SER 46 Ca 0.05 -3.25 -0.20 0.00 -0.26 0.00 0.00 58.87 55.22 1m3i n SER 46 Cb 0.56 -0.77 -0.15 0.00 -0.26 0.00 0.00 64.21 63.58 1m3i n SER 46 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1m3i s TYR 47 N -1.63 0.86 -0.45 7.33 -0.85 -1.26 -4.97 117.35 116.39 1m3i s TYR 47 Ca 0.27 -0.20 -0.18 0.00 -0.52 0.00 0.00 57.07 56.44 1m3i s TYR 47 Cb -0.02 -0.61 0.04 0.00 0.38 0.00 0.00 41.96 41.75 1m3i s TYR 47 CO -0.14 -0.08 0.51 1.21 -1.52 0.00 0.00 175.55 175.52 1m3i s ASN 48 N 0.15 6.21 0.30 -0.18 3.84 -1.26 -4.95 114.94 119.04 1m3i s ASN 48 Ca -0.02 -0.78 0.06 0.00 0.21 0.00 0.00 52.86 52.33 1m3i s ASN 48 Cb -0.07 -2.25 0.79 0.00 -0.55 0.00 0.00 41.25 39.17 1m3i s ASN 48 CO 0.00 -0.69 1.69 0.03 -2.79 0.00 0.00 177.10 175.34 1m3i h ARG 49 N 8.82 0.39 0.00 0.43 -0.00 -1.99 0.42 114.38 122.45 1m3i h ARG 49 Ca -0.27 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.19 1m3i h ARG 49 Cb 1.10 -0.09 0.00 0.00 0.00 0.00 0.00 29.97 30.99 1m3i h ARG 49 CO 0.86 0.26 0.00 0.09 0.00 0.00 0.00 179.97 181.18 1m3i n ASN 50 N -5.04 0.30 0.00 7.04 4.13 -1.26 -3.56 115.26 116.87 1m3i n ASN 50 Ca 0.24 0.60 0.00 0.00 1.68 0.00 0.00 54.58 57.10 1m3i n ASN 50 Cb 0.71 -0.65 0.00 0.00 -1.54 0.00 0.00 39.78 38.30 1m3i n ASN 50 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1m3i n GLU 51 N -1.86 2.49 0.00 3.52 1.02 0.12 -4.70 120.64 121.23 1m3i n GLU 51 Ca 0.01 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.24 1m3i n GLU 51 Cb 0.12 -0.94 0.37 0.00 -0.02 0.00 0.00 31.44 30.98 1m3i n GLU 51 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1m3i n VAL 52 N -1.63 0.79 -2.03 2.62 0.24 0.26 -2.88 118.33 115.70 1m3i n VAL 52 Ca 0.00 0.20 -0.22 0.00 -2.04 0.00 0.00 64.34 62.28 1m3i n VAL 52 Cb 0.28 -0.90 0.03 0.00 -1.47 0.00 0.00 33.84 31.77 1m3i n VAL 52 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1m3i n LEU 53 N -1.48 4.73 -4.93 1.34 4.77 -1.25 -4.67 117.00 115.51 1m3i n LEU 53 Ca 0.04 -4.66 -0.25 0.00 -0.03 0.00 0.00 56.01 51.12 1m3i n LEU 53 Cb 0.20 -0.32 -0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1m3i n LEU 53 CO 0.16 2.05 0.28 0.00 -1.33 0.00 0.00 177.39 178.55 1m3i s ALA 54 N -3.59 3.62 -0.10 -1.18 0.00 -1.14 0.05 121.76 119.42 1m3i s ALA 54 Ca 0.50 -0.83 0.02 0.00 0.00 0.00 0.00 51.96 51.65 1m3i s ALA 54 Cb 0.41 -2.26 0.01 0.00 0.00 0.00 0.00 23.12 21.28 1m3i s ALA 54 CO 0.03 -0.21 -0.15 -1.54 0.00 0.00 0.00 175.76 173.89 1m3i s SER 55 N -4.10 2.38 -0.05 0.00 1.04 0.14 -4.82 113.70 108.28 1m3i s SER 55 Ca 0.44 -0.41 -0.29 0.00 0.48 0.00 0.00 55.95 56.16 1m3i s SER 55 Cb -0.10 -1.07 -0.07 0.00 0.10 0.00 0.00 66.02 64.88 1m3i s SER 55 CO 0.39 0.03 1.94 0.21 0.98 0.00 0.00 173.24 176.78 1m3i s ASN 56 N 0.90 6.28 -0.30 7.02 3.04 -1.26 -4.07 114.94 126.55 1m3i s ASN 56 Ca -0.09 2.35 -0.16 0.00 0.04 0.00 0.00 52.86 55.01 1m3i s ASN 56 Cb -0.15 -2.53 -0.03 0.00 -1.54 0.00 0.00 41.25 37.00 1m3i s ASN 56 CO -0.00 -1.23 0.40 -0.83 -3.04 0.00 0.00 177.10 172.40 1m3i s GLY 57 N 5.01 1.87 -0.01 1.21 0.00 -1.12 -4.97 107.32 109.32 1m3i s GLY 57 Ca 0.87 -0.92 -0.37 0.00 0.00 0.00 0.00 44.72 44.30 1m3i s GLY 57 CO 0.37 1.04 1.51 2.09 0.00 0.00 0.00 173.10 178.12 1m3i n ASP 58 N 5.42 2.14 -4.41 1.64 5.68 -1.26 -4.77 116.55 120.99 1m3i n ASP 58 Ca -0.08 1.09 -0.36 0.00 -0.50 0.00 0.00 54.79 54.94 1m3i n ASP 58 Cb 0.50 -1.22 -0.13 0.00 -1.14 0.00 0.00 41.12 39.13 1m3i n ASP 58 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1m3i s LYS 59 N 1.57 3.51 0.40 0.11 1.02 -1.26 -3.78 119.74 121.31 1m3i s LYS 59 Ca 0.88 -0.57 0.08 0.00 0.02 0.00 0.00 55.97 56.37 1m3i s LYS 59 Cb -0.93 -3.29 -0.08 0.00 -0.52 0.00 0.00 37.83 33.01 1m3i s LYS 59 CO 0.51 -0.24 -0.00 0.42 -0.92 0.00 0.00 175.35 175.11 1m3i s ILE 60 N 1.58 2.07 0.19 2.17 -1.09 -1.26 -5.12 121.20 119.73 1m3i s ILE 60 Ca 0.06 -2.03 0.04 0.00 -2.23 0.00 0.00 60.65 56.49 1m3i s ILE 60 Cb -0.15 -2.93 -0.02 0.00 -1.58 0.00 0.00 42.46 37.78 1m3i s ILE 60 CO 0.02 -0.04 0.16 1.21 -1.23 0.00 0.00 174.94 175.06 1m3i n GLU 61 N -0.95 0.23 0.00 2.79 4.07 -1.26 -5.07 120.64 120.46 1m3i n GLU 61 Ca -0.05 -1.90 0.00 0.00 -0.06 0.00 0.00 57.16 55.15 1m3i n GLU 61 Cb 0.66 1.56 0.00 0.00 -0.06 0.00 0.00 31.44 33.60 1m3i n GLU 61 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1m3i n SER 62 N -2.25 0.00 -3.76 4.31 3.41 -1.26 -5.04 113.62 109.03 1m3i n SER 62 Ca 0.04 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.56 1m3i n SER 62 Cb 0.34 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.23 1m3i n SER 62 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1m3i s PHE 63 N 0.00 -0.03 -0.11 7.33 -0.00 -1.26 -5.15 117.98 118.76 1m3i s PHE 63 Ca 0.00 -0.30 -0.10 0.00 -0.00 0.00 0.00 56.93 56.52 1m3i s PHE 63 Cb 0.00 0.08 -0.05 0.00 -0.00 0.00 0.00 43.02 43.06 1m3i s PHE 63 CO 0.00 -0.59 0.22 0.14 -0.00 0.00 0.00 175.22 175.00 1m3i s VAL 64 N -3.56 5.36 0.15 -2.49 -7.23 -1.26 -5.01 120.40 106.36 1m3i s VAL 64 Ca 0.02 0.40 -0.18 0.00 -1.81 0.00 0.00 61.98 60.42 1m3i s VAL 64 Cb 0.03 -3.52 0.03 0.00 0.56 0.00 0.00 36.38 33.48 1m3i s VAL 64 CO -0.10 0.55 1.70 -0.65 -0.31 0.00 0.00 175.10 176.29 1m3i h PRO 65 N 5.44 0.07 -5.09 4.82 0.11 -1.82 -3.39 132.00 132.13 1m3i h PRO 65 Ca -0.50 -0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.06 1m3i h PRO 65 Cb 1.21 -0.02 -0.32 0.00 0.11 0.00 0.00 31.00 31.98 1m3i h PRO 65 CO 0.64 0.05 -0.83 0.21 -0.21 0.00 0.00 178.00 177.86 1m3i s LYS 66 N -6.19 1.72 0.00 1.05 2.20 -1.26 0.08 119.74 117.34 1m3i s LYS 66 Ca -0.13 -0.55 0.00 0.00 -0.36 0.00 0.00 55.97 54.93 1m3i s LYS 66 Cb 0.12 -1.48 0.00 0.00 -1.51 0.00 0.00 37.83 34.97 1m3i s LYS 66 CO 0.70 0.19 0.00 -1.91 -0.36 0.00 0.00 175.35 173.97 1m3i n GLU 67 N 3.29 0.00 -0.83 4.03 4.07 0.11 -4.45 120.64 126.85 1m3i n GLU 67 Ca -0.19 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.91 1m3i n GLU 67 Cb 0.53 -0.20 0.00 0.00 -0.06 0.00 0.00 31.44 31.71 1m3i n GLU 67 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1m3i n GLY 68 N 2.52 -2.95 3.32 8.31 0.00 -1.20 -4.60 105.19 110.59 1m3i n GLY 68 Ca 0.00 -0.65 -0.15 0.00 0.00 0.00 0.00 46.02 45.23 1m3i n GLY 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1m3i s LYS 69 N -2.27 0.78 -0.26 1.61 -2.85 0.21 -4.93 119.74 112.03 1m3i s LYS 69 Ca 0.00 -0.07 -0.05 0.00 -1.00 0.00 0.00 55.97 54.85 1m3i s LYS 69 Cb 0.00 0.35 0.01 0.00 -2.06 0.00 0.00 37.83 36.13 1m3i s LYS 69 CO 0.00 -0.23 0.02 0.21 0.10 0.00 0.00 175.35 175.45 1m3i s LYS 70 N -1.31 3.14 -0.92 1.78 2.20 -1.26 0.30 119.74 123.66 1m3i s LYS 70 Ca -0.13 -0.80 -0.02 0.00 -0.36 0.00 0.00 55.97 54.66 1m3i s LYS 70 Cb -0.04 -3.20 0.24 0.00 -1.51 0.00 0.00 37.83 33.32 1m3i s LYS 70 CO 0.06 -0.36 0.91 0.00 -0.36 0.00 0.00 175.35 175.60 1m3i n ALA 71 N 4.81 4.07 -0.17 3.13 0.00 -0.06 -4.94 120.51 127.36 1m3i n ALA 71 Ca -0.16 -4.66 0.00 0.00 0.00 0.00 0.00 53.44 48.63 1m3i n ALA 71 Cb 0.49 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 18.17 1m3i n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m3i n GLY 72 N 2.02 2.11 2.07 0.00 0.00 -1.26 -2.88 105.19 107.26 1m3i n GLY 72 Ca 0.24 -0.27 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 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 9.66 4.59 -4.15 1.61 2.04 -1.26 -4.91 115.26 122.83 1m3i n ASN 73 Ca 0.00 -3.40 -0.10 0.00 -0.44 0.00 0.00 54.58 50.64 1m3i n ASN 73 Cb 0.00 -0.84 -0.10 0.00 -2.53 0.00 0.00 39.78 36.31 1m3i n ASN 73 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1m3i s LYS 74 N -2.87 0.83 -0.25 -3.83 -0.14 -1.14 -2.90 119.74 109.45 1m3i s LYS 74 Ca 0.49 -1.35 -0.02 0.00 -1.36 0.00 0.00 55.97 53.73 1m3i s LYS 74 Cb 0.41 -0.01 0.08 0.00 -1.68 0.00 0.00 37.83 36.62 1m3i s LYS 74 CO 0.07 -0.11 0.06 0.12 -0.76 0.00 0.00 175.35 174.73 1m3i s PHE 75 N -3.79 1.27 -0.39 3.18 5.36 -0.02 -0.88 117.98 122.70 1m3i s PHE 75 Ca 0.14 -1.21 -0.21 0.00 -0.96 0.00 0.00 56.93 54.69 1m3i s PHE 75 Cb 0.07 -1.28 0.01 0.00 -0.34 0.00 0.00 43.02 41.47 1m3i s PHE 75 CO -0.04 -0.73 0.69 0.42 -1.46 0.00 0.00 175.22 174.10 1m3i s ILE 76 N 1.77 4.80 -0.33 3.12 -1.09 0.86 -1.68 121.20 128.66 1m3i s ILE 76 Ca 0.03 0.52 -0.08 0.00 -2.23 0.00 0.00 60.65 58.89 1m3i s ILE 76 Cb -0.17 -4.17 0.02 0.00 -1.58 0.00 0.00 42.46 36.56 1m3i s ILE 76 CO -0.17 -0.47 0.13 -0.69 -1.23 0.00 0.00 174.94 172.52 1m3i s VAL 77 N 2.91 4.14 -0.08 2.92 1.01 0.17 0.67 120.40 132.14 1m3i s VAL 77 Ca 0.26 -0.84 0.03 0.00 0.00 0.00 0.00 61.98 61.42 1m3i s VAL 77 Cb -0.14 -3.24 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 1m3i s VAL 77 CO 0.17 -0.09 -0.16 -0.69 0.00 0.00 0.00 175.10 174.34 1m3i s VAL 78 N 1.50 2.87 0.05 2.92 1.01 -1.26 0.53 120.40 128.01 1m3i s VAL 78 Ca 0.01 -0.77 0.06 0.00 0.00 0.00 0.00 61.98 61.29 1m3i s VAL 78 Cb -0.18 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1m3i s VAL 78 CO 0.04 0.56 -0.13 -1.61 0.00 0.00 0.00 175.10 173.96 1m3i s GLU 79 N -0.23 2.19 0.09 2.72 2.02 0.66 0.04 118.70 126.19 1m3i s GLU 79 Ca 0.00 -0.93 0.10 0.00 0.02 0.00 0.00 54.97 54.16 1m3i s GLU 79 Cb -0.13 -2.29 -0.03 0.00 0.10 0.00 0.00 34.13 31.78 1m3i s GLU 79 CO 0.03 0.55 -0.26 1.03 0.02 0.00 0.00 175.26 176.63 1m3i s ARG 80 N -1.63 1.54 -0.12 1.61 0.52 0.11 -0.96 118.95 120.02 1m3i s ARG 80 Ca 0.17 -1.20 -0.05 0.00 -0.52 0.00 0.00 55.73 54.13 1m3i s ARG 80 Cb -0.11 -1.86 0.06 0.00 0.52 0.00 0.00 34.95 33.57 1m3i s ARG 80 CO 0.08 0.46 0.25 -1.14 0.02 0.00 0.00 175.30 174.97 1m3i s GLN 81 N -1.64 0.14 0.40 3.54 0.74 -1.05 -4.72 119.66 117.07 1m3i s GLN 81 Ca 0.12 0.72 -0.27 0.00 0.05 0.00 0.00 55.36 55.98 1m3i s GLN 81 Cb -0.10 -0.07 -0.09 0.00 1.10 0.00 0.00 33.01 33.85 1m3i s GLN 81 CO 0.04 -0.28 1.41 0.21 -0.55 0.00 0.00 175.29 176.12 1m3i s LYS 82 N 2.34 3.96 -0.13 1.67 2.20 -1.26 -0.85 119.74 127.67 1m3i s LYS 82 Ca 0.01 2.40 -0.08 0.00 -0.36 0.00 0.00 55.97 57.94 1m3i s LYS 82 Cb -0.12 -2.83 0.05 0.00 -1.51 0.00 0.00 37.83 33.42 1m3i s LYS 82 CO -0.08 -0.59 0.32 1.03 -0.36 0.00 0.00 175.35 175.67 1m3i s ARG 83 N -2.21 0.31 0.15 4.03 1.81 -0.71 -4.87 118.95 117.46 1m3i s ARG 83 Ca 0.56 0.60 0.03 0.00 -1.72 0.00 0.00 55.73 55.20 1m3i s ARG 83 Cb -0.43 -0.01 -0.04 0.00 -0.45 0.00 0.00 34.95 34.02 1m3i s ARG 83 CO 0.57 -0.13 0.26 -1.12 -0.68 0.00 0.00 175.30 174.20 1m3i s SER 84 N 1.05 6.22 -0.15 0.23 0.01 -1.26 -1.63 113.70 118.18 1m3i s SER 84 Ca -0.07 0.13 -0.16 0.00 1.31 0.00 0.00 55.95 57.16 1m3i s SER 84 Cb -0.08 -1.84 0.04 0.00 0.21 0.00 0.00 66.02 64.35 1m3i s SER 84 CO -0.08 0.06 0.43 -0.22 0.41 0.00 0.00 173.24 173.84 1m3i s LEU 85 N -3.20 0.35 -0.23 2.44 2.96 -0.52 -5.00 118.68 115.47 1m3i s LEU 85 Ca 0.34 0.80 -0.03 0.00 -0.22 0.00 0.00 54.13 55.02 1m3i s LEU 85 Cb -0.11 1.51 0.12 0.00 0.50 0.00 0.00 46.19 48.21 1m3i s LEU 85 CO 0.28 -0.20 0.30 -0.89 -1.32 0.00 0.00 176.35 174.52 1m3i s THR 86 N 0.03 -0.46 -0.08 3.68 2.01 -1.26 -1.42 115.64 118.16 1m3i s THR 86 Ca -0.02 -0.13 0.05 0.00 0.31 0.00 0.00 61.69 61.90 1m3i s THR 86 Cb -0.03 -0.77 -0.01 0.00 0.01 0.00 0.00 72.50 71.70 1m3i s THR 86 CO 0.01 -0.19 -0.25 0.42 -0.69 0.00 0.00 174.62 173.92 1m3i s THR 87 N 2.43 2.06 -0.67 -0.82 -4.23 -0.07 -4.95 115.64 109.40 1m3i s THR 87 Ca 0.10 -1.05 0.05 0.00 -1.18 0.00 0.00 61.69 59.61 1m3i s THR 87 Cb -0.15 -1.76 0.17 0.00 1.34 0.00 0.00 72.50 72.10 1m3i s THR 87 CO -0.16 0.57 0.50 -1.20 -0.54 0.00 0.00 174.62 173.78 1m3i n SER 88 N 3.18 2.70 -4.86 3.99 7.64 -1.25 -0.71 113.62 124.31 1m3i n SER 88 Ca -0.18 -3.14 -0.30 0.00 1.01 0.00 0.00 58.87 56.26 1m3i n SER 88 Cb 0.52 -0.73 0.05 0.00 -1.01 0.00 0.00 64.21 63.04 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 -1.37 2.81 -0.10 1.43 0.04 -1.05 -4.65 135.00 132.11 1m3i s PRO 89 Ca 0.27 0.56 0.02 0.00 0.04 0.00 0.00 61.00 61.88 1m3i s PRO 89 Cb -0.02 -2.01 -0.07 0.00 0.04 0.00 0.00 34.50 32.44 1m3i s PRO 89 CO -0.17 -1.09 -0.07 1.33 0.04 0.00 0.00 177.00 177.04 1m3i n VAL 90 N -3.06 0.57 -1.54 -0.36 0.24 -1.26 0.12 118.33 113.04 1m3i n VAL 90 Ca 0.07 -0.24 -0.33 0.00 -2.04 0.00 0.00 64.34 61.80 1m3i n VAL 90 Cb 0.56 -0.85 0.07 0.00 -1.47 0.00 0.00 33.84 32.16 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 -4.83 4.62 -0.02 -1.34 3.68 -1.26 -4.50 116.67 113.01 1m3i s ASP 91 Ca -0.12 2.11 0.00 0.00 2.13 0.00 0.00 52.55 56.67 1m3i s ASP 91 Cb 0.03 -2.56 0.02 0.00 -1.45 0.00 0.00 42.92 38.96 1m3i s ASP 91 CO 0.25 -1.97 0.00 -0.63 0.13 0.00 0.00 175.17 172.96 1m3i s ILE 92 N -2.30 0.11 -0.01 4.11 1.01 0.64 -4.90 121.20 119.86 1m3i s ILE 92 Ca 0.69 0.09 -0.30 0.00 0.00 0.00 0.00 60.65 61.13 1m3i s ILE 92 Cb -0.23 -0.19 -0.06 0.00 0.01 0.00 0.00 42.46 41.99 1m3i s ILE 92 CO 0.45 0.11 1.47 -0.94 0.00 0.00 0.00 174.94 176.03 1m3i s SER 93 N 0.83 6.79 -0.56 3.58 1.04 -1.26 -1.39 113.70 122.73 1m3i s SER 93 Ca -0.08 2.17 -0.22 0.00 0.48 0.00 0.00 55.95 58.30 1m3i s SER 93 Cb -0.11 -2.56 0.06 0.00 0.10 0.00 0.00 66.02 63.51 1m3i s SER 93 CO -0.02 -0.78 0.85 -0.63 0.98 0.00 0.00 173.24 173.64 1m3i s ILE 94 N 2.75 4.53 0.26 -1.02 1.01 -0.13 -4.91 121.20 123.68 1m3i s ILE 94 Ca 0.66 -0.14 -0.04 0.00 0.00 0.00 0.00 60.65 61.14 1m3i s ILE 94 Cb -0.32 -4.50 0.29 0.00 0.01 0.00 0.00 42.46 37.93 1m3i s ILE 94 CO 0.27 -1.10 1.64 0.40 0.00 0.00 0.00 174.94 176.15 1m3i h ILE 95 N 5.96 0.34 -3.71 2.92 2.04 -1.87 -3.37 117.51 119.82 1m3i h ILE 95 Ca -0.27 -0.05 -0.63 0.00 1.00 0.00 0.00 64.86 64.90 1m3i h ILE 95 Cb 1.08 0.18 -0.15 0.00 -0.74 0.00 0.00 36.82 37.19 1m3i h ILE 95 CO 1.08 0.03 -0.24 -1.81 0.00 0.00 0.00 178.15 177.21 1m3i s ASP 96 N -5.16 6.24 -0.00 1.72 1.01 -1.26 -4.85 116.67 114.36 1m3i s ASP 96 Ca -0.13 0.19 0.00 0.00 0.71 0.00 0.00 52.55 53.33 1m3i s ASP 96 Cb 0.23 -2.21 -0.01 0.00 1.01 0.00 0.00 42.92 41.95 1m3i s ASP 96 CO 0.76 -0.22 0.01 -1.54 0.21 0.00 0.00 175.17 174.39 1m3i n SER 97 N 5.36 3.97 -0.01 0.27 3.41 -1.26 -4.59 113.62 120.77 1m3i n SER 97 Ca -0.08 -0.10 0.08 0.00 -0.26 0.00 0.00 58.87 58.50 1m3i n SER 97 Cb 0.50 1.01 -0.12 0.00 -0.26 0.00 0.00 64.21 65.35 1m3i n SER 97 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1m3i n VAL 98 N -1.42 0.00 0.10 -3.33 0.31 -1.26 -4.60 118.33 108.13 1m3i n VAL 98 Ca -0.00 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1m3i n VAL 98 Cb 0.01 0.20 0.00 0.00 -0.91 0.00 0.00 33.84 33.14 1m3i n VAL 98 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1m3i n ASN 99 N -1.98 0.28 -4.71 4.52 5.03 -1.26 -5.12 115.26 112.01 1m3i n ASN 99 Ca -0.02 0.32 -0.34 0.00 0.87 0.00 0.00 54.58 55.41 1m3i n ASN 99 Cb 0.38 0.11 0.11 0.00 -1.02 0.00 0.00 39.78 39.37 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 -5.27 3.91 -0.04 6.41 2.15 -1.26 -5.05 116.67 117.52 1m3i s ASP 100 Ca 0.00 2.33 0.07 0.00 0.43 0.00 0.00 52.55 55.38 1m3i s ASP 100 Cb 0.00 -2.59 -0.02 0.00 -0.30 0.00 0.00 42.92 40.02 1m3i s ASP 100 CO 0.00 -2.46 -0.25 0.00 -0.17 0.00 0.00 175.17 172.29 1m3i s ARG 101 N -4.07 2.27 -0.08 4.34 1.70 -1.26 -4.75 118.95 117.10 1m3i s ARG 101 Ca 0.73 -0.91 -0.31 0.00 -0.47 0.00 0.00 55.73 54.78 1m3i s ARG 101 Cb -0.28 -2.07 0.08 0.00 -0.57 0.00 0.00 34.95 32.12 1m3i s ARG 101 CO 0.48 0.48 0.76 0.99 -1.08 0.00 0.00 175.30 176.93 1m3i s THR 102 N -0.41 0.00 0.18 4.99 2.01 -1.26 -5.09 115.64 116.06 1m3i s THR 102 Ca 0.04 0.00 -0.10 0.00 0.31 0.00 0.00 61.69 61.94 1m3i s THR 102 Cb -0.11 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.39 1m3i s THR 102 CO 0.01 0.00 0.32 -0.72 -0.69 0.00 0.00 174.62 173.54 1m3i s TYR 103 N -1.17 0.39 0.58 4.92 -0.85 -1.26 -4.98 117.35 114.99 1m3i s TYR 103 Ca -0.09 -0.75 -0.20 0.00 -0.52 0.00 0.00 57.07 55.51 1m3i s TYR 103 Cb -0.00 -0.01 -0.04 0.00 0.38 0.00 0.00 41.96 42.29 1m3i s TYR 103 CO 0.08 -0.77 1.29 -1.25 -1.52 0.00 0.00 175.55 173.37 1m3i s PRO 104 N -3.98 3.00 0.00 -3.49 0.04 -1.26 -1.89 135.00 127.42 1m3i s PRO 104 Ca 0.19 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.27 1m3i s PRO 104 Cb 0.03 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.49 1m3i s PRO 104 CO 0.02 -1.25 0.00 0.41 0.04 0.00 0.00 177.00 176.22 1m3i n GLY 105 N 0.70 0.82 0.97 0.56 0.00 1.01 -4.92 105.19 104.32 1m3i n GLY 105 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 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 0.86 -1.40 -3.05 4.61 0.00 -0.79 -4.49 120.51 116.25 1m3i n ALA 106 Ca 0.00 -0.46 -0.17 0.00 0.00 0.00 0.00 53.44 52.81 1m3i n ALA 106 Cb 0.00 -0.04 -0.15 0.00 0.00 0.00 0.00 19.45 19.26 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 0.00 1.77 0.35 0.00 1.43 -1.26 -1.46 118.68 119.51 1m3i s LEU 107 Ca 0.20 -0.09 -0.04 0.00 -1.03 0.00 0.00 54.13 53.17 1m3i s LEU 107 Cb -0.03 -0.29 0.01 0.00 0.03 0.00 0.00 46.19 45.91 1m3i s LEU 107 CO 0.16 0.02 0.53 0.00 0.23 0.00 0.00 176.35 177.29 1m3i s GLN 108 N 0.22 1.98 0.04 1.70 -2.07 -0.88 -1.44 119.66 119.21 1m3i s GLN 108 Ca -0.02 -1.71 0.01 0.00 -1.82 0.00 0.00 55.36 51.82 1m3i s GLN 108 Cb -0.06 0.47 -0.04 0.00 -1.09 0.00 0.00 33.01 32.30 1m3i s GLN 108 CO -0.00 -0.84 0.10 -0.51 -1.32 0.00 0.00 175.29 172.71 1m3i s LEU 109 N -3.21 3.91 -1.19 2.60 1.43 -0.49 -2.14 118.68 119.59 1m3i s LEU 109 Ca 0.28 0.09 -0.06 0.00 -1.03 0.00 0.00 54.13 53.41 1m3i s LEU 109 Cb -0.01 -2.46 0.22 0.00 0.03 0.00 0.00 46.19 43.97 1m3i s LEU 109 CO 0.19 0.21 1.87 0.00 0.23 0.00 0.00 176.35 178.85 1m3i n ALA 110 N 0.73 5.75 -2.57 4.21 0.00 0.18 -4.56 120.51 124.24 1m3i n ALA 110 Ca -0.10 -4.45 -0.27 0.00 0.00 0.00 0.00 53.44 48.62 1m3i n ALA 110 Cb 0.52 -2.63 -0.08 0.00 0.00 0.00 0.00 19.45 17.25 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 -0.37 3.12 0.43 0.00 -4.77 -1.26 -4.27 116.67 109.56 1m3i s ASP 111 Ca 0.40 -1.62 0.17 0.00 -3.30 0.00 0.00 52.55 48.21 1m3i s ASP 111 Cb 0.12 0.39 1.10 0.00 -1.09 0.00 0.00 42.92 43.43 1m3i s ASP 111 CO -0.01 -0.85 1.90 0.11 0.70 0.00 0.00 175.17 177.02 1m3i h LYS 112 N 1.72 0.37 -0.75 2.11 1.57 -1.89 -1.06 116.57 118.63 1m3i h LYS 112 Ca -0.39 -0.02 0.13 0.00 -1.87 0.00 0.00 60.65 58.50 1m3i h LYS 112 Cb 1.28 -0.08 -0.09 0.00 0.08 0.00 0.00 32.23 33.42 1m3i h LYS 112 CO 0.64 0.24 0.34 0.00 -0.57 0.00 0.00 179.45 180.10 1m3i h ALA 113 N 1.63 1.07 -0.16 3.86 0.00 -1.94 0.38 119.26 124.11 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 1.02 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1m3i h ALA 113 CO -0.13 -0.14 -0.04 1.25 0.00 0.00 0.00 179.25 180.19 1m3i h LEU 114 N 0.52 0.31 -1.25 0.00 5.85 -1.33 0.40 115.31 119.81 1m3i h LEU 114 Ca 0.40 -0.37 0.16 0.00 0.84 0.00 0.00 57.88 58.91 1m3i h LEU 114 Cb 0.55 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.42 1m3i h LEU 114 CO -0.35 0.61 0.59 0.58 -0.34 0.00 0.00 178.44 179.53 1m3i h VAL 115 N 0.00 0.78 -0.00 1.05 2.07 -0.84 0.58 116.25 119.89 1m3i h VAL 115 Ca 0.04 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.33 1m3i h VAL 115 Cb 0.48 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1m3i h VAL 115 CO 0.02 0.12 0.00 -0.62 0.02 0.00 0.00 177.57 177.11 1m3i n GLU 116 N -4.60 1.00 -1.00 1.57 1.02 0.12 -4.87 120.64 113.89 1m3i n GLU 116 Ca 0.19 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 1m3i n GLU 116 Cb 0.53 -1.11 0.00 0.00 -0.02 0.00 0.00 31.44 30.84 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 -0.60 -2.63 -3.34 1.62 4.13 0.20 -4.97 115.26 109.66 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 -0.44 -0.08 0.00 -1.54 0.00 0.00 39.78 37.75 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 -2.88 1.82 -1.51 3.52 1.85 0.10 -4.72 116.66 114.85 1m3i n ARG 118 Ca 0.00 -4.12 -0.37 0.00 -1.00 0.00 0.00 57.85 52.36 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 1.10 0.71 -3.05 2.89 -0.04 -1.23 -3.98 135.00 131.40 1m3i n PRO 119 Ca 0.26 0.29 -0.44 0.00 -0.04 0.00 0.00 63.50 63.57 1m3i n PRO 119 Cb 0.45 -2.18 -0.04 0.00 -0.04 0.00 0.00 33.50 31.69 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 -1.64 4.71 -0.07 0.52 2.01 -1.26 -4.89 115.64 115.01 1m3i s THR 120 Ca 0.75 -0.86 -0.30 0.00 0.31 0.00 0.00 61.69 61.59 1m3i s THR 120 Cb -0.38 -4.54 -0.03 0.00 0.01 0.00 0.00 72.50 67.57 1m3i s THR 120 CO 0.48 -1.20 1.16 -0.63 -0.69 0.00 0.00 174.62 173.74 1m3i s ILE 121 N 2.99 4.37 -0.08 1.82 -1.09 -1.26 -1.39 121.20 126.56 1m3i s ILE 121 Ca 0.14 1.68 -0.21 0.00 -2.23 0.00 0.00 60.65 60.03 1m3i s ILE 121 Cb -0.23 -4.08 -0.04 0.00 -1.58 0.00 0.00 42.46 36.53 1m3i s ILE 121 CO 0.07 -0.01 0.60 -0.76 -1.23 0.00 0.00 174.94 173.61 1m3i s LEU 122 N 2.22 4.32 -0.37 2.97 1.43 -0.52 -4.95 118.68 123.78 1m3i s LEU 122 Ca 0.54 1.04 -0.05 0.00 -1.03 0.00 0.00 54.13 54.62 1m3i s LEU 122 Cb -0.23 -2.91 0.07 0.00 0.03 0.00 0.00 46.19 43.15 1m3i s LEU 122 CO 0.21 -0.04 0.15 -0.04 0.23 0.00 0.00 176.35 176.85 1m3i s MET 123 N 0.58 2.43 0.10 1.70 -1.94 -1.26 -4.64 119.30 116.27 1m3i s MET 123 Ca 0.32 -1.42 -0.05 0.00 -1.71 0.00 0.00 55.69 52.83 1m3i s MET 123 Cb -0.17 -3.51 -0.02 0.00 2.01 0.00 0.00 34.83 33.14 1m3i s MET 123 CO 0.15 -0.82 0.12 0.14 -0.01 0.00 0.00 175.02 174.59 1m3i s VAL 124 N 1.32 0.15 0.07 -6.03 -7.23 -1.26 -5.12 120.40 102.28 1m3i s VAL 124 Ca 0.01 -1.54 -0.31 0.00 -1.81 0.00 0.00 61.98 58.34 1m3i s VAL 124 Cb -0.21 -1.61 -0.07 0.00 0.56 0.00 0.00 36.38 35.05 1m3i s VAL 124 CO 0.00 -0.66 1.43 -0.75 -0.31 0.00 0.00 175.10 174.81 1m3i s LYS 125 N -3.93 4.29 0.12 4.82 2.20 -1.26 -4.95 119.74 121.03 1m3i s LYS 125 Ca 0.11 2.07 0.05 0.00 -0.36 0.00 0.00 55.97 57.85 1m3i s LYS 125 Cb 0.06 -3.42 -0.04 0.00 -1.51 0.00 0.00 37.83 32.93 1m3i s LYS 125 CO -0.06 -0.53 -0.13 -0.98 -0.36 0.00 0.00 175.35 173.28 1m3i s ARG 126 N 1.80 1.00 0.92 4.03 1.70 -1.26 0.08 118.95 127.22 1m3i s ARG 126 Ca 0.66 -1.25 -0.12 0.00 -0.47 0.00 0.00 55.73 54.55 1m3i s ARG 126 Cb -0.35 -0.82 0.14 0.00 -0.57 0.00 0.00 34.95 33.34 1m3i s ARG 126 CO 0.29 0.15 1.09 0.15 -1.08 0.00 0.00 175.30 175.90 1m3i s LYS 127 N -2.79 1.09 0.41 3.89 1.02 0.98 -4.67 119.74 119.67 1m3i s LYS 127 Ca 0.09 0.73 -0.24 0.00 0.02 0.00 0.00 55.97 56.57 1m3i s LYS 127 Cb -0.04 -1.80 -0.09 0.00 -0.52 0.00 0.00 37.83 35.39 1m3i s LYS 127 CO 0.02 -2.33 1.10 -2.14 -0.92 0.00 0.00 175.35 171.08 1m3i s PRO 128 N -4.96 4.07 0.11 -1.68 0.02 -1.19 -4.54 135.00 126.83 1m3i s PRO 128 Ca 0.64 1.65 0.03 0.00 0.02 0.00 0.00 61.00 63.33 1m3i s PRO 128 Cb -0.18 -2.56 -0.04 0.00 0.02 0.00 0.00 34.50 31.74 1m3i s PRO 128 CO 0.57 -0.25 -0.09 -1.50 -0.33 0.00 0.00 177.00 175.40 1m3i s ILE 129 N -1.57 0.90 -0.19 2.83 2.07 0.27 -4.96 121.20 120.55 1m3i s ILE 129 Ca 0.58 -1.83 -0.08 0.00 -1.41 0.00 0.00 60.65 57.91 1m3i s ILE 129 Cb -0.26 -1.57 -0.04 0.00 0.13 0.00 0.00 42.46 40.72 1m3i s ILE 129 CO 0.32 -0.71 0.07 0.20 -1.91 0.00 0.00 174.94 172.91 1m3i s ASN 130 N -2.82 5.74 0.01 4.50 -0.87 -1.26 0.42 114.94 120.67 1m3i s ASN 130 Ca 0.10 0.11 0.00 0.00 -1.57 0.00 0.00 52.86 51.50 1m3i s ASN 130 Cb 0.01 -1.99 -0.04 0.00 -0.02 0.00 0.00 41.25 39.22 1m3i s ASN 130 CO -0.02 0.18 0.09 -0.63 -2.57 0.00 0.00 177.10 174.15 1m3i s ILE 131 N 0.36 4.73 -0.06 0.60 1.09 0.55 -1.88 121.20 126.59 1m3i s ILE 131 Ca 0.04 -0.47 -0.01 0.00 -1.10 0.00 0.00 60.65 59.10 1m3i s ILE 131 Cb -0.12 -3.19 0.03 0.00 -1.06 0.00 0.00 42.46 38.11 1m3i s ILE 131 CO -0.00 0.30 0.01 0.20 -0.10 0.00 0.00 174.94 175.35 1m3i s ASN 132 N -1.90 1.35 0.09 3.58 -0.87 0.17 -1.65 114.94 115.71 1m3i s ASN 132 Ca 0.25 -0.04 -0.03 0.00 -1.57 0.00 0.00 52.86 51.47 1m3i s ASN 132 Cb -0.12 -0.35 -0.05 0.00 -0.02 0.00 0.00 41.25 40.72 1m3i s ASN 132 CO 0.16 -0.20 0.29 -0.51 -2.57 0.00 0.00 177.10 174.28 1m3i s ILE 133 N 1.91 5.28 -0.43 0.60 2.07 -1.22 -0.39 121.20 129.00 1m3i s ILE 133 Ca 0.03 -0.12 0.04 0.00 -1.41 0.00 0.00 60.65 59.19 1m3i s ILE 133 Cb -0.12 -3.62 0.48 0.00 0.13 0.00 0.00 42.46 39.33 1m3i s ILE 133 CO -0.04 0.13 1.57 -0.90 -1.91 0.00 0.00 174.94 173.79 1m3i n ASP 134 N 0.31 5.31 -4.73 4.50 3.85 -0.90 -4.83 116.55 120.06 1m3i n ASP 134 Ca -0.05 -3.77 -0.32 0.00 -0.71 0.00 0.00 54.79 49.94 1m3i n ASP 134 Cb 0.52 -0.65 0.10 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 3.15 0.60 -2.12 1.43 -1.26 -4.84 118.68 112.04 1m3i s LEU 135 Ca 0.55 2.09 -0.17 0.00 -1.03 0.00 0.00 54.13 55.57 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 -2.26 1.11 -2.16 0.23 0.00 0.00 176.35 173.29 1m3i s PRO 136 N -4.40 3.10 -1.29 1.29 0.04 -1.26 -4.13 135.00 128.35 1m3i s PRO 136 Ca 0.67 1.46 -0.10 0.00 0.04 0.00 0.00 61.00 63.08 1m3i s PRO 136 Cb -0.22 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 32.33 1m3i s PRO 136 CO 0.50 -1.03 0.59 0.41 0.04 0.00 0.00 177.00 177.52 1m3i n GLY 137 N -0.27 -0.55 0.83 0.56 0.00 -1.26 -4.90 105.19 99.59 1m3i n GLY 137 Ca 0.11 0.27 -0.00 0.00 0.00 0.00 0.00 46.02 46.40 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 -4.34 0.11 -4.77 0.99 7.94 -1.26 -5.08 117.00 110.58 1m3i n LEU 138 Ca -0.22 -1.40 -0.40 0.00 -1.11 0.00 0.00 56.01 52.88 1m3i n LEU 138 Cb 0.64 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.60 1m3i n LEU 138 CO 0.72 0.66 1.12 -1.59 -1.11 0.00 0.00 177.39 177.18 1m3i s LYS 139 N 0.00 3.88 -1.51 1.96 -2.85 -1.26 -1.33 119.74 118.63 1m3i s LYS 139 Ca 0.09 2.52 -0.05 0.00 -1.00 0.00 0.00 55.97 57.53 1m3i s LYS 139 Cb 0.10 -2.81 0.01 0.00 -2.06 0.00 0.00 37.83 33.06 1m3i s LYS 139 CO -0.04 -0.70 0.68 0.41 0.10 0.00 0.00 175.35 175.80 1m3i n GLY 140 N 0.50 -0.51 0.00 0.59 0.00 -1.26 -4.68 105.19 99.84 1m3i n GLY 140 Ca 0.03 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -4.12 0.00 0.16 1.61 1.02 -0.95 -4.94 120.64 113.42 1m3i n GLU 141 Ca -0.10 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.17 1m3i n GLU 141 Cb 0.61 0.00 0.35 0.00 -0.02 0.00 0.00 31.44 32.38 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 -3.78 1.62 -1.07 -1.48 -3.46 115.58 107.41 1m3i h ASN 142 Ca 0.00 0.00 -0.49 0.00 0.07 0.00 0.00 56.30 55.88 1m3i h ASN 142 Cb 0.00 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 36.22 1m3i h ASN 142 CO 0.00 0.00 0.19 -0.44 0.07 0.00 0.00 177.43 177.25 1m3i s SER 143 N -5.21 6.96 0.05 6.14 0.01 -1.26 -3.46 113.70 116.93 1m3i s SER 143 Ca 0.08 1.48 -0.12 0.00 1.31 0.00 0.00 55.95 58.70 1m3i s SER 143 Cb 0.09 -2.45 0.01 0.00 0.21 0.00 0.00 66.02 63.88 1m3i s SER 143 CO 0.60 -0.15 0.26 -0.51 0.41 0.00 0.00 173.24 173.85 1m3i s ILE 144 N -1.85 0.10 -0.25 1.44 2.07 -0.66 -4.99 121.20 117.06 1m3i s ILE 144 Ca 0.52 -0.79 -0.04 0.00 -1.41 0.00 0.00 60.65 58.94 1m3i s ILE 144 Cb -0.13 -0.97 0.01 0.00 0.13 0.00 0.00 42.46 41.50 1m3i s ILE 144 CO 0.18 -0.43 -0.01 -0.75 -1.91 0.00 0.00 174.94 172.01 1m3i s LYS 145 N -2.69 3.13 -0.27 3.50 2.20 -1.26 -0.33 119.74 124.02 1m3i s LYS 145 Ca -0.04 -0.80 -0.17 0.00 -0.36 0.00 0.00 55.97 54.60 1m3i s LYS 145 Cb -0.00 -3.10 -0.03 0.00 -1.51 0.00 0.00 37.83 33.19 1m3i s LYS 145 CO -0.04 -0.33 0.48 0.08 -0.36 0.00 0.00 175.35 175.18 1m3i s VAL 146 N 1.44 5.09 -0.02 4.02 1.01 0.17 -4.93 120.40 127.17 1m3i s VAL 146 Ca 0.03 0.79 -0.21 0.00 0.00 0.00 0.00 61.98 62.59 1m3i s VAL 146 Cb -0.16 -3.80 -0.13 0.00 0.00 0.00 0.00 36.38 32.29 1m3i s VAL 146 CO -0.02 0.09 0.89 0.44 0.00 0.00 0.00 175.10 176.51 1m3i h ASP 147 N 8.07 -0.44 -4.00 3.32 3.32 -1.92 0.78 116.42 125.56 1m3i h ASP 147 Ca -0.29 -0.11 -0.74 0.00 0.02 0.00 0.00 57.03 55.91 1m3i h ASP 147 Cb 1.14 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 -0.16 -0.62 -1.72 0.00 0.00 179.24 177.44 1m3i s ASP 148 N -5.00 5.93 -0.53 6.45 3.68 -1.26 -3.19 116.67 122.75 1m3i s ASP 148 Ca -0.11 -2.79 -0.26 0.00 2.13 0.00 0.00 52.55 51.52 1m3i s ASP 148 Cb 0.01 -2.02 -0.08 0.00 -1.45 0.00 0.00 42.92 39.39 1m3i s ASP 148 CO 0.39 -0.46 2.40 -2.84 0.13 0.00 0.00 175.17 174.79 1m3i s PRO 149 N 0.03 2.04 0.24 4.34 0.02 -1.26 -4.57 135.00 135.84 1m3i s PRO 149 Ca 0.17 1.29 -0.02 0.00 0.02 0.00 0.00 61.00 62.46 1m3i s PRO 149 Cb -0.16 -4.61 -0.03 0.00 0.02 0.00 0.00 34.50 29.73 1m3i s PRO 149 CO -0.06 -3.41 0.24 0.95 -0.33 0.00 0.00 177.00 174.38 1m3i s THR 150 N 12.48 0.00 0.02 0.99 -4.23 -1.26 -4.96 115.64 118.67 1m3i s THR 150 Ca 0.96 -1.87 -0.08 0.00 -1.18 0.00 0.00 61.69 59.52 1m3i s THR 150 Cb -0.16 -2.46 -0.04 0.00 1.34 0.00 0.00 72.50 71.17 1m3i s THR 150 CO 0.24 0.00 1.13 0.22 -0.54 0.00 0.00 174.62 175.67 1m3i h TYR 151 N 2.45 -0.30 -0.70 3.99 3.20 -1.97 0.29 116.97 123.94 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 0.11 -0.11 0.00 1.54 0.00 0.00 36.73 39.52 1m3i h TYR 151 CO 0.63 -0.17 0.14 0.78 -1.64 0.00 0.00 178.16 177.90 1m3i h GLY 152 N -0.27 0.93 0.00 1.82 0.00 -1.98 0.28 103.07 103.84 1m3i h GLY 152 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1m3i h GLY 152 CO 0.02 -0.19 0.00 0.28 0.00 0.00 0.00 176.54 176.65 1m3i n LYS 153 N -5.17 0.00 -0.36 4.80 4.76 -1.18 -2.26 118.16 118.75 1m3i n LYS 153 Ca 0.13 0.43 0.29 0.00 -2.87 0.00 0.00 58.31 56.29 1m3i n LYS 153 Cb 0.42 -1.42 0.55 0.00 -1.84 0.00 0.00 35.03 32.75 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 0.21 0.65 -0.18 2.07 -0.20 0.01 116.25 118.81 1m3i h VAL 154 Ca 0.00 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1m3i h VAL 154 Cb 0.00 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.75 1m3i h VAL 154 CO 0.00 0.04 -0.50 0.28 0.02 0.00 0.00 177.57 177.41 1m3i h SER 155 N 0.20 -1.32 -0.85 0.57 0.02 -0.34 -2.31 113.55 109.52 1m3i h SER 155 Ca 0.77 0.09 0.16 0.00 -0.84 0.00 0.00 61.79 61.97 1m3i h SER 155 Cb 2.04 0.41 -0.10 0.00 0.14 0.00 0.00 62.40 64.89 1m3i h SER 155 CO -0.55 -0.71 0.43 1.23 -1.14 0.00 0.00 176.83 176.08 1m3i h GLY 156 N -1.11 1.40 0.45 -3.77 0.00 -0.55 0.82 103.07 100.31 1m3i h GLY 156 Ca -0.08 -0.24 0.10 0.00 0.00 0.00 0.00 47.33 47.10 1m3i h GLY 156 CO 0.02 -0.07 0.34 0.00 0.00 0.00 0.00 176.54 176.82 1m3i h ALA 157 N 1.58 0.96 -0.05 3.60 0.00 -1.18 0.16 119.26 124.33 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 0.72 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1m3i h ALA 157 CO -0.39 -0.07 0.01 0.82 0.00 0.00 0.00 179.25 179.62 1m3i h ILE 158 N 0.57 1.21 -0.94 0.00 2.04 -0.48 -2.72 117.51 117.20 1m3i h ILE 158 Ca 0.35 -0.63 0.26 0.00 1.00 0.00 0.00 64.86 65.83 1m3i h ILE 158 Cb 0.38 1.53 -0.14 0.00 -0.74 0.00 0.00 36.82 37.85 1m3i h ILE 158 CO -0.28 0.17 0.44 0.44 0.00 0.00 0.00 178.15 178.92 1m3i h ASP 159 N -0.15 0.36 0.70 1.72 5.19 0.72 -0.86 116.42 124.11 1m3i h ASP 159 Ca 0.02 0.17 -0.03 0.00 -0.62 0.00 0.00 57.03 56.56 1m3i h ASP 159 Cb 0.27 0.15 0.01 0.00 0.18 0.00 0.00 39.33 39.93 1m3i h ASP 159 CO 0.00 -0.06 -0.34 -0.33 -3.12 0.00 0.00 179.24 175.39 1m3i h GLU 160 N 0.36 -0.91 -1.24 3.56 5.08 -0.46 -1.30 114.58 119.68 1m3i h GLU 160 Ca 0.62 0.06 0.37 0.00 -1.00 0.00 0.00 59.36 59.41 1m3i h GLU 160 Cb 1.27 0.21 -0.11 0.00 0.50 0.00 0.00 28.75 30.62 1m3i h GLU 160 CO -0.57 -0.61 0.81 -0.07 -1.00 0.00 0.00 179.01 177.57 1m3i h LEU 161 N -0.95 0.28 0.61 1.33 3.38 -0.95 1.16 115.31 120.17 1m3i h LEU 161 Ca -0.10 0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1m3i h LEU 161 Cb 0.72 0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.54 1m3i h LEU 161 CO 0.16 -0.06 -0.29 0.58 0.09 0.00 0.00 178.44 178.92 1m3i h VAL 162 N 0.18 0.17 -0.81 1.22 2.07 -0.86 0.19 116.25 118.42 1m3i h VAL 162 Ca 0.72 -0.36 0.10 0.00 0.82 0.00 0.00 66.70 67.98 1m3i h VAL 162 Cb 2.21 0.24 -0.06 0.00 -1.52 0.00 0.00 31.29 32.16 1m3i h VAL 162 CO -0.31 0.03 0.53 0.28 0.02 0.00 0.00 177.57 178.11 1m3i h SER 163 N -1.13 0.66 0.09 0.57 0.02 0.52 0.76 113.55 115.05 1m3i h SER 163 Ca -0.08 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1m3i h SER 163 Cb 0.67 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.09 1m3i h SER 163 CO 0.14 0.39 -0.09 0.50 -1.14 0.00 0.00 176.83 176.63 1m3i h LYS 164 N 0.73 0.00 0.12 3.45 3.64 0.15 0.93 116.57 125.58 1m3i h LYS 164 Ca 0.37 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.58 1m3i h LYS 164 Cb 0.48 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1m3i h LYS 164 CO -0.15 0.09 -0.81 2.35 -2.27 0.00 0.00 179.45 178.66 1m3i h TRP 165 N 0.00 0.47 -0.25 1.91 7.01 0.24 -2.49 115.95 122.84 1m3i h TRP 165 Ca -0.00 -0.34 -0.02 0.00 2.11 0.00 0.00 58.89 60.63 1m3i h TRP 165 Cb 0.16 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.19 1m3i h TRP 165 CO 0.00 1.31 0.05 -0.91 -2.79 0.00 0.00 178.44 176.10 1m3i h ASN 166 N -0.44 0.32 0.20 2.65 2.35 0.54 0.24 115.58 121.45 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 1.59 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.88 1m3i h ASN 166 CO 0.12 0.34 -0.10 -0.08 -1.65 0.00 0.00 177.43 176.06 1m3i h GLU 167 N 0.35 -0.26 -0.26 0.81 4.57 0.77 -3.17 114.58 117.39 1m3i h GLU 167 Ca 0.09 0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.33 1m3i h GLU 167 Cb 0.15 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 1m3i h GLU 167 CO -0.00 0.13 0.18 -0.22 -1.18 0.00 0.00 179.01 177.92 1m3i h LYS 168 N -0.82 0.12 -3.92 1.92 3.64 -1.12 -3.35 116.57 113.03 1m3i h LYS 168 Ca -0.03 -0.01 -0.60 0.00 -1.27 0.00 0.00 60.65 58.74 1m3i h LYS 168 Cb 0.52 -0.03 -0.40 0.00 -0.41 0.00 0.00 32.23 31.91 1m3i h LYS 168 CO 0.05 0.08 -0.75 0.71 -2.27 0.00 0.00 179.45 177.26 1m3i s TYR 169 N -5.15 2.29 -0.43 1.91 1.51 0.83 -4.96 117.35 113.36 1m3i s TYR 169 Ca -0.06 -2.05 0.20 0.00 -1.01 0.00 0.00 57.07 54.15 1m3i s TYR 169 Cb 0.18 -2.01 -0.27 0.00 -0.11 0.00 0.00 41.96 39.75 1m3i s TYR 169 CO 0.70 -0.88 0.62 0.43 -1.11 0.00 0.00 175.55 175.31 1m3i n SER 170 N 4.68 0.61 0.29 2.29 7.64 -1.20 -4.39 113.62 123.53 1m3i n SER 170 Ca -0.01 -0.43 -0.16 0.00 1.01 0.00 0.00 58.87 59.27 1m3i n SER 170 Cb 0.42 1.52 -0.08 0.00 -1.01 0.00 0.00 64.21 65.06 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 -3.38 6.43 0.02 -1.93 -3.45 113.55 110.52 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 0.72 0.21 -0.17 0.00 0.14 0.00 0.00 62.40 63.31 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 1.85 -0.01 -2.27 2.01 -1.26 -5.04 115.64 104.86 1m3i s THR 172 Ca -0.17 -2.02 0.01 0.00 0.31 0.00 0.00 61.69 59.82 1m3i s THR 172 Cb 0.05 -1.92 0.01 0.00 0.01 0.00 0.00 72.50 70.65 1m3i s THR 172 CO 0.63 -0.38 0.72 0.00 -0.69 0.00 0.00 174.62 174.89 1m3i n HIS 173 N 0.08 0.00 -4.08 4.92 1.44 -1.26 -4.94 115.22 111.38 1m3i n HIS 173 Ca -0.11 -0.09 -0.32 0.00 -2.01 0.00 0.00 57.72 55.18 1m3i n HIS 173 Cb 0.58 -0.03 -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 2.08 0.07 0.61 -4.23 -1.26 0.21 115.64 112.90 1m3i s THR 174 Ca 0.01 -1.31 0.04 0.00 -1.18 0.00 0.00 61.69 59.25 1m3i s THR 174 Cb 0.01 -2.06 -0.04 0.00 1.34 0.00 0.00 72.50 71.75 1m3i s THR 174 CO 0.00 0.21 0.03 -0.76 -0.54 0.00 0.00 174.62 173.57 1m3i s LEU 175 N 1.20 3.62 -0.17 4.79 1.43 0.13 -4.88 118.68 124.80 1m3i s LEU 175 Ca -0.03 -0.08 -0.29 0.00 -1.03 0.00 0.00 54.13 52.70 1m3i s LEU 175 Cb -0.17 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.73 1m3i s LEU 175 CO -0.08 0.19 1.70 -2.84 0.23 0.00 0.00 176.35 175.54 1m3i s PRO 176 N -2.22 3.84 0.42 1.29 0.02 -1.26 -0.57 135.00 136.51 1m3i s PRO 176 Ca 0.26 1.87 -0.26 0.00 0.02 0.00 0.00 61.00 62.88 1m3i s PRO 176 Cb -0.12 -4.06 -0.09 0.00 0.02 0.00 0.00 34.50 30.25 1m3i s PRO 176 CO 0.19 -1.25 1.44 0.00 -0.33 0.00 0.00 177.00 177.05 1m3i s ALA 177 N 5.18 3.37 -0.62 -1.55 0.00 -0.69 -4.90 121.76 122.55 1m3i s ALA 177 Ca 0.75 1.49 -0.26 0.00 0.00 0.00 0.00 51.96 53.94 1m3i s ALA 177 Cb -0.28 -3.59 0.04 0.00 0.00 0.00 0.00 23.12 19.28 1m3i s ALA 177 CO 0.31 -1.11 1.12 1.03 0.00 0.00 0.00 175.76 177.10 1m3i s ARG 178 N -2.29 3.34 0.03 0.00 0.52 0.36 -4.86 118.95 116.06 1m3i s ARG 178 Ca 0.57 -0.14 -0.15 0.00 -0.52 0.00 0.00 55.73 55.50 1m3i s ARG 178 Cb -0.44 -4.09 -0.06 0.00 0.52 0.00 0.00 34.95 30.88 1m3i s ARG 178 CO 0.58 -1.76 0.44 0.99 0.02 0.00 0.00 175.30 175.58 1m3i s THR 179 N 4.76 4.98 -0.22 0.02 2.01 -1.25 0.51 115.64 126.45 1m3i s THR 179 Ca 0.35 0.84 -0.01 0.00 0.31 0.00 0.00 61.69 63.17 1m3i s THR 179 Cb -0.10 -3.73 0.07 0.00 0.01 0.00 0.00 72.50 68.75 1m3i s THR 179 CO 0.19 0.50 0.02 -1.10 -0.69 0.00 0.00 174.62 173.55 1m3i s GLN 180 N -1.28 0.94 0.05 4.92 -0.21 0.23 -4.93 119.66 119.39 1m3i s GLN 180 Ca 0.27 -0.68 -0.21 0.00 0.02 0.00 0.00 55.36 54.76 1m3i s GLN 180 Cb -0.17 -2.24 -0.06 0.00 1.00 0.00 0.00 33.01 31.54 1m3i s GLN 180 CO 0.15 -0.68 0.61 -0.47 -2.12 0.00 0.00 175.29 172.78 1m3i s TYR 181 N 1.69 3.76 0.01 0.91 5.04 -1.26 -0.36 117.35 127.15 1m3i s TYR 181 Ca -0.01 1.28 -0.09 0.00 -2.44 0.00 0.00 57.07 55.82 1m3i s TYR 181 Cb -0.18 -2.59 0.00 0.00 0.35 0.00 0.00 41.96 39.55 1m3i s TYR 181 CO -0.10 0.47 0.18 -1.12 -1.34 0.00 0.00 175.55 173.64 1m3i s SER 182 N -0.67 0.01 -0.00 4.32 0.01 -0.57 -4.99 113.70 111.80 1m3i s SER 182 Ca 0.31 -0.24 -0.14 0.00 1.31 0.00 0.00 55.95 57.19 1m3i s SER 182 Cb -0.19 0.25 0.02 0.00 0.21 0.00 0.00 66.02 66.31 1m3i s SER 182 CO 0.19 -0.45 0.29 -1.83 0.41 0.00 0.00 173.24 171.85 1m3i s GLU 183 N -1.85 0.67 -0.29 12.44 -1.05 -1.26 -0.87 118.70 126.49 1m3i s GLU 183 Ca -0.11 -0.26 -0.25 0.00 -0.15 0.00 0.00 54.97 54.20 1m3i s GLU 183 Cb -0.05 0.30 0.17 0.00 -0.44 0.00 0.00 34.13 34.11 1m3i s GLU 183 CO -0.00 -0.19 1.31 0.45 0.95 0.00 0.00 175.26 177.78 1m3i s SER 184 N -1.45 -0.18 0.38 0.83 0.15 -1.05 -5.01 113.70 107.38 1m3i s SER 184 Ca -0.12 0.34 -0.24 0.00 0.70 0.00 0.00 55.95 56.62 1m3i s SER 184 Cb -0.05 0.34 -0.09 0.00 -1.71 0.00 0.00 66.02 64.51 1m3i s SER 184 CO 0.03 -0.06 1.02 -0.04 1.20 0.00 0.00 173.24 175.39 1m3i s MET 185 N 0.05 4.26 0.17 5.44 -1.94 -1.26 -2.13 119.30 123.89 1m3i s MET 185 Ca 0.06 1.46 -0.15 0.00 -1.71 0.00 0.00 55.69 55.35 1m3i s MET 185 Cb -0.05 -2.58 -0.07 0.00 2.01 0.00 0.00 34.83 34.14 1m3i s MET 185 CO -0.12 -0.05 0.58 0.08 -0.01 0.00 0.00 175.02 175.50 1m3i s VAL 186 N -1.68 4.81 0.00 -6.03 1.01 -0.42 -4.78 120.40 113.32 1m3i s VAL 186 Ca 0.56 0.87 0.00 0.00 0.00 0.00 0.00 61.98 63.41 1m3i s VAL 186 Cb -0.21 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1m3i s VAL 186 CO 0.26 0.19 0.00 -1.22 0.00 0.00 0.00 175.10 174.33 1m3i n TYR 187 N 0.66 0.00 0.00 5.22 4.02 -1.26 -4.78 117.16 121.02 1m3i n TYR 187 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.85 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 -0.07 7.72 3.41 -1.26 -4.71 113.62 118.71 1m3i n SER 188 Ca 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.54 1m3i n SER 188 Cb 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.03 -0.23 4.33 1.57 -2.00 -1.56 116.57 118.66 1m3i h LYS 189 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1m3i h LYS 189 Cb 0.00 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1m3i h LYS 189 CO 0.00 -0.02 0.13 0.66 -0.57 0.00 0.00 179.45 179.65 1m3i h SER 190 N -0.03 0.28 0.35 0.86 4.64 -1.97 -1.81 113.55 115.88 1m3i h SER 190 Ca 0.14 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 1m3i h SER 190 Cb 0.23 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 1m3i h SER 190 CO -0.30 0.27 -0.36 -0.61 -0.87 0.00 0.00 176.83 174.96 1m3i h GLN 191 N 0.27 -0.69 -0.92 4.77 -0.00 -1.79 -2.04 115.11 114.71 1m3i h GLN 191 Ca 0.08 0.05 -0.00 0.00 -0.00 0.00 0.00 58.65 58.77 1m3i h GLN 191 Cb 0.05 0.16 -0.04 0.00 0.00 0.00 0.00 27.48 27.64 1m3i h GLN 191 CO -0.01 -0.46 0.56 0.97 0.00 0.00 0.00 178.83 179.89 1m3i h ILE 192 N -0.72 1.25 0.10 2.39 6.09 -1.37 -0.17 117.51 125.09 1m3i h ILE 192 Ca -0.04 -0.53 0.02 0.00 -1.37 0.00 0.00 64.86 62.94 1m3i h ILE 192 Cb 0.62 -0.05 -0.05 0.00 0.47 0.00 0.00 36.82 37.81 1m3i h ILE 192 CO -0.05 0.26 -0.42 -1.28 -3.07 0.00 0.00 178.15 173.59 1m3i h SER 193 N 1.26 -1.23 -0.69 2.19 0.87 -1.19 0.10 113.55 114.86 1m3i h SER 193 Ca 0.33 0.14 -0.08 0.00 -1.23 0.00 0.00 61.79 60.95 1m3i h SER 193 Cb -0.07 0.47 -0.03 0.00 -0.44 0.00 0.00 62.40 62.33 1m3i h SER 193 CO -0.06 -0.48 0.12 0.77 -0.53 0.00 0.00 176.83 176.65 1m3i h SER 194 N -0.64 1.08 -0.81 6.23 4.64 -1.23 0.16 113.55 122.98 1m3i h SER 194 Ca 0.03 -0.25 0.10 0.00 -0.47 0.00 0.00 61.79 61.19 1m3i h SER 194 Cb 0.67 -0.29 -0.08 0.00 -0.31 0.00 0.00 62.40 62.40 1m3i h SER 194 CO -0.25 1.06 0.45 0.00 -0.87 0.00 0.00 176.83 177.22 1m3i h ALA 195 N 1.06 1.16 -0.43 5.18 0.00 -0.33 -2.47 119.26 123.43 1m3i h ALA 195 Ca 0.21 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1m3i h ALA 195 Cb 0.43 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1m3i h ALA 195 CO 0.01 0.05 0.00 1.28 0.00 0.00 0.00 179.25 180.59 1m3i n LEU 196 N -4.78 3.25 -3.93 0.00 4.77 0.30 -4.97 117.00 111.65 1m3i n LEU 196 Ca 0.14 -2.08 -0.36 0.00 -0.03 0.00 0.00 56.01 53.67 1m3i n LEU 196 Cb 0.30 -0.31 0.01 0.00 -2.33 0.00 0.00 43.42 41.09 1m3i n LEU 196 CO 0.26 0.78 -0.17 -3.20 -1.33 0.00 0.00 177.39 173.73 1m3i n ASN 197 N 0.69 -3.58 -3.99 -1.43 4.05 0.46 -4.98 115.26 106.47 1m3i n ASN 197 Ca 0.15 -1.15 -0.08 0.00 0.45 0.00 0.00 54.58 53.96 1m3i n ASN 197 Cb 0.51 -2.54 -0.09 0.00 1.23 0.00 0.00 39.78 38.89 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 0.17 -0.08 3.44 -7.23 -0.60 -4.50 120.40 107.96 1m3i s VAL 198 Ca 0.37 -1.43 -0.30 0.00 -1.81 0.00 0.00 61.98 58.82 1m3i s VAL 198 Cb -0.17 -1.22 -0.02 0.00 0.56 0.00 0.00 36.38 35.52 1m3i s VAL 198 CO 0.92 -0.79 1.14 0.21 -0.31 0.00 0.00 175.10 176.27 1m3i s ASN 199 N -2.59 7.11 0.23 4.85 3.84 -1.26 -4.54 114.94 122.57 1m3i s ASN 199 Ca 0.02 1.71 -0.13 0.00 0.21 0.00 0.00 52.86 54.67 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 -0.55 1.60 0.00 -2.79 0.00 0.00 177.10 175.28 1m3i h ALA 200 N 7.38 0.43 -0.72 1.71 0.00 -1.91 0.62 119.26 126.77 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 0.60 -0.05 0.00 0.00 0.00 0.00 17.79 19.49 1m3i h ALA 200 CO 0.88 -0.44 0.49 0.87 0.00 0.00 0.00 179.25 181.05 1m3i h LYS 201 N -0.02 0.33 0.07 0.00 1.79 -1.96 -1.81 116.57 114.97 1m3i h LYS 201 Ca 0.35 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.79 1m3i h LYS 201 Cb 0.55 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.12 1m3i h LYS 201 CO -0.76 0.22 -0.03 0.28 -1.08 0.00 0.00 179.45 178.07 1m3i h VAL 202 N 0.34 1.03 0.22 0.50 2.07 -1.26 0.11 116.25 119.25 1m3i h VAL 202 Ca 0.35 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 1m3i h VAL 202 Cb 0.90 1.26 -0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1m3i h VAL 202 CO -0.10 0.09 -0.12 -0.07 0.02 0.00 0.00 177.57 177.39 1m3i h LEU 203 N -0.25 -0.28 -2.15 2.57 3.38 -1.40 0.64 115.31 117.81 1m3i h LEU 203 Ca -0.01 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.03 1m3i h LEU 203 Cb 0.22 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1m3i h LEU 203 CO 0.02 -0.20 0.29 -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 -1.26 0.44 114.58 119.39 1m3i h GLU 204 Ca -0.03 0.00 -0.40 0.00 -0.13 0.00 0.00 59.36 58.81 1m3i h GLU 204 Cb 0.25 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.57 1m3i h GLU 204 CO 0.04 0.00 -2.23 0.09 -0.73 0.00 0.00 179.01 176.18 1m3i n ASN 205 N -3.57 1.94 -0.03 1.04 4.13 0.02 -3.30 115.26 115.50 1m3i n ASN 205 Ca 0.02 0.36 -0.12 0.00 1.68 0.00 0.00 54.58 56.52 1m3i n ASN 205 Cb 0.41 -0.84 -0.10 0.00 -1.54 0.00 0.00 39.78 37.71 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 -0.04 1.22 6.41 0.02 0.36 -3.35 113.55 117.17 1m3i h SER 206 Ca -0.60 -0.65 -0.13 0.00 -0.84 0.00 0.00 61.79 59.56 1m3i h SER 206 Cb 1.52 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 64.04 1m3i h SER 206 CO -0.36 0.68 -0.82 -0.07 -1.14 0.00 0.00 176.83 175.13 1m3i h LEU 207 N -0.82 0.00 -2.76 5.07 3.38 -0.37 -3.49 115.31 116.32 1m3i h LEU 207 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 1m3i h LEU 207 Cb 0.69 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.52 1m3i h LEU 207 CO 0.01 0.57 -0.35 0.61 0.09 0.00 0.00 178.44 179.38 1m3i n GLY 208 N 1.29 -0.05 3.45 0.83 0.00 0.26 -4.97 105.19 106.00 1m3i n GLY 208 Ca -0.02 0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.16 4.56 -1.09 1.61 1.01 -1.23 -4.96 120.40 117.15 1m3i s VAL 209 Ca 0.18 -0.36 -0.22 0.00 0.00 0.00 0.00 61.98 61.59 1m3i s VAL 209 Cb -0.02 -4.52 -0.09 0.00 0.00 0.00 0.00 36.38 31.75 1m3i s VAL 209 CO 0.32 -1.15 1.92 -0.67 0.00 0.00 0.00 175.10 175.52 1m3i n ASP 210 N 7.02 3.14 0.28 3.32 -0.08 -1.26 -4.67 116.55 124.30 1m3i n ASP 210 Ca -0.04 -2.72 0.17 0.00 -1.51 0.00 0.00 54.79 50.69 1m3i n ASP 210 Cb 0.45 -1.57 0.87 0.00 2.34 0.00 0.00 41.12 43.21 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 8.89 0.00 -0.01 -0.67 -1.00 -1.99 -1.01 116.94 121.16 1m3i h PHE 211 Ca 0.31 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 61.08 1m3i h PHE 211 Cb 0.85 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.41 1m3i h PHE 211 CO 1.25 0.00 -0.01 -0.97 -1.61 0.00 0.00 178.31 176.97 1m3i h ASN 212 N 0.00 0.01 -0.38 2.17 -1.24 -1.99 -1.70 115.58 112.46 1m3i h ASN 212 Ca 0.04 -0.51 0.04 0.00 0.71 0.00 0.00 56.30 56.58 1m3i h ASN 212 Cb 0.61 -0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.62 1m3i h ASN 212 CO -0.00 0.53 0.14 0.00 -1.29 0.00 0.00 177.43 176.81 1m3i h ALA 213 N 0.49 0.44 -0.92 1.57 0.00 -1.59 0.88 119.26 120.13 1m3i h ALA 213 Ca 0.00 0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.04 1m3i h ALA 213 Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.24 1m3i h ALA 213 CO 0.00 -0.24 0.57 0.28 0.00 0.00 0.00 179.25 179.86 1m3i h VAL 214 N 0.31 0.98 0.52 0.00 2.07 -1.50 -0.26 116.25 118.38 1m3i h VAL 214 Ca 0.17 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 1m3i h VAL 214 Cb 0.13 -0.08 0.01 0.00 -1.52 0.00 0.00 31.29 29.83 1m3i h VAL 214 CO -0.16 0.18 -0.25 0.00 0.02 0.00 0.00 177.57 177.36 1m3i h ALA 215 N 1.46 -0.69 0.00 1.67 0.00 -0.21 -2.43 119.26 119.06 1m3i h ALA 215 Ca 0.43 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1m3i h ALA 215 Cb 0.31 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1m3i h ALA 215 CO -0.22 -0.81 0.00 0.09 0.00 0.00 0.00 179.25 178.31 1m3i n ASN 216 N -5.33 0.00 -3.63 0.00 3.02 0.17 -4.81 115.26 104.68 1m3i n ASN 216 Ca -0.12 -0.50 -0.24 0.00 -0.03 0.00 0.00 54.58 53.69 1m3i n ASN 216 Cb 0.31 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.56 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 -0.77 -5.98 -0.00 6.41 2.85 -0.56 -4.88 115.26 112.33 1m3i n ASN 217 Ca 0.04 -0.57 0.06 0.00 -0.11 0.00 0.00 54.58 54.01 1m3i n ASN 217 Cb 0.02 -4.91 -0.08 0.00 1.24 0.00 0.00 39.78 36.05 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 -4.93 2.01 -3.89 1.20 1.02 -0.21 -4.98 120.64 110.84 1m3i n GLU 218 Ca -0.00 -0.03 -0.11 0.00 -0.02 0.00 0.00 57.16 56.99 1m3i n GLU 218 Cb 0.56 -1.18 -0.12 0.00 -0.02 0.00 0.00 31.44 30.68 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 0.22 -0.18 3.49 1.02 -1.21 -4.64 119.74 115.99 1m3i s LYS 219 Ca 0.02 -0.22 -0.03 0.00 0.02 0.00 0.00 55.97 55.76 1m3i s LYS 219 Cb 0.10 0.09 -0.02 0.00 -0.52 0.00 0.00 37.83 37.48 1m3i s LYS 219 CO 0.55 -0.04 -0.04 0.15 -0.92 0.00 0.00 175.35 175.05 1m3i s LYS 220 N -0.68 3.52 -0.03 1.68 -0.14 0.60 -4.28 119.74 120.41 1m3i s LYS 220 Ca -0.08 -0.58 0.02 0.00 -1.36 0.00 0.00 55.97 53.97 1m3i s LYS 220 Cb -0.05 -2.94 0.01 0.00 -1.68 0.00 0.00 37.83 33.18 1m3i s LYS 220 CO -0.00 0.05 -0.07 0.08 -0.76 0.00 0.00 175.35 174.65 1m3i s VAL 221 N 0.85 0.63 -0.09 3.17 1.01 -1.26 -0.82 120.40 123.90 1m3i s VAL 221 Ca -0.01 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 61.76 1m3i s VAL 221 Cb -0.15 -0.59 0.01 0.00 0.00 0.00 0.00 36.38 35.65 1m3i s VAL 221 CO 0.01 0.22 -0.20 -0.32 0.00 0.00 0.00 175.10 174.82 1m3i s MET 222 N 0.43 2.54 -0.09 2.72 1.75 0.13 -1.30 119.30 125.48 1m3i s MET 222 Ca -0.06 -0.70 0.01 0.00 -1.25 0.00 0.00 55.69 53.69 1m3i s MET 222 Cb -0.10 -1.96 -0.02 0.00 2.84 0.00 0.00 34.83 35.59 1m3i s MET 222 CO 0.00 0.12 -0.13 0.42 -0.65 0.00 0.00 175.02 174.78 1m3i s ILE 223 N 0.47 3.12 -0.11 10.11 1.01 -0.91 0.64 121.20 135.53 1m3i s ILE 223 Ca -0.17 -0.67 -0.02 0.00 0.00 0.00 0.00 60.65 59.79 1m3i s ILE 223 Cb -0.17 -2.27 -0.03 0.00 0.01 0.00 0.00 42.46 40.00 1m3i s ILE 223 CO 0.07 0.56 -0.03 -0.76 0.00 0.00 0.00 174.94 174.77 1m3i s LEU 224 N -0.20 3.33 -0.29 2.97 1.43 0.34 -2.52 118.68 123.74 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 0.07 0.00 0.03 0.00 0.00 46.19 44.40 1m3i s LEU 224 CO 0.03 0.29 -0.05 0.00 0.23 0.00 0.00 176.35 176.86 1m3i s ALA 225 N -0.39 2.62 -0.76 4.21 0.00 -0.05 -0.96 121.76 126.43 1m3i s ALA 225 Ca 0.06 -2.00 -0.13 0.00 0.00 0.00 0.00 51.96 49.90 1m3i s ALA 225 Cb -0.12 -1.71 0.20 0.00 0.00 0.00 0.00 23.12 21.49 1m3i s ALA 225 CO 0.02 -1.38 0.68 0.71 0.00 0.00 0.00 175.76 175.80 1m3i s TYR 226 N 1.06 3.65 -0.29 0.00 1.51 0.65 -1.52 117.35 122.42 1m3i s TYR 226 Ca -0.01 -2.00 -0.29 0.00 -1.01 0.00 0.00 57.07 53.76 1m3i s TYR 226 Cb -0.20 -3.73 0.01 0.00 -0.11 0.00 0.00 41.96 37.93 1m3i s TYR 226 CO -0.07 -0.98 1.10 0.21 -1.11 0.00 0.00 175.55 174.71 1m3i s LYS 227 N 0.34 4.10 -0.44 -0.62 2.20 0.52 -0.90 119.74 124.94 1m3i s LYS 227 Ca 0.16 1.18 -0.06 0.00 -0.36 0.00 0.00 55.97 56.89 1m3i s LYS 227 Cb -0.14 -3.73 0.11 0.00 -1.51 0.00 0.00 37.83 32.56 1m3i s LYS 227 CO -0.07 -0.86 0.27 -0.65 -0.36 0.00 0.00 175.35 173.69 1m3i s GLN 228 N 3.61 2.25 0.01 4.03 -0.21 0.18 0.78 119.66 130.31 1m3i s GLN 228 Ca 0.47 -1.77 -0.17 0.00 0.02 0.00 0.00 55.36 53.90 1m3i s GLN 228 Cb -0.14 -3.75 -0.06 0.00 1.00 0.00 0.00 33.01 30.07 1m3i s GLN 228 CO 0.14 -1.12 0.48 0.42 -2.12 0.00 0.00 175.29 173.10 1m3i s ILE 229 N 1.26 4.95 -0.26 1.08 1.01 0.18 -1.16 121.20 128.26 1m3i s ILE 229 Ca 0.07 1.01 -0.03 0.00 0.00 0.00 0.00 60.65 61.70 1m3i s ILE 229 Cb -0.24 -3.80 -0.15 0.00 0.01 0.00 0.00 42.46 38.27 1m3i s ILE 229 CO -0.02 0.52 -0.27 0.49 0.00 0.00 0.00 174.94 175.67 1m3i n PHE 230 N 2.11 0.00 -3.65 3.97 3.72 0.42 0.14 117.46 124.17 1m3i n PHE 230 Ca -0.11 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.25 1m3i n PHE 230 Cb 0.52 -0.99 -0.01 0.00 -0.94 0.00 0.00 39.48 38.05 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 -0.15 0.15 1.38 1.13 -1.22 -4.85 117.35 111.28 1m3i s TYR 231 Ca -0.36 -0.04 0.04 0.00 -1.41 0.00 0.00 57.07 55.30 1m3i s TYR 231 Cb 0.11 0.58 -0.04 0.00 -1.10 0.00 0.00 41.96 41.50 1m3i s TYR 231 CO 0.56 -0.57 -0.08 -0.08 -2.51 0.00 0.00 175.55 172.88 1m3i s THR 232 N -2.94 1.06 -0.06 -3.49 -1.32 -1.26 -1.26 115.64 106.36 1m3i s THR 232 Ca 0.11 -2.04 0.01 0.00 -1.21 0.00 0.00 61.69 58.57 1m3i s THR 232 Cb 0.00 -1.88 0.02 0.00 -1.51 0.00 0.00 72.50 69.13 1m3i s THR 232 CO -0.02 -0.72 -0.09 -0.69 -2.21 0.00 0.00 174.62 170.89 1m3i s VAL 233 N -3.40 0.89 0.00 5.08 1.01 -0.44 -2.12 120.40 121.43 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 0.03 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.53 1m3i s VAL 233 CO 0.01 0.31 -0.20 -0.94 0.00 0.00 0.00 175.10 174.27 1m3i s SER 234 N 0.92 3.60 -0.30 3.32 1.04 0.47 -1.30 113.70 121.45 1m3i s SER 234 Ca -0.10 -0.40 -0.10 0.00 0.48 0.00 0.00 55.95 55.83 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 0.30 0.15 0.00 0.98 0.00 0.00 173.24 174.68 1m3i s ALA 235 N -0.78 3.33 0.27 5.32 0.00 -0.66 -0.66 121.76 128.58 1m3i s ALA 235 Ca 0.12 -1.28 -0.28 0.00 0.00 0.00 0.00 51.96 50.52 1m3i s ALA 235 Cb -0.10 -2.38 -0.15 0.00 0.00 0.00 0.00 23.12 20.49 1m3i s ALA 235 CO 0.02 -0.76 0.92 -0.25 0.00 0.00 0.00 175.76 175.70 1m3i n ASP 236 N 5.00 0.82 -4.71 0.00 8.00 -0.79 -4.80 116.55 120.07 1m3i n ASP 236 Ca -0.14 1.17 -0.42 0.00 0.71 0.00 0.00 54.79 56.11 1m3i n ASP 236 Cb 0.50 -1.22 -0.03 0.00 -0.02 0.00 0.00 41.12 40.35 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 0.94 4.34 0.31 0.64 1.43 -1.26 -4.82 118.68 120.26 1m3i s LEU 237 Ca 0.60 1.54 -0.27 0.00 -1.03 0.00 0.00 54.13 54.98 1m3i s LEU 237 Cb -0.75 -3.47 -0.10 0.00 0.03 0.00 0.00 46.19 41.90 1m3i s LEU 237 CO 0.59 -0.26 0.97 -2.16 0.23 0.00 0.00 176.35 175.72 1m3i s PRO 238 N 1.12 4.59 0.32 1.29 0.04 -1.26 -4.95 135.00 136.15 1m3i s PRO 238 Ca 0.49 1.43 0.02 0.00 0.04 0.00 0.00 61.00 62.98 1m3i s PRO 238 Cb -0.20 -2.90 0.60 0.00 0.04 0.00 0.00 34.50 32.04 1m3i s PRO 238 CO 0.25 0.26 1.92 -0.22 0.04 0.00 0.00 177.00 179.25 1m3i h LYS 239 N 3.33 0.91 -4.28 4.56 1.63 -1.98 -3.43 116.57 117.31 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 -0.21 -0.17 0.00 -0.60 0.00 0.00 32.23 32.45 1m3i h LYS 239 CO 0.65 0.60 -0.69 -0.80 -3.45 0.00 0.00 179.45 175.76 1m3i s ASN 240 N -6.05 0.58 0.31 4.20 0.01 -1.26 -5.05 114.94 107.67 1m3i s ASN 240 Ca -0.11 -0.81 0.07 0.00 -0.71 0.00 0.00 52.86 51.30 1m3i s ASN 240 Cb 0.20 0.14 0.80 0.00 0.41 0.00 0.00 41.25 42.80 1m3i s ASN 240 CO 0.79 -0.45 1.74 -0.65 -1.51 0.00 0.00 177.10 177.03 1m3i h PRO 241 N 3.68 0.62 -0.77 -0.60 0.11 -1.84 -2.33 132.00 130.85 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 32.03 1m3i h PRO 241 CO 0.56 0.41 0.25 0.66 -0.21 0.00 0.00 178.00 179.67 1m3i h SER 242 N 0.63 0.15 0.00 -2.05 4.64 -1.94 -0.97 113.55 114.01 1m3i h SER 242 Ca 0.61 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 62.06 1m3i h SER 242 Cb 1.07 0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1m3i h SER 242 CO -0.44 0.01 0.27 0.47 -0.87 0.00 0.00 176.83 176.27 1m3i n ASP 243 N -5.09 0.26 -0.09 4.97 8.00 -0.88 -2.11 116.55 121.62 1m3i n ASP 243 Ca 0.16 0.50 -0.11 0.00 0.71 0.00 0.00 54.79 56.05 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 -1.87 1.88 -4.76 0.64 4.77 -0.37 -4.46 117.00 112.83 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 0.14 0.00 -2.33 0.00 0.00 43.42 40.69 1m3i n LEU 244 CO 0.04 -0.22 0.69 -0.36 -1.33 0.00 0.00 177.39 176.22 1m3i s PHE 245 N -2.53 2.46 0.79 -1.77 0.40 -0.90 0.33 117.98 116.76 1m3i s PHE 245 Ca -0.24 0.98 -0.05 0.00 -0.60 0.00 0.00 56.93 57.02 1m3i s PHE 245 Cb 0.04 -3.28 0.15 0.00 0.51 0.00 0.00 43.02 40.44 1m3i s PHE 245 CO 0.36 -2.38 1.09 0.34 0.70 0.00 0.00 175.22 175.33 1m3i s ASP 246 N -3.81 3.95 0.12 1.36 2.15 0.11 -3.51 116.67 117.05 1m3i s ASP 246 Ca 0.64 -0.23 -0.06 0.00 0.43 0.00 0.00 52.55 53.33 1m3i s ASP 246 Cb -0.16 -0.03 -0.12 0.00 -0.30 0.00 0.00 42.92 42.31 1m3i s ASP 246 CO 0.55 -2.14 1.28 0.44 -0.17 0.00 0.00 175.17 175.13 1m3i h ASP 247 N -0.86 0.59 0.18 -0.34 3.32 -1.93 -3.22 116.42 114.17 1m3i h ASP 247 Ca -0.38 -0.47 -0.00 0.00 0.02 0.00 0.00 57.03 56.20 1m3i h ASP 247 Cb 1.26 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.63 1m3i h ASP 247 CO 0.39 1.27 -0.01 0.77 -1.72 0.00 0.00 179.24 179.94 1m3i h SER 248 N 0.25 0.00 -3.40 6.45 4.64 -1.95 -3.42 113.55 116.13 1m3i h SER 248 Ca -0.09 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.68 1m3i h SER 248 Cb 1.60 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.65 1m3i h SER 248 CO 0.17 0.01 0.17 -0.69 -0.87 0.00 0.00 176.83 175.62 1m3i s VAL 249 N -4.14 4.89 0.41 0.95 1.01 -1.22 -5.07 120.40 117.24 1m3i s VAL 249 Ca -0.04 1.63 0.07 0.00 0.00 0.00 0.00 61.98 63.65 1m3i s VAL 249 Cb 0.13 -4.12 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 1m3i s VAL 249 CO 0.46 0.28 0.10 0.42 0.00 0.00 0.00 175.10 176.36 1m3i s THR 250 N 0.50 2.15 0.55 3.92 -4.23 -1.26 -4.49 115.64 112.77 1m3i s THR 250 Ca 0.41 -1.83 0.22 0.00 -1.18 0.00 0.00 61.69 59.30 1m3i s THR 250 Cb -0.19 -2.99 0.30 0.00 1.34 0.00 0.00 72.50 70.96 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 1.58 0.00 0.00 3.99 3.57 -1.35 -0.25 116.94 124.48 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 0.69 0.01 0.00 -0.91 -2.23 0.00 0.00 178.31 175.86 1m3i h ASN 252 N 0.00 0.00 0.36 0.41 2.35 -1.87 0.42 115.58 117.25 1m3i h ASN 252 Ca -0.00 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.45 1m3i h ASN 252 Cb 0.01 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.41 1m3i h ASN 252 CO 0.00 0.00 -1.31 0.44 -1.65 0.00 0.00 177.43 174.91 1m3i h ASP 253 N 0.00 0.69 0.04 5.81 3.32 -1.36 -2.83 116.42 122.09 1m3i h ASP 253 Ca 0.00 -0.70 -0.06 0.00 0.02 0.00 0.00 57.03 56.28 1m3i h ASP 253 Cb 0.68 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 40.01 1m3i h ASP 253 CO 0.00 1.53 -0.27 -0.07 -1.72 0.00 0.00 179.24 178.71 1m3i h LEU 254 N 0.16 0.17 0.00 1.55 3.38 -1.35 -2.85 115.31 116.37 1m3i h LEU 254 Ca -0.19 -0.94 0.00 0.00 0.09 0.00 0.00 57.88 56.84 1m3i h LEU 254 Cb 2.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.70 1m3i h LEU 254 CO 0.24 1.10 0.00 1.17 0.09 0.00 0.00 178.44 181.03 1m3i n LYS 255 N -4.46 0.03 -0.11 1.13 4.81 0.15 -1.32 118.16 118.39 1m3i n LYS 255 Ca -0.11 0.31 -0.22 0.00 -0.87 0.00 0.00 58.31 57.42 1m3i n LYS 255 Cb 0.58 -1.50 -0.10 0.00 0.02 0.00 0.00 35.03 34.03 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 -1.33 0.56 0.04 1.64 0.00 -1.07 -4.24 117.38 112.98 1m3i n GLN 256 Ca 0.01 0.47 0.19 0.00 -0.00 0.00 0.00 57.00 57.67 1m3i n GLN 256 Cb 0.02 -1.66 0.70 0.00 0.00 0.00 0.00 30.24 29.30 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 -1.14 -3.43 116.57 116.48 1m3i h LYS 257 Ca -0.40 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.07 1m3i h LYS 257 Cb 1.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.94 1m3i h LYS 257 CO -0.24 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.54 1m3i n GLY 258 N -1.61 -0.50 3.55 3.86 0.00 -1.06 -5.10 105.19 104.32 1m3i n GLY 258 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 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 3.44 0.06 1.61 1.01 -0.43 -4.41 120.40 121.68 1m3i s VAL 259 Ca 0.00 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.11 1m3i s VAL 259 Cb 0.00 -4.14 -0.00 0.00 0.00 0.00 0.00 36.38 32.24 1m3i s VAL 259 CO 0.00 -1.09 0.04 -1.54 0.00 0.00 0.00 175.10 172.51 1m3i n SER 260 N 12.30 0.19 0.26 3.32 3.41 -1.23 -3.96 113.62 127.90 1m3i n SER 260 Ca 0.21 -1.38 0.14 0.00 -0.26 0.00 0.00 58.87 57.59 1m3i n SER 260 Cb 0.51 0.26 0.65 0.00 -0.26 0.00 0.00 64.21 65.37 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 0.33 0.00 0.84 4.04 2.35 -1.93 -2.04 115.58 119.17 1m3i h ASN 261 Ca -0.04 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.63 1m3i h ASN 261 Cb 0.21 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 1m3i h ASN 261 CO 0.07 0.11 -1.21 -0.62 -1.65 0.00 0.00 177.43 174.12 1m3i n GLU 262 N -3.32 0.61 -2.89 0.81 4.71 -1.26 -4.43 120.64 114.87 1m3i n GLU 262 Ca -0.00 0.16 -0.20 0.00 -0.01 0.00 0.00 57.16 57.10 1m3i n GLU 262 Cb 0.32 -1.81 -0.01 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 3.53 -1.59 0.62 0.00 -0.96 -4.53 120.51 115.31 1m3i n ALA 263 Ca -0.04 -3.84 -0.48 0.00 0.00 0.00 0.00 53.44 49.07 1m3i n ALA 263 Cb 0.68 -0.81 -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 -0.06 1.24 -1.67 0.00 -0.02 -0.81 -3.53 135.00 130.15 1m3i n PRO 264 Ca 0.25 0.44 -0.30 0.00 -2.02 0.00 0.00 63.50 61.87 1m3i n PRO 264 Cb 0.62 -1.95 0.06 0.00 -0.02 0.00 0.00 33.50 32.21 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 -0.39 2.61 0.25 0.52 0.04 -1.26 -0.65 135.00 136.12 1m3i s PRO 265 Ca 0.73 0.68 -0.22 0.00 0.04 0.00 0.00 61.00 62.23 1m3i s PRO 265 Cb -0.83 -1.97 0.05 0.00 0.04 0.00 0.00 34.50 31.78 1m3i s PRO 265 CO 0.52 -1.26 0.84 -0.48 0.04 0.00 0.00 177.00 176.66 1m3i s LEU 266 N -5.57 -0.16 0.01 -3.56 0.05 -0.91 -2.27 118.68 106.27 1m3i s LEU 266 Ca 0.59 -0.64 0.03 0.00 0.05 0.00 0.00 54.13 54.16 1m3i s LEU 266 Cb -0.13 2.50 -0.01 0.00 -2.05 0.00 0.00 46.19 46.49 1m3i s LEU 266 CO 0.54 -1.22 -0.10 -0.32 -0.55 0.00 0.00 176.35 174.69 1m3i s MET 267 N -3.27 0.76 -0.14 1.48 1.75 -0.12 -2.08 119.30 117.68 1m3i s MET 267 Ca 0.13 -0.49 -0.29 0.00 -1.25 0.00 0.00 55.69 53.79 1m3i s MET 267 Cb -0.04 -0.72 -0.04 0.00 2.84 0.00 0.00 34.83 36.86 1m3i s MET 267 CO 0.06 0.19 1.75 0.08 -0.65 0.00 0.00 175.02 176.45 1m3i s VAL 268 N -0.53 3.48 -0.12 10.11 1.01 -0.53 -1.44 120.40 132.39 1m3i s VAL 268 Ca 0.01 0.56 0.19 0.00 0.00 0.00 0.00 61.98 62.75 1m3i s VAL 268 Cb -0.05 -3.46 -0.26 0.00 0.00 0.00 0.00 36.38 32.61 1m3i s VAL 268 CO 0.00 -0.16 0.39 -1.54 0.00 0.00 0.00 175.10 173.79 1m3i n SER 269 N 8.43 0.18 -3.89 3.32 3.41 -0.80 0.33 113.62 124.59 1m3i n SER 269 Ca 0.20 0.08 -0.11 0.00 -0.26 0.00 0.00 58.87 58.78 1m3i n SER 269 Cb 0.44 1.23 -0.12 0.00 -0.26 0.00 0.00 64.21 65.50 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 -5.16 0.04 -0.16 4.04 0.01 -1.02 -1.66 114.94 111.03 1m3i s ASN 270 Ca -0.08 -0.13 -0.04 0.00 -0.71 0.00 0.00 52.86 51.90 1m3i s ASN 270 Cb 0.10 0.15 0.07 0.00 0.41 0.00 0.00 41.25 41.98 1m3i s ASN 270 CO 0.86 -0.19 0.19 -0.69 -1.51 0.00 0.00 177.10 175.75 1m3i s VAL 271 N -0.76 -0.27 0.13 1.60 1.01 -0.42 -2.41 120.40 119.28 1m3i s VAL 271 Ca -0.08 0.02 -0.22 0.00 0.00 0.00 0.00 61.98 61.70 1m3i s VAL 271 Cb -0.05 -0.55 -0.07 0.00 0.00 0.00 0.00 36.38 35.71 1m3i s VAL 271 CO 0.00 -0.11 0.68 0.00 0.00 0.00 0.00 175.10 175.68 1m3i s ALA 272 N 2.29 3.51 -0.03 5.51 0.00 -0.34 -1.32 121.76 131.38 1m3i s ALA 272 Ca 0.05 0.20 0.07 0.00 0.00 0.00 0.00 51.96 52.28 1m3i s ALA 272 Cb -0.15 -2.80 -0.02 0.00 0.00 0.00 0.00 23.12 20.15 1m3i s ALA 272 CO -0.10 0.34 -0.23 0.71 0.00 0.00 0.00 175.76 176.48 1m3i s TYR 273 N -1.18 2.15 0.00 0.00 1.51 -0.39 0.37 117.35 119.81 1m3i s TYR 273 Ca 0.34 -0.46 0.00 0.00 -1.01 0.00 0.00 57.07 55.93 1m3i s TYR 273 Cb -0.21 -1.39 0.00 0.00 -0.11 0.00 0.00 41.96 40.25 1m3i s TYR 273 CO 0.23 -0.08 0.00 0.41 -1.11 0.00 0.00 175.55 175.00 1m3i n GLY 274 N 2.62 -0.17 3.69 0.71 0.00 -0.23 -0.44 105.19 111.38 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 -0.31 -2.49 118.95 120.93 1m3i s ARG 275 Ca 0.00 -0.78 -0.00 0.00 -0.47 0.00 0.00 55.73 54.47 1m3i s ARG 275 Cb 0.00 0.60 0.03 0.00 -0.57 0.00 0.00 34.95 35.00 1m3i s ARG 275 CO 0.00 -0.71 -0.07 0.99 -1.08 0.00 0.00 175.30 174.42 1m3i s THR 276 N -3.84 0.98 -0.11 4.99 2.01 -0.46 0.49 115.64 119.70 1m3i s THR 276 Ca 0.07 -0.26 -0.17 0.00 0.31 0.00 0.00 61.69 61.64 1m3i s THR 276 Cb -0.04 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.41 1m3i s THR 276 CO -0.01 0.36 0.43 -0.63 -0.69 0.00 0.00 174.62 174.08 1m3i s ILE 277 N 1.73 5.19 -0.18 1.82 1.01 -0.08 -1.80 121.20 128.89 1m3i s ILE 277 Ca 0.05 0.86 -0.00 0.00 0.00 0.00 0.00 60.65 61.56 1m3i s ILE 277 Cb -0.13 -3.77 0.01 0.00 0.01 0.00 0.00 42.46 38.59 1m3i s ILE 277 CO -0.08 0.37 -0.16 -0.31 0.00 0.00 0.00 174.94 174.77 1m3i s TYR 278 N 0.36 2.81 -0.09 3.97 1.51 0.10 -0.25 117.35 125.76 1m3i s TYR 278 Ca 0.24 -1.32 0.02 0.00 -1.01 0.00 0.00 57.07 54.99 1m3i s TYR 278 Cb -0.15 -1.94 -0.02 0.00 -0.11 0.00 0.00 41.96 39.74 1m3i s TYR 278 CO 0.09 -0.66 -0.13 0.08 -1.11 0.00 0.00 175.55 173.82 1m3i s VAL 279 N 1.18 3.08 -0.10 0.71 1.01 -0.14 0.25 120.40 126.39 1m3i s VAL 279 Ca 0.02 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.35 1m3i s VAL 279 Cb -0.14 -2.25 -0.00 0.00 0.00 0.00 0.00 36.38 33.99 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 -0.20 3.02 -0.25 2.72 2.20 -0.39 0.13 119.74 126.97 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 0.00 175.35 174.65 1m3i s LEU 281 N 0.25 3.19 -0.02 5.43 1.02 0.21 -1.29 118.68 127.48 1m3i s LEU 281 Ca -0.15 -0.96 0.05 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 44.39 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 1.29 0.06 1.70 -1.05 -0.44 0.23 118.70 121.78 1m3i s GLU 282 Ca -0.01 -0.55 -0.04 0.00 -0.15 0.00 0.00 54.97 54.22 1m3i s GLU 282 Cb -0.17 -1.24 -0.03 0.00 -0.44 0.00 0.00 34.13 32.26 1m3i s GLU 282 CO -0.05 0.32 0.04 -0.08 0.95 0.00 0.00 175.26 176.44 1m3i s THR 283 N -0.31 0.19 -0.36 1.83 -1.32 0.00 0.07 115.64 115.75 1m3i s THR 283 Ca 0.05 -1.60 0.20 0.00 -1.21 0.00 0.00 61.69 59.13 1m3i s THR 283 Cb -0.07 -1.46 -0.28 0.00 -1.51 0.00 0.00 72.50 69.18 1m3i s THR 283 CO -0.00 -0.88 0.59 0.35 -2.21 0.00 0.00 174.62 172.47 1m3i n THR 284 N 0.05 0.00 -1.67 5.08 -2.24 -1.18 -0.29 114.28 114.03 1m3i n THR 284 Ca -0.14 -0.30 -0.45 0.00 -2.27 0.00 0.00 64.05 60.88 1m3i n THR 284 Cb 0.61 0.39 -0.03 0.00 -2.10 0.00 0.00 70.33 69.20 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 -1.93 2.94 -0.73 3.42 2.88 -1.26 -4.80 113.62 114.15 1m3i n SER 285 Ca -0.01 1.11 0.10 0.00 -1.33 0.00 0.00 58.87 58.74 1m3i n SER 285 Cb 0.45 -1.43 0.29 0.00 -0.75 0.00 0.00 64.21 62.77 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 2.83 2.15 -4.60 -3.46 7.64 -1.26 -4.80 113.62 112.12 1m3i n SER 286 Ca 0.14 -1.84 -0.33 0.00 1.01 0.00 0.00 58.87 57.86 1m3i n SER 286 Cb 0.30 -0.18 0.14 0.00 -1.01 0.00 0.00 64.21 63.46 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 0.65 -0.13 -0.16 6.43 2.88 -1.26 -3.34 113.62 118.69 1m3i n SER 287 Ca 0.16 0.46 0.12 0.00 -1.33 0.00 0.00 58.87 58.29 1m3i n SER 287 Cb 0.39 -1.40 0.29 0.00 -0.75 0.00 0.00 64.21 62.74 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 -3.08 0.51 -0.51 -1.46 2.85 -0.77 -3.88 118.16 111.82 1m3i n LYS 288 Ca 0.11 -0.31 0.10 0.00 -1.05 0.00 0.00 58.31 57.15 1m3i n LYS 288 Cb 0.52 -1.49 0.33 0.00 -0.65 0.00 0.00 35.03 33.74 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 -0.97 4.27 0.31 -5.58 10.43 -1.26 -4.52 116.55 119.24 1m3i n ASP 289 Ca 0.09 -2.27 -0.17 0.00 2.57 0.00 0.00 54.79 55.02 1m3i n ASP 289 Cb 0.35 -0.53 -0.08 0.00 1.84 0.00 0.00 41.12 42.69 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 4.00 0.26 -0.04 2.53 2.07 -1.94 0.39 116.25 123.51 1m3i h VAL 290 Ca 0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1m3i h VAL 290 Cb 1.23 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 31.20 1m3i h VAL 290 CO 0.14 0.00 -0.49 -0.61 0.02 0.00 0.00 177.57 176.63 1m3i h GLN 291 N -0.87 -0.59 -0.90 1.57 4.15 -1.90 0.60 115.11 117.17 1m3i h GLN 291 Ca -0.06 0.04 0.17 0.00 0.77 0.00 0.00 58.65 59.56 1m3i h GLN 291 Cb 0.72 0.13 -0.07 0.00 0.21 0.00 0.00 27.48 28.47 1m3i h GLN 291 CO 0.04 -0.39 0.58 0.00 -1.93 0.00 0.00 178.83 177.13 1m3i h ALA 292 N -0.21 1.94 0.07 3.38 0.00 -1.83 0.12 119.26 122.74 1m3i h ALA 292 Ca 0.04 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1m3i h ALA 292 Cb 0.69 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1m3i h ALA 292 CO -0.37 -0.21 -0.03 0.00 0.00 0.00 0.00 179.25 178.64 1m3i h ALA 293 N 1.61 -0.09 -0.04 0.00 0.00 0.21 -1.41 119.26 119.54 1m3i h ALA 293 Ca 0.46 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 55.22 1m3i h ALA 293 Cb 0.88 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 1m3i h ALA 293 CO -0.21 -0.37 -0.23 0.74 0.00 0.00 0.00 179.25 179.18 1m3i h PHE 294 N -0.47 -0.63 -0.30 0.00 0.05 0.14 -1.28 116.94 114.45 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 0.40 0.28 -0.07 0.00 2.00 0.00 0.00 35.95 38.57 1m3i h PHE 294 CO 0.05 -0.32 -0.12 0.87 -0.18 0.00 0.00 178.31 178.60 1m3i h LYS 295 N -0.35 -0.07 -0.91 1.51 1.57 -0.83 0.31 116.57 117.81 1m3i h LYS 295 Ca 0.07 0.00 0.26 0.00 -1.87 0.00 0.00 60.65 59.12 1m3i h LYS 295 Cb 0.45 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.74 1m3i h LYS 295 CO -0.24 -0.04 0.65 0.00 -0.57 0.00 0.00 179.45 179.24 1m3i h ALA 296 N 1.19 2.82 0.05 3.86 0.00 -0.64 -0.04 119.26 126.50 1m3i h ALA 296 Ca 0.15 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1m3i h ALA 296 Cb 0.30 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1m3i h ALA 296 CO -0.35 -1.08 -0.02 1.25 0.00 0.00 0.00 179.25 179.04 1m3i h LEU 297 N 0.03 -0.06 0.42 0.00 5.85 0.73 -2.55 115.31 119.73 1m3i h LEU 297 Ca 0.43 -0.52 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1m3i h LEU 297 Cb 1.70 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.74 1m3i h LEU 297 CO -0.02 0.52 -0.25 0.40 -0.34 0.00 0.00 178.44 178.75 1m3i h ILE 298 N -0.66 0.47 0.00 4.05 2.04 -0.23 -2.41 117.51 120.77 1m3i h ILE 298 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1m3i h ILE 298 Cb 0.58 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.13 1m3i h ILE 298 CO 0.01 0.00 0.00 0.29 0.00 0.00 0.00 178.15 178.45 1m3i n LYS 299 N -5.39 0.13 -3.54 2.37 4.01 -0.19 -4.89 118.16 110.67 1m3i n LYS 299 Ca -0.11 0.54 -0.19 0.00 -0.51 0.00 0.00 58.31 58.05 1m3i n LYS 299 Cb 0.29 -1.87 0.06 0.00 -0.51 0.00 0.00 35.03 33.01 1m3i n LYS 299 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1m3i n ASN 300 N -2.14 -2.11 -4.44 4.39 5.15 -0.91 -5.02 115.26 110.19 1m3i n ASN 300 Ca -0.00 -0.73 -0.26 0.00 -0.60 0.00 0.00 54.58 53.00 1m3i n ASN 300 Cb 0.09 -4.62 0.15 0.00 -0.53 0.00 0.00 39.78 34.87 1m3i n ASN 300 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1m3i s THR 301 N -3.50 2.02 0.13 -0.44 -4.23 -1.15 -5.01 115.64 103.47 1m3i s THR 301 Ca 0.05 -0.43 0.05 0.00 -1.18 0.00 0.00 61.69 60.19 1m3i s THR 301 Cb -0.01 -2.60 -0.20 0.00 1.34 0.00 0.00 72.50 71.03 1m3i s THR 301 CO 0.77 0.00 1.30 -0.78 -0.54 0.00 0.00 174.62 175.37 1m3i h ASP 302 N -0.95 0.08 -0.50 3.99 -0.00 -1.95 -3.32 116.42 113.76 1m3i h ASP 302 Ca -0.38 -0.08 0.15 0.00 -0.00 0.00 0.00 57.03 56.72 1m3i h ASP 302 Cb 1.25 -0.02 -0.02 0.00 -0.00 0.00 0.00 39.33 40.53 1m3i h ASP 302 CO 0.36 1.02 0.37 0.40 -0.00 0.00 0.00 179.24 181.39 1m3i h ILE 303 N 0.02 0.71 0.00 2.25 1.08 -1.95 -2.04 117.51 117.58 1m3i h ILE 303 Ca -0.03 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.44 1m3i h ILE 303 Cb 1.72 0.74 -0.00 0.00 -3.07 0.00 0.00 36.82 36.21 1m3i h ILE 303 CO 0.14 0.00 -0.01 0.07 -0.69 0.00 0.00 178.15 177.65 1m3i h LYS 304 N 0.00 0.00 -0.72 2.37 5.09 -1.82 -1.57 116.57 119.92 1m3i h LYS 304 Ca 0.24 0.00 -0.05 0.00 0.09 0.00 0.00 60.65 60.92 1m3i h LYS 304 Cb 0.98 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 33.28 1m3i h LYS 304 CO -0.00 0.01 0.07 0.09 -2.09 0.00 0.00 179.45 177.53 1m3i n ASN 305 N -3.17 4.53 -4.66 7.07 4.13 -0.77 -4.47 115.26 117.93 1m3i n ASN 305 Ca -0.02 -2.79 -0.40 0.00 1.68 0.00 0.00 54.58 53.05 1m3i n ASN 305 Cb 0.17 -0.66 -0.06 0.00 -1.54 0.00 0.00 39.78 37.69 1m3i n ASN 305 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1m3i s SER 306 N -0.62 6.68 0.16 6.41 1.04 -0.59 -4.94 113.70 121.83 1m3i s SER 306 Ca 0.42 0.83 0.05 0.00 0.48 0.00 0.00 55.95 57.73 1m3i s SER 306 Cb 0.33 -2.35 0.48 0.00 0.10 0.00 0.00 66.02 64.59 1m3i s SER 306 CO 0.12 -0.27 0.74 0.00 0.98 0.00 0.00 173.24 174.81 1m3i n GLN 307 N 5.04 -0.03 -0.03 4.02 1.13 -1.26 0.25 117.38 126.49 1m3i n GLN 307 Ca -0.01 0.68 -0.09 0.00 -1.94 0.00 0.00 57.00 55.64 1m3i n GLN 307 Cb 0.50 -1.15 -0.03 0.00 0.11 0.00 0.00 30.24 29.67 1m3i n GLN 307 CO 0.00 0.00 0.00 0.37 -1.44 0.00 0.00 177.06 175.99 1m3i h GLN 308 N 0.00 -0.28 0.00 -1.09 5.75 -1.93 -1.68 115.11 115.88 1m3i h GLN 308 Ca 0.34 0.02 -0.07 0.00 -0.15 0.00 0.00 58.65 58.79 1m3i h GLN 308 Cb 0.80 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.40 1m3i h GLN 308 CO -0.41 -0.19 -0.34 1.88 -2.65 0.00 0.00 178.83 177.12 1m3i h TYR 309 N -0.29 0.00 -0.57 3.99 0.05 -0.50 -3.22 116.97 116.42 1m3i h TYR 309 Ca 0.12 0.00 0.11 0.00 0.05 0.00 0.00 58.73 59.01 1m3i h TYR 309 Cb 0.48 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 38.14 1m3i h TYR 309 CO -0.39 0.34 0.10 0.87 -1.05 0.00 0.00 178.16 178.03 1m3i h LYS 310 N 0.00 0.22 -0.16 4.88 1.79 -0.87 0.18 116.57 122.61 1m3i h LYS 310 Ca -0.00 -0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.50 1m3i h LYS 310 Cb 0.90 -0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 31.43 1m3i h LYS 310 CO 0.04 0.15 -0.27 -0.44 -1.08 0.00 0.00 179.45 177.85 1m3i h ASP 311 N 0.23 -0.84 0.53 0.86 3.32 -1.54 0.55 116.42 119.52 1m3i h ASP 311 Ca 0.30 0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.47 1m3i h ASP 311 Cb 0.44 0.37 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 1m3i h ASP 311 CO -0.40 -0.31 -0.41 0.40 -1.72 0.00 0.00 179.24 176.80 1m3i h ILE 312 N -0.32 0.17 -0.99 0.35 5.03 -1.33 -2.21 117.51 118.20 1m3i h ILE 312 Ca 0.11 0.00 0.18 0.00 -0.12 0.00 0.00 64.86 65.03 1m3i h ILE 312 Cb 0.49 0.17 -0.10 0.00 -3.03 0.00 0.00 36.82 34.35 1m3i h ILE 312 CO -0.34 0.00 0.62 1.88 -0.68 0.00 0.00 178.15 179.62 1m3i h TYR 313 N -0.93 1.02 -0.24 1.37 0.99 -0.38 0.53 116.97 119.34 1m3i h TYR 313 Ca -0.06 0.03 0.04 0.00 2.00 0.00 0.00 58.73 60.75 1m3i h TYR 313 Cb 0.78 -0.31 -0.01 0.00 1.00 0.00 0.00 36.73 38.19 1m3i h TYR 313 CO -0.17 0.26 0.17 1.49 -0.00 0.00 0.00 178.16 179.91 1m3i h GLU 314 N 0.76 0.13 -0.75 4.88 4.81 0.67 -1.91 114.58 123.18 1m3i h GLU 314 Ca 0.55 -0.01 -0.53 0.00 -0.13 0.00 0.00 59.36 59.25 1m3i h GLU 314 Cb 0.86 -0.03 -0.35 0.00 0.63 0.00 0.00 28.75 29.87 1m3i h GLU 314 CO -0.34 0.08 -0.30 0.09 -0.73 0.00 0.00 179.01 177.82 1m3i n ASN 315 N -4.49 5.26 -4.26 1.04 4.13 0.18 -4.97 115.26 112.15 1m3i n ASN 315 Ca 0.02 -3.77 -0.20 0.00 1.68 0.00 0.00 54.58 52.31 1m3i n ASN 315 Cb 0.22 -0.54 -0.11 0.00 -1.54 0.00 0.00 39.78 37.81 1m3i n ASN 315 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1m3i s SER 316 N -3.03 2.21 0.02 6.41 0.01 -0.72 -3.10 113.70 115.51 1m3i s SER 316 Ca 0.53 -0.78 0.04 0.00 1.31 0.00 0.00 55.95 57.06 1m3i s SER 316 Cb 0.43 -0.10 -0.02 0.00 0.21 0.00 0.00 66.02 66.55 1m3i s SER 316 CO 0.02 -0.08 -0.12 -0.55 0.41 0.00 0.00 173.24 172.92 1m3i s SER 317 N -2.33 1.45 -0.12 2.44 0.15 0.11 -4.75 113.70 110.66 1m3i s SER 317 Ca 0.09 -0.37 0.02 0.00 0.70 0.00 0.00 55.95 56.38 1m3i s SER 317 Cb -0.07 -0.11 0.01 0.00 -1.71 0.00 0.00 66.02 64.15 1m3i s SER 317 CO 0.04 0.05 -0.17 -0.36 1.20 0.00 0.00 173.24 174.00 1m3i s PHE 318 N -0.68 2.13 -0.32 3.44 0.40 0.03 -1.33 117.98 121.65 1m3i s PHE 318 Ca 0.01 -1.04 0.03 0.00 -0.60 0.00 0.00 56.93 55.34 1m3i s PHE 318 Cb -0.07 -1.52 0.09 0.00 0.51 0.00 0.00 43.02 42.04 1m3i s PHE 318 CO 0.01 -0.52 0.03 0.99 0.70 0.00 0.00 175.22 176.42 1m3i s THR 319 N 0.99 2.02 -0.05 0.64 2.01 -0.41 -0.72 115.64 120.12 1m3i s THR 319 Ca -0.06 -2.04 -0.10 0.00 0.31 0.00 0.00 61.69 59.80 1m3i s THR 319 Cb -0.15 -2.43 -0.05 0.00 0.01 0.00 0.00 72.50 69.88 1m3i s THR 319 CO -0.02 -0.50 0.27 0.00 -0.69 0.00 0.00 174.62 173.68 1m3i s ALA 320 N 1.06 3.80 -0.08 7.40 0.00 0.12 -1.26 121.76 132.80 1m3i s ALA 320 Ca 0.07 -0.45 -0.06 0.00 0.00 0.00 0.00 51.96 51.52 1m3i s ALA 320 Cb -0.19 -2.16 0.03 0.00 0.00 0.00 0.00 23.12 20.80 1m3i s ALA 320 CO -0.10 0.57 0.20 0.14 0.00 0.00 0.00 175.76 176.57 1m3i s VAL 321 N -1.09 -0.02 -0.02 0.00 -7.23 0.14 -1.00 120.40 111.17 1m3i s VAL 321 Ca 0.20 0.08 -0.15 0.00 -1.81 0.00 0.00 61.98 60.30 1m3i s VAL 321 Cb -0.14 -0.30 -0.05 0.00 0.56 0.00 0.00 36.38 36.44 1m3i s VAL 321 CO 0.10 0.03 0.42 0.68 -0.31 0.00 0.00 175.10 176.01 1m3i s VAL 322 N 0.66 5.05 -0.21 1.32 -7.23 -1.13 0.02 120.40 118.88 1m3i s VAL 322 Ca -0.05 0.85 -0.02 0.00 -1.81 0.00 0.00 61.98 60.96 1m3i s VAL 322 Cb -0.06 -3.73 0.06 0.00 0.56 0.00 0.00 36.38 33.21 1m3i s VAL 322 CO -0.04 0.54 0.00 -0.76 -0.31 0.00 0.00 175.10 174.54 1m3i s LEU 323 N -0.81 1.67 0.00 1.32 1.43 -0.74 -4.62 118.68 116.93 1m3i s LEU 323 Ca 0.24 -0.93 0.00 0.00 -1.03 0.00 0.00 54.13 52.41 1m3i s LEU 323 Cb -0.16 -0.81 0.00 0.00 0.03 0.00 0.00 46.19 45.25 1m3i s LEU 323 CO 0.13 -0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.04 1m3i n GLY 324 N 4.91 0.23 3.90 -3.19 0.00 -1.26 -1.35 105.19 108.43 1m3i n GLY 324 Ca -0.10 -1.72 -0.29 0.00 0.00 0.00 0.00 46.02 43.91 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 1.62 0.00 -0.02 0.00 -1.04 -4.33 107.32 103.56 1m3i s GLY 325 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 44.72 44.20 1m3i s GLY 325 CO 0.00 -0.14 0.00 1.22 0.00 0.00 0.00 173.10 174.18 1m3i n ASP 326 N -2.97 0.00 -4.93 1.64 9.92 -1.26 -4.80 116.55 114.15 1m3i n ASP 326 Ca 0.07 0.00 -0.28 0.00 -0.53 0.00 0.00 54.79 54.04 1m3i n ASP 326 Cb 0.58 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 41.03 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 0.00 3.97 0.26 2.24 0.00 -1.26 -5.06 121.76 121.92 1m3i s ALA 327 Ca 0.00 -0.95 -0.30 0.00 0.00 0.00 0.00 51.96 50.71 1m3i s ALA 327 Cb 0.00 -1.79 -0.11 0.00 0.00 0.00 0.00 23.12 21.23 1m3i s ALA 327 CO 0.00 0.67 1.50 -1.14 0.00 0.00 0.00 175.76 176.79 1m3i s GLN 328 N -2.90 4.21 0.26 0.00 -0.44 -1.26 -4.79 119.66 114.74 1m3i s GLN 328 Ca 0.35 2.40 -0.12 0.00 -2.50 0.00 0.00 55.36 55.49 1m3i s GLN 328 Cb -0.12 -3.08 0.37 0.00 -1.64 0.00 0.00 33.01 28.54 1m3i s GLN 328 CO 0.28 -0.50 1.56 1.49 0.50 0.00 0.00 175.29 178.62 1m3i h GLU 329 N 5.00 -0.00 -1.25 1.67 4.22 -1.90 0.33 114.58 122.64 1m3i h GLU 329 Ca -0.46 0.00 -0.67 0.00 0.08 0.00 0.00 59.36 58.31 1m3i h GLU 329 Cb 1.22 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 30.14 1m3i h GLU 329 CO 0.79 -0.00 0.45 0.72 -2.18 0.00 0.00 179.01 178.78 1m3i n HIS 330 N -5.56 3.10 -2.80 0.92 8.25 -1.26 -4.88 115.22 112.98 1m3i n HIS 330 Ca 0.14 -2.72 -0.43 0.00 -0.26 0.00 0.00 57.72 54.45 1m3i n HIS 330 Cb 0.46 -1.05 -0.03 0.00 1.12 0.00 0.00 29.99 30.49 1m3i n HIS 330 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1m3i s ASN 331 N -2.15 6.43 0.06 0.41 3.04 0.11 -5.00 114.94 117.85 1m3i s ASN 331 Ca 0.57 -1.49 0.06 0.00 0.04 0.00 0.00 52.86 52.05 1m3i s ASN 331 Cb 0.46 -2.45 -0.04 0.00 -1.54 0.00 0.00 41.25 37.69 1m3i s ASN 331 CO -0.12 -1.33 -0.11 -0.75 -3.04 0.00 0.00 177.10 171.75 1m3i s LYS 332 N 3.79 2.25 -0.04 0.43 2.20 -1.26 -2.86 119.74 124.25 1m3i s LYS 332 Ca 0.32 -0.92 -0.02 0.00 -0.36 0.00 0.00 55.97 55.00 1m3i s LYS 332 Cb -0.08 -2.34 0.03 0.00 -1.51 0.00 0.00 37.83 33.94 1m3i s LYS 332 CO -0.02 0.55 0.07 0.08 -0.36 0.00 0.00 175.35 175.67 1m3i s VAL 333 N -1.07 -0.12 -0.12 4.02 1.01 -0.17 -5.03 120.40 118.92 1m3i s VAL 333 Ca 0.18 0.40 -0.00 0.00 0.00 0.00 0.00 61.98 62.56 1m3i s VAL 333 Cb -0.11 -0.16 0.02 0.00 0.00 0.00 0.00 36.38 36.13 1m3i s VAL 333 CO 0.10 0.17 -0.08 -0.69 0.00 0.00 0.00 175.10 174.59 1m3i s VAL 334 N 2.09 1.10 0.26 2.92 1.01 -1.26 0.15 120.40 126.66 1m3i s VAL 334 Ca 0.03 -0.33 -0.09 0.00 0.00 0.00 0.00 61.98 61.59 1m3i s VAL 334 Cb -0.12 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 1m3i s VAL 334 CO -0.03 0.38 0.43 -0.89 0.00 0.00 0.00 175.10 174.98 1m3i s THR 335 N 1.68 0.00 -1.01 3.92 2.01 0.11 -4.98 115.64 117.37 1m3i s THR 335 Ca 0.05 -1.53 0.22 0.00 0.31 0.00 0.00 61.69 60.74 1m3i s THR 335 Cb -0.13 -2.33 -0.17 0.00 0.01 0.00 0.00 72.50 69.89 1m3i s THR 335 CO -0.08 0.00 1.04 0.29 -0.69 0.00 0.00 174.62 175.17 1m3i n LYS 336 N -0.39 0.01 -3.22 4.92 5.02 -1.26 -0.79 118.16 122.44 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 0.62 -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 -3.00 6.21 0.56 4.39 -1.08 -1.26 -4.91 116.67 117.58 1m3i s ASP 337 Ca 0.09 -0.98 0.34 0.00 -0.52 0.00 0.00 52.55 51.48 1m3i s ASP 337 Cb 0.16 -2.26 1.52 0.00 -1.46 0.00 0.00 42.92 40.88 1m3i s ASP 337 CO 0.82 -0.81 2.05 0.15 0.52 0.00 0.00 175.17 177.90 1m3i h PHE 338 N 8.91 0.00 -0.77 -5.34 3.57 -1.97 -2.44 116.94 118.90 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 0.04 0.47 -0.44 -2.23 0.00 0.00 178.31 176.87 1m3i h ASP 339 N 0.00 0.92 -0.21 0.41 3.45 -1.97 0.21 116.42 119.22 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 0.43 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 38.96 1m3i h ASP 339 CO 0.01 0.70 0.23 -0.33 -1.57 0.00 0.00 179.24 178.28 1m3i h GLU 340 N 1.05 0.00 0.00 3.56 4.39 -1.86 1.21 114.58 122.93 1m3i h GLU 340 Ca 0.28 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.78 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 -0.05 0.00 -0.99 0.82 -1.16 0.00 0.00 179.01 177.63 1m3i h ILE 341 N 0.00 1.38 -0.49 3.13 1.08 -0.75 -3.09 117.51 118.77 1m3i h ILE 341 Ca 0.10 -3.02 -0.13 0.00 -0.39 0.00 0.00 64.86 61.43 1m3i h ILE 341 Cb 0.56 2.67 -0.01 0.00 -3.07 0.00 0.00 36.82 36.96 1m3i h ILE 341 CO -0.00 0.79 -0.19 0.03 -0.69 0.00 0.00 178.15 178.09 1m3i h ARG 342 N 0.00 0.99 0.29 2.37 3.08 0.30 -3.02 114.38 118.39 1m3i h ARG 342 Ca -0.05 -0.41 -0.01 0.00 0.07 0.00 0.00 59.98 59.58 1m3i h ARG 342 Cb 1.70 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.72 1m3i h ARG 342 CO 0.11 1.09 -0.14 -0.22 -1.07 0.00 0.00 179.97 179.74 1m3i h LYS 343 N 0.85 -0.37 -1.20 0.04 3.64 -0.97 0.90 116.57 119.47 1m3i h LYS 343 Ca 0.12 0.03 0.35 0.00 -1.27 0.00 0.00 60.65 59.87 1m3i h LYS 343 Cb 0.76 0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.62 1m3i h LYS 343 CO 0.06 -0.20 0.86 0.28 -2.27 0.00 0.00 179.45 178.18 1m3i h VAL 344 N -0.46 0.40 0.00 2.00 2.07 -1.51 0.50 116.25 119.26 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 0.34 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1m3i h VAL 344 CO 0.06 0.00 -0.41 0.40 0.02 0.00 0.00 177.57 177.64 1m3i h ILE 345 N 0.01 1.42 -0.42 4.57 2.04 -1.28 -3.22 117.51 120.64 1m3i h ILE 345 Ca 0.57 -2.23 0.06 0.00 1.00 0.00 0.00 64.86 64.27 1m3i h ILE 345 Cb 2.27 2.85 -0.05 0.00 -0.74 0.00 0.00 36.82 41.14 1m3i h ILE 345 CO -0.02 0.48 0.10 0.50 0.00 0.00 0.00 178.15 179.21 1m3i h LYS 346 N -1.00 0.23 -0.37 2.37 3.64 0.12 -1.82 116.57 119.74 1m3i h LYS 346 Ca -0.11 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.27 1m3i h LYS 346 Cb 1.06 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 1m3i h LYS 346 CO -0.07 0.15 0.25 -0.44 -2.27 0.00 0.00 179.45 177.07 1m3i h ASP 347 N 0.24 0.37 -0.62 4.20 5.19 -0.27 -2.04 116.42 123.49 1m3i h ASP 347 Ca 0.20 -0.01 -0.26 0.00 -0.62 0.00 0.00 57.03 56.35 1m3i h ASP 347 Cb 0.24 -0.09 -0.16 0.00 0.18 0.00 0.00 39.33 39.50 1m3i h ASP 347 CO -0.25 0.26 0.33 0.59 -3.12 0.00 0.00 179.24 177.05 1m3i n ASN 348 N -4.48 3.78 0.16 6.45 5.03 -0.70 -4.24 115.26 121.26 1m3i n ASN 348 Ca 0.03 -3.00 0.13 0.00 0.87 0.00 0.00 54.58 52.61 1m3i n ASN 348 Cb 0.12 -0.71 0.30 0.00 -1.02 0.00 0.00 39.78 38.47 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 1.92 1.00 -2.90 5.41 0.00 -1.23 -3.46 119.26 120.01 1m3i h ALA 349 Ca 0.32 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.76 1m3i h ALA 349 Cb 2.11 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 19.72 1m3i h ALA 349 CO 0.66 0.00 -0.77 0.99 0.00 0.00 0.00 179.25 180.13 1m3i s THR 350 N -3.16 1.61 0.04 0.00 2.01 -1.26 -1.71 115.64 113.16 1m3i s THR 350 Ca 0.09 -1.84 0.04 0.00 0.31 0.00 0.00 61.69 60.29 1m3i s THR 350 Cb 0.09 -1.72 -0.02 0.00 0.01 0.00 0.00 72.50 70.86 1m3i s THR 350 CO 0.63 -0.36 -0.12 0.72 -0.69 0.00 0.00 174.62 174.79 1m3i s PHE 351 N -2.11 1.04 -0.16 4.92 -0.12 0.26 -4.78 117.98 117.03 1m3i s PHE 351 Ca 0.13 -0.37 -0.12 0.00 -0.05 0.00 0.00 56.93 56.52 1m3i s PHE 351 Cb -0.05 -0.62 -0.05 0.00 -0.63 0.00 0.00 43.02 41.67 1m3i s PHE 351 CO 0.05 0.01 0.22 0.45 -0.05 0.00 0.00 175.22 175.90 1m3i s SER 352 N -1.21 6.36 0.54 1.98 0.15 -1.26 0.17 113.70 120.42 1m3i s SER 352 Ca -0.01 0.41 0.34 0.00 0.70 0.00 0.00 55.95 57.39 1m3i s SER 352 Cb -0.08 -2.14 1.40 0.00 -1.71 0.00 0.00 66.02 63.50 1m3i s SER 352 CO 0.01 0.17 1.99 0.71 1.20 0.00 0.00 173.24 177.32 1m3i h THR 353 N 4.56 0.00 -0.44 6.45 1.35 0.21 -1.70 112.91 123.35 1m3i h THR 353 Ca -0.43 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 64.97 1m3i h THR 353 Cb 1.17 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 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 -3.03 2.80 -4.43 4.72 5.02 -1.25 -4.90 118.16 117.09 1m3i n LYS 354 Ca 0.00 -1.90 -0.26 0.00 -2.02 0.00 0.00 58.31 54.13 1m3i n LYS 354 Cb 0.29 -1.67 -0.11 0.00 -0.02 0.00 0.00 35.03 33.52 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 -0.77 3.56 -0.10 4.39 -0.87 -0.64 -5.11 114.94 115.40 1m3i s ASN 355 Ca 0.34 -0.90 -0.30 0.00 -1.57 0.00 0.00 52.86 50.43 1m3i s ASN 355 Cb 0.22 -0.31 -0.03 0.00 -0.02 0.00 0.00 41.25 41.10 1m3i s ASN 355 CO 0.17 0.09 1.37 -2.16 -2.57 0.00 0.00 177.10 174.00 1m3i s PRO 356 N -2.99 4.24 -0.17 -0.60 0.04 -1.26 -4.94 135.00 129.32 1m3i s PRO 356 Ca 0.24 1.84 -0.08 0.00 0.04 0.00 0.00 61.00 63.05 1m3i s PRO 356 Cb -0.07 -3.76 -0.04 0.00 0.04 0.00 0.00 34.50 30.67 1m3i s PRO 356 CO 0.12 -0.69 0.10 0.00 0.04 0.00 0.00 177.00 176.57 1m3i s ALA 357 N 3.29 3.60 0.29 8.56 0.00 -1.26 -4.29 121.76 131.94 1m3i s ALA 357 Ca 0.61 -0.71 0.09 0.00 0.00 0.00 0.00 51.96 51.95 1m3i s ALA 357 Cb -0.26 -1.99 -0.04 0.00 0.00 0.00 0.00 23.12 20.82 1m3i s ALA 357 CO 0.21 0.29 0.08 0.71 0.00 0.00 0.00 175.76 177.05 1m3i s TYR 358 N -0.02 2.77 0.38 0.00 4.12 -1.26 -4.88 117.35 118.47 1m3i s TYR 358 Ca 0.08 -0.25 -0.27 0.00 0.02 0.00 0.00 57.07 56.65 1m3i s TYR 358 Cb -0.12 -1.37 -0.09 0.00 -1.52 0.00 0.00 41.96 38.86 1m3i s TYR 358 CO 0.00 0.51 1.27 -1.25 0.02 0.00 0.00 175.55 176.10 1m3i s PRO 359 N -3.76 4.10 -0.05 -1.71 0.04 -1.26 -1.07 135.00 131.29 1m3i s PRO 359 Ca 0.34 2.09 -0.01 0.00 0.04 0.00 0.00 61.00 63.46 1m3i s PRO 359 Cb -0.05 -2.83 -0.03 0.00 0.04 0.00 0.00 34.50 31.63 1m3i s PRO 359 CO 0.22 -0.36 -0.05 -0.89 0.04 0.00 0.00 177.00 175.95 1m3i n ILE 360 N 0.31 0.30 -3.84 0.56 2.08 0.16 -4.47 119.36 114.46 1m3i n ILE 360 Ca 0.03 -0.10 -0.07 0.00 0.56 0.00 0.00 62.75 63.17 1m3i n ILE 360 Cb 0.44 -0.98 -0.00 0.00 -0.75 0.00 0.00 39.64 38.34 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 -4.83 -0.16 0.09 4.38 1.04 -1.23 -0.96 113.70 112.02 1m3i s SER 361 Ca -0.07 -0.77 -0.25 0.00 0.48 0.00 0.00 55.95 55.33 1m3i s SER 361 Cb 0.02 0.75 0.08 0.00 0.10 0.00 0.00 66.02 66.97 1m3i s SER 361 CO 0.11 -1.42 0.69 -0.72 0.98 0.00 0.00 173.24 172.88 1m3i s TYR 362 N -3.31 -0.50 -0.02 5.02 -0.85 -0.49 -1.20 117.35 116.01 1m3i s TYR 362 Ca 0.13 0.38 0.07 0.00 -0.52 0.00 0.00 57.07 57.13 1m3i s TYR 362 Cb -0.05 0.54 -0.02 0.00 0.38 0.00 0.00 41.96 42.80 1m3i s TYR 362 CO 0.08 -0.73 -0.23 0.95 -1.52 0.00 0.00 175.55 174.10 1m3i s THR 363 N -3.27 2.31 0.49 -3.49 -4.23 -1.01 -0.26 115.64 106.18 1m3i s THR 363 Ca 0.01 -1.04 0.07 0.00 -1.18 0.00 0.00 61.69 59.55 1m3i s THR 363 Cb -0.01 -1.84 0.02 0.00 1.34 0.00 0.00 72.50 72.01 1m3i s THR 363 CO -0.09 0.56 0.43 -0.44 -0.54 0.00 0.00 174.62 174.54 1m3i s SER 364 N -0.70 4.85 -0.07 3.99 0.01 -1.26 -1.91 113.70 118.61 1m3i s SER 364 Ca 0.11 -0.99 -0.03 0.00 1.31 0.00 0.00 55.95 56.35 1m3i s SER 364 Cb -0.10 -0.04 0.04 0.00 0.21 0.00 0.00 66.02 66.13 1m3i s SER 364 CO -0.00 -0.93 0.14 -0.69 0.41 0.00 0.00 173.24 172.17 1m3i s VAL 365 N -2.63 -0.15 0.18 3.43 1.01 -0.52 -1.31 120.40 120.41 1m3i s VAL 365 Ca 0.44 0.28 -0.32 0.00 0.00 0.00 0.00 61.98 62.38 1m3i s VAL 365 Cb -0.03 -0.25 -0.11 0.00 0.00 0.00 0.00 36.38 35.99 1m3i s VAL 365 CO 0.26 0.12 1.73 -0.36 0.00 0.00 0.00 175.10 176.85 1m3i s PHE 366 N 1.76 2.75 0.16 5.22 0.40 0.11 -0.95 117.98 127.43 1m3i s PHE 366 Ca -0.02 0.30 -0.16 0.00 -0.60 0.00 0.00 56.93 56.45 1m3i s PHE 366 Cb -0.12 -4.12 0.08 0.00 0.51 0.00 0.00 43.02 39.37 1m3i s PHE 366 CO -0.05 -4.32 1.75 -0.07 0.70 0.00 0.00 175.22 173.23 1m3i h LEU 367 N 7.24 0.14 0.00 -0.37 3.38 -1.78 0.96 115.31 124.87 1m3i h LEU 367 Ca -0.44 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1m3i h LEU 367 Cb 1.20 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1m3i h LEU 367 CO 0.95 0.11 0.00 1.17 0.09 0.00 0.00 178.44 180.76 1m3i n LYS 368 N -5.02 0.00 -0.16 1.13 4.81 -1.26 -3.63 118.16 114.03 1m3i n LYS 368 Ca 0.02 0.34 0.09 0.00 -0.87 0.00 0.00 58.31 57.89 1m3i n LYS 368 Cb 0.14 -1.08 0.27 0.00 0.02 0.00 0.00 35.03 34.38 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 -1.04 2.17 -1.79 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 52.70 1m3i n ASP 369 Cb 0.00 -0.20 -0.07 0.00 -1.03 0.00 0.00 41.12 39.81 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 0.66 -5.59 -4.80 -1.12 5.03 0.33 -4.96 115.26 104.82 1m3i n ASN 370 Ca 0.16 0.39 -0.37 0.00 0.87 0.00 0.00 54.58 55.63 1m3i n ASN 370 Cb 0.38 -4.87 -0.06 0.00 -1.02 0.00 0.00 39.78 34.21 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 -2.60 7.21 0.27 6.41 1.04 -1.24 -4.68 113.70 120.11 1m3i s SER 371 Ca 0.00 1.59 -0.29 0.00 0.48 0.00 0.00 55.95 57.72 1m3i s SER 371 Cb 0.00 -2.48 -0.10 0.00 0.10 0.00 0.00 66.02 63.54 1m3i s SER 371 CO 0.00 0.05 1.35 -0.69 0.98 0.00 0.00 173.24 174.92 1m3i s VAL 372 N -1.46 2.83 0.10 5.02 1.01 -1.26 0.06 120.40 126.70 1m3i s VAL 372 Ca 0.43 0.75 -0.29 0.00 0.00 0.00 0.00 61.98 62.86 1m3i s VAL 372 Cb -0.19 -3.48 -0.06 0.00 0.00 0.00 0.00 36.38 32.66 1m3i s VAL 372 CO 0.23 0.14 0.94 0.00 0.00 0.00 0.00 175.10 176.41 1m3i s ALA 373 N -0.47 3.25 -0.10 5.51 0.00 -0.42 -4.84 121.76 124.69 1m3i s ALA 373 Ca 0.54 0.54 0.01 0.00 0.00 0.00 0.00 51.96 53.05 1m3i s ALA 373 Cb -0.39 -3.25 0.02 0.00 0.00 0.00 0.00 23.12 19.49 1m3i s ALA 373 CO 0.46 -0.03 -0.10 0.00 0.00 0.00 0.00 175.76 176.10 1m3i s ALA 374 N 0.04 1.32 0.32 0.00 0.00 -1.26 -4.46 121.76 117.72 1m3i s ALA 374 Ca 0.46 -0.51 -0.26 0.00 0.00 0.00 0.00 51.96 51.66 1m3i s ALA 374 Cb -0.23 -0.78 -0.10 0.00 0.00 0.00 0.00 23.12 22.01 1m3i s ALA 374 CO 0.29 -0.21 0.94 0.08 0.00 0.00 0.00 175.76 176.87 1m3i s VAL 375 N 1.28 4.21 -0.27 0.00 1.01 0.12 -4.71 120.40 122.05 1m3i s VAL 375 Ca -0.03 1.83 0.00 0.00 0.00 0.00 0.00 61.98 63.78 1m3i s VAL 375 Cb -0.14 -4.01 0.05 0.00 0.00 0.00 0.00 36.38 32.28 1m3i s VAL 375 CO -0.04 0.14 -0.07 -1.00 0.00 0.00 0.00 175.10 174.14 1m3i s HIS 376 N -1.61 3.20 -0.11 5.22 3.76 0.11 -2.52 115.29 123.33 1m3i s HIS 376 Ca 0.50 -1.99 -0.01 0.00 -0.15 0.00 0.00 55.06 53.40 1m3i s HIS 376 Cb -0.19 -2.01 -0.03 0.00 1.11 0.00 0.00 32.58 31.46 1m3i s HIS 376 CO 0.24 -0.82 -0.05 -0.80 -0.85 0.00 0.00 174.74 172.45 1m3i s ASN 377 N 1.20 4.73 -0.19 1.40 0.01 0.11 0.23 114.94 122.44 1m3i s ASN 377 Ca -0.05 -0.07 -0.11 0.00 -0.71 0.00 0.00 52.86 51.92 1m3i s ASN 377 Cb -0.19 -1.49 0.06 0.00 0.41 0.00 0.00 41.25 40.04 1m3i s ASN 377 CO -0.04 0.27 0.46 -0.75 -1.51 0.00 0.00 177.10 175.53 1m3i s LYS 378 N -0.25 0.46 0.17 -0.60 2.20 -1.26 -0.89 119.74 119.57 1m3i s LYS 378 Ca 0.04 0.83 -0.24 0.00 -0.36 0.00 0.00 55.97 56.25 1m3i s LYS 378 Cb -0.13 0.03 0.07 0.00 -1.51 0.00 0.00 37.83 36.30 1m3i s LYS 378 CO 0.02 -0.15 1.02 -0.08 -0.36 0.00 0.00 175.35 175.80 1m3i s THR 379 N 1.30 0.00 0.32 3.43 -1.32 -0.50 -2.77 115.64 116.09 1m3i s THR 379 Ca -0.08 -0.61 0.10 0.00 -1.21 0.00 0.00 61.69 59.89 1m3i s THR 379 Cb -0.07 -2.47 -0.06 0.00 -1.51 0.00 0.00 72.50 68.38 1m3i s THR 379 CO -0.12 0.00 -0.12 -1.81 -2.21 0.00 0.00 174.62 170.36 1m3i s ASP 380 N -3.19 3.73 -0.08 8.08 -0.00 -1.25 -1.44 116.67 122.53 1m3i s ASP 380 Ca 0.17 -1.12 -0.30 0.00 -0.00 0.00 0.00 52.55 51.30 1m3i s ASP 380 Cb -0.02 -0.35 0.11 0.00 -0.00 0.00 0.00 42.92 42.66 1m3i s ASP 380 CO 0.04 -0.13 0.96 -0.72 -0.00 0.00 0.00 175.17 175.32 1m3i s TYR 381 N -2.57 -0.34 -0.39 4.23 -0.85 -0.64 -4.87 117.35 111.92 1m3i s TYR 381 Ca 0.32 0.36 -0.21 0.00 -0.52 0.00 0.00 57.07 57.02 1m3i s TYR 381 Cb -0.00 0.50 0.01 0.00 0.38 0.00 0.00 41.96 42.85 1m3i s TYR 381 CO 0.16 -0.44 0.65 0.96 -1.52 0.00 0.00 175.55 175.36 1m3i s ILE 382 N -2.30 4.85 -1.00 -3.49 -4.36 -1.26 -1.74 121.20 111.89 1m3i s ILE 382 Ca 0.03 0.39 -0.22 0.00 -0.26 0.00 0.00 60.65 60.59 1m3i s ILE 382 Cb -0.01 -4.14 0.07 0.00 1.25 0.00 0.00 42.46 39.63 1m3i s ILE 382 CO -0.05 -0.45 1.39 -0.70 0.24 0.00 0.00 174.94 175.37 1m3i s GLU 383 N 2.79 3.60 -0.21 0.37 -6.30 -0.03 -4.84 118.70 114.08 1m3i s GLU 383 Ca 0.24 -1.26 -0.15 0.00 -2.50 0.00 0.00 54.97 51.30 1m3i s GLU 383 Cb -0.14 -5.27 -0.04 0.00 0.00 0.00 0.00 34.13 28.68 1m3i s GLU 383 CO 0.17 -2.12 0.36 0.95 0.02 0.00 0.00 175.26 174.64 1m3i s THR 384 N 4.50 5.22 0.26 -1.70 -4.23 -1.26 -2.51 115.64 115.91 1m3i s THR 384 Ca 0.43 0.62 0.10 0.00 -1.18 0.00 0.00 61.69 61.66 1m3i s THR 384 Cb -0.01 -3.69 -0.04 0.00 1.34 0.00 0.00 72.50 70.09 1m3i s THR 384 CO -0.10 0.26 -0.05 0.42 -0.54 0.00 0.00 174.62 174.61 1m3i s THR 385 N 1.31 3.25 -0.01 3.99 -4.23 -0.13 -4.96 115.64 114.86 1m3i s THR 385 Ca 0.17 -1.97 -0.10 0.00 -1.18 0.00 0.00 61.69 58.61 1m3i s THR 385 Cb -0.15 -2.72 0.01 0.00 1.34 0.00 0.00 72.50 70.99 1m3i s THR 385 CO 0.07 -0.35 0.21 -0.94 -0.54 0.00 0.00 174.62 173.08 1m3i s SER 386 N -3.54 -0.08 0.07 3.99 1.04 -1.26 -0.24 113.70 113.68 1m3i s SER 386 Ca 0.30 -0.05 0.05 0.00 0.48 0.00 0.00 55.95 56.74 1m3i s SER 386 Cb -0.06 0.27 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 1m3i s SER 386 CO 0.18 -0.38 -0.14 -0.89 0.98 0.00 0.00 173.24 172.99 1m3i s THR 387 N -1.26 1.13 0.06 2.02 2.01 0.19 -1.85 115.64 117.93 1m3i s THR 387 Ca -0.13 -1.33 0.05 0.00 0.31 0.00 0.00 61.69 60.59 1m3i s THR 387 Cb -0.06 -1.10 -0.03 0.00 0.01 0.00 0.00 72.50 71.32 1m3i s THR 387 CO 0.03 -0.23 -0.15 -1.83 -0.69 0.00 0.00 174.62 171.74 1m3i s GLU 388 N -1.78 0.96 0.08 4.92 -1.05 -1.26 0.44 118.70 121.02 1m3i s GLU 388 Ca -0.01 -0.87 0.07 0.00 -0.15 0.00 0.00 54.97 54.00 1m3i s GLU 388 Cb -0.10 -1.01 -0.03 0.00 -0.44 0.00 0.00 34.13 32.55 1m3i s GLU 388 CO 0.02 0.24 -0.18 0.71 0.95 0.00 0.00 175.26 177.00 1m3i s TYR 389 N -1.00 1.56 0.34 4.83 1.51 -0.68 -4.95 117.35 118.97 1m3i s TYR 389 Ca 0.02 -0.43 0.08 0.00 -1.01 0.00 0.00 57.07 55.73 1m3i s TYR 389 Cb -0.09 -0.87 -0.03 0.00 -0.11 0.00 0.00 41.96 40.86 1m3i s TYR 389 CO 0.02 0.14 0.26 -1.12 -1.11 0.00 0.00 175.55 173.74 1m3i s SER 390 N -1.76 5.12 0.79 2.29 0.01 -1.26 -0.84 113.70 118.04 1m3i s SER 390 Ca 0.03 -0.58 -0.11 0.00 1.31 0.00 0.00 55.95 56.60 1m3i s SER 390 Cb -0.10 -0.88 0.06 0.00 0.21 0.00 0.00 66.02 65.31 1m3i s SER 390 CO 0.03 -0.36 1.10 -0.54 0.41 0.00 0.00 173.24 173.88 1m3i s LYS 391 N -3.97 2.18 0.10 12.44 1.02 -1.14 -4.24 119.74 126.13 1m3i s LYS 391 Ca 0.41 0.60 -0.26 0.00 0.02 0.00 0.00 55.97 56.74 1m3i s LYS 391 Cb -0.05 -1.93 0.08 0.00 -0.52 0.00 0.00 37.83 35.41 1m3i s LYS 391 CO 0.26 -1.54 0.80 0.20 -0.92 0.00 0.00 175.35 174.15 1m3i s GLY 392 N -3.99 -0.43 0.03 -3.33 0.00 -1.05 -4.41 107.32 94.14 1m3i s GLY 392 Ca 0.60 0.58 0.02 0.00 0.00 0.00 0.00 44.72 45.92 1m3i s GLY 392 CO 0.54 0.19 -0.06 -1.59 0.00 0.00 0.00 173.10 172.17 1m3i s LYS 393 N -3.41 0.45 -0.26 2.90 0.00 -0.95 0.36 119.74 118.83 1m3i s LYS 393 Ca 0.06 -0.61 -0.17 0.00 0.00 0.00 0.00 55.97 55.25 1m3i s LYS 393 Cb -0.02 -0.22 -0.03 0.00 0.00 0.00 0.00 37.83 37.56 1m3i s LYS 393 CO -0.07 0.04 0.45 0.42 0.00 0.00 0.00 175.35 176.19 1m3i s ILE 394 N -1.15 5.12 -0.24 3.79 1.01 0.35 -1.39 121.20 128.69 1m3i s ILE 394 Ca -0.09 0.74 -0.08 0.00 0.00 0.00 0.00 60.65 61.22 1m3i s ILE 394 Cb -0.08 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 1m3i s ILE 394 CO 0.00 0.12 0.10 0.20 0.00 0.00 0.00 174.94 175.36 1m3i s ASN 395 N 1.58 5.49 -0.09 3.58 0.02 0.83 -0.09 114.94 126.27 1m3i s ASN 395 Ca 0.18 -0.08 -0.02 0.00 -1.02 0.00 0.00 52.86 51.93 1m3i s ASN 395 Cb -0.16 -1.99 -0.03 0.00 0.02 0.00 0.00 41.25 39.10 1m3i s ASN 395 CO 0.09 0.02 -0.01 -0.76 0.02 0.00 0.00 177.10 176.46 1m3i s LEU 396 N 1.33 3.47 -0.06 0.60 1.43 -0.63 -0.64 118.68 124.18 1m3i s LEU 396 Ca 0.06 0.08 -0.03 0.00 -1.03 0.00 0.00 54.13 53.21 1m3i s LEU 396 Cb -0.15 -1.79 0.04 0.00 0.03 0.00 0.00 46.19 44.32 1m3i s LEU 396 CO 0.05 0.35 0.11 -0.62 0.23 0.00 0.00 176.35 176.46 1m3i s ASP 397 N -0.69 0.98 -0.12 2.29 -1.08 -0.70 -1.89 116.67 115.46 1m3i s ASP 397 Ca 0.11 0.18 0.01 0.00 -0.52 0.00 0.00 52.55 52.33 1m3i s ASP 397 Cb -0.12 0.05 -0.01 0.00 -1.46 0.00 0.00 42.92 41.38 1m3i s ASP 397 CO 0.02 -0.25 -0.17 -2.28 0.52 0.00 0.00 175.17 173.02 1m3i s HIS 398 N 2.23 2.73 0.00 -5.34 5.65 0.34 -0.74 115.29 120.16 1m3i s HIS 398 Ca 0.04 -0.76 0.00 0.00 0.25 0.00 0.00 55.06 54.59 1m3i s HIS 398 Cb -0.12 -1.80 0.00 0.00 -1.18 0.00 0.00 32.58 29.48 1m3i s HIS 398 CO -0.04 -0.27 0.77 -1.13 -0.65 0.00 0.00 174.74 173.42 1m3i n SER 399 N 3.50 0.00 -4.81 9.88 3.41 -0.80 -1.07 113.62 123.73 1m3i n SER 399 Ca -0.18 -1.59 -0.32 0.00 -0.26 0.00 0.00 58.87 56.52 1m3i n SER 399 Cb 0.53 -0.12 0.02 0.00 -0.26 0.00 0.00 64.21 64.38 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 -0.59 1.97 -1.39 5.00 0.00 -1.25 -4.59 107.32 106.47 1m3i s GLY 400 Ca 0.00 0.26 -0.07 0.00 0.00 0.00 0.00 44.72 44.92 1m3i s GLY 400 CO 0.00 0.57 2.48 0.00 0.00 0.00 0.00 173.10 176.15 1m3i n ALA 401 N -2.33 6.88 -3.79 3.20 0.00 0.19 -4.43 120.51 120.22 1m3i n ALA 401 Ca 0.08 -3.97 -0.03 0.00 0.00 0.00 0.00 53.44 49.52 1m3i n ALA 401 Cb 0.53 -2.93 -0.00 0.00 0.00 0.00 0.00 19.45 17.05 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 -0.25 -0.05 -0.02 0.00 -0.85 -1.26 -4.17 117.35 110.74 1m3i s TYR 402 Ca 0.57 -0.29 -0.10 0.00 -0.52 0.00 0.00 57.07 56.73 1m3i s TYR 402 Cb 0.18 0.66 -0.05 0.00 0.38 0.00 0.00 41.96 43.13 1m3i s TYR 402 CO -0.08 -0.85 0.29 0.08 -1.52 0.00 0.00 175.55 173.47 1m3i s VAL 403 N -2.84 5.24 0.05 -3.49 1.01 -1.26 -4.62 120.40 114.49 1m3i s VAL 403 Ca 0.16 0.45 -0.03 0.00 0.00 0.00 0.00 61.98 62.56 1m3i s VAL 403 Cb -0.02 -3.58 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 1m3i s VAL 403 CO 0.03 0.51 0.02 0.00 0.00 0.00 0.00 175.10 175.66 1m3i s ALA 404 N -1.15 0.31 -0.00 5.51 0.00 -0.78 -1.13 121.76 124.51 1m3i s ALA 404 Ca 0.23 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 51.20 1m3i s ALA 404 Cb -0.14 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 23.27 1m3i s ALA 404 CO 0.12 -0.38 -0.08 -0.65 0.00 0.00 0.00 175.76 174.77 1m3i s GLN 405 N -3.66 0.63 0.23 0.00 -0.21 -0.78 -0.70 119.66 115.17 1m3i s GLN 405 Ca 0.04 -0.29 0.06 0.00 0.02 0.00 0.00 55.36 55.20 1m3i s GLN 405 Cb 0.06 -0.60 -0.04 0.00 1.00 0.00 0.00 33.01 33.43 1m3i s GLN 405 CO -0.09 0.17 0.19 -0.06 -2.12 0.00 0.00 175.29 173.37 1m3i s PHE 406 N -0.21 3.15 -0.36 0.91 0.40 -1.26 -0.68 117.98 119.92 1m3i s PHE 406 Ca 0.03 -0.08 0.00 0.00 -0.60 0.00 0.00 56.93 56.28 1m3i s PHE 406 Cb -0.03 -1.44 0.14 0.00 0.51 0.00 0.00 43.02 42.19 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 -3.65 0.63 -0.20 0.44 2.12 0.21 -1.01 118.70 117.24 1m3i s GLU 407 Ca 0.32 -1.41 -0.05 0.00 0.36 0.00 0.00 54.97 54.19 1m3i s GLU 407 Cb -0.09 -1.41 -0.03 0.00 0.26 0.00 0.00 34.13 32.86 1m3i s GLU 407 CO 0.25 -1.21 0.01 0.08 -0.54 0.00 0.00 175.26 173.85 1m3i s VAL 408 N 0.99 4.05 0.13 3.70 1.01 -1.26 -2.00 120.40 127.02 1m3i s VAL 408 Ca 0.18 -0.28 -0.10 0.00 0.00 0.00 0.00 61.98 61.78 1m3i s VAL 408 Cb -0.23 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.32 1m3i s VAL 408 CO 0.01 0.43 0.27 0.00 0.00 0.00 0.00 175.10 175.80 1m3i s ALA 409 N 0.97 -0.23 0.19 5.51 0.00 -0.75 -1.17 121.76 126.27 1m3i s ALA 409 Ca 0.02 -0.66 -0.20 0.00 0.00 0.00 0.00 51.96 51.12 1m3i s ALA 409 Cb -0.14 0.69 0.07 0.00 0.00 0.00 0.00 23.12 23.74 1m3i s ALA 409 CO 0.02 -0.60 0.95 -2.67 0.00 0.00 0.00 175.76 173.46 1m3i n TRP 410 N -0.16 -1.39 -4.41 0.00 2.14 -0.67 -0.74 117.44 112.22 1m3i n TRP 410 Ca -0.11 -1.24 -0.22 0.00 2.07 0.00 0.00 57.50 57.99 1m3i n TRP 410 Cb 0.63 0.60 -0.10 0.00 -0.81 0.00 0.00 31.31 31.63 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 -3.27 3.14 -0.19 -0.67 -0.00 0.88 -0.98 116.67 115.58 1m3i s ASP 411 Ca 0.21 -0.99 0.01 0.00 -0.00 0.00 0.00 52.55 51.79 1m3i s ASP 411 Cb -0.03 -0.23 0.03 0.00 -0.00 0.00 0.00 42.92 42.69 1m3i s ASP 411 CO 0.06 -0.02 -0.19 -1.61 -0.00 0.00 0.00 175.17 173.41 1m3i s GLU 412 N -3.36 2.89 0.14 8.23 2.02 0.84 0.39 118.70 129.86 1m3i s GLU 412 Ca 0.25 -0.90 -0.25 0.00 0.02 0.00 0.00 54.97 54.09 1m3i s GLU 412 Cb -0.04 -2.62 -0.08 0.00 0.10 0.00 0.00 34.13 31.49 1m3i s GLU 412 CO 0.11 -0.26 0.76 0.54 0.02 0.00 0.00 175.26 176.42 1m3i s VAL 413 N 1.27 4.45 0.04 2.63 0.11 -0.13 -1.21 120.40 127.56 1m3i s VAL 413 Ca 0.03 1.65 -0.01 0.00 -2.93 0.00 0.00 61.98 60.72 1m3i s VAL 413 Cb -0.14 -4.11 -0.03 0.00 -1.53 0.00 0.00 36.38 30.56 1m3i s VAL 413 CO -0.12 0.51 -0.03 -0.44 -3.33 0.00 0.00 175.10 171.69 1m3i s SER 414 N -1.00 0.46 -0.09 3.54 0.01 0.56 -4.94 113.70 112.23 1m3i s SER 414 Ca 0.35 -0.84 0.03 0.00 1.31 0.00 0.00 55.95 56.80 1m3i s SER 414 Cb -0.22 0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.17 1m3i s SER 414 CO 0.25 -0.50 -0.20 -0.31 0.41 0.00 0.00 173.24 172.89 1m3i s TYR 415 N -3.13 2.20 0.00 2.43 1.51 -1.26 0.17 117.35 119.28 1m3i s TYR 415 Ca 0.00 -0.89 0.00 0.00 -1.01 0.00 0.00 57.07 55.17 1m3i s TYR 415 Cb 0.02 -1.50 0.00 0.00 -0.11 0.00 0.00 41.96 40.37 1m3i s TYR 415 CO -0.07 -0.38 0.00 -0.40 -1.11 0.00 0.00 175.55 173.59 1m3i n ASP 416 N 3.63 -0.14 0.17 2.29 5.68 -0.90 -4.87 116.55 122.41 1m3i n ASP 416 Ca -0.20 -0.42 0.04 0.00 -0.50 0.00 0.00 54.79 53.71 1m3i n ASP 416 Cb 0.53 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 -0.09 0.11 1.57 -1.91 -2.83 116.57 113.42 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 0.43 0.00 0.39 -0.57 0.00 0.00 179.45 179.70 1m3i n GLU 418 N -3.38 1.53 -2.94 3.15 -0.58 -1.26 -4.59 120.64 112.56 1m3i n GLU 418 Ca 0.01 -0.78 -0.10 0.00 -0.42 0.00 0.00 57.16 55.86 1m3i n GLU 418 Cb 0.61 -1.40 0.04 0.00 -0.57 0.00 0.00 31.44 30.11 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 1.07 0.27 3.66 0.62 0.00 -1.07 -4.65 105.19 105.10 1m3i n GLY 419 Ca 0.17 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.20 5.08 0.10 1.61 0.01 -1.26 -4.58 114.94 112.70 1m3i s ASN 420 Ca 0.23 0.08 -0.31 0.00 -0.71 0.00 0.00 52.86 52.14 1m3i s ASN 420 Cb -0.10 -1.38 -0.09 0.00 0.41 0.00 0.00 41.25 40.10 1m3i s ASN 420 CO 0.32 0.35 1.57 -0.70 -1.51 0.00 0.00 177.10 177.13 1m3i s GLU 421 N -1.02 4.23 -0.26 -0.60 2.12 -1.26 -2.13 118.70 119.78 1m3i s GLU 421 Ca 0.14 2.27 0.03 0.00 0.36 0.00 0.00 54.97 57.77 1m3i s GLU 421 Cb -0.11 -3.40 0.06 0.00 0.26 0.00 0.00 34.13 30.93 1m3i s GLU 421 CO 0.04 -0.64 -0.11 0.08 -0.54 0.00 0.00 175.26 174.09 1m3i s VAL 422 N 1.92 2.20 -0.41 3.70 1.01 0.45 -4.95 120.40 124.33 1m3i s VAL 422 Ca 0.70 -1.58 -0.17 0.00 0.00 0.00 0.00 61.98 60.93 1m3i s VAL 422 Cb -0.40 -2.27 0.02 0.00 0.00 0.00 0.00 36.38 33.73 1m3i s VAL 422 CO 0.31 0.01 0.46 -0.76 0.00 0.00 0.00 175.10 175.11 1m3i s LEU 423 N 1.12 4.74 -0.25 3.92 1.43 -1.26 -0.33 118.68 128.06 1m3i s LEU 423 Ca -0.08 -0.55 -0.14 0.00 -1.03 0.00 0.00 54.13 52.33 1m3i s LEU 423 Cb -0.19 -2.43 -0.04 0.00 0.03 0.00 0.00 46.19 43.55 1m3i s LEU 423 CO -0.05 -0.57 0.33 -0.89 0.23 0.00 0.00 176.35 175.40 1m3i s THR 424 N 2.21 5.22 0.46 5.49 2.01 -0.35 -4.90 115.64 125.78 1m3i s THR 424 Ca 0.14 0.52 -0.21 0.00 0.31 0.00 0.00 61.69 62.45 1m3i s THR 424 Cb -0.17 -3.66 -0.10 0.00 0.01 0.00 0.00 72.50 68.58 1m3i s THR 424 CO 0.14 0.22 0.99 -2.28 -0.69 0.00 0.00 174.62 173.00 1m3i s HIS 425 N 1.66 3.18 0.01 4.92 2.46 -1.26 -0.11 115.29 126.14 1m3i s HIS 425 Ca 0.14 1.59 -0.07 0.00 0.47 0.00 0.00 55.06 57.20 1m3i s HIS 425 Cb -0.15 -2.94 -0.00 0.00 -0.13 0.00 0.00 32.58 29.36 1m3i s HIS 425 CO 0.09 -0.42 0.12 0.15 -2.47 0.00 0.00 174.74 172.20 1m3i s LYS 426 N -3.23 0.50 -0.02 2.88 -0.14 -0.16 -4.89 119.74 114.69 1m3i s LYS 426 Ca 0.64 -0.48 -0.10 0.00 -1.36 0.00 0.00 55.97 54.67 1m3i s LYS 426 Cb -0.12 0.20 0.01 0.00 -1.68 0.00 0.00 37.83 36.24 1m3i s LYS 426 CO 0.16 -0.12 0.21 0.95 -0.76 0.00 0.00 175.35 175.80 1m3i s THR 427 N -1.64 0.06 0.30 2.17 -4.23 -1.26 -1.66 115.64 109.38 1m3i s THR 427 Ca -0.13 -0.52 -0.28 0.00 -1.18 0.00 0.00 61.69 59.58 1m3i s THR 427 Cb -0.07 -0.48 -0.09 0.00 1.34 0.00 0.00 72.50 73.20 1m3i s THR 427 CO 0.00 -0.29 1.06 0.86 -0.54 0.00 0.00 174.62 175.72 1m3i s TRP 428 N -1.16 3.58 -0.51 3.99 -0.00 -0.32 -4.94 118.94 119.58 1m3i s TRP 428 Ca -0.12 1.72 0.26 0.00 -0.00 0.00 0.00 56.10 57.96 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 -0.41 1.75 0.38 -0.00 0.00 0.00 176.95 178.70 1m3i h ASP 429 N 3.59 0.00 -0.00 5.86 2.03 -2.01 -2.72 116.42 123.17 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 0.79 -0.96 3.77 7.15 0.00 -1.26 -4.85 105.19 109.83 1m3i n GLY 430 Ca 0.04 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.80 3.75 -3.77 1.61 4.13 -1.03 -2.69 115.26 116.47 1m3i n ASN 431 Ca 0.16 1.22 -0.27 0.00 1.68 0.00 0.00 54.58 57.36 1m3i n ASN 431 Cb 0.08 -1.61 0.05 0.00 -1.54 0.00 0.00 39.78 36.76 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 0.60 -2.58 -4.08 3.10 0.53 -0.18 -4.94 117.16 109.61 1m3i n TYR 432 Ca 0.02 0.96 -0.26 0.00 -1.02 0.00 0.00 57.90 57.60 1m3i n TYR 432 Cb 0.38 -4.48 -0.17 0.00 -1.03 0.00 0.00 39.34 34.05 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 -6.48 1.57 0.11 -0.72 -0.21 -1.10 -4.99 119.66 107.85 1m3i s GLN 433 Ca 0.63 -0.30 -0.35 0.00 0.02 0.00 0.00 55.36 55.37 1m3i s GLN 433 Cb -0.30 -1.53 -0.17 0.00 1.00 0.00 0.00 33.01 32.01 1m3i s GLN 433 CO 0.78 -0.19 1.17 -0.25 -2.12 0.00 0.00 175.29 174.69 1m3i n ASP 434 N 4.64 1.06 -3.96 5.90 8.00 -1.26 -4.54 116.55 126.39 1m3i n ASP 434 Ca -0.15 1.14 -0.16 0.00 0.71 0.00 0.00 54.79 56.32 1m3i n ASP 434 Cb 0.50 -1.14 -0.14 0.00 -0.02 0.00 0.00 41.12 40.32 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 0.43 0.00 -1.24 -0.14 0.12 -4.95 119.74 113.94 1m3i s LYS 435 Ca 0.80 -0.22 0.00 0.00 -1.36 0.00 0.00 55.97 55.19 1m3i s LYS 435 Cb -0.97 -0.41 0.00 0.00 -1.68 0.00 0.00 37.83 34.77 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 2.88 0.00 0.00 2.17 -2.24 -1.26 -1.87 114.28 113.96 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 -3.28 6.98 0.00 -1.26 -2.91 120.51 117.04 1m3i n ALA 437 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 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 -0.95 -4.91 0.00 -0.00 -0.76 -5.00 115.22 103.61 1m3i n HIS 438 Ca 0.00 0.40 -0.33 0.00 -0.00 0.00 0.00 57.72 57.79 1m3i n HIS 438 Cb 0.00 -1.33 -0.15 0.00 -0.00 0.00 0.00 29.99 28.52 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 -1.17 2.72 0.27 1.57 6.14 -0.23 -4.94 117.35 121.72 1m3i s TYR 439 Ca 0.12 -0.66 0.08 0.00 0.64 0.00 0.00 57.07 57.25 1m3i s TYR 439 Cb -0.01 -1.77 -0.06 0.00 0.42 0.00 0.00 41.96 40.54 1m3i s TYR 439 CO 0.29 -0.20 -0.10 -1.12 0.64 0.00 0.00 175.55 175.07 1m3i s SER 440 N 0.18 2.95 -0.17 4.32 0.01 -1.26 -0.50 113.70 119.23 1m3i s SER 440 Ca -0.09 -1.14 -0.35 0.00 1.31 0.00 0.00 55.95 55.68 1m3i s SER 440 Cb -0.16 -0.20 0.14 0.00 0.21 0.00 0.00 66.02 66.02 1m3i s SER 440 CO 0.06 -0.24 1.34 0.28 0.41 0.00 0.00 173.24 175.08 1m3i s THR 441 N -2.89 0.00 -0.06 1.44 -1.32 -0.79 -4.97 115.64 107.04 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 -1.43 0.03 0.00 -1.51 0.00 0.00 72.50 69.60 1m3i s THR 441 CO 0.12 0.00 -0.01 -0.69 -2.21 0.00 0.00 174.62 171.83 1m3i s VAL 442 N -2.20 0.38 -0.30 5.08 1.01 -1.26 -1.60 120.40 121.51 1m3i s VAL 442 Ca 0.12 0.08 -0.06 0.00 0.00 0.00 0.00 61.98 62.12 1m3i s VAL 442 Cb 0.02 -0.51 0.02 0.00 0.00 0.00 0.00 36.38 35.91 1m3i s VAL 442 CO -0.04 0.24 0.07 -0.63 0.00 0.00 0.00 175.10 174.74 1m3i s ILE 443 N 1.71 3.83 0.24 2.22 1.01 0.88 -4.94 121.20 126.14 1m3i s ILE 443 Ca 0.01 -0.82 -0.17 0.00 0.00 0.00 0.00 60.65 59.67 1m3i s ILE 443 Cb -0.13 -3.02 -0.08 0.00 0.01 0.00 0.00 42.46 39.24 1m3i s ILE 443 CO -0.04 0.03 0.69 -2.16 0.00 0.00 0.00 174.94 173.46 1m3i s PRO 444 N 1.46 4.11 -0.03 2.79 0.04 -1.26 0.13 135.00 142.24 1m3i s PRO 444 Ca 0.01 0.71 0.03 0.00 0.04 0.00 0.00 61.00 61.80 1m3i s PRO 444 Cb -0.18 -2.75 -0.00 0.00 0.04 0.00 0.00 34.50 31.62 1m3i s PRO 444 CO 0.02 0.34 -0.12 -0.51 0.04 0.00 0.00 177.00 176.76 1m3i s LEU 445 N -2.31 1.85 0.69 -3.56 1.43 0.16 -4.93 118.68 112.01 1m3i s LEU 445 Ca 0.46 -0.25 -0.16 0.00 -1.03 0.00 0.00 54.13 53.14 1m3i s LEU 445 Cb -0.14 -0.72 0.02 0.00 0.03 0.00 0.00 46.19 45.38 1m3i s LEU 445 CO 0.20 0.11 1.24 -1.61 0.23 0.00 0.00 176.35 176.51 1m3i s GLU 446 N 0.10 2.34 0.01 1.70 0.41 -1.26 -2.52 118.70 119.48 1m3i s GLU 446 Ca -0.03 1.88 0.02 0.00 -0.41 0.00 0.00 54.97 56.44 1m3i s GLU 446 Cb -0.09 -1.84 0.10 0.00 -1.78 0.00 0.00 34.13 30.51 1m3i s GLU 446 CO 0.01 -1.71 1.07 0.00 -0.49 0.00 0.00 175.26 174.14 1m3i n ALA 447 N -2.34 1.07 -1.50 5.21 0.00 -1.26 -2.37 120.51 119.32 1m3i n ALA 447 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.31 1m3i n ALA 447 Cb 0.49 -1.03 0.09 0.00 0.00 0.00 0.00 19.45 19.00 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 -1.52 5.84 -4.67 0.00 6.94 -1.26 -4.52 115.26 116.08 1m3i n ASN 448 Ca 0.00 -3.76 -0.38 0.00 -0.02 0.00 0.00 54.58 50.43 1m3i n ASN 448 Cb 0.02 -0.76 -0.08 0.00 -2.36 0.00 0.00 39.78 36.60 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 -3.63 3.56 0.36 -2.53 0.00 -1.00 -0.96 121.76 117.57 1m3i s ALA 449 Ca 0.58 -0.58 0.05 0.00 0.00 0.00 0.00 51.96 52.01 1m3i s ALA 449 Cb 0.47 -2.59 -0.06 0.00 0.00 0.00 0.00 23.12 20.93 1m3i s ALA 449 CO 0.02 -0.29 0.05 1.03 0.00 0.00 0.00 175.76 176.56 1m3i s ARG 450 N 1.29 1.79 -1.24 0.00 3.00 0.16 -4.72 118.95 119.23 1m3i s ARG 450 Ca 0.17 -2.01 -0.23 0.00 0.00 0.00 0.00 55.73 53.66 1m3i s ARG 450 Cb -0.15 -1.11 0.02 0.00 0.00 0.00 0.00 34.95 33.71 1m3i s ARG 450 CO 0.07 -0.17 0.63 0.09 0.00 0.00 0.00 175.30 175.92 1m3i n ASN 451 N -0.84 -3.63 -4.65 0.23 5.03 -1.26 -0.08 115.26 110.06 1m3i n ASN 451 Ca -0.04 -1.17 -0.42 0.00 0.87 0.00 0.00 54.58 53.82 1m3i n ASN 451 Cb 0.67 -2.39 -0.04 0.00 -1.02 0.00 0.00 39.78 37.00 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 -3.64 4.85 -0.04 2.41 1.01 -1.25 -4.05 121.20 120.49 1m3i s ILE 452 Ca 0.39 1.60 0.06 0.00 0.00 0.00 0.00 60.65 62.70 1m3i s ILE 452 Cb -0.18 -4.13 -0.01 0.00 0.01 0.00 0.00 42.46 38.15 1m3i s ILE 452 CO 0.93 -0.04 -0.23 0.00 0.00 0.00 0.00 174.94 175.60 1m3i s ARG 453 N 2.62 2.17 -0.09 2.79 1.70 0.08 0.25 118.95 128.48 1m3i s ARG 453 Ca 0.36 -0.81 0.01 0.00 -0.47 0.00 0.00 55.73 54.82 1m3i s ARG 453 Cb -0.16 -1.92 0.02 0.00 -0.57 0.00 0.00 34.95 32.33 1m3i s ARG 453 CO 0.09 0.38 -0.12 0.42 -1.08 0.00 0.00 175.30 174.99 1m3i s ILE 454 N -0.22 1.20 -0.00 4.99 1.01 -0.07 -1.81 121.20 126.31 1m3i s ILE 454 Ca -0.00 -0.47 -0.02 0.00 0.00 0.00 0.00 60.65 60.16 1m3i s ILE 454 Cb -0.12 -1.13 -0.00 0.00 0.01 0.00 0.00 42.46 41.22 1m3i s ILE 454 CO 0.02 0.38 0.04 -0.75 0.00 0.00 0.00 174.94 174.63 1m3i s LYS 455 N 1.05 0.21 -0.02 2.79 2.20 -0.85 -0.42 119.74 124.70 1m3i s LYS 455 Ca -0.07 -0.24 0.01 0.00 -0.36 0.00 0.00 55.97 55.32 1m3i s LYS 455 Cb -0.15 0.08 0.01 0.00 -1.51 0.00 0.00 37.83 36.27 1m3i s LYS 455 CO -0.01 -0.04 -0.04 0.00 -0.36 0.00 0.00 175.35 174.90 1m3i s ALA 456 N -0.71 0.47 0.02 3.13 0.00 -0.36 0.65 121.76 124.97 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 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 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 0.48 1.97 0.03 0.00 6.06 0.14 -0.74 118.95 126.89 1m3i s ARG 457 Ca -0.05 -1.01 -0.22 0.00 -2.50 0.00 0.00 55.73 51.94 1m3i s ARG 457 Cb -0.09 -2.03 -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 0.00 175.30 172.00 1m3i s GLU 458 N -0.98 4.39 -1.24 5.12 -6.30 -0.92 -1.86 118.70 116.91 1m3i s GLU 458 Ca 0.11 0.88 -0.12 0.00 -2.50 0.00 0.00 54.97 53.34 1m3i s GLU 458 Cb -0.10 -3.33 0.17 0.00 0.00 0.00 0.00 34.13 30.86 1m3i s GLU 458 CO 0.01 0.38 1.60 0.00 0.02 0.00 0.00 175.26 177.27 1m3i s THR 460 N 1.29 0.13 -5.00 0.00 2.01 -1.26 -4.81 115.64 108.00 1m3i s THR 460 Ca 0.42 -0.85 0.00 0.00 0.31 0.00 0.00 61.69 61.58 1m3i s THR 460 Cb 0.02 -1.09 0.00 0.00 0.01 0.00 0.00 72.50 71.43 1m3i s THR 460 CO 0.01 -0.68 0.00 0.61 -0.69 0.00 0.00 174.62 173.87 1m3i n GLY 461 N 5.17 -0.14 0.29 4.40 0.00 -1.26 -4.73 105.19 108.92 1m3i n GLY 461 Ca -0.05 -1.74 -0.11 0.00 0.00 0.00 0.00 46.02 44.12 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 -0.77 0.00 0.99 5.85 -1.98 -3.48 115.31 115.92 1m3i h LEU 462 Ca 0.00 0.05 -0.20 0.00 0.84 0.00 0.00 57.88 58.57 1m3i h LEU 462 Cb 0.00 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1m3i h LEU 462 CO 0.00 -0.41 -0.04 0.00 -0.34 0.00 0.00 178.44 177.65 1m3i n ALA 463 N -2.53 -0.63 -0.31 1.25 0.00 -1.26 -5.05 120.51 111.98 1m3i n ALA 463 Ca -0.08 -1.42 0.02 0.00 0.00 0.00 0.00 53.44 51.97 1m3i n ALA 463 Cb 0.28 1.14 0.09 0.00 0.00 0.00 0.00 19.45 20.96 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 1.93 -0.59 0.00 0.00 2.91 -1.97 0.24 115.95 118.47 1m3i h TRP 464 Ca -0.26 0.08 0.00 0.00 1.13 0.00 0.00 58.89 59.84 1m3i h TRP 464 Cb 1.11 0.39 0.00 0.00 -0.51 0.00 0.00 29.16 30.15 1m3i h TRP 464 CO 0.00 -0.38 0.00 -0.85 -1.03 0.00 0.00 178.44 176.18 1m3i n GLU 465 N -5.53 0.27 -0.41 2.65 0.00 -1.26 -2.39 120.64 113.96 1m3i n GLU 465 Ca 0.12 0.09 0.06 0.00 0.00 0.00 0.00 57.16 57.43 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 -1.14 0.00 -4.05 -1.84 8.01 0.82 -5.05 117.44 114.18 1m3i n TRP 466 Ca 0.07 -0.80 -0.29 0.00 -1.31 0.00 0.00 57.50 55.17 1m3i n TRP 466 Cb 0.07 -0.14 -0.06 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 -1.97 3.19 0.68 -5.99 0.51 -1.01 -4.68 118.94 109.68 1m3i s TRP 467 Ca 0.25 0.06 -0.13 0.00 -2.12 0.00 0.00 56.10 54.16 1m3i s TRP 467 Cb 0.24 -1.60 0.01 0.00 -0.81 0.00 0.00 33.47 31.31 1m3i s TRP 467 CO -0.02 0.52 1.09 -0.98 -0.51 0.00 0.00 176.95 177.05 1m3i s ARG 468 N -2.55 2.77 -0.07 4.98 1.70 -1.25 -4.86 118.95 119.66 1m3i s ARG 468 Ca 0.30 1.23 -0.15 0.00 -0.47 0.00 0.00 55.73 56.64 1m3i s ARG 468 Cb -0.12 -1.96 -0.05 0.00 -0.57 0.00 0.00 34.95 32.26 1m3i s ARG 468 CO 0.22 -1.26 0.37 -0.51 -1.08 0.00 0.00 175.30 173.05 1m3i s ASP 469 N -3.02 6.66 -0.20 -2.89 -0.00 -1.26 -2.17 116.67 113.79 1m3i s ASP 469 Ca 0.63 0.78 0.18 0.00 -0.00 0.00 0.00 52.55 54.14 1m3i s ASP 469 Cb -0.18 -2.23 -0.25 0.00 -0.00 0.00 0.00 42.92 40.27 1m3i s ASP 469 CO 0.47 0.21 0.07 0.52 -0.00 0.00 0.00 175.17 176.44 1m3i n VAL 470 N 2.65 1.39 -3.66 -1.27 0.31 0.08 -4.90 118.33 112.93 1m3i n VAL 470 Ca -0.12 -0.86 -0.12 0.00 -0.01 0.00 0.00 64.34 63.23 1m3i n VAL 470 Cb 0.52 -0.47 -0.08 0.00 -0.91 0.00 0.00 33.84 32.90 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 -2.49 -0.00 -0.36 2.52 2.07 -1.17 -4.36 121.20 117.41 1m3i s ILE 471 Ca -0.10 0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.18 1m3i s ILE 471 Cb 0.06 -0.87 0.15 0.00 0.13 0.00 0.00 42.46 41.94 1m3i s ILE 471 CO 0.83 0.00 0.35 -0.55 -1.91 0.00 0.00 174.94 173.66 1m3i s SER 472 N 0.79 1.43 -0.15 4.50 0.15 -1.26 -1.22 113.70 117.94 1m3i s SER 472 Ca -0.04 -1.60 -0.04 0.00 0.70 0.00 0.00 55.95 54.98 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 -0.28 -0.02 -1.61 1.20 0.00 0.00 173.24 172.48 1m3i s GLU 473 N 1.45 3.63 0.04 5.44 0.41 0.44 -5.01 118.70 125.10 1m3i s GLU 473 Ca 0.16 -0.48 0.05 0.00 -0.41 0.00 0.00 54.97 54.30 1m3i s GLU 473 Cb -0.16 -2.94 -0.03 0.00 -1.78 0.00 0.00 34.13 29.21 1m3i s GLU 473 CO -0.05 0.31 -0.11 0.71 -0.49 0.00 0.00 175.26 175.63 1m3i s TYR 474 N 0.20 2.75 -1.14 1.61 1.51 -1.26 -0.89 117.35 120.12 1m3i s TYR 474 Ca -0.01 -0.14 -0.22 0.00 -1.01 0.00 0.00 57.07 55.69 1m3i s TYR 474 Cb -0.13 -1.52 -0.00 0.00 -0.11 0.00 0.00 41.96 40.19 1m3i s TYR 474 CO 0.02 0.35 0.79 -0.25 -1.11 0.00 0.00 175.55 175.35 1m3i n ASP 475 N 1.34 -5.26 -4.74 2.29 8.00 -0.73 -4.91 116.55 112.53 1m3i n ASP 475 Ca -0.15 -1.04 -0.41 0.00 0.71 0.00 0.00 54.79 53.90 1m3i n ASP 475 Cb 0.52 -3.23 -0.04 0.00 -0.02 0.00 0.00 41.12 38.35 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 -3.46 3.95 -0.13 2.53 1.01 0.71 -4.80 120.40 120.21 1m3i s VAL 476 Ca 0.48 1.76 -0.29 0.00 0.00 0.00 0.00 61.98 63.93 1m3i s VAL 476 Cb -0.18 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.07 1m3i s VAL 476 CO 0.87 0.34 1.07 -2.16 0.00 0.00 0.00 175.10 175.22 1m3i s PRO 477 N -0.63 4.35 -0.09 2.72 0.04 -1.26 -3.81 135.00 136.32 1m3i s PRO 477 Ca 0.47 1.46 -0.34 0.00 0.04 0.00 0.00 61.00 62.63 1m3i s PRO 477 Cb -0.28 -3.59 -0.11 0.00 0.04 0.00 0.00 34.50 30.56 1m3i s PRO 477 CO 0.34 -0.45 1.92 -0.11 0.04 0.00 0.00 177.00 178.74 1m3i n LEU 478 N 5.49 3.48 -4.28 -3.56 7.94 -1.26 -4.96 117.00 119.85 1m3i n LEU 478 Ca 0.10 0.92 -0.18 0.00 -1.11 0.00 0.00 56.01 55.74 1m3i n LEU 478 Cb 0.47 -1.39 -0.09 0.00 0.53 0.00 0.00 43.42 42.95 1m3i n LEU 478 CO 0.53 -0.07 -0.16 0.42 -1.11 0.00 0.00 177.39 177.00 1m3i s THR 479 N 4.41 0.07 0.24 1.96 -4.23 -1.26 -5.02 115.64 111.81 1m3i s THR 479 Ca 0.93 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 59.37 1m3i s THR 479 Cb -0.66 -2.49 0.22 0.00 1.34 0.00 0.00 72.50 70.91 1m3i s THR 479 CO 0.50 0.00 1.91 0.78 -0.54 0.00 0.00 174.62 177.27 1m3i h ASN 480 N 2.24 1.07 -2.96 3.99 2.35 -1.61 -3.32 115.58 117.34 1m3i h ASN 480 Ca -0.29 -0.04 -0.35 0.00 -0.55 0.00 0.00 56.30 55.07 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 0.43 0.79 -0.67 0.20 -1.65 0.00 0.00 177.43 176.53 1m3i s ASN 481 N -6.07 1.36 -0.45 5.81 0.01 -1.16 -2.24 114.94 112.20 1m3i s ASN 481 Ca -0.13 -0.08 -0.13 0.00 -0.71 0.00 0.00 52.86 51.81 1m3i s ASN 481 Cb 0.17 0.13 0.07 0.00 0.41 0.00 0.00 41.25 42.03 1m3i s ASN 481 CO 0.81 -0.29 0.34 -0.63 -1.51 0.00 0.00 177.10 175.82 1m3i s ILE 482 N 2.25 4.86 -0.55 0.60 1.01 -0.49 -1.20 121.20 127.68 1m3i s ILE 482 Ca 0.04 -1.18 -0.19 0.00 0.00 0.00 0.00 60.65 59.32 1m3i s ILE 482 Cb -0.14 -3.92 0.09 0.00 0.01 0.00 0.00 42.46 38.49 1m3i s ILE 482 CO -0.08 -0.55 0.65 0.20 0.00 0.00 0.00 174.94 175.17 1m3i s ASN 483 N 2.41 6.20 -0.12 3.58 0.02 0.92 -0.12 114.94 127.83 1m3i s ASN 483 Ca 0.04 -1.25 -0.04 0.00 -1.02 0.00 0.00 52.86 50.59 1m3i s ASN 483 Cb -0.24 -2.29 -0.03 0.00 0.02 0.00 0.00 41.25 38.71 1m3i s ASN 483 CO 0.05 -1.00 0.02 -0.69 0.02 0.00 0.00 177.10 175.50 1m3i s VAL 484 N 2.59 4.48 -0.21 1.60 1.01 0.18 0.08 120.40 130.13 1m3i s VAL 484 Ca 0.12 -0.17 -0.11 0.00 0.00 0.00 0.00 61.98 61.82 1m3i s VAL 484 Cb -0.23 -2.93 0.07 0.00 0.00 0.00 0.00 36.38 33.30 1m3i s VAL 484 CO 0.08 0.56 0.50 -0.94 0.00 0.00 0.00 175.10 175.30 1m3i s SER 485 N -0.48 -0.63 0.17 3.32 1.04 -0.50 -1.73 113.70 114.90 1m3i s SER 485 Ca 0.09 1.11 0.06 0.00 0.48 0.00 0.00 55.95 57.70 1m3i s SER 485 Cb -0.12 1.12 -0.04 0.00 0.10 0.00 0.00 66.02 67.08 1m3i s SER 485 CO 0.02 -0.21 0.07 0.27 0.98 0.00 0.00 173.24 174.37 1m3i s ILE 486 N 1.75 4.09 0.00 -1.02 -4.36 0.08 -1.13 121.20 120.60 1m3i s ILE 486 Ca -0.08 -1.27 0.00 0.00 -0.26 0.00 0.00 60.65 59.04 1m3i s ILE 486 Cb -0.08 -3.08 0.00 0.00 1.25 0.00 0.00 42.46 40.55 1m3i s ILE 486 CO -0.15 -0.12 0.00 -2.67 0.24 0.00 0.00 174.94 172.24 1m3i n TRP 487 N -0.26 -0.04 -2.68 1.37 2.14 -0.02 -1.91 117.44 116.03 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 3.74 -1.67 0.00 -1.26 -0.40 105.19 103.85 1m3i n GLY 488 Ca 0.00 -1.57 -0.26 0.00 0.00 0.00 0.00 46.02 44.18 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 2.07 0.21 2.61 -4.23 -0.55 -0.64 115.64 115.12 1m3i s THR 489 Ca 0.00 -1.75 -0.09 0.00 -1.18 0.00 0.00 61.69 58.67 1m3i s THR 489 Cb 0.00 -2.82 0.14 0.00 1.34 0.00 0.00 72.50 71.16 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 1.40 0.90 0.01 3.99 2.02 -1.95 0.47 112.91 119.75 1m3i h THR 490 Ca -0.42 -0.20 -0.20 0.00 0.77 0.00 0.00 66.41 66.36 1m3i h THR 490 Cb 1.26 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1m3i h THR 490 CO 0.71 0.11 -0.89 -0.07 0.37 0.00 0.00 175.52 175.75 1m3i h LEU 491 N 0.59 0.20 -6.11 2.58 3.38 -1.95 -3.37 115.31 110.63 1m3i h LEU 491 Ca 0.30 -0.17 -0.58 0.00 0.09 0.00 0.00 57.88 57.52 1m3i h LEU 491 Cb 0.26 -0.06 -0.41 0.00 0.09 0.00 0.00 40.66 40.54 1m3i h LEU 491 CO -0.22 0.99 -0.83 -1.22 0.09 0.00 0.00 178.44 177.24 1m3i n TYR 492 N -3.62 1.78 -1.86 1.13 4.02 -0.86 -5.10 117.16 112.65 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 -0.46 0.02 0.00 -0.02 0.00 0.00 39.34 39.70 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 -1.87 3.23 0.25 -0.72 0.02 0.10 -1.48 135.00 134.54 1m3i s PRO 493 Ca 0.38 1.04 0.02 0.00 0.02 0.00 0.00 61.00 62.46 1m3i s PRO 493 Cb 0.16 -2.03 -0.04 0.00 0.02 0.00 0.00 34.50 32.61 1m3i s PRO 493 CO -0.06 -0.87 0.17 0.20 -0.33 0.00 0.00 177.00 176.11 1m3i s GLY 494 N -3.33 1.78 -0.21 0.52 0.00 0.46 -4.86 107.32 101.68 1m3i s GLY 494 Ca 0.60 -1.81 -0.35 0.00 0.00 0.00 0.00 44.72 43.16 1m3i s GLY 494 CO 0.45 -1.46 1.24 -1.35 0.00 0.00 0.00 173.10 171.98 1m3i s SER 495 N -3.26 -0.12 0.05 1.64 1.04 -1.26 -0.84 113.70 110.95 1m3i s SER 495 Ca 0.39 0.02 -0.21 0.00 0.48 0.00 0.00 55.95 56.63 1m3i s SER 495 Cb 0.06 0.12 0.05 0.00 0.10 0.00 0.00 66.02 66.34 1m3i s SER 495 CO 0.17 -0.19 0.49 -0.94 0.98 0.00 0.00 173.24 173.76 1m3i s SER 496 N -1.99 -0.40 -0.05 7.02 1.04 -0.29 -4.99 113.70 114.04 1m3i s SER 496 Ca 0.09 0.11 0.01 0.00 0.48 0.00 0.00 55.95 56.64 1m3i s SER 496 Cb -0.01 0.48 0.02 0.00 0.10 0.00 0.00 66.02 66.61 1m3i s SER 496 CO -0.04 -0.72 -0.04 -0.51 0.98 0.00 0.00 173.24 172.91 1m3i s ILE 497 N -2.53 0.57 0.29 -1.02 2.07 -1.25 -1.41 121.20 117.92 1m3i s ILE 497 Ca -0.05 -0.11 0.06 0.00 -1.41 0.00 0.00 60.65 59.13 1m3i s ILE 497 Cb -0.01 -0.61 -0.06 0.00 0.13 0.00 0.00 42.46 41.91 1m3i s ILE 497 CO -0.03 0.25 -0.02 -0.89 -1.91 0.00 0.00 174.94 172.34 1m3i s THR 498 N 1.12 1.47 0.23 4.00 2.01 0.11 -4.95 115.64 119.64 1m3i s THR 498 Ca -0.08 -2.07 0.06 0.00 0.31 0.00 0.00 61.69 59.91 1m3i s THR 498 Cb -0.14 -2.55 -0.05 0.00 0.01 0.00 0.00 72.50 69.77 1m3i s THR 498 CO -0.01 -0.21 -0.09 -0.31 -0.69 0.00 0.00 174.62 173.31 1m3i s TYR 499 N -3.12 1.74 0.00 4.92 1.51 -1.26 -0.06 117.35 121.09 1m3i s TYR 499 Ca 0.31 -0.69 0.00 0.00 -1.01 0.00 0.00 57.07 55.68 1m3i s TYR 499 Cb 0.06 -0.92 0.00 0.00 -0.11 0.00 0.00 41.96 40.99 1m3i s TYR 499 CO 0.13 0.24 0.00 0.09 -1.11 0.00 0.00 175.55 174.90