#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qmd n SER 59 N 0.00 2.95 -2.62 1.61 7.64 -1.26 -4.44 113.62 117.50 2qmd n SER 59 Ca 0.00 -1.92 -0.24 0.00 1.01 0.00 0.00 58.87 57.72 2qmd n SER 59 Cb 0.00 -0.19 -0.00 0.00 -1.01 0.00 0.00 64.21 63.01 2qmd n SER 59 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2qmd n PHE 60 N 1.18 3.01 -0.03 1.43 3.01 -1.26 -4.89 117.46 119.90 2qmd n PHE 60 Ca 0.18 -3.25 0.23 0.00 1.01 0.00 0.00 57.45 55.62 2qmd n PHE 60 Cb 0.54 -0.22 0.72 0.00 -0.01 0.00 0.00 39.48 40.51 2qmd n PHE 60 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 2qmd h VAL 61 N 2.65 0.59 0.00 -4.37 2.07 -1.96 -0.57 116.25 114.65 2qmd h VAL 61 Ca 0.20 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.68 2qmd h VAL 61 Cb 0.89 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 2qmd h VAL 61 CO 0.77 0.00 -0.15 -0.08 0.02 0.00 0.00 177.57 178.13 2qmd h GLU 62 N 0.00 0.00 0.00 1.57 4.81 -1.94 -3.08 114.58 115.93 2qmd h GLU 62 Ca 0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 2qmd h GLU 62 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2qmd h GLU 62 CO -0.00 0.15 -1.29 -1.33 -0.73 0.00 0.00 179.01 175.81 2qmd n MET 63 N -3.36 0.87 -1.83 1.92 2.81 -0.27 -4.44 117.12 112.82 2qmd n MET 63 Ca -0.00 -0.08 -0.41 0.00 -1.81 0.00 0.00 57.70 55.40 2qmd n MET 63 Cb 0.36 -1.38 -0.01 0.00 -0.71 0.00 0.00 33.22 31.48 2qmd n MET 63 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2qmd s VAL 64 N -2.95 2.17 -1.27 2.03 1.01 -0.91 -2.68 120.40 117.80 2qmd s VAL 64 Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.14 2qmd s VAL 64 Cb 0.13 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.41 2qmd s VAL 64 CO 0.75 0.03 0.00 0.47 0.00 0.00 0.00 175.10 176.34 2qmd n ASP 65 N 1.78 -4.40 -0.40 3.32 10.43 -1.20 -4.91 116.55 121.17 2qmd n ASP 65 Ca 0.06 0.08 0.14 0.00 2.57 0.00 0.00 54.79 57.64 2qmd n ASP 65 Cb 0.38 -3.45 0.58 0.00 1.84 0.00 0.00 41.12 40.47 2qmd n ASP 65 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 2qmd n ASN 66 N -0.56 1.26 -4.84 -2.24 6.94 -1.01 -4.84 115.26 109.98 2qmd n ASN 66 Ca -0.16 -1.40 -0.28 0.00 -0.02 0.00 0.00 54.58 52.72 2qmd n ASN 66 Cb 0.58 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.95 2qmd n ASN 66 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2qmd s LEU 67 N -2.02 3.99 0.09 -4.53 1.43 -0.50 -4.42 118.68 112.71 2qmd s LEU 67 Ca 0.39 0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.53 2qmd s LEU 67 Cb 0.21 -2.62 -0.04 0.00 0.03 0.00 0.00 46.19 43.77 2qmd s LEU 67 CO 0.35 0.12 -0.04 -0.13 0.23 0.00 0.00 176.35 176.87 2qmd s ARG 68 N -2.79 0.79 0.00 1.70 0.52 -0.84 -0.29 118.95 118.03 2qmd s ARG 68 Ca 0.32 -1.32 0.00 0.00 -0.52 0.00 0.00 55.73 54.21 2qmd s ARG 68 Cb -0.11 -0.05 0.00 0.00 0.52 0.00 0.00 34.95 35.31 2qmd s ARG 68 CO 0.25 -0.07 0.00 0.41 0.02 0.00 0.00 175.30 175.91 2qmd n GLY 69 N -0.01 0.57 3.50 -3.53 0.00 -1.26 -0.22 105.19 104.23 2qmd n GLY 69 Ca -0.12 -2.20 -0.11 0.00 0.00 0.00 0.00 46.02 43.59 2qmd n GLY 69 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qmd s LYS 70 N -0.46 1.37 0.30 1.61 -2.85 -1.08 -4.72 119.74 113.90 2qmd s LYS 70 Ca 0.00 -0.62 0.01 0.00 -1.00 0.00 0.00 55.97 54.36 2qmd s LYS 70 Cb 0.00 0.58 0.54 0.00 -2.06 0.00 0.00 37.83 36.89 2qmd s LYS 70 CO 0.00 -0.60 1.89 0.66 0.10 0.00 0.00 175.35 177.40 2qmd h SER 71 N 2.05 0.91 0.93 0.03 4.64 -1.94 0.97 113.55 121.14 2qmd h SER 71 Ca -0.31 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.02 2qmd h SER 71 Cb 1.29 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2qmd h SER 71 CO 0.36 0.56 -0.04 1.23 -0.87 0.00 0.00 176.83 178.06 2qmd h GLY 72 N 1.02 0.00 0.00 -0.77 0.00 -1.96 -3.26 103.07 98.10 2qmd h GLY 72 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.75 2qmd h GLY 72 CO -0.18 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.30 2qmd n GLN 73 N -3.17 0.66 0.00 4.80 6.02 -0.97 -4.98 117.38 119.74 2qmd n GLN 73 Ca 0.00 -0.32 0.00 0.00 -0.01 0.00 0.00 57.00 56.67 2qmd n GLN 73 Cb 0.31 -0.80 0.00 0.00 1.02 0.00 0.00 30.24 30.77 2qmd n GLN 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qmd n GLY 74 N 0.18 1.29 3.70 1.08 0.00 0.30 -4.90 105.19 106.85 2qmd n GLY 74 Ca 0.00 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 43.92 2qmd n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qmd s TYR 75 N -2.74 3.33 0.14 1.61 1.51 -1.26 -2.65 117.35 117.30 2qmd s TYR 75 Ca 0.00 0.22 0.06 0.00 -1.01 0.00 0.00 57.07 56.34 2qmd s TYR 75 Cb 0.00 -2.03 -0.04 0.00 -0.11 0.00 0.00 41.96 39.78 2qmd s TYR 75 CO 0.00 0.32 -0.14 1.52 -1.11 0.00 0.00 175.55 176.14 2qmd s TYR 76 N -0.04 1.49 0.08 2.71 -0.85 0.69 -0.69 117.35 120.73 2qmd s TYR 76 Ca 0.07 -0.57 0.09 0.00 -0.52 0.00 0.00 57.07 56.14 2qmd s TYR 76 Cb -0.12 -0.75 -0.03 0.00 0.38 0.00 0.00 41.96 41.44 2qmd s TYR 76 CO 0.01 0.20 -0.23 0.54 -1.52 0.00 0.00 175.55 174.54 2qmd s VAL 77 N -2.42 1.91 0.19 -3.49 0.11 -0.32 -1.98 120.40 114.40 2qmd s VAL 77 Ca 0.13 -1.44 -0.30 0.00 -2.93 0.00 0.00 61.98 57.44 2qmd s VAL 77 Cb -0.03 -1.68 -0.08 0.00 -1.53 0.00 0.00 36.38 33.06 2qmd s VAL 77 CO 0.04 0.15 1.01 -0.70 -3.33 0.00 0.00 175.10 172.27 2qmd s GLU 78 N -1.55 4.71 0.13 1.54 2.12 -1.26 -0.63 118.70 123.75 2qmd s GLU 78 Ca 0.10 1.57 0.00 0.00 0.36 0.00 0.00 54.97 57.00 2qmd s GLU 78 Cb -0.10 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 30.95 2qmd s GLU 78 CO 0.03 0.27 0.02 -1.64 -0.54 0.00 0.00 175.26 173.40 2qmd s MET 79 N -0.60 0.94 0.05 4.30 -1.94 0.09 -4.04 119.30 118.08 2qmd s MET 79 Ca 0.46 -1.43 0.07 0.00 -1.71 0.00 0.00 55.69 53.07 2qmd s MET 79 Cb -0.27 0.04 -0.02 0.00 2.01 0.00 0.00 34.83 36.58 2qmd s MET 79 CO 0.33 -0.18 -0.19 0.95 -0.01 0.00 0.00 175.02 175.93 2qmd s THR 80 N -3.87 1.49 -0.00 2.05 -4.23 0.05 -1.12 115.64 110.01 2qmd s THR 80 Ca 0.21 -1.15 0.03 0.00 -1.18 0.00 0.00 61.69 59.59 2qmd s THR 80 Cb 0.07 -1.31 -0.01 0.00 1.34 0.00 0.00 72.50 72.59 2qmd s THR 80 CO 0.00 0.12 -0.10 0.68 -0.54 0.00 0.00 174.62 174.79 2qmd s VAL 81 N -0.84 0.75 0.00 2.29 -7.23 -0.04 -1.65 120.40 113.68 2qmd s VAL 81 Ca 0.05 -0.45 0.00 0.00 -1.81 0.00 0.00 61.98 59.77 2qmd s VAL 81 Cb -0.09 -0.64 0.00 0.00 0.56 0.00 0.00 36.38 36.22 2qmd s VAL 81 CO 0.02 0.18 0.00 0.61 -0.31 0.00 0.00 175.10 175.60 2qmd n GLY 82 N 2.76 -0.84 2.75 2.32 0.00 -0.18 -0.42 105.19 111.58 2qmd n GLY 82 Ca -0.14 -1.69 -0.25 0.00 0.00 0.00 0.00 46.02 43.93 2qmd n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qmd s SER 83 N -2.08 2.29 0.72 1.61 0.01 -1.26 -2.45 113.70 112.54 2qmd s SER 83 Ca 0.00 -0.48 -0.13 0.00 1.31 0.00 0.00 55.95 56.65 2qmd s SER 83 Cb 0.00 -0.52 0.03 0.00 0.21 0.00 0.00 66.02 65.74 2qmd s SER 83 CO 0.00 -0.25 1.12 -2.16 0.41 0.00 0.00 173.24 172.36 2qmd s PRO 84 N 1.92 2.42 0.20 12.44 0.04 -1.26 -0.89 135.00 149.87 2qmd s PRO 84 Ca 0.02 1.39 -0.32 0.00 0.04 0.00 0.00 61.00 62.13 2qmd s PRO 84 Cb -0.15 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.36 2qmd s PRO 84 CO -0.07 -1.55 1.55 -0.35 0.04 0.00 0.00 177.00 176.62 2qmd n PRO 85 N -2.91 2.25 -3.74 0.56 -0.04 -1.02 -4.90 135.00 125.20 2qmd n PRO 85 Ca 0.11 0.81 -0.37 0.00 -0.04 0.00 0.00 63.50 64.00 2qmd n PRO 85 Cb 0.52 -2.56 -0.12 0.00 -0.04 0.00 0.00 33.50 31.30 2qmd n PRO 85 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2qmd s GLN 86 N 0.41 3.43 0.05 0.54 -0.21 0.44 -4.88 119.66 119.43 2qmd s GLN 86 Ca 0.74 -0.63 -0.30 0.00 0.02 0.00 0.00 55.36 55.18 2qmd s GLN 86 Cb -0.63 -3.38 -0.04 0.00 1.00 0.00 0.00 33.01 29.96 2qmd s GLN 86 CO 0.42 -0.31 1.01 0.99 -2.12 0.00 0.00 175.29 175.28 2qmd s THR 87 N 1.58 4.62 -0.02 -0.19 2.01 -1.26 -0.87 115.64 121.52 2qmd s THR 87 Ca 0.05 1.97 -0.05 0.00 0.31 0.00 0.00 61.69 63.98 2qmd s THR 87 Cb -0.16 -4.26 0.00 0.00 0.01 0.00 0.00 72.50 68.09 2qmd s THR 87 CO 0.04 0.20 0.11 -0.76 -0.69 0.00 0.00 174.62 173.52 2qmd s LEU 88 N 0.66 1.65 -0.07 4.42 1.43 -0.28 -4.96 118.68 121.53 2qmd s LEU 88 Ca 0.51 -0.02 -0.20 0.00 -1.03 0.00 0.00 54.13 53.39 2qmd s LEU 88 Cb -0.23 0.46 -0.04 0.00 0.03 0.00 0.00 46.19 46.41 2qmd s LEU 88 CO 0.29 -0.20 0.55 0.20 0.23 0.00 0.00 176.35 177.43 2qmd s ASN 89 N -0.67 6.83 -0.12 2.29 0.01 -1.26 -0.73 114.94 121.28 2qmd s ASN 89 Ca -0.08 1.00 0.01 0.00 -0.71 0.00 0.00 52.86 53.08 2qmd s ASN 89 Cb -0.05 -2.33 0.02 0.00 0.41 0.00 0.00 41.25 39.30 2qmd s ASN 89 CO 0.01 0.02 -0.14 -0.63 -1.51 0.00 0.00 177.10 174.85 2qmd s ILE 90 N 0.36 1.43 0.12 0.60 -1.09 0.20 -0.06 121.20 122.76 2qmd s ILE 90 Ca 0.30 -0.58 -0.32 0.00 -2.23 0.00 0.00 60.65 57.82 2qmd s ILE 90 Cb -0.17 -1.34 -0.12 0.00 -1.58 0.00 0.00 42.46 39.26 2qmd s ILE 90 CO 0.14 0.43 1.76 -0.11 -1.23 0.00 0.00 174.94 175.93 2qmd n LEU 91 N 4.49 3.71 -4.60 2.97 7.94 0.41 -1.17 117.00 130.75 2qmd n LEU 91 Ca -0.18 1.02 -0.43 0.00 -1.11 0.00 0.00 56.01 55.32 2qmd n LEU 91 Cb 0.51 -1.50 -0.04 0.00 0.53 0.00 0.00 43.42 42.92 2qmd n LEU 91 CO 0.22 0.03 0.74 -0.69 -1.11 0.00 0.00 177.39 176.57 2qmd s VAL 92 N 2.15 4.59 -0.32 1.96 1.01 0.13 -0.16 120.40 129.76 2qmd s VAL 92 Ca 0.81 1.09 0.02 0.00 0.00 0.00 0.00 61.98 63.90 2qmd s VAL 92 Cb -0.56 -4.33 0.10 0.00 0.00 0.00 0.00 36.38 31.58 2qmd s VAL 92 CO 0.38 -0.56 0.06 -0.62 0.00 0.00 0.00 175.10 174.36 2qmd s ASP 93 N 1.93 4.36 0.00 3.32 2.15 -0.46 -4.23 116.67 123.74 2qmd s ASP 93 Ca 0.37 -1.85 0.27 0.00 0.43 0.00 0.00 52.55 51.77 2qmd s ASP 93 Cb -0.12 -1.24 1.59 0.00 -0.30 0.00 0.00 42.92 42.85 2qmd s ASP 93 CO 0.19 -0.39 1.96 0.35 -0.17 0.00 0.00 175.17 177.12 2qmd n THR 94 N 4.56 0.00 0.04 1.71 -2.24 -1.26 -0.81 114.28 116.28 2qmd n THR 94 Ca 0.00 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 2qmd n THR 94 Cb 0.42 -0.53 0.27 0.00 -2.10 0.00 0.00 70.33 68.39 2qmd n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qmd n GLY 95 N 0.75 2.02 3.56 3.38 0.00 -1.26 -4.22 105.19 109.42 2qmd n GLY 95 Ca 0.20 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.32 2qmd n GLY 95 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qmd s SER 96 N -1.28 0.72 -0.00 1.61 1.04 -1.22 -4.99 113.70 109.58 2qmd s SER 96 Ca 0.43 -1.41 0.00 0.00 0.48 0.00 0.00 55.95 55.46 2qmd s SER 96 Cb 0.24 0.70 0.00 0.00 0.10 0.00 0.00 66.02 67.07 2qmd s SER 96 CO 0.32 -1.38 0.72 -1.20 0.98 0.00 0.00 173.24 172.68 2qmd n SER 97 N -1.40 0.85 -4.71 7.02 7.64 -1.26 -0.76 113.62 120.99 2qmd n SER 97 Ca -0.01 -1.44 -0.35 0.00 1.01 0.00 0.00 58.87 58.07 2qmd n SER 97 Cb 0.61 -0.01 -0.09 0.00 -1.01 0.00 0.00 64.21 63.72 2qmd n SER 97 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2qmd s ASN 98 N -0.45 5.62 -0.29 6.43 -0.87 -1.26 -4.53 114.94 119.59 2qmd s ASN 98 Ca 0.00 0.20 -0.14 0.00 -1.57 0.00 0.00 52.86 51.35 2qmd s ASN 98 Cb 0.00 -1.77 -0.03 0.00 -0.02 0.00 0.00 41.25 39.43 2qmd s ASN 98 CO 0.00 0.33 0.34 0.12 -2.57 0.00 0.00 177.10 175.32 2qmd s PHE 99 N -0.55 3.23 -0.02 2.20 5.99 -1.26 -1.45 117.98 126.13 2qmd s PHE 99 Ca 0.10 0.24 -0.03 0.00 0.00 0.00 0.00 56.93 57.24 2qmd s PHE 99 Cb -0.12 -2.57 0.00 0.00 0.00 0.00 0.00 43.02 40.33 2qmd s PHE 99 CO 0.02 -0.28 0.07 0.00 -0.00 0.00 0.00 175.22 175.04 2qmd s ALA 100 N 2.01 -0.16 0.02 11.12 0.00 -0.46 -1.30 121.76 132.97 2qmd s ALA 100 Ca 0.13 0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.12 2qmd s ALA 100 Cb -0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.91 2qmd s ALA 100 CO 0.11 -0.09 -0.08 0.14 0.00 0.00 0.00 175.76 175.83 2qmd s VAL 101 N -0.50 0.60 0.26 0.00 -7.23 -0.39 0.03 120.40 113.18 2qmd s VAL 101 Ca -0.06 -0.65 -0.31 0.00 -1.81 0.00 0.00 61.98 59.15 2qmd s VAL 101 Cb -0.04 -0.57 -0.13 0.00 0.56 0.00 0.00 36.38 36.20 2qmd s VAL 101 CO 0.00 -0.06 1.45 0.61 -0.31 0.00 0.00 175.10 176.79 2qmd n GLY 102 N 2.27 0.91 0.19 2.32 0.00 0.39 -0.44 105.19 110.83 2qmd n GLY 102 Ca -0.17 0.47 0.03 0.00 0.00 0.00 0.00 46.02 46.35 2qmd n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qmd n ALA 103 N 1.83 1.84 -3.41 4.61 0.00 -0.37 -0.59 120.51 124.41 2qmd n ALA 103 Ca 0.10 -1.30 -0.16 0.00 0.00 0.00 0.00 53.44 52.08 2qmd n ALA 103 Cb 0.33 -0.27 -0.06 0.00 0.00 0.00 0.00 19.45 19.45 2qmd n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qmd s ALA 104 N -0.90 -1.47 0.21 0.00 0.00 -1.22 -4.78 121.76 113.61 2qmd s ALA 104 Ca 0.08 0.94 -0.30 0.00 0.00 0.00 0.00 51.96 52.68 2qmd s ALA 104 Cb 0.07 0.12 -0.16 0.00 0.00 0.00 0.00 23.12 23.15 2qmd s ALA 104 CO 0.01 -0.39 0.92 -2.30 0.00 0.00 0.00 175.76 174.01 2qmd n PRO 105 N 0.85 0.85 -3.76 0.00 -0.02 -1.26 -4.96 135.00 126.70 2qmd n PRO 105 Ca -0.19 0.30 -0.13 0.00 -2.02 0.00 0.00 63.50 61.46 2qmd n PRO 105 Cb 0.58 -1.61 -0.11 0.00 -0.02 0.00 0.00 33.50 32.33 2qmd n PRO 105 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2qmd s HIS 106 N -0.73 -0.37 0.50 6.00 2.46 -1.26 -5.05 115.29 116.84 2qmd s HIS 106 Ca 0.66 0.90 0.32 0.00 0.47 0.00 0.00 55.06 57.42 2qmd s HIS 106 Cb -0.84 0.13 1.44 0.00 -0.13 0.00 0.00 32.58 33.18 2qmd s HIS 106 CO 0.56 -0.18 1.79 -1.35 -2.47 0.00 0.00 174.74 173.09 2qmd h PRO 107 N 5.72 0.10 -0.31 2.88 0.11 -2.03 -0.39 132.00 138.08 2qmd h PRO 107 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2qmd h PRO 107 Cb 1.19 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2qmd h PRO 107 CO 0.30 0.06 0.00 1.19 -0.21 0.00 0.00 178.00 179.34 2qmd n PHE 108 N -4.31 0.39 -4.61 0.65 0.99 -1.26 -4.91 117.46 104.40 2qmd n PHE 108 Ca 0.26 -0.19 -0.33 0.00 -0.00 0.00 0.00 57.45 57.18 2qmd n PHE 108 Cb 1.17 0.00 -0.13 0.00 -1.00 0.00 0.00 39.48 39.52 2qmd n PHE 108 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2qmd s LEU 109 N -1.56 3.03 0.00 4.37 1.43 -0.16 -4.68 118.68 121.11 2qmd s LEU 109 Ca 0.36 -0.17 0.18 0.00 -1.03 0.00 0.00 54.13 53.47 2qmd s LEU 109 Cb 0.21 -1.69 0.23 0.00 0.03 0.00 0.00 46.19 44.97 2qmd s LEU 109 CO 0.30 0.23 1.16 0.00 0.23 0.00 0.00 176.35 178.27 2qmd n HIS 110 N 3.14 0.19 -3.47 0.29 1.44 -1.26 -4.58 115.22 110.96 2qmd n HIS 110 Ca -0.18 -0.12 -0.15 0.00 -2.01 0.00 0.00 57.72 55.26 2qmd n HIS 110 Cb 0.53 -0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.59 2qmd n HIS 110 CO 0.00 0.00 0.00 -0.98 -2.81 0.00 0.00 176.34 172.55 2qmd s ARG 111 N -1.39 1.16 0.17 -1.40 1.70 -1.26 -5.17 118.95 112.76 2qmd s ARG 111 Ca 0.25 -0.11 -0.18 0.00 -0.47 0.00 0.00 55.73 55.22 2qmd s ARG 111 Cb 0.16 0.54 0.04 0.00 -0.57 0.00 0.00 34.95 35.12 2qmd s ARG 111 CO 0.23 -0.44 0.51 1.52 -1.08 0.00 0.00 175.30 176.04 2qmd s TYR 112 N -2.46 -0.25 -0.04 5.89 -0.85 -1.26 -4.93 117.35 113.45 2qmd s TYR 112 Ca -0.05 -0.06 -0.30 0.00 -0.52 0.00 0.00 57.07 56.14 2qmd s TYR 112 Cb -0.01 0.40 -0.05 0.00 0.38 0.00 0.00 41.96 42.68 2qmd s TYR 112 CO -0.02 -0.85 1.53 -0.47 -1.52 0.00 0.00 175.55 174.23 2qmd s TYR 113 N -3.82 2.38 -0.62 -3.49 5.04 0.24 -4.94 117.35 112.13 2qmd s TYR 113 Ca 0.05 0.48 -0.05 0.00 -2.44 0.00 0.00 57.07 55.11 2qmd s TYR 113 Cb -0.00 -3.80 0.16 0.00 0.35 0.00 0.00 41.96 38.67 2qmd s TYR 113 CO -0.08 -3.20 0.46 -0.65 -1.34 0.00 0.00 175.55 170.75 2qmd s GLN 114 N 3.35 2.67 0.35 4.97 -0.21 -1.26 -4.42 119.66 125.11 2qmd s GLN 114 Ca 0.68 -2.38 0.09 0.00 0.02 0.00 0.00 55.36 53.78 2qmd s GLN 114 Cb -0.32 -3.85 0.82 0.00 1.00 0.00 0.00 33.01 30.66 2qmd s GLN 114 CO 0.27 -1.19 1.87 0.00 -2.12 0.00 0.00 175.29 174.12 2qmd h ARG 115 N 7.39 0.67 0.00 2.91 3.08 -1.93 -1.33 114.38 125.17 2qmd h ARG 115 Ca -0.03 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2qmd h ARG 115 Cb 0.99 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.88 2qmd h ARG 115 CO 0.73 0.45 0.00 0.00 -1.07 0.00 0.00 179.97 180.08 2qmd n GLN 116 N -4.56 0.15 0.00 0.04 0.00 -1.26 -1.97 117.38 109.78 2qmd n GLN 116 Ca 0.17 0.41 0.12 0.00 0.00 0.00 0.00 57.00 57.70 2qmd n GLN 116 Cb 0.47 -1.80 0.19 0.00 0.00 0.00 0.00 30.24 29.11 2qmd n GLN 116 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2qmd n LEU 117 N -2.08 2.52 -4.48 2.61 4.77 -0.50 -4.87 117.00 114.96 2qmd n LEU 117 Ca 0.02 -0.84 -0.37 0.00 -0.03 0.00 0.00 56.01 54.78 2qmd n LEU 117 Cb 0.20 -0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.17 2qmd n LEU 117 CO 0.17 0.42 -0.23 -0.55 -1.33 0.00 0.00 177.39 175.88 2qmd s SER 118 N -2.06 5.48 0.40 -1.43 0.15 -0.83 -4.23 113.70 111.18 2qmd s SER 118 Ca 0.29 -0.23 0.28 0.00 0.70 0.00 0.00 55.95 56.99 2qmd s SER 118 Cb 0.20 -2.00 1.04 0.00 -1.71 0.00 0.00 66.02 63.55 2qmd s SER 118 CO 0.34 -0.08 1.82 0.77 1.20 0.00 0.00 173.24 177.29 2qmd h SER 119 N 8.30 0.00 -0.02 5.45 4.64 -1.32 -2.99 113.55 127.61 2qmd h SER 119 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2qmd h SER 119 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2qmd h SER 119 CO 0.58 0.00 -0.04 0.35 -0.87 0.00 0.00 176.83 176.85 2qmd n THR 120 N -2.71 0.00 -1.77 2.95 -2.24 -1.26 -4.96 114.28 104.29 2qmd n THR 120 Ca 0.02 -0.45 -0.42 0.00 -2.27 0.00 0.00 64.05 60.93 2qmd n THR 120 Cb 0.32 1.36 -0.02 0.00 -2.10 0.00 0.00 70.33 69.89 2qmd n THR 120 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2qmd s TYR 121 N -2.05 2.86 -0.11 4.78 5.04 -1.13 -4.53 117.35 122.21 2qmd s TYR 121 Ca 0.28 0.54 0.01 0.00 -2.44 0.00 0.00 57.07 55.46 2qmd s TYR 121 Cb 0.20 -4.09 0.02 0.00 0.35 0.00 0.00 41.96 38.43 2qmd s TYR 121 CO 0.33 -3.95 -0.12 1.03 -1.34 0.00 0.00 175.55 171.50 2qmd s ARG 122 N 0.49 1.90 -0.15 4.97 0.52 -0.63 -4.99 118.95 121.06 2qmd s ARG 122 Ca 0.70 -0.43 -0.25 0.00 -0.52 0.00 0.00 55.73 55.23 2qmd s ARG 122 Cb -0.48 -1.72 -0.02 0.00 0.52 0.00 0.00 34.95 33.24 2qmd s ARG 122 CO 0.38 -0.14 0.79 0.34 0.02 0.00 0.00 175.30 176.70 2qmd s ASP 123 N 1.22 6.94 0.00 0.23 2.15 -1.26 -0.72 116.67 125.24 2qmd s ASP 123 Ca -0.03 1.15 0.28 0.00 0.43 0.00 0.00 52.55 54.38 2qmd s ASP 123 Cb -0.14 -2.44 1.06 0.00 -0.30 0.00 0.00 42.92 41.10 2qmd s ASP 123 CO -0.04 -0.33 1.75 0.18 -0.17 0.00 0.00 175.17 176.56 2qmd n LEU 124 N 4.92 0.76 -3.90 -1.34 4.77 -0.76 -4.95 117.00 116.51 2qmd n LEU 124 Ca 0.03 -0.14 -0.29 0.00 -0.03 0.00 0.00 56.01 55.58 2qmd n LEU 124 Cb 0.49 -0.14 0.02 0.00 -2.33 0.00 0.00 43.42 41.47 2qmd n LEU 124 CO 0.48 0.14 0.06 0.54 -1.33 0.00 0.00 177.39 177.27 2qmd n ARG 125 N -0.73 -5.22 -3.80 3.23 1.74 -1.26 -4.97 116.66 105.66 2qmd n ARG 125 Ca 0.14 0.58 -0.13 0.00 -0.77 0.00 0.00 57.85 57.68 2qmd n ARG 125 Cb 0.30 -5.38 -0.13 0.00 -1.02 0.00 0.00 32.46 26.24 2qmd n ARG 125 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2qmd s LYS 126 N -6.53 0.15 0.53 5.56 2.20 -1.26 -5.06 119.74 115.34 2qmd s LYS 126 Ca 0.53 0.26 -0.05 0.00 -0.36 0.00 0.00 55.97 56.35 2qmd s LYS 126 Cb -0.27 0.01 -0.01 0.00 -1.51 0.00 0.00 37.83 36.06 2qmd s LYS 126 CO 0.83 -0.06 0.83 0.20 -0.36 0.00 0.00 175.35 176.79 2qmd s GLY 127 N 0.39 1.56 -0.10 5.54 0.00 -1.26 -0.80 107.32 112.64 2qmd s GLY 127 Ca -0.03 -0.68 -0.09 0.00 0.00 0.00 0.00 44.72 43.93 2qmd s GLY 127 CO -0.02 -0.46 0.27 0.54 0.00 0.00 0.00 173.10 173.44 2qmd s VAL 128 N -2.84 -0.01 -0.09 1.40 0.11 -0.33 -4.80 120.40 113.85 2qmd s VAL 128 Ca 0.51 0.02 0.01 0.00 -2.93 0.00 0.00 61.98 59.59 2qmd s VAL 128 Cb -0.10 -0.39 0.02 0.00 -1.53 0.00 0.00 36.38 34.38 2qmd s VAL 128 CO 0.44 0.01 -0.12 -0.47 -3.33 0.00 0.00 175.10 171.63 2qmd s TYR 129 N 0.32 1.62 -0.22 1.54 5.04 -1.26 -0.44 117.35 123.95 2qmd s TYR 129 Ca -0.01 -0.70 -0.00 0.00 -2.44 0.00 0.00 57.07 53.91 2qmd s TYR 129 Cb -0.03 -1.21 0.06 0.00 0.35 0.00 0.00 41.96 41.12 2qmd s TYR 129 CO -0.01 -0.39 -0.04 0.08 -1.34 0.00 0.00 175.55 173.85 2qmd s VAL 130 N 1.01 1.30 -0.40 3.14 1.01 -0.64 -4.87 120.40 120.95 2qmd s VAL 130 Ca -0.08 -1.02 -0.14 0.00 0.00 0.00 0.00 61.98 60.75 2qmd s VAL 130 Cb -0.15 -1.59 0.02 0.00 0.00 0.00 0.00 36.38 34.66 2qmd s VAL 130 CO -0.01 -0.08 0.28 -2.16 0.00 0.00 0.00 175.10 173.13 2qmd s PRO 131 N 1.51 2.97 0.00 2.72 0.04 -1.26 -2.04 135.00 138.94 2qmd s PRO 131 Ca -0.04 -1.01 0.00 0.00 0.04 0.00 0.00 61.00 59.99 2qmd s PRO 131 Cb -0.18 -3.91 0.00 0.00 0.04 0.00 0.00 34.50 30.45 2qmd s PRO 131 CO -0.07 -0.72 0.00 0.66 0.04 0.00 0.00 177.00 176.91 2qmd n TYR 132 N 5.12 -3.33 -0.01 0.56 4.01 0.15 -4.98 117.16 118.67 2qmd n TYR 132 Ca -0.11 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.46 2qmd n TYR 132 Cb 0.47 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.41 2qmd n TYR 132 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2qmd h THR 133 N -0.62 1.38 0.00 -0.72 2.02 -2.00 -3.41 112.91 109.56 2qmd h THR 133 Ca 0.00 -1.94 0.00 0.00 0.77 0.00 0.00 66.41 65.24 2qmd h THR 133 Cb 0.00 2.33 0.00 0.00 -1.74 0.00 0.00 68.15 68.74 2qmd h THR 133 CO 0.00 0.58 0.00 1.67 0.37 0.00 0.00 175.52 178.14 2qmd n GLN 134 N -4.19 0.00 -0.91 6.66 -0.06 -1.26 -5.04 117.38 112.57 2qmd n GLN 134 Ca -0.09 0.11 0.00 0.00 -2.00 0.00 0.00 57.00 55.02 2qmd n GLN 134 Cb 0.65 -0.78 0.00 0.00 -4.06 0.00 0.00 30.24 26.05 2qmd n GLN 134 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2qmd n GLY 135 N 1.37 6.19 3.33 1.69 0.00 -1.25 -4.96 105.19 111.57 2qmd n GLY 135 Ca 0.00 -2.11 -0.11 0.00 0.00 0.00 0.00 46.02 43.80 2qmd n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qmd s LYS 136 N -0.37 1.10 0.06 1.61 -2.85 -0.50 -0.68 119.74 118.12 2qmd s LYS 136 Ca 0.00 -0.65 -0.10 0.00 -1.00 0.00 0.00 55.97 54.22 2qmd s LYS 136 Cb 0.00 0.49 0.00 0.00 -2.06 0.00 0.00 37.83 36.26 2qmd s LYS 136 CO 0.00 -0.44 0.21 1.67 0.10 0.00 0.00 175.35 176.89 2qmd s TRP 137 N -3.75 0.06 0.03 1.78 1.48 -0.86 -0.88 118.94 116.79 2qmd s TRP 137 Ca 0.02 -0.34 0.07 0.00 -1.06 0.00 0.00 56.10 54.79 2qmd s TRP 137 Cb 0.01 -0.02 -0.02 0.00 -1.16 0.00 0.00 33.47 32.28 2qmd s TRP 137 CO -0.12 -0.48 -0.20 -1.21 -4.06 0.00 0.00 176.95 170.89 2qmd s GLU 138 N -2.97 1.42 0.05 3.25 2.02 0.93 -1.62 118.70 121.78 2qmd s GLU 138 Ca -0.02 -0.86 -0.01 0.00 0.02 0.00 0.00 54.97 54.10 2qmd s GLU 138 Cb 0.01 -1.48 0.01 0.00 0.10 0.00 0.00 34.13 32.77 2qmd s GLU 138 CO -0.06 0.38 0.09 0.41 0.02 0.00 0.00 175.26 176.10 2qmd n GLY 139 N 2.06 2.35 3.16 -1.39 0.00 0.42 -1.17 105.19 110.61 2qmd n GLY 139 Ca -0.17 -1.20 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 2qmd n GLY 139 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qmd s GLU 140 N -2.05 2.83 0.33 1.61 2.02 -0.28 -1.18 118.70 121.97 2qmd s GLU 140 Ca 0.03 -0.79 -0.26 0.00 0.02 0.00 0.00 54.97 53.96 2qmd s GLU 140 Cb -0.00 -2.25 -0.09 0.00 0.10 0.00 0.00 34.13 31.88 2qmd s GLU 140 CO 0.02 0.03 1.00 -0.51 0.02 0.00 0.00 175.26 175.83 2qmd s LEU 141 N 0.70 4.35 0.00 1.80 1.43 0.02 -0.43 118.68 126.55 2qmd s LEU 141 Ca -0.11 1.99 -0.16 0.00 -1.03 0.00 0.00 54.13 54.82 2qmd s LEU 141 Cb -0.16 -3.96 0.06 0.00 0.03 0.00 0.00 46.19 42.16 2qmd s LEU 141 CO 0.01 -0.19 0.79 0.61 0.23 0.00 0.00 176.35 177.81 2qmd n GLY 142 N 0.70 0.84 3.23 -3.19 0.00 -0.78 -1.82 105.19 104.16 2qmd n GLY 142 Ca 0.02 -1.13 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 2qmd n GLY 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qmd s THR 143 N -2.18 1.06 0.18 2.61 -4.23 0.10 -0.52 115.64 112.65 2qmd s THR 143 Ca 0.17 -2.00 -0.24 0.00 -1.18 0.00 0.00 61.69 58.45 2qmd s THR 143 Cb -0.03 -1.77 0.07 0.00 1.34 0.00 0.00 72.50 72.11 2qmd s THR 143 CO 0.06 -0.76 0.98 -0.62 -0.54 0.00 0.00 174.62 173.74 2qmd s ASP 144 N -3.08 -0.11 0.00 3.99 -1.08 -0.86 -1.61 116.67 113.94 2qmd s ASP 144 Ca 0.15 -0.53 -0.28 0.00 -0.52 0.00 0.00 52.55 51.36 2qmd s ASP 144 Cb 0.03 0.51 -0.04 0.00 -1.46 0.00 0.00 42.92 41.96 2qmd s ASP 144 CO -0.01 -0.97 0.91 -0.76 0.52 0.00 0.00 175.17 174.86 2qmd s LEU 145 N -3.10 4.38 -0.03 -1.34 1.43 -1.26 -1.69 118.68 117.08 2qmd s LEU 145 Ca 0.15 1.58 0.05 0.00 -1.03 0.00 0.00 54.13 54.88 2qmd s LEU 145 Cb -0.02 -3.46 -0.01 0.00 0.03 0.00 0.00 46.19 42.73 2qmd s LEU 145 CO 0.04 -0.19 -0.18 -0.69 0.23 0.00 0.00 176.35 175.55 2qmd s VAL 146 N 0.78 1.47 0.14 -1.59 1.01 0.61 -1.01 120.40 121.81 2qmd s VAL 146 Ca 0.48 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.70 2qmd s VAL 146 Cb -0.21 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 2qmd s VAL 146 CO 0.26 0.42 -0.03 -0.44 0.00 0.00 0.00 175.10 175.31 2qmd s SER 147 N -0.27 1.18 -0.29 3.32 0.01 -0.66 -1.55 113.70 115.44 2qmd s SER 147 Ca 0.03 -1.09 0.01 0.00 1.31 0.00 0.00 55.95 56.21 2qmd s SER 147 Cb -0.09 0.11 0.08 0.00 0.21 0.00 0.00 66.02 66.33 2qmd s SER 147 CO 0.00 -0.51 0.02 -0.63 0.41 0.00 0.00 173.24 172.53 2qmd s ILE 148 N -3.64 1.56 0.24 1.44 1.01 -1.26 -0.77 121.20 119.78 2qmd s ILE 148 Ca 0.18 -1.62 -0.08 0.00 0.00 0.00 0.00 60.65 59.13 2qmd s ILE 148 Cb 0.06 -2.03 0.25 0.00 0.01 0.00 0.00 42.46 40.75 2qmd s ILE 148 CO -0.00 -0.43 1.65 -0.65 0.00 0.00 0.00 174.94 175.51 2qmd h PRO 149 N 7.89 0.12 -2.24 2.79 0.11 -1.92 -1.65 132.00 137.09 2qmd h PRO 149 Ca -0.12 -0.01 -0.75 0.00 0.11 0.00 0.00 66.00 65.23 2qmd h PRO 149 Cb 1.04 -0.03 -0.31 0.00 0.11 0.00 0.00 31.00 31.82 2qmd h PRO 149 CO 0.46 0.08 0.63 0.72 -0.21 0.00 0.00 178.00 179.67 2qmd n HIS 150 N -5.31 3.09 -0.97 0.65 8.25 -1.26 -4.91 115.22 114.75 2qmd n HIS 150 Ca 0.12 -2.89 0.00 0.00 -0.26 0.00 0.00 57.72 54.69 2qmd n HIS 150 Cb 0.44 -1.02 0.00 0.00 1.12 0.00 0.00 29.99 30.53 2qmd n HIS 150 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qmd n GLY 151 N -0.13 4.79 3.76 -1.41 0.00 -0.62 -4.45 105.19 107.13 2qmd n GLY 151 Ca 0.43 -0.78 -0.39 0.00 0.00 0.00 0.00 46.02 45.28 2qmd n GLY 151 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qmd s PRO 152 N 3.20 4.57 -1.42 1.61 0.04 -1.26 -4.80 135.00 136.93 2qmd s PRO 152 Ca 0.00 1.67 -0.14 0.00 0.04 0.00 0.00 61.00 62.57 2qmd s PRO 152 Cb 0.00 -3.04 0.06 0.00 0.04 0.00 0.00 34.50 31.55 2qmd s PRO 152 CO 0.00 0.19 2.13 0.09 0.04 0.00 0.00 177.00 179.45 2qmd n ASN 153 N 0.93 4.12 -3.92 6.66 3.02 -1.26 -4.66 115.26 120.15 2qmd n ASN 153 Ca 0.00 -2.87 -0.09 0.00 -0.03 0.00 0.00 54.58 51.59 2qmd n ASN 153 Cb 0.46 -1.66 -0.09 0.00 -0.61 0.00 0.00 39.78 37.89 2qmd n ASN 153 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2qmd s VAL 154 N 3.09 0.15 -0.06 2.41 -7.23 -1.26 -5.16 120.40 112.34 2qmd s VAL 154 Ca 0.47 -1.20 0.03 0.00 -1.81 0.00 0.00 61.98 59.47 2qmd s VAL 154 Cb 0.12 -1.11 0.01 0.00 0.56 0.00 0.00 36.38 35.96 2qmd s VAL 154 CO -0.06 -0.66 -0.15 -0.89 -0.31 0.00 0.00 175.10 173.03 2qmd s THR 155 N -3.14 1.32 0.11 5.32 2.01 -1.26 -4.46 115.64 115.54 2qmd s THR 155 Ca -0.00 -0.61 0.06 0.00 0.31 0.00 0.00 61.69 61.44 2qmd s THR 155 Cb 0.02 -1.17 -0.04 0.00 0.01 0.00 0.00 72.50 71.32 2qmd s THR 155 CO -0.07 0.39 -0.14 0.68 -0.69 0.00 0.00 174.62 174.79 2qmd s VAL 156 N 0.42 1.26 -0.22 3.82 -7.23 -0.60 -4.93 120.40 112.93 2qmd s VAL 156 Ca -0.12 -1.59 -0.19 0.00 -1.81 0.00 0.00 61.98 58.27 2qmd s VAL 156 Cb -0.14 -1.40 -0.03 0.00 0.56 0.00 0.00 36.38 35.37 2qmd s VAL 156 CO 0.04 -0.36 0.53 -0.60 -0.31 0.00 0.00 175.10 174.40 2qmd s ARG 157 N -2.40 4.16 0.11 4.82 3.52 -1.26 -0.28 118.95 127.62 2qmd s ARG 157 Ca 0.06 0.42 0.05 0.00 -0.13 0.00 0.00 55.73 56.12 2qmd s ARG 157 Cb -0.06 -3.59 -0.04 0.00 -1.56 0.00 0.00 34.95 29.70 2qmd s ARG 157 CO 0.03 -0.22 -0.11 0.00 -0.81 0.00 0.00 175.30 174.18 2qmd s ALA 158 N 1.88 1.30 0.30 6.12 0.00 -0.68 -4.92 121.76 125.75 2qmd s ALA 158 Ca 0.24 -1.28 -0.29 0.00 0.00 0.00 0.00 51.96 50.63 2qmd s ALA 158 Cb -0.15 -0.00 -0.10 0.00 0.00 0.00 0.00 23.12 22.86 2qmd s ALA 158 CO 0.09 -0.00 1.28 -0.80 0.00 0.00 0.00 175.76 176.33 2qmd s ASN 159 N -2.58 6.86 -0.04 0.00 0.01 -1.26 -2.02 114.94 115.91 2qmd s ASN 159 Ca 0.09 2.58 -0.00 0.00 -0.71 0.00 0.00 52.86 54.81 2qmd s ASN 159 Cb -0.02 -2.64 0.03 0.00 0.41 0.00 0.00 41.25 39.02 2qmd s ASN 159 CO 0.01 -0.48 0.01 -0.63 -1.51 0.00 0.00 177.10 174.50 2qmd s ILE 160 N -0.90 0.21 -0.32 0.60 1.01 0.32 -4.67 121.20 117.45 2qmd s ILE 160 Ca 0.50 0.13 -0.18 0.00 0.00 0.00 0.00 60.65 61.10 2qmd s ILE 160 Cb -0.38 -0.34 -0.01 0.00 0.01 0.00 0.00 42.46 41.74 2qmd s ILE 160 CO 0.48 0.18 0.52 0.00 0.00 0.00 0.00 174.94 176.12 2qmd s ALA 161 N 1.39 3.51 -0.50 9.38 0.00 -0.42 -1.87 121.76 133.25 2qmd s ALA 161 Ca -0.04 -0.87 -0.24 0.00 0.00 0.00 0.00 51.96 50.81 2qmd s ALA 161 Cb -0.13 -2.98 0.03 0.00 0.00 0.00 0.00 23.12 20.05 2qmd s ALA 161 CO -0.03 -1.07 0.86 0.00 0.00 0.00 0.00 175.76 175.53 2qmd s ALA 162 N 2.38 3.24 -0.11 0.00 0.00 0.42 -1.27 121.76 126.42 2qmd s ALA 162 Ca 0.20 -1.12 -0.29 0.00 0.00 0.00 0.00 51.96 50.74 2qmd s ALA 162 Cb -0.15 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.34 2qmd s ALA 162 CO 0.12 -2.14 1.47 0.42 0.00 0.00 0.00 175.76 175.64 2qmd s ILE 163 N 3.58 3.90 -0.07 0.00 1.01 0.42 -1.13 121.20 128.92 2qmd s ILE 163 Ca 0.30 1.09 0.12 0.00 0.00 0.00 0.00 60.65 62.16 2qmd s ILE 163 Cb -0.12 -3.71 -0.18 0.00 0.01 0.00 0.00 42.46 38.45 2qmd s ILE 163 CO 0.21 -0.11 0.28 0.35 0.00 0.00 0.00 174.94 175.68 2qmd n THR 164 N 5.47 0.00 -3.76 2.92 -2.24 -0.32 -1.23 114.28 115.12 2qmd n THR 164 Ca 0.16 -0.27 -0.13 0.00 -2.27 0.00 0.00 64.05 61.54 2qmd n THR 164 Cb 0.44 0.30 -0.10 0.00 -2.10 0.00 0.00 70.33 68.86 2qmd n THR 164 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2qmd s GLU 165 N -2.76 0.47 0.08 -0.78 2.02 -1.04 -4.91 118.70 111.77 2qmd s GLU 165 Ca -0.04 0.29 -0.18 0.00 0.02 0.00 0.00 54.97 55.06 2qmd s GLU 165 Cb 0.08 0.22 0.04 0.00 0.10 0.00 0.00 34.13 34.57 2qmd s GLU 165 CO 0.50 -0.09 0.42 -1.54 0.02 0.00 0.00 175.26 174.58 2qmd s SER 166 N -0.24 -0.29 -0.08 -0.19 1.04 -1.26 -0.05 113.70 112.63 2qmd s SER 166 Ca -0.04 -0.10 -0.03 0.00 0.48 0.00 0.00 55.95 56.27 2qmd s SER 166 Cb -0.03 0.45 0.04 0.00 0.10 0.00 0.00 66.02 66.58 2qmd s SER 166 CO 0.02 -0.75 0.08 -0.62 0.98 0.00 0.00 173.24 172.95 2qmd s ASP 167 N -2.31 1.42 -1.82 7.02 3.68 -0.06 -4.86 116.67 119.74 2qmd s ASP 167 Ca -0.02 -0.08 0.00 0.00 2.13 0.00 0.00 52.55 54.58 2qmd s ASP 167 Cb 0.00 -0.12 0.00 0.00 -1.45 0.00 0.00 42.92 41.35 2qmd s ASP 167 CO -0.06 -0.28 0.00 0.29 0.13 0.00 0.00 175.17 175.25 2qmd n LYS 168 N 5.30 -1.65 -0.01 4.34 5.02 -1.26 -1.40 118.16 128.49 2qmd n LYS 168 Ca -0.04 1.03 -0.01 0.00 -2.02 0.00 0.00 58.31 57.26 2qmd n LYS 168 Cb 0.50 -5.58 -0.00 0.00 -0.02 0.00 0.00 35.03 29.93 2qmd n LYS 168 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2qmd n PHE 169 N -3.33 0.06 -1.90 2.13 7.35 -1.26 -3.76 117.46 116.75 2qmd n PHE 169 Ca -0.22 0.02 -0.39 0.00 -0.76 0.00 0.00 57.45 56.10 2qmd n PHE 169 Cb 0.66 -0.17 0.02 0.00 0.35 0.00 0.00 39.48 40.34 2qmd n PHE 169 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 2qmd s PHE 170 N -1.28 2.53 -0.18 -5.13 0.40 -1.26 -4.98 117.98 108.08 2qmd s PHE 170 Ca -0.04 1.36 -0.02 0.00 -0.60 0.00 0.00 56.93 57.62 2qmd s PHE 170 Cb 0.01 -3.77 -0.01 0.00 0.51 0.00 0.00 43.02 39.75 2qmd s PHE 170 CO 0.06 -2.58 -0.07 0.42 0.70 0.00 0.00 175.22 173.74 2qmd s ILE 171 N -1.28 3.34 0.05 0.64 1.01 -1.26 -5.03 121.20 118.67 2qmd s ILE 171 Ca 0.63 -0.53 -0.30 0.00 0.00 0.00 0.00 60.65 60.45 2qmd s ILE 171 Cb -0.40 -2.47 -0.09 0.00 0.01 0.00 0.00 42.46 39.51 2qmd s ILE 171 CO 0.50 0.47 1.95 -3.20 0.00 0.00 0.00 174.94 174.66 2qmd n ASN 172 N 4.11 4.14 0.00 3.58 4.05 -1.26 -2.14 115.26 127.74 2qmd n ASN 172 Ca -0.18 0.92 0.00 0.00 0.45 0.00 0.00 54.58 55.77 2qmd n ASN 172 Cb 0.52 -1.53 0.00 0.00 1.23 0.00 0.00 39.78 40.00 2qmd n ASN 172 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2qmd n GLY 173 N 4.50 0.67 0.23 8.20 0.00 -1.26 -4.92 105.19 112.60 2qmd n GLY 173 Ca 0.20 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.34 2qmd n GLY 173 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qmd h SER 174 N 0.00 0.00 0.00 1.61 4.64 -1.78 -3.47 113.55 114.55 2qmd h SER 174 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qmd h SER 174 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2qmd h SER 174 CO 0.00 0.12 0.00 -3.20 -0.87 0.00 0.00 176.83 172.88 2qmd n ASN 175 N -3.19 -3.58 -4.64 4.97 5.15 -1.26 -4.94 115.26 107.77 2qmd n ASN 175 Ca 0.02 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 53.69 2qmd n ASN 175 Cb 0.46 -1.38 -0.09 0.00 -0.53 0.00 0.00 39.78 38.24 2qmd n ASN 175 CO 0.00 0.00 0.00 -1.66 1.40 0.00 0.00 177.26 177.00 2qmd s TRP 176 N -1.81 2.91 0.00 1.20 1.48 -1.26 -4.61 118.94 116.84 2qmd s TRP 176 Ca 0.00 -0.06 0.00 0.00 -1.06 0.00 0.00 56.10 54.98 2qmd s TRP 176 Cb 0.00 -1.52 0.00 0.00 -1.16 0.00 0.00 33.47 30.79 2qmd s TRP 176 CO 0.00 0.45 0.83 0.39 -4.06 0.00 0.00 176.95 174.56 2qmd n GLU 177 N 0.75 1.65 -3.79 3.25 4.71 0.91 -4.86 120.64 123.25 2qmd n GLU 177 Ca -0.12 -1.16 -0.05 0.00 -0.01 0.00 0.00 57.16 55.82 2qmd n GLU 177 Cb 0.52 -0.99 0.02 0.00 -1.01 0.00 0.00 31.44 29.98 2qmd n GLU 177 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2qmd n GLY 178 N -0.33 0.74 2.98 0.62 0.00 -1.13 -0.46 105.19 107.61 2qmd n GLY 178 Ca 0.00 -1.18 -0.17 0.00 0.00 0.00 0.00 46.02 44.67 2qmd n GLY 178 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qmd s ILE 179 N -2.08 0.54 -0.44 -0.61 2.07 0.10 -0.44 121.20 120.34 2qmd s ILE 179 Ca 0.20 -0.29 -0.03 0.00 -1.41 0.00 0.00 60.65 59.12 2qmd s ILE 179 Cb -0.03 -0.46 0.12 0.00 0.13 0.00 0.00 42.46 42.21 2qmd s ILE 179 CO 0.07 0.16 0.25 -0.22 -1.91 0.00 0.00 174.94 173.29 2qmd s LEU 180 N -0.11 5.29 -0.38 8.50 2.96 0.78 -1.36 118.68 134.36 2qmd s LEU 180 Ca 0.02 -2.13 -0.29 0.00 -0.22 0.00 0.00 54.13 51.51 2qmd s LEU 180 Cb -0.03 -1.85 0.02 0.00 0.50 0.00 0.00 46.19 44.83 2qmd s LEU 180 CO -0.00 -0.53 1.18 -0.83 -1.32 0.00 0.00 176.35 174.84 2qmd s GLY 181 N 1.75 1.38 0.00 7.98 0.00 -0.53 -1.36 107.32 116.55 2qmd s GLY 181 Ca 0.09 -0.18 0.26 0.00 0.00 0.00 0.00 44.72 44.89 2qmd s GLY 181 CO -0.04 2.44 1.53 1.04 0.00 0.00 0.00 173.10 178.07 2qmd n LEU 182 N 7.57 1.70 0.00 0.66 4.77 0.01 -4.24 117.00 127.47 2qmd n LEU 182 Ca 0.13 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 2qmd n LEU 182 Cb 0.48 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 2qmd n LEU 182 CO 0.66 0.29 0.00 0.00 -1.33 0.00 0.00 177.39 177.01 2qmd n ALA 183 N 0.12 0.00 -2.03 -1.18 0.00 0.06 -4.93 120.51 112.55 2qmd n ALA 183 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.29 2qmd n ALA 183 Cb 0.41 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.86 2qmd n ALA 183 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2qmd s TYR 184 N -0.88 3.56 0.56 0.00 1.51 -0.59 -4.66 117.35 116.86 2qmd s TYR 184 Ca 0.00 1.14 0.27 0.00 -1.01 0.00 0.00 57.07 57.46 2qmd s TYR 184 Cb 0.00 -2.56 1.51 0.00 -0.11 0.00 0.00 41.96 40.79 2qmd s TYR 184 CO 0.00 -0.43 2.03 0.00 -1.11 0.00 0.00 175.55 176.04 2qmd h ALA 185 N 0.26 2.13 -0.75 3.71 0.00 -1.88 -2.67 119.26 120.07 2qmd h ALA 185 Ca -0.46 -0.01 0.20 0.00 0.00 0.00 0.00 54.91 54.65 2qmd h ALA 185 Cb 1.19 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 2qmd h ALA 185 CO 0.62 -0.48 0.53 1.49 0.00 0.00 0.00 179.25 181.41 2qmd h GLU 186 N 0.00 0.08 -0.51 0.00 4.81 -1.88 -0.40 114.58 116.68 2qmd h GLU 186 Ca 0.16 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 2qmd h GLU 186 Cb 0.76 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.13 2qmd h GLU 186 CO -0.00 0.05 0.00 0.44 -0.73 0.00 0.00 179.01 178.77 2qmd n ILE 187 N -4.35 1.09 -2.48 2.32 -5.35 -1.01 -4.65 119.36 104.93 2qmd n ILE 187 Ca 0.15 -1.04 -0.37 0.00 -0.27 0.00 0.00 62.75 61.22 2qmd n ILE 187 Cb 0.77 0.45 -0.03 0.00 -1.74 0.00 0.00 39.64 39.09 2qmd n ILE 187 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qmd s ALA 188 N -1.11 3.09 0.01 -1.28 0.00 -0.16 -4.59 121.76 117.72 2qmd s ALA 188 Ca 0.35 0.77 0.00 0.00 0.00 0.00 0.00 51.96 53.08 2qmd s ALA 188 Cb 0.19 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 2qmd s ALA 188 CO 0.23 -0.30 0.07 1.03 0.00 0.00 0.00 175.76 176.78 2qmd s ARG 189 N -2.46 3.00 0.39 0.00 1.81 -1.26 -2.68 118.95 117.75 2qmd s ARG 189 Ca 0.58 -0.53 0.16 0.00 -1.72 0.00 0.00 55.73 54.22 2qmd s ARG 189 Cb -0.24 -2.81 0.80 0.00 -0.45 0.00 0.00 34.95 32.25 2qmd s ARG 189 CO 0.30 0.63 1.83 -1.35 -0.68 0.00 0.00 175.30 176.03 2qmd h PRO 190 N 4.01 0.00 -2.92 3.54 0.11 -1.90 -3.47 132.00 131.38 2qmd h PRO 190 Ca -0.49 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.63 2qmd h PRO 190 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2qmd h PRO 190 CO 0.62 0.35 0.34 0.16 -0.21 0.00 0.00 178.00 179.26 2qmd s ASP 191 N -6.68 0.03 0.00 -2.05 3.84 -1.09 -5.04 116.67 105.69 2qmd s ASP 191 Ca -0.02 -1.11 0.11 0.00 -0.00 0.00 0.00 52.55 51.52 2qmd s ASP 191 Cb 0.13 0.80 0.63 0.00 -1.38 0.00 0.00 42.92 43.10 2qmd s ASP 191 CO 0.70 -1.59 1.06 -0.90 -0.00 0.00 0.00 175.17 174.43 2qmd n ASP 192 N -1.49 0.00 0.03 2.11 5.68 -1.25 -2.27 116.55 119.37 2qmd n ASP 192 Ca -0.08 -0.42 0.13 0.00 -0.50 0.00 0.00 54.79 53.92 2qmd n ASP 192 Cb 0.60 0.00 0.37 0.00 -1.14 0.00 0.00 41.12 40.95 2qmd n ASP 192 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2qmd n SER 193 N -0.94 0.45 -4.45 -1.12 3.41 -1.26 -4.59 113.62 105.11 2qmd n SER 193 Ca 0.08 0.20 -0.43 0.00 -0.26 0.00 0.00 58.87 58.46 2qmd n SER 193 Cb 0.04 -0.18 -0.04 0.00 -0.26 0.00 0.00 64.21 63.77 2qmd n SER 193 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2qmd s LEU 194 N -3.54 4.49 0.11 1.04 2.96 -0.96 -4.99 118.68 117.79 2qmd s LEU 194 Ca 0.11 -1.13 -0.32 0.00 -0.22 0.00 0.00 54.13 52.57 2qmd s LEU 194 Cb 0.16 -2.41 -0.11 0.00 0.50 0.00 0.00 46.19 44.33 2qmd s LEU 194 CO 0.64 -1.39 1.82 1.21 -1.32 0.00 0.00 176.35 177.31 2qmd n GLU 195 N 7.54 2.69 -1.55 1.98 2.13 -1.26 -4.90 120.64 127.27 2qmd n GLU 195 Ca -0.01 0.98 -0.33 0.00 0.66 0.00 0.00 57.16 58.46 2qmd n GLU 195 Cb 0.46 -2.86 0.07 0.00 0.27 0.00 0.00 31.44 29.38 2qmd n GLU 195 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 2qmd s PRO 196 N 2.70 2.45 0.23 5.31 0.02 -1.26 -4.53 135.00 139.92 2qmd s PRO 196 Ca 0.83 1.47 -0.06 0.00 0.02 0.00 0.00 61.00 63.26 2qmd s PRO 196 Cb -0.51 -1.90 0.41 0.00 0.02 0.00 0.00 34.50 32.51 2qmd s PRO 196 CO 0.39 -1.54 1.70 0.35 -0.33 0.00 0.00 177.00 177.57 2qmd h PHE 197 N -0.30 0.31 -0.04 6.54 3.57 -1.82 -2.07 116.94 123.13 2qmd h PHE 197 Ca -0.46 0.04 -0.11 0.00 3.53 0.00 0.00 57.97 60.96 2qmd h PHE 197 Cb 1.26 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.96 2qmd h PHE 197 CO 0.53 -0.03 -0.49 0.35 -2.23 0.00 0.00 178.31 176.44 2qmd h PHE 198 N 0.31 0.11 -0.63 0.41 3.57 -1.92 -0.23 116.94 118.57 2qmd h PHE 198 Ca 0.38 -0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.77 2qmd h PHE 198 Cb 0.61 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 2qmd h PHE 198 CO -0.23 0.56 0.06 -0.44 -2.23 0.00 0.00 178.31 176.03 2qmd h ASP 199 N 0.07 1.02 -0.46 0.41 3.32 -1.77 -1.36 116.42 117.65 2qmd h ASP 199 Ca 0.00 -0.26 -0.05 0.00 0.02 0.00 0.00 57.03 56.74 2qmd h ASP 199 Cb 0.89 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 2qmd h ASP 199 CO 0.07 1.04 0.08 0.28 -1.72 0.00 0.00 179.24 178.98 2qmd h SER 200 N 0.98 0.73 -0.18 6.45 0.02 -0.74 -0.96 113.55 119.85 2qmd h SER 200 Ca 0.19 -0.26 0.04 0.00 -0.84 0.00 0.00 61.79 60.92 2qmd h SER 200 Cb 0.48 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.79 2qmd h SER 200 CO 0.02 0.80 -0.06 0.25 -1.14 0.00 0.00 176.83 176.70 2qmd h LEU 201 N 0.63 -0.22 -0.53 5.07 5.85 -0.74 -0.99 115.31 124.39 2qmd h LEU 201 Ca 0.14 0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.82 2qmd h LEU 201 Cb 0.38 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 2qmd h LEU 201 CO 0.01 -0.08 -0.08 0.58 -0.34 0.00 0.00 178.44 178.53 2qmd h VAL 202 N -0.03 1.27 -0.19 1.05 2.07 -1.14 -2.42 116.25 116.86 2qmd h VAL 202 Ca 0.09 -1.22 -0.10 0.00 0.82 0.00 0.00 66.70 66.30 2qmd h VAL 202 Cb 0.17 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2qmd h VAL 202 CO -0.20 0.43 -0.31 0.50 0.02 0.00 0.00 177.57 178.01 2qmd h LYS 203 N 0.86 0.38 0.00 1.57 3.64 -0.89 -3.21 116.57 118.91 2qmd h LYS 203 Ca 0.14 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2qmd h LYS 203 Cb 0.63 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2qmd h LYS 203 CO 0.04 0.65 -0.69 1.04 -2.27 0.00 0.00 179.45 178.22 2qmd n GLN 204 N -4.09 0.08 -2.04 1.90 6.02 -0.40 -4.99 117.38 113.86 2qmd n GLN 204 Ca -0.01 0.01 -0.00 0.00 -0.01 0.00 0.00 57.00 56.98 2qmd n GLN 204 Cb 0.43 -1.53 -0.00 0.00 1.02 0.00 0.00 30.24 30.15 2qmd n GLN 204 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2qmd n THR 205 N -1.64 0.00 -0.35 5.09 -2.24 -0.92 -5.04 114.28 109.18 2qmd n THR 205 Ca 0.04 -0.04 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 2qmd n THR 205 Cb 0.36 0.02 0.30 0.00 -2.10 0.00 0.00 70.33 68.91 2qmd n THR 205 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2qmd n HIS 206 N -0.01 0.91 -1.80 4.78 8.25 -1.26 -4.82 115.22 121.26 2qmd n HIS 206 Ca 0.00 -0.50 -0.42 0.00 -0.26 0.00 0.00 57.72 56.54 2qmd n HIS 206 Cb 0.01 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 2qmd n HIS 206 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2qmd s VAL 207 N -1.02 2.58 0.50 1.59 1.01 -1.26 -4.94 120.40 118.86 2qmd s VAL 207 Ca 0.45 0.20 -0.23 0.00 0.00 0.00 0.00 61.98 62.41 2qmd s VAL 207 Cb 0.24 -3.13 -0.07 0.00 0.00 0.00 0.00 36.38 33.41 2qmd s VAL 207 CO 0.30 0.00 1.20 -2.65 0.00 0.00 0.00 175.10 173.96 2qmd n PRO 208 N 5.13 1.56 -1.71 2.72 -0.02 -1.26 -4.69 135.00 136.73 2qmd n PRO 208 Ca 0.16 0.57 -0.42 0.00 -2.02 0.00 0.00 63.50 61.79 2qmd n PRO 208 Cb 0.38 -2.36 -0.01 0.00 -0.02 0.00 0.00 33.50 31.50 2qmd n PRO 208 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2qmd n ASN 209 N -0.35 3.78 -3.61 2.55 5.15 -1.26 -4.26 115.26 117.26 2qmd n ASN 209 Ca 0.10 -2.83 -0.12 0.00 -0.60 0.00 0.00 54.58 51.13 2qmd n ASN 209 Cb 0.43 -1.61 -0.07 0.00 -0.53 0.00 0.00 39.78 38.00 2qmd n ASN 209 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2qmd s LEU 210 N 2.23 -0.55 0.06 1.20 0.20 -1.26 -1.34 118.68 119.22 2qmd s LEU 210 Ca 0.48 0.94 -0.06 0.00 0.69 0.00 0.00 54.13 56.18 2qmd s LEU 210 Cb 0.14 2.13 -0.01 0.00 -0.43 0.00 0.00 46.19 48.01 2qmd s LEU 210 CO -0.06 -0.27 0.10 0.72 -0.29 0.00 0.00 176.35 176.55 2qmd s PHE 211 N -0.14 0.25 0.02 5.38 -0.71 -1.01 0.18 117.98 121.95 2qmd s PHE 211 Ca -0.00 -0.64 0.02 0.00 -1.04 0.00 0.00 56.93 55.26 2qmd s PHE 211 Cb -0.04 -0.16 -0.01 0.00 -1.21 0.00 0.00 43.02 41.60 2qmd s PHE 211 CO -0.01 -0.43 -0.06 -1.54 -1.34 0.00 0.00 175.22 171.85 2qmd s SER 212 N -2.52 0.67 -0.09 1.98 1.04 -0.27 -0.16 113.70 114.35 2qmd s SER 212 Ca 0.01 -0.32 0.03 0.00 0.48 0.00 0.00 55.95 56.14 2qmd s SER 212 Cb 0.03 -0.01 0.01 0.00 0.10 0.00 0.00 66.02 66.15 2qmd s SER 212 CO -0.08 -0.08 -0.19 -0.76 0.98 0.00 0.00 173.24 173.11 2qmd s LEU 213 N -0.87 1.91 -0.34 2.42 1.43 0.35 -0.90 118.68 122.69 2qmd s LEU 213 Ca -0.05 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 52.61 2qmd s LEU 213 Cb -0.06 -1.20 0.09 0.00 0.03 0.00 0.00 46.19 45.06 2qmd s LEU 213 CO 0.00 0.10 0.05 -1.58 0.23 0.00 0.00 176.35 175.14 2qmd s GLN 214 N 0.55 1.74 -0.20 1.70 0.74 -0.11 -1.05 119.66 123.03 2qmd s GLN 214 Ca -0.15 -1.75 -0.14 0.00 0.05 0.00 0.00 55.36 53.37 2qmd s GLN 214 Cb -0.17 -3.22 -0.04 0.00 1.10 0.00 0.00 33.01 30.68 2qmd s GLN 214 CO 0.05 -0.88 0.30 -0.51 -0.55 0.00 0.00 175.29 173.70 2qmd s LEU 215 N 0.99 4.17 -0.39 3.68 1.43 -1.26 -0.65 118.68 126.65 2qmd s LEU 215 Ca 0.06 0.40 -0.05 0.00 -1.03 0.00 0.00 54.13 53.51 2qmd s LEU 215 Cb -0.20 -2.36 0.08 0.00 0.03 0.00 0.00 46.19 43.75 2qmd s LEU 215 CO -0.06 0.01 0.18 0.00 0.23 0.00 0.00 176.35 176.71 2qmd s GLY 217 N 1.81 2.74 0.35 0.00 0.00 -1.26 -4.71 107.32 106.25 2qmd s GLY 217 Ca 0.03 0.59 0.19 0.00 0.00 0.00 0.00 44.72 45.53 2qmd s GLY 217 CO -0.01 1.01 1.54 0.00 0.00 0.00 0.00 173.10 175.64 2qmd h ALA 218 N 2.82 0.82 0.00 3.20 0.00 -1.94 -3.44 119.26 120.73 2qmd h ALA 218 Ca -0.48 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.17 2qmd h ALA 218 Cb 1.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2qmd h ALA 218 CO 0.64 0.37 0.00 0.41 0.00 0.00 0.00 179.25 180.66 2qmd n GLY 219 N 1.09 0.90 3.55 0.00 0.00 -1.26 -5.00 105.19 104.47 2qmd n GLY 219 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 2qmd n GLY 219 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qmd s PHE 220 N -3.04 0.03 0.35 1.61 -0.71 -1.26 -4.88 117.98 110.08 2qmd s PHE 220 Ca 0.00 -0.39 -0.28 0.00 -1.04 0.00 0.00 56.93 55.21 2qmd s PHE 220 Cb 0.00 0.34 -0.10 0.00 -1.21 0.00 0.00 43.02 42.04 2qmd s PHE 220 CO 0.00 -0.95 1.36 -2.14 -1.34 0.00 0.00 175.22 172.15 2qmd s PRO 221 N -3.92 4.28 -0.19 1.99 0.02 -1.26 -4.91 135.00 131.01 2qmd s PRO 221 Ca 0.13 2.32 -0.02 0.00 0.02 0.00 0.00 61.00 63.45 2qmd s PRO 221 Cb -0.01 -3.04 -0.00 0.00 0.02 0.00 0.00 34.50 31.47 2qmd s PRO 221 CO 0.01 -0.29 -0.10 -0.51 -0.33 0.00 0.00 177.00 175.78 2qmd s LEU 222 N -1.89 2.68 1.09 -5.54 1.43 -1.26 -5.07 118.68 110.11 2qmd s LEU 222 Ca 0.50 -0.44 -0.18 0.00 -1.03 0.00 0.00 54.13 52.98 2qmd s LEU 222 Cb -0.42 -1.65 0.25 0.00 0.03 0.00 0.00 46.19 44.40 2qmd s LEU 222 CO 0.56 0.02 1.26 0.54 0.23 0.00 0.00 176.35 178.96 2qmd s ASN 223 N 1.19 1.99 0.29 2.29 2.20 -1.26 -4.63 114.94 117.01 2qmd s ASN 223 Ca 0.02 0.31 -0.00 0.00 -0.94 0.00 0.00 52.86 52.25 2qmd s ASN 223 Cb -0.14 -0.35 0.49 0.00 -2.00 0.00 0.00 41.25 39.25 2qmd s ASN 223 CO -0.04 -3.44 1.91 -0.61 -2.94 0.00 0.00 177.10 171.99 2qmd h GLN 224 N -2.12 1.04 -0.06 3.55 4.15 -1.99 -0.76 115.11 118.92 2qmd h GLN 224 Ca -0.44 -0.06 -0.24 0.00 0.77 0.00 0.00 58.65 58.68 2qmd h GLN 224 Cb 1.24 -0.23 0.01 0.00 0.21 0.00 0.00 27.48 28.71 2qmd h GLN 224 CO 0.32 0.69 -0.92 0.77 -1.93 0.00 0.00 178.83 177.76 2qmd h SER 225 N 1.07 0.83 -0.50 -0.69 0.02 -2.00 -3.16 113.55 109.11 2qmd h SER 225 Ca 0.39 -0.61 -0.11 0.00 -0.84 0.00 0.00 61.79 60.61 2qmd h SER 225 Cb 0.15 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 2qmd h SER 225 CO -0.14 1.41 -0.10 -0.33 -1.14 0.00 0.00 176.83 176.53 2qmd h GLU 226 N 0.41 0.99 0.00 3.45 5.08 -1.82 -2.59 114.58 120.09 2qmd h GLU 226 Ca -0.09 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 2qmd h GLU 226 Cb 1.55 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.73 2qmd h GLU 226 CO 0.18 1.03 0.00 -0.24 -1.00 0.00 0.00 179.01 178.98 2qmd h VAL 227 N 0.88 0.00 0.00 3.13 3.04 -1.21 -0.46 116.25 121.64 2qmd h VAL 227 Ca 0.14 -0.53 -0.13 0.00 -1.01 0.00 0.00 66.70 65.17 2qmd h VAL 227 Cb 0.65 1.47 -0.02 0.00 -2.01 0.00 0.00 31.29 31.38 2qmd h VAL 227 CO 0.05 0.00 -0.82 -0.07 -1.01 0.00 0.00 177.57 175.71 2qmd h LEU 228 N 0.00 0.00 -0.61 3.16 3.38 -1.45 -3.33 115.31 116.46 2qmd h LEU 228 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qmd h LEU 228 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2qmd h LEU 228 CO 0.00 0.57 -0.64 0.00 0.09 0.00 0.00 178.44 178.46 2qmd n ALA 229 N -2.29 3.93 -2.38 1.53 0.00 -0.88 -4.97 120.51 115.45 2qmd n ALA 229 Ca -0.02 -0.61 -0.37 0.00 0.00 0.00 0.00 53.44 52.45 2qmd n ALA 229 Cb 0.79 -0.75 -0.06 0.00 0.00 0.00 0.00 19.45 19.43 2qmd n ALA 229 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2qmd s SER 230 N -2.58 6.88 -0.16 0.00 0.15 -0.23 -5.06 113.70 112.70 2qmd s SER 230 Ca 0.14 1.09 -0.29 0.00 0.70 0.00 0.00 55.95 57.58 2qmd s SER 230 Cb 0.16 -2.29 -0.00 0.00 -1.71 0.00 0.00 66.02 62.18 2qmd s SER 230 CO 0.65 0.20 1.06 -0.69 1.20 0.00 0.00 173.24 175.67 2qmd s VAL 231 N -1.28 4.64 -2.94 4.45 1.01 -1.26 -4.68 120.40 120.35 2qmd s VAL 231 Ca 0.32 1.95 0.24 0.00 0.00 0.00 0.00 61.98 64.49 2qmd s VAL 231 Cb -0.17 -4.25 0.22 0.00 0.00 0.00 0.00 36.38 32.18 2qmd s VAL 231 CO 0.18 -0.09 1.30 0.61 0.00 0.00 0.00 175.10 177.10 2qmd n GLY 232 N 3.26 0.89 0.00 4.51 0.00 0.60 -4.92 105.19 109.54 2qmd n GLY 232 Ca 0.11 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.46 2qmd n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qmd n GLY 233 N 1.34 0.72 2.88 -0.02 0.00 -1.19 -0.19 105.19 108.73 2qmd n GLY 233 Ca 0.14 -1.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.24 2qmd n GLY 233 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qmd s SER 234 N -4.00 0.17 -0.26 1.61 0.01 0.17 -1.41 113.70 109.98 2qmd s SER 234 Ca 0.00 -0.02 0.03 0.00 1.31 0.00 0.00 55.95 57.27 2qmd s SER 234 Cb 0.00 -0.03 0.06 0.00 0.21 0.00 0.00 66.02 66.26 2qmd s SER 234 CO 0.00 -0.00 -0.10 -0.32 0.41 0.00 0.00 173.24 173.23 2qmd s MET 235 N 0.11 2.18 -0.36 12.44 0.00 -1.26 -0.93 119.30 131.48 2qmd s MET 235 Ca -0.01 -1.38 -0.16 0.00 0.00 0.00 0.00 55.69 54.14 2qmd s MET 235 Cb -0.02 -2.90 -0.00 0.00 0.00 0.00 0.00 34.83 31.90 2qmd s MET 235 CO -0.00 -0.59 0.39 0.42 0.00 0.00 0.00 175.02 175.24 2qmd s ILE 236 N 1.09 5.13 -0.31 10.11 -1.09 -0.07 -4.83 121.20 131.24 2qmd s ILE 236 Ca -0.08 -0.01 -0.18 0.00 -2.23 0.00 0.00 60.65 58.15 2qmd s ILE 236 Cb -0.20 -3.89 -0.02 0.00 -1.58 0.00 0.00 42.46 36.78 2qmd s ILE 236 CO -0.05 -0.18 0.50 -0.63 -1.23 0.00 0.00 174.94 173.35 2qmd s ILE 237 N 2.08 5.05 0.00 2.92 -1.09 -1.26 -1.11 121.20 127.79 2qmd s ILE 237 Ca 0.12 0.58 0.00 0.00 -2.23 0.00 0.00 60.65 59.13 2qmd s ILE 237 Cb -0.17 -3.89 0.00 0.00 -1.58 0.00 0.00 42.46 36.83 2qmd s ILE 237 CO 0.12 -0.06 0.00 0.61 -1.23 0.00 0.00 174.94 174.38 2qmd n GLY 238 N 4.63 0.72 2.27 6.18 0.00 0.13 -4.77 105.19 114.35 2qmd n GLY 238 Ca -0.05 -0.05 -0.00 0.00 0.00 0.00 0.00 46.02 45.92 2qmd n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qmd n GLY 239 N -2.54 0.65 3.07 -0.02 0.00 -1.24 -4.38 105.19 100.73 2qmd n GLY 239 Ca 0.00 -1.01 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 2qmd n GLY 239 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qmd s ILE 240 N -2.18 1.68 -0.34 -0.61 1.01 -1.26 -4.04 121.20 115.46 2qmd s ILE 240 Ca 0.15 -0.72 -0.12 0.00 0.00 0.00 0.00 60.65 59.96 2qmd s ILE 240 Cb -0.01 -1.53 -0.01 0.00 0.01 0.00 0.00 42.46 40.92 2qmd s ILE 240 CO 0.01 0.48 0.21 -0.62 0.00 0.00 0.00 174.94 175.02 2qmd s ASP 241 N 1.19 5.86 0.00 3.58 2.15 -1.26 -4.75 116.67 123.44 2qmd s ASP 241 Ca -0.01 -0.54 0.09 0.00 0.43 0.00 0.00 52.55 52.53 2qmd s ASP 241 Cb -0.14 -2.08 0.42 0.00 -0.30 0.00 0.00 42.92 40.82 2qmd s ASP 241 CO -0.06 -0.25 1.28 1.41 -0.17 0.00 0.00 175.17 177.38 2qmd n HIS 242 N 5.06 0.00 0.80 -5.34 8.25 -1.26 -2.38 115.22 120.35 2qmd n HIS 242 Ca -0.13 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.46 2qmd n HIS 242 Cb 0.49 -0.46 0.44 0.00 1.12 0.00 0.00 29.99 31.57 2qmd n HIS 242 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2qmd n SER 243 N -1.46 0.46 -0.14 0.41 3.41 -1.26 -3.79 113.62 111.25 2qmd n SER 243 Ca 0.03 0.39 0.14 0.00 -0.26 0.00 0.00 58.87 59.17 2qmd n SER 243 Cb 0.10 -0.44 0.62 0.00 -0.26 0.00 0.00 64.21 64.24 2qmd n SER 243 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2qmd n LEU 244 N -1.87 0.53 -4.00 1.04 4.77 -1.00 -4.82 117.00 111.64 2qmd n LEU 244 Ca 0.06 -0.04 -0.10 0.00 -0.03 0.00 0.00 56.01 55.91 2qmd n LEU 244 Cb 0.39 -0.16 -0.08 0.00 -2.33 0.00 0.00 43.42 41.25 2qmd n LEU 244 CO 0.30 0.10 -0.07 -0.72 -1.33 0.00 0.00 177.39 175.67 2qmd s TYR 245 N -2.41 0.51 0.22 -1.77 1.13 -1.25 -1.44 117.35 112.34 2qmd s TYR 245 Ca 0.31 -0.87 0.11 0.00 -1.41 0.00 0.00 57.07 55.21 2qmd s TYR 245 Cb 0.20 -0.14 -0.05 0.00 -1.10 0.00 0.00 41.96 40.87 2qmd s TYR 245 CO 0.46 -0.69 -0.21 0.95 -2.51 0.00 0.00 175.55 173.55 2qmd s THR 246 N -3.99 2.26 0.00 -3.49 -4.23 -0.54 -4.79 115.64 100.85 2qmd s THR 246 Ca 0.19 -2.17 0.00 0.00 -1.18 0.00 0.00 61.69 58.53 2qmd s THR 246 Cb 0.04 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 71.74 2qmd s THR 246 CO 0.01 -0.30 0.00 0.61 -0.54 0.00 0.00 174.62 174.40 2qmd n GLY 247 N -0.11 -0.38 3.92 3.99 0.00 -1.26 -3.68 105.19 107.66 2qmd n GLY 247 Ca -0.09 -1.08 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 2qmd n GLY 247 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qmd s SER 248 N -4.00 6.38 -0.06 1.61 0.01 -1.26 -4.97 113.70 111.41 2qmd s SER 248 Ca 0.00 0.31 -0.25 0.00 1.31 0.00 0.00 55.95 57.32 2qmd s SER 248 Cb 0.00 -1.97 -0.03 0.00 0.21 0.00 0.00 66.02 64.22 2qmd s SER 248 CO 0.00 0.12 0.78 -0.76 0.41 0.00 0.00 173.24 173.79 2qmd s LEU 249 N -2.70 4.31 -0.09 2.44 1.43 -1.26 -4.49 118.68 118.32 2qmd s LEU 249 Ca 0.36 1.30 0.03 0.00 -1.03 0.00 0.00 54.13 54.79 2qmd s LEU 249 Cb -0.12 -3.22 -0.02 0.00 0.03 0.00 0.00 46.19 42.86 2qmd s LEU 249 CO 0.28 -0.18 -0.17 0.26 0.23 0.00 0.00 176.35 176.77 2qmd s TRP 250 N 0.99 2.68 -0.10 0.29 0.52 -0.20 -4.90 118.94 118.21 2qmd s TRP 250 Ca 0.41 -0.56 -0.02 0.00 0.02 0.00 0.00 56.10 55.95 2qmd s TRP 250 Cb -0.18 -1.72 -0.03 0.00 -1.15 0.00 0.00 33.47 30.38 2qmd s TRP 250 CO 0.20 -0.12 -0.01 0.71 0.02 0.00 0.00 176.95 177.75 2qmd s TYR 251 N -0.06 3.13 0.02 -1.98 1.51 -1.26 -0.28 117.35 118.43 2qmd s TYR 251 Ca -0.04 0.11 0.08 0.00 -1.01 0.00 0.00 57.07 56.21 2qmd s TYR 251 Cb -0.14 -1.82 -0.03 0.00 -0.11 0.00 0.00 41.96 39.86 2qmd s TYR 251 CO 0.04 0.37 -0.23 -0.08 -1.11 0.00 0.00 175.55 174.54 2qmd s THR 252 N -0.63 2.35 0.44 -0.71 -1.32 0.11 -3.38 115.64 112.50 2qmd s THR 252 Ca 0.10 -1.23 -0.25 0.00 -1.21 0.00 0.00 61.69 59.10 2qmd s THR 252 Cb -0.12 -1.91 -0.08 0.00 -1.51 0.00 0.00 72.50 68.88 2qmd s THR 252 CO 0.02 0.42 1.30 -2.84 -2.21 0.00 0.00 174.62 171.32 2qmd s PRO 253 N -1.12 3.76 -0.35 7.08 0.02 -1.26 -0.68 135.00 142.45 2qmd s PRO 253 Ca 0.12 2.14 -0.27 0.00 0.02 0.00 0.00 61.00 63.01 2qmd s PRO 253 Cb -0.10 -2.60 0.01 0.00 0.02 0.00 0.00 34.50 31.83 2qmd s PRO 253 CO 0.02 -0.66 0.98 0.42 -0.33 0.00 0.00 177.00 177.43 2qmd s ILE 254 N -1.31 4.56 0.18 2.83 1.01 -0.42 -4.59 121.20 123.45 2qmd s ILE 254 Ca 0.61 1.42 -0.13 0.00 0.00 0.00 0.00 60.65 62.55 2qmd s ILE 254 Cb -0.38 -4.36 0.08 0.00 0.01 0.00 0.00 42.46 37.81 2qmd s ILE 254 CO 0.47 -0.51 1.81 -0.09 0.00 0.00 0.00 174.94 176.63 2qmd h ARG 255 N 8.31 0.77 -2.42 2.79 2.43 -1.12 -3.44 114.38 121.70 2qmd h ARG 255 Ca -0.22 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 58.79 2qmd h ARG 255 Cb 1.07 -0.16 -0.21 0.00 -0.42 0.00 0.00 29.97 30.25 2qmd h ARG 255 CO 1.00 0.56 -0.05 0.50 -1.51 0.00 0.00 179.97 180.47 2qmd s ARG 256 N -5.99 0.74 -1.01 0.20 3.52 -1.26 -5.08 118.95 110.07 2qmd s ARG 256 Ca -0.13 0.48 -0.19 0.00 -0.13 0.00 0.00 55.73 55.76 2qmd s ARG 256 Cb 0.13 0.35 0.12 0.00 -1.56 0.00 0.00 34.95 33.99 2qmd s ARG 256 CO 0.76 -0.15 1.28 -1.21 -0.81 0.00 0.00 175.30 175.17 2qmd s GLU 257 N -0.34 3.70 0.00 5.12 2.02 -1.26 -4.02 118.70 123.92 2qmd s GLU 257 Ca -0.05 -1.76 0.00 0.00 0.02 0.00 0.00 54.97 53.18 2qmd s GLU 257 Cb -0.03 -5.08 0.00 0.00 0.10 0.00 0.00 34.13 29.12 2qmd s GLU 257 CO 0.03 -1.90 0.00 -2.67 0.02 0.00 0.00 175.26 170.75 2qmd n TRP 258 N 7.04 0.00 -2.14 1.61 4.27 -1.26 -4.63 117.44 122.33 2qmd n TRP 258 Ca 0.29 0.00 -0.27 0.00 -3.89 0.00 0.00 57.50 53.63 2qmd n TRP 258 Cb 0.48 0.00 0.13 0.00 -1.36 0.00 0.00 31.31 30.56 2qmd n TRP 258 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 2qmd s TYR 259 N 0.00 2.05 -1.09 -2.67 2.02 -1.26 -1.54 117.35 114.86 2qmd s TYR 259 Ca 0.00 0.26 -0.19 0.00 -0.37 0.00 0.00 57.07 56.77 2qmd s TYR 259 Cb 0.00 -3.59 0.10 0.00 -0.40 0.00 0.00 41.96 38.07 2qmd s TYR 259 CO 0.00 -2.06 1.41 0.71 -1.57 0.00 0.00 175.55 174.05 2qmd s TYR 260 N -3.54 2.94 -0.00 2.71 1.51 -1.26 -4.84 117.35 114.87 2qmd s TYR 260 Ca 0.68 -1.42 -0.24 0.00 -1.01 0.00 0.00 57.07 55.08 2qmd s TYR 260 Cb -0.07 -4.52 -0.05 0.00 -0.11 0.00 0.00 41.96 37.22 2qmd s TYR 260 CO 0.49 -1.68 0.72 -2.00 -1.11 0.00 0.00 175.55 171.97 2qmd s GLU 261 N 3.49 4.45 0.34 -0.62 2.12 -1.26 -1.94 118.70 125.29 2qmd s GLU 261 Ca 0.43 0.96 0.03 0.00 0.36 0.00 0.00 54.97 56.76 2qmd s GLU 261 Cb -0.01 -3.39 -0.05 0.00 0.26 0.00 0.00 34.13 30.94 2qmd s GLU 261 CO -0.04 0.22 0.09 0.14 -0.54 0.00 0.00 175.26 175.12 2qmd s VAL 262 N 0.23 0.88 -0.15 3.70 -7.23 -0.35 -0.51 120.40 116.96 2qmd s VAL 262 Ca 0.37 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.55 2qmd s VAL 262 Cb -0.19 -2.62 0.02 0.00 0.56 0.00 0.00 36.38 34.15 2qmd s VAL 262 CO 0.21 0.00 -0.16 -0.63 -0.31 0.00 0.00 175.10 174.21 2qmd s ILE 263 N -3.35 1.71 -0.14 -0.62 1.01 -1.26 -4.07 121.20 114.48 2qmd s ILE 263 Ca 0.32 -0.72 -0.18 0.00 0.00 0.00 0.00 60.65 60.07 2qmd s ILE 263 Cb 0.06 -1.58 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 2qmd s ILE 263 CO 0.15 0.48 0.48 -0.63 0.00 0.00 0.00 174.94 175.42 2qmd s ILE 264 N 1.40 5.18 -0.48 2.92 1.01 -1.26 -2.04 121.20 127.92 2qmd s ILE 264 Ca 0.04 0.94 0.10 0.00 0.00 0.00 0.00 60.65 61.73 2qmd s ILE 264 Cb -0.13 -3.81 -0.11 0.00 0.01 0.00 0.00 42.46 38.41 2qmd s ILE 264 CO -0.11 0.30 0.43 1.33 0.00 0.00 0.00 174.94 176.89 2qmd n VAL 265 N 3.85 0.00 -3.59 2.92 0.24 0.90 -4.75 118.33 117.90 2qmd n VAL 265 Ca -0.07 -0.26 -0.12 0.00 -2.04 0.00 0.00 64.34 61.85 2qmd n VAL 265 Cb 0.51 0.99 -0.06 0.00 -1.47 0.00 0.00 33.84 33.81 2qmd n VAL 265 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2qmd s ARG 266 N -1.97 0.72 -0.04 7.34 3.52 -1.24 -4.77 118.95 122.52 2qmd s ARG 266 Ca 0.04 0.46 0.02 0.00 -0.13 0.00 0.00 55.73 56.12 2qmd s ARG 266 Cb 0.08 0.34 0.01 0.00 -1.56 0.00 0.00 34.95 33.82 2qmd s ARG 266 CO 0.42 -0.17 -0.09 0.08 -0.81 0.00 0.00 175.30 174.73 2qmd s VAL 267 N -0.46 0.82 0.05 7.11 1.01 -1.26 -0.59 120.40 127.08 2qmd s VAL 267 Ca -0.02 -0.35 0.06 0.00 0.00 0.00 0.00 61.98 61.67 2qmd s VAL 267 Cb -0.03 -0.75 -0.02 0.00 0.00 0.00 0.00 36.38 35.58 2qmd s VAL 267 CO 0.01 0.27 -0.17 -1.61 0.00 0.00 0.00 175.10 173.60 2qmd s GLU 268 N 0.40 1.10 -0.23 2.72 2.02 -0.48 -0.68 118.70 123.55 2qmd s GLU 268 Ca -0.07 -0.85 0.02 0.00 0.02 0.00 0.00 54.97 54.09 2qmd s GLU 268 Cb -0.11 -1.16 0.04 0.00 0.10 0.00 0.00 34.13 33.00 2qmd s GLU 268 CO 0.01 0.29 -0.13 0.42 0.02 0.00 0.00 175.26 175.87 2qmd s ILE 269 N -0.86 2.23 -1.57 -1.63 -1.09 -0.30 -1.08 121.20 116.90 2qmd s ILE 269 Ca 0.04 -1.31 -0.13 0.00 -2.23 0.00 0.00 60.65 57.01 2qmd s ILE 269 Cb -0.08 -2.16 0.10 0.00 -1.58 0.00 0.00 42.46 38.73 2qmd s ILE 269 CO 0.02 0.20 0.83 0.59 -1.23 0.00 0.00 174.94 175.35 2qmd n ASN 270 N 4.53 -3.51 0.00 3.58 3.02 0.33 -1.09 115.26 122.11 2qmd n ASN 270 Ca -0.17 -0.90 0.00 0.00 -0.03 0.00 0.00 54.58 53.49 2qmd n ASN 270 Cb 0.45 -3.37 0.00 0.00 -0.61 0.00 0.00 39.78 36.26 2qmd n ASN 270 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qmd n GLY 271 N -1.60 2.87 3.65 7.41 0.00 -1.26 -4.98 105.19 111.27 2qmd n GLY 271 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 2qmd n GLY 271 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2qmd s GLN 272 N -0.00 4.18 0.19 1.61 0.74 -0.25 -4.98 119.66 121.14 2qmd s GLN 272 Ca 0.00 0.64 -0.32 0.00 0.05 0.00 0.00 55.36 55.73 2qmd s GLN 272 Cb 0.00 -3.61 -0.12 0.00 1.10 0.00 0.00 33.01 30.39 2qmd s GLN 272 CO 0.00 -0.33 1.75 0.34 -0.55 0.00 0.00 175.29 176.50 2qmd s ASP 273 N 1.31 6.38 0.54 6.67 2.15 -1.26 -1.15 116.67 131.30 2qmd s ASP 273 Ca 0.29 2.85 0.33 0.00 0.43 0.00 0.00 52.55 56.45 2qmd s ASP 273 Cb -0.16 -2.59 1.36 0.00 -0.30 0.00 0.00 42.92 41.23 2qmd s ASP 273 CO 0.09 -0.98 1.97 0.25 -0.17 0.00 0.00 175.17 176.33 2qmd h LEU 274 N 7.21 0.00 0.99 -1.34 5.85 -1.27 -3.47 115.31 123.29 2qmd h LEU 274 Ca -0.44 0.00 -0.40 0.00 0.84 0.00 0.00 57.88 57.88 2qmd h LEU 274 Cb 1.20 0.00 0.04 0.00 0.37 0.00 0.00 40.66 42.28 2qmd h LEU 274 CO 0.96 0.00 -0.60 1.17 -0.34 0.00 0.00 178.44 179.63 2qmd n LYS 275 N -3.04 -4.66 -3.80 1.25 4.81 -1.26 -5.02 118.16 106.43 2qmd n LYS 275 Ca 0.01 0.86 -0.27 0.00 -0.87 0.00 0.00 58.31 58.04 2qmd n LYS 275 Cb 0.30 -5.70 -0.03 0.00 0.02 0.00 0.00 35.03 29.62 2qmd n LYS 275 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 2qmd s MET 276 N -5.73 3.48 0.05 1.64 -1.94 -1.26 -5.03 119.30 110.52 2qmd s MET 276 Ca 0.31 -0.45 -0.33 0.00 -1.71 0.00 0.00 55.69 53.51 2qmd s MET 276 Cb -0.14 -2.90 -0.12 0.00 2.01 0.00 0.00 34.83 33.68 2qmd s MET 276 CO 0.38 0.45 1.79 -3.47 -0.01 0.00 0.00 175.02 174.16 2qmd n ASP 277 N -0.61 3.55 0.25 3.03 -0.08 -1.26 -4.79 116.55 116.64 2qmd n ASP 277 Ca -0.06 1.00 0.14 0.00 -1.51 0.00 0.00 54.79 54.37 2qmd n ASP 277 Cb 0.54 -1.44 0.77 0.00 2.34 0.00 0.00 41.12 43.32 2qmd n ASP 277 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2qmd h LYS 279 N 0.00 0.00 -0.02 0.00 3.64 -1.78 -2.13 116.57 116.27 2qmd h LYS 279 Ca 0.00 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2qmd h LYS 279 Cb 0.25 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 2qmd h LYS 279 CO 0.00 0.27 -0.15 0.93 -2.27 0.00 0.00 179.45 178.22 2qmd h GLU 280 N 0.00 0.03 0.00 1.90 4.39 -1.18 -2.42 114.58 117.30 2qmd h GLU 280 Ca -0.00 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2qmd h GLU 280 Cb 0.63 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 2qmd h GLU 280 CO 0.03 0.19 0.00 1.88 -1.16 0.00 0.00 179.01 179.95 2qmd h TYR 281 N 0.03 0.00 0.00 4.33 0.99 -1.53 -3.14 116.97 117.65 2qmd h TYR 281 Ca 0.01 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 2qmd h TYR 281 Cb 0.29 0.00 -0.05 0.00 1.00 0.00 0.00 36.73 37.97 2qmd h TYR 281 CO 0.00 0.00 -0.45 0.09 -0.00 0.00 0.00 178.16 177.80 2qmd n ASN 282 N -2.91 1.69 -4.50 3.88 3.02 -0.93 -4.44 115.26 111.07 2qmd n ASN 282 Ca 0.01 -3.38 -0.43 0.00 -0.03 0.00 0.00 54.58 50.76 2qmd n ASN 282 Cb 0.32 -0.46 -0.08 0.00 -0.61 0.00 0.00 39.78 38.95 2qmd n ASN 282 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2qmd s TYR 283 N -2.59 3.14 -2.67 3.10 5.04 -1.08 -0.57 117.35 121.72 2qmd s TYR 283 Ca 0.34 -0.23 0.24 0.00 -2.44 0.00 0.00 57.07 54.98 2qmd s TYR 283 Cb 0.33 -3.02 0.39 0.00 0.35 0.00 0.00 41.96 40.02 2qmd s TYR 283 CO -0.05 -0.72 1.38 -0.40 -1.34 0.00 0.00 175.55 174.41 2qmd n ASP 284 N 5.79 3.07 -3.60 4.32 5.75 -1.26 -3.53 116.55 127.09 2qmd n ASP 284 Ca -0.06 -1.95 -0.05 0.00 -0.01 0.00 0.00 54.79 52.73 2qmd n ASP 284 Cb 0.48 -0.13 -0.02 0.00 -1.03 0.00 0.00 41.12 40.42 2qmd n ASP 284 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2qmd s LYS 285 N -1.74 0.69 -0.08 0.11 -2.85 0.27 -4.71 119.74 111.43 2qmd s LYS 285 Ca 0.34 -0.32 0.02 0.00 -1.00 0.00 0.00 55.97 55.01 2qmd s LYS 285 Cb 0.21 0.28 0.02 0.00 -2.06 0.00 0.00 37.83 36.28 2qmd s LYS 285 CO 0.31 -0.31 -0.12 -1.12 0.10 0.00 0.00 175.35 174.20 2qmd s SER 286 N -2.59 2.02 0.15 0.03 0.01 -1.26 -0.52 113.70 111.54 2qmd s SER 286 Ca 0.09 -0.33 0.06 0.00 1.31 0.00 0.00 55.95 57.07 2qmd s SER 286 Cb -0.00 -0.90 -0.04 0.00 0.21 0.00 0.00 66.02 65.29 2qmd s SER 286 CO -0.05 0.01 -0.12 0.27 0.41 0.00 0.00 173.24 173.76 2qmd s ILE 287 N 0.90 1.32 -0.29 1.44 -4.36 -0.43 -1.21 121.20 118.58 2qmd s ILE 287 Ca -0.10 -1.96 -0.10 0.00 -0.26 0.00 0.00 60.65 58.24 2qmd s ILE 287 Cb -0.15 -1.76 -0.03 0.00 1.25 0.00 0.00 42.46 41.77 2qmd s ILE 287 CO 0.01 -0.60 0.16 -0.69 0.24 0.00 0.00 174.94 174.06 2qmd s VAL 288 N -2.82 4.92 -0.30 8.37 1.01 -0.82 -0.56 120.40 130.20 2qmd s VAL 288 Ca 0.15 -0.08 -0.03 0.00 0.00 0.00 0.00 61.98 62.02 2qmd s VAL 288 Cb -0.01 -3.39 0.10 0.00 0.00 0.00 0.00 36.38 33.08 2qmd s VAL 288 CO 0.03 0.20 0.12 -0.62 0.00 0.00 0.00 175.10 174.83 2qmd s ASP 289 N 1.69 3.68 0.02 3.32 2.15 -0.29 -4.43 116.67 122.82 2qmd s ASP 289 Ca 0.06 -1.41 0.15 0.00 0.43 0.00 0.00 52.55 51.78 2qmd s ASP 289 Cb -0.16 -0.51 0.62 0.00 -0.30 0.00 0.00 42.92 42.58 2qmd s ASP 289 CO 0.08 -0.43 1.46 -1.54 -0.17 0.00 0.00 175.17 174.58 2qmd n SER 290 N 5.11 0.06 -0.96 -0.34 3.41 -1.26 -2.81 113.62 116.84 2qmd n SER 290 Ca -0.05 0.52 0.07 0.00 -0.26 0.00 0.00 58.87 59.15 2qmd n SER 290 Cb 0.42 -0.53 0.22 0.00 -0.26 0.00 0.00 64.21 64.06 2qmd n SER 290 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qmd n GLY 291 N -0.08 1.41 3.00 5.00 0.00 -1.26 -4.56 105.19 108.70 2qmd n GLY 291 Ca 0.03 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.29 2qmd n GLY 291 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qmd s THR 292 N -1.46 0.96 0.02 2.61 2.01 -1.12 -5.04 115.64 113.62 2qmd s THR 292 Ca 0.33 -0.40 -0.26 0.00 0.31 0.00 0.00 61.69 61.67 2qmd s THR 292 Cb 0.18 -0.88 -0.17 0.00 0.01 0.00 0.00 72.50 71.64 2qmd s THR 292 CO 0.20 0.31 1.30 0.74 -0.69 0.00 0.00 174.62 176.49 2qmd h THR 293 N 5.83 0.61 -4.20 -0.82 2.02 -1.87 0.28 112.91 114.76 2qmd h THR 293 Ca -0.33 -0.47 -0.49 0.00 0.77 0.00 0.00 66.41 65.89 2qmd h THR 293 Cb 1.18 0.84 0.07 0.00 -1.74 0.00 0.00 68.15 68.49 2qmd h THR 293 CO 0.48 0.08 0.34 0.20 0.37 0.00 0.00 175.52 176.99 2qmd s ASN 294 N -4.95 5.74 -0.32 4.18 0.01 -1.26 -1.22 114.94 117.12 2qmd s ASN 294 Ca -0.15 1.10 -0.28 0.00 -0.71 0.00 0.00 52.86 52.82 2qmd s ASN 294 Cb 0.02 -2.04 0.01 0.00 0.41 0.00 0.00 41.25 39.66 2qmd s ASN 294 CO 0.55 -1.10 1.01 -0.22 -1.51 0.00 0.00 177.10 175.83 2qmd s LEU 295 N -5.18 3.97 -0.13 0.60 2.96 -0.66 -2.50 118.68 117.74 2qmd s LEU 295 Ca 0.56 0.93 -0.03 0.00 -0.22 0.00 0.00 54.13 55.37 2qmd s LEU 295 Cb -0.11 -3.43 -0.03 0.00 0.50 0.00 0.00 46.19 43.12 2qmd s LEU 295 CO 0.50 -0.83 -0.02 -0.13 -1.32 0.00 0.00 176.35 174.56 2qmd s ARG 296 N 3.50 3.41 0.04 1.98 0.52 0.04 -1.41 118.95 127.02 2qmd s ARG 296 Ca 0.42 -0.47 0.08 0.00 -0.52 0.00 0.00 55.73 55.24 2qmd s ARG 296 Cb -0.13 -2.87 -0.03 0.00 0.52 0.00 0.00 34.95 32.45 2qmd s ARG 296 CO 0.15 0.42 -0.23 -0.51 0.02 0.00 0.00 175.30 175.16 2qmd s LEU 297 N -0.13 2.15 0.33 2.53 1.43 0.29 -0.53 118.68 124.76 2qmd s LEU 297 Ca 0.03 -0.53 -0.27 0.00 -1.03 0.00 0.00 54.13 52.34 2qmd s LEU 297 Cb -0.13 -1.10 -0.13 0.00 0.03 0.00 0.00 46.19 44.86 2qmd s LEU 297 CO 0.02 0.21 0.95 -2.65 0.23 0.00 0.00 176.35 175.11 2qmd n PRO 298 N 1.92 1.25 -0.32 1.29 -0.02 -1.26 -0.12 135.00 137.74 2qmd n PRO 298 Ca -0.17 0.44 -0.05 0.00 -2.02 0.00 0.00 63.50 61.71 2qmd n PRO 298 Cb 0.53 -1.84 -0.02 0.00 -0.02 0.00 0.00 33.50 32.14 2qmd n PRO 298 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2qmd n LYS 299 N 0.57 -0.27 -0.01 -0.52 4.81 -0.95 -0.31 118.16 121.48 2qmd n LYS 299 Ca 0.10 1.20 -0.01 0.00 -0.87 0.00 0.00 58.31 58.73 2qmd n LYS 299 Cb 0.34 -1.77 0.27 0.00 0.02 0.00 0.00 35.03 33.89 2qmd n LYS 299 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2qmd h LYS 300 N 0.00 0.55 -0.19 1.64 1.57 -1.91 -0.88 116.57 117.35 2qmd h LYS 300 Ca 0.20 -0.13 -0.20 0.00 -1.87 0.00 0.00 60.65 58.65 2qmd h LYS 300 Cb 0.40 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.64 2qmd h LYS 300 CO -0.76 0.60 -0.68 0.28 -0.57 0.00 0.00 179.45 178.32 2qmd h VAL 301 N 0.53 1.29 -0.29 0.50 2.07 -1.20 -2.08 116.25 117.07 2qmd h VAL 301 Ca 0.11 -1.90 -0.00 0.00 0.82 0.00 0.00 66.70 65.73 2qmd h VAL 301 Cb 0.38 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 32.00 2qmd h VAL 301 CO 0.02 0.60 0.16 0.15 0.02 0.00 0.00 177.57 178.52 2qmd h PHE 302 N 0.55 0.40 -0.66 1.57 3.57 -0.29 0.20 116.94 122.28 2qmd h PHE 302 Ca -0.02 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.49 2qmd h PHE 302 Cb 1.29 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.87 2qmd h PHE 302 CO 0.07 0.32 0.42 0.93 -2.23 0.00 0.00 178.31 177.82 2qmd h GLU 303 N 0.36 0.82 -0.32 1.11 5.08 -1.10 -0.02 114.58 120.50 2qmd h GLU 303 Ca 0.10 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.30 2qmd h GLU 303 Cb 0.05 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 2qmd h GLU 303 CO -0.02 0.54 -0.25 0.00 -1.00 0.00 0.00 179.01 178.29 2qmd h ALA 304 N 1.27 0.46 -0.47 3.43 0.00 -1.04 -2.38 119.26 120.53 2qmd h ALA 304 Ca 0.26 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2qmd h ALA 304 Cb -0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2qmd h ALA 304 CO -0.08 0.45 0.14 0.00 0.00 0.00 0.00 179.25 179.76 2qmd h ALA 305 N 0.74 0.62 -0.55 0.00 0.00 -0.31 -1.86 119.26 117.90 2qmd h ALA 305 Ca 0.06 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2qmd h ALA 305 Cb 0.81 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2qmd h ALA 305 CO 0.06 0.28 0.04 0.28 0.00 0.00 0.00 179.25 179.91 2qmd h VAL 306 N 0.63 1.25 -0.84 0.00 2.07 -1.01 0.20 116.25 118.56 2qmd h VAL 306 Ca 0.15 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.62 2qmd h VAL 306 Cb 0.28 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 2qmd h VAL 306 CO -0.00 0.37 0.40 0.50 0.02 0.00 0.00 177.57 178.86 2qmd h LYS 307 N 0.86 1.21 -0.17 1.57 3.64 -1.20 0.92 116.57 123.40 2qmd h LYS 307 Ca 0.17 -0.18 -0.20 0.00 -1.27 0.00 0.00 60.65 59.17 2qmd h LYS 307 Cb 0.45 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2qmd h LYS 307 CO 0.02 0.93 -0.70 1.03 -2.27 0.00 0.00 179.45 178.46 2qmd h SER 308 N 1.20 0.81 -0.04 4.20 0.87 -0.82 -1.36 113.55 118.41 2qmd h SER 308 Ca 0.29 -0.50 -0.12 0.00 -1.23 0.00 0.00 61.79 60.22 2qmd h SER 308 Cb 0.12 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 2qmd h SER 308 CO -0.04 1.28 -0.37 0.40 -0.53 0.00 0.00 176.83 177.58 2qmd h ILE 309 N 0.49 1.29 -0.44 2.23 2.04 -0.37 -0.81 117.51 121.94 2qmd h ILE 309 Ca -0.03 -1.50 -0.04 0.00 1.00 0.00 0.00 64.86 64.29 2qmd h ILE 309 Cb 1.30 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 38.87 2qmd h ILE 309 CO 0.14 0.47 0.11 0.11 0.00 0.00 0.00 178.15 178.98 2qmd h LYS 310 N 0.45 0.70 -0.68 2.37 1.57 -0.74 -1.87 116.57 118.37 2qmd h LYS 310 Ca 0.05 -0.16 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 2qmd h LYS 310 Cb 0.85 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.03 2qmd h LYS 310 CO 0.07 0.70 0.28 0.00 -0.57 0.00 0.00 179.45 179.92 2qmd h ALA 311 N 0.97 1.20 -0.00 3.86 0.00 -0.91 -1.10 119.26 123.28 2qmd h ALA 311 Ca 0.14 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 2qmd h ALA 311 Cb 0.31 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2qmd h ALA 311 CO 0.00 0.58 -0.57 0.00 0.00 0.00 0.00 179.25 179.27 2qmd h ALA 312 N 1.32 1.06 -0.57 0.00 0.00 -0.95 -3.02 119.26 117.10 2qmd h ALA 312 Ca 0.23 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2qmd h ALA 312 Cb 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2qmd h ALA 312 CO -0.02 0.71 0.00 -1.13 0.00 0.00 0.00 179.25 178.81 2qmd n SER 313 N -3.87 5.00 0.05 0.00 3.41 -0.72 -4.71 113.62 112.78 2qmd n SER 313 Ca -0.01 -2.69 0.03 0.00 -0.26 0.00 0.00 58.87 55.94 2qmd n SER 313 Cb 0.57 -0.61 0.16 0.00 -0.26 0.00 0.00 64.21 64.08 2qmd n SER 313 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2qmd n SER 314 N 0.72 0.15 0.02 4.04 3.41 -0.45 -1.82 113.62 119.69 2qmd n SER 314 Ca 0.26 0.54 0.08 0.00 -0.26 0.00 0.00 58.87 59.49 2qmd n SER 314 Cb 1.00 -0.55 0.35 0.00 -0.26 0.00 0.00 64.21 64.75 2qmd n SER 314 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2qmd n THR 315 N -1.68 0.91 -4.30 6.66 -2.24 -1.26 -4.51 114.28 107.86 2qmd n THR 315 Ca -0.00 0.22 -0.20 0.00 -2.27 0.00 0.00 64.05 61.80 2qmd n THR 315 Cb 0.05 -0.98 -0.16 0.00 -2.10 0.00 0.00 70.33 67.14 2qmd n THR 315 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2qmd s GLU 316 N -3.04 0.98 -0.16 -0.78 2.02 -0.75 -5.14 118.70 111.83 2qmd s GLU 316 Ca 0.07 -0.22 -0.16 0.00 0.02 0.00 0.00 54.97 54.69 2qmd s GLU 316 Cb 0.10 -0.91 -0.04 0.00 0.10 0.00 0.00 34.13 33.38 2qmd s GLU 316 CO 0.30 0.01 0.39 0.21 0.02 0.00 0.00 175.26 176.19 2qmd s LYS 317 N 0.59 4.26 -0.00 1.61 2.47 -1.26 -4.95 119.74 122.46 2qmd s LYS 317 Ca -0.09 0.25 0.07 0.00 -1.56 0.00 0.00 55.97 54.63 2qmd s LYS 317 Cb -0.12 -3.47 -0.03 0.00 -1.46 0.00 0.00 37.83 32.75 2qmd s LYS 317 CO 0.01 0.12 -0.20 -0.06 0.16 0.00 0.00 175.35 175.37 2qmd s PHE 318 N 0.80 2.50 0.62 4.03 0.40 -1.26 -5.12 117.98 119.95 2qmd s PHE 318 Ca 0.20 -0.30 -0.19 0.00 -0.60 0.00 0.00 56.93 56.04 2qmd s PHE 318 Cb -0.14 -1.51 -0.03 0.00 0.51 0.00 0.00 43.02 41.85 2qmd s PHE 318 CO 0.07 0.13 1.28 -0.35 0.70 0.00 0.00 175.22 177.05 2qmd n PRO 319 N 2.06 1.26 -0.10 0.24 -0.04 -1.26 -4.89 135.00 132.26 2qmd n PRO 319 Ca -0.16 0.48 0.17 0.00 -0.04 0.00 0.00 63.50 63.94 2qmd n PRO 319 Cb 0.52 -2.51 0.56 0.00 -0.04 0.00 0.00 33.50 32.03 2qmd n PRO 319 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2qmd h ASP 320 N 0.78 0.27 -0.31 3.54 3.32 -2.00 -0.03 116.42 121.98 2qmd h ASP 320 Ca -0.51 0.01 0.03 0.00 0.02 0.00 0.00 57.03 56.58 2qmd h ASP 320 Cb 1.33 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.83 2qmd h ASP 320 CO 0.54 0.14 0.21 1.23 -1.72 0.00 0.00 179.24 179.64 2qmd h GLY 321 N 0.28 0.34 0.73 2.75 0.00 -1.94 -1.48 103.07 103.75 2qmd h GLY 321 Ca 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.52 2qmd h GLY 321 CO -0.08 0.11 -0.01 -2.75 0.00 0.00 0.00 176.54 173.81 2qmd h PHE 322 N 0.31 0.16 0.00 5.60 3.57 -1.17 -1.84 116.94 123.57 2qmd h PHE 322 Ca 0.13 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.60 2qmd h PHE 322 Cb 0.13 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.83 2qmd h PHE 322 CO -0.00 0.43 0.00 -1.49 -2.23 0.00 0.00 178.31 175.02 2qmd h TRP 323 N -0.16 0.00 -0.00 0.41 4.06 -1.36 -0.48 115.95 118.42 2qmd h TRP 323 Ca 0.02 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.97 2qmd h TRP 323 Cb 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.53 2qmd h TRP 323 CO 0.04 0.00 -0.01 1.28 -3.56 0.00 0.00 178.44 176.19 2qmd n LEU 324 N -3.06 0.45 -0.31 -4.49 4.77 -0.62 -4.90 117.00 108.84 2qmd n LEU 324 Ca -0.00 -0.12 -0.04 0.00 -0.03 0.00 0.00 56.01 55.82 2qmd n LEU 324 Cb 0.25 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.29 2qmd n LEU 324 CO 0.25 0.08 -0.04 0.61 -1.33 0.00 0.00 177.39 176.96 2qmd n GLY 325 N 1.09 0.66 0.11 -0.72 0.00 -0.19 -4.90 105.19 101.24 2qmd n GLY 325 Ca 0.21 -0.32 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 2qmd n GLY 325 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qmd n GLU 326 N -2.07 0.71 -4.59 1.61 1.02 -0.87 -4.76 120.64 111.68 2qmd n GLU 326 Ca -0.04 0.07 -0.31 0.00 -0.02 0.00 0.00 57.16 56.86 2qmd n GLU 326 Cb 0.24 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.03 2qmd n GLU 326 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 2qmd s GLN 327 N -2.49 2.21 0.58 3.49 -2.07 -0.75 -5.00 119.66 115.64 2qmd s GLN 327 Ca -0.22 -0.91 -0.12 0.00 -1.82 0.00 0.00 55.36 52.29 2qmd s GLN 327 Cb 0.07 -2.28 -0.05 0.00 -1.09 0.00 0.00 33.01 29.66 2qmd s GLN 327 CO 0.69 0.56 1.00 -0.48 -1.32 0.00 0.00 175.29 175.74 2qmd s LEU 328 N -1.45 3.38 0.01 2.60 0.05 -1.26 -4.23 118.68 117.78 2qmd s LEU 328 Ca 0.15 1.44 0.07 0.00 0.05 0.00 0.00 54.13 55.84 2qmd s LEU 328 Cb -0.11 -4.45 -0.02 0.00 -2.05 0.00 0.00 46.19 39.56 2qmd s LEU 328 CO 0.06 -0.76 -0.20 0.68 -0.55 0.00 0.00 176.35 175.58 2qmd s VAL 329 N -2.98 1.60 0.07 1.48 -7.23 -0.28 -4.94 120.40 108.11 2qmd s VAL 329 Ca 0.56 -1.00 0.06 0.00 -1.81 0.00 0.00 61.98 59.79 2qmd s VAL 329 Cb -0.11 -1.35 -0.03 0.00 0.56 0.00 0.00 36.38 35.45 2qmd s VAL 329 CO 0.46 0.33 -0.16 0.00 -0.31 0.00 0.00 175.10 175.42 2qmd s TRP 331 N -1.08 1.43 0.36 0.00 0.51 -0.20 -4.97 118.94 115.00 2qmd s TRP 331 Ca 0.02 -0.54 -0.27 0.00 -2.12 0.00 0.00 56.10 53.19 2qmd s TRP 331 Cb -0.09 -0.75 -0.12 0.00 -0.81 0.00 0.00 33.47 31.70 2qmd s TRP 331 CO 0.02 0.15 1.29 0.94 -0.51 0.00 0.00 176.95 178.85 2qmd n GLN 332 N 0.59 2.09 -1.34 4.98 7.27 -1.26 -0.92 117.38 128.80 2qmd n GLN 332 Ca -0.16 0.74 -0.52 0.00 0.07 0.00 0.00 57.00 57.13 2qmd n GLN 332 Cb 0.57 -2.35 -0.08 0.00 2.41 0.00 0.00 30.24 30.79 2qmd n GLN 332 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2qmd n ALA 333 N 0.20 -1.55 -0.72 1.69 0.00 -1.24 -0.72 120.51 118.17 2qmd n ALA 333 Ca 0.05 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.91 2qmd n ALA 333 Cb 0.37 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.33 2qmd n ALA 333 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qmd n GLY 334 N 2.68 1.35 1.32 0.00 0.00 -1.26 -4.89 105.19 104.39 2qmd n GLY 334 Ca 0.22 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.36 2qmd n GLY 334 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qmd n THR 335 N -2.00 0.94 -1.67 2.61 -2.24 0.11 -4.98 114.28 107.05 2qmd n THR 335 Ca 0.00 -0.97 -0.53 0.00 -2.27 0.00 0.00 64.05 60.28 2qmd n THR 335 Cb 0.00 0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 68.73 2qmd n THR 335 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2qmd n THR 336 N 1.61 0.23 -1.53 4.28 -1.04 -1.26 -4.80 114.28 111.76 2qmd n THR 336 Ca 0.24 -0.04 -0.40 0.00 -2.04 0.00 0.00 64.05 61.81 2qmd n THR 336 Cb 0.62 -1.24 -0.02 0.00 -1.82 0.00 0.00 70.33 67.86 2qmd n THR 336 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2qmd n PRO 337 N 4.52 3.68 -0.34 -2.82 -0.04 -1.26 -4.75 135.00 133.99 2qmd n PRO 337 Ca 0.22 -2.52 0.19 0.00 -0.04 0.00 0.00 63.50 61.36 2qmd n PRO 337 Cb 0.19 -2.87 0.41 0.00 -0.04 0.00 0.00 33.50 31.19 2qmd n PRO 337 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2qmd h TRP 338 N 5.16 0.93 0.00 0.54 4.06 -1.95 -0.98 115.95 123.71 2qmd h TRP 338 Ca 0.77 0.04 0.00 0.00 2.06 0.00 0.00 58.89 61.76 2qmd h TRP 338 Cb 0.37 -0.25 0.00 0.00 -1.00 0.00 0.00 29.16 28.27 2qmd h TRP 338 CO 1.74 -0.04 0.00 -2.95 -3.56 0.00 0.00 178.44 173.63 2qmd h ASN 339 N 0.46 0.00 1.31 -3.49 7.08 -2.00 -1.86 115.58 117.08 2qmd h ASN 339 Ca 0.67 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.89 2qmd h ASN 339 Cb 1.38 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.62 2qmd h ASN 339 CO -0.53 0.00 -0.36 0.16 -2.08 0.00 0.00 177.43 174.62 2qmd h ILE 340 N 0.00 0.00 -3.29 6.14 3.07 -1.54 -3.44 117.51 118.45 2qmd h ILE 340 Ca 0.00 -0.67 -0.57 0.00 1.55 0.00 0.00 64.86 65.17 2qmd h ILE 340 Cb 0.22 1.45 -0.05 0.00 -0.27 0.00 0.00 36.82 38.18 2qmd h ILE 340 CO 0.00 0.00 -0.01 -0.36 -1.05 0.00 0.00 178.15 176.73 2qmd s PHE 341 N -3.18 3.78 0.57 0.16 0.08 -0.70 -3.54 117.98 115.15 2qmd s PHE 341 Ca 0.07 1.29 -0.14 0.00 0.12 0.00 0.00 56.93 58.26 2qmd s PHE 341 Cb 0.11 -2.56 -0.05 0.00 -0.57 0.00 0.00 43.02 39.94 2qmd s PHE 341 CO 0.68 0.50 1.02 -1.25 -0.10 0.00 0.00 175.22 176.07 2qmd s PRO 342 N -0.80 3.65 0.44 0.24 0.04 -1.26 -4.81 135.00 132.50 2qmd s PRO 342 Ca 0.30 0.94 -0.12 0.00 0.04 0.00 0.00 61.00 62.17 2qmd s PRO 342 Cb -0.19 -2.09 -0.06 0.00 0.04 0.00 0.00 34.50 32.19 2qmd s PRO 342 CO 0.19 -0.52 0.83 0.14 0.04 0.00 0.00 177.00 177.67 2qmd s VAL 343 N -2.78 4.74 -0.12 -0.36 -7.23 -1.26 -4.27 120.40 109.11 2qmd s VAL 343 Ca 0.59 0.73 0.03 0.00 -1.81 0.00 0.00 61.98 61.52 2qmd s VAL 343 Cb -0.12 -3.74 0.01 0.00 0.56 0.00 0.00 36.38 33.09 2qmd s VAL 343 CO 0.41 -0.60 -0.20 -0.63 -0.31 0.00 0.00 175.10 173.76 2qmd s ILE 344 N -2.48 1.89 -0.13 -0.62 1.01 -0.25 -0.52 121.20 120.11 2qmd s ILE 344 Ca 0.53 -0.89 -0.00 0.00 0.00 0.00 0.00 60.65 60.29 2qmd s ILE 344 Cb -0.10 -1.67 -0.02 0.00 0.01 0.00 0.00 42.46 40.68 2qmd s ILE 344 CO 0.33 0.52 -0.12 -0.44 0.00 0.00 0.00 174.94 175.23 2qmd s SER 345 N 0.73 4.10 -0.21 3.58 0.01 -0.24 -0.71 113.70 120.96 2qmd s SER 345 Ca -0.10 -0.30 -0.03 0.00 1.31 0.00 0.00 55.95 56.83 2qmd s SER 345 Cb -0.16 -1.59 -0.01 0.00 0.21 0.00 0.00 66.02 64.48 2qmd s SER 345 CO 0.01 0.18 -0.06 -0.76 0.41 0.00 0.00 173.24 173.01 2qmd s LEU 346 N 0.28 2.82 -0.10 2.44 1.43 -0.15 -1.39 118.68 124.01 2qmd s LEU 346 Ca -0.09 -0.40 -0.18 0.00 -1.03 0.00 0.00 54.13 52.43 2qmd s LEU 346 Cb -0.15 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 2qmd s LEU 346 CO 0.05 0.00 0.46 -0.31 0.23 0.00 0.00 176.35 176.79 2qmd s TYR 347 N 1.35 3.54 0.02 0.29 1.51 0.24 -1.13 117.35 123.18 2qmd s TYR 347 Ca 0.04 0.90 0.06 0.00 -1.01 0.00 0.00 57.07 57.06 2qmd s TYR 347 Cb -0.14 -2.51 -0.03 0.00 -0.11 0.00 0.00 41.96 39.16 2qmd s TYR 347 CO -0.03 0.23 -0.15 -0.51 -1.11 0.00 0.00 175.55 173.98 2qmd s LEU 348 N 0.38 2.73 0.19 -1.29 1.43 0.18 -0.07 118.68 122.24 2qmd s LEU 348 Ca 0.25 -0.35 -0.33 0.00 -1.03 0.00 0.00 54.13 52.68 2qmd s LEU 348 Cb -0.15 -1.59 -0.14 0.00 0.03 0.00 0.00 46.19 44.34 2qmd s LEU 348 CO 0.11 0.27 1.46 0.80 0.23 0.00 0.00 176.35 179.21 2qmd n MET 349 N 1.63 1.97 -2.47 1.70 0.00 -0.87 -1.97 117.12 117.12 2qmd n MET 349 Ca -0.16 0.71 -0.25 0.00 -0.00 0.00 0.00 57.70 58.00 2qmd n MET 349 Cb 0.52 -2.40 0.14 0.00 0.00 0.00 0.00 33.22 31.48 2qmd n MET 349 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2qmd s GLY 350 N 0.54 1.76 0.01 -5.12 0.00 0.76 -4.02 107.32 101.25 2qmd s GLY 350 Ca 0.74 -1.73 0.26 0.00 0.00 0.00 0.00 44.72 43.99 2qmd s GLY 350 CO 0.45 -1.07 1.56 1.18 0.00 0.00 0.00 173.10 175.22 2qmd n GLU 351 N -3.09 0.03 -3.73 2.90 1.02 -1.22 -4.58 120.64 111.97 2qmd n GLU 351 Ca 0.16 0.01 -0.37 0.00 -0.02 0.00 0.00 57.16 56.95 2qmd n GLU 351 Cb 0.60 -1.52 -0.07 0.00 -0.02 0.00 0.00 31.44 30.44 2qmd n GLU 351 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2qmd s VAL 352 N -3.01 5.38 0.20 2.62 1.01 -1.26 -5.04 120.40 120.29 2qmd s VAL 352 Ca 0.11 0.36 -0.31 0.00 0.00 0.00 0.00 61.98 62.14 2qmd s VAL 352 Cb 0.18 -3.50 -0.16 0.00 0.00 0.00 0.00 36.38 32.90 2qmd s VAL 352 CO 0.65 0.53 1.05 0.41 0.00 0.00 0.00 175.10 177.75 2qmd n THR 353 N 2.57 1.24 -1.71 3.92 -1.04 -1.26 -1.40 114.28 116.59 2qmd n THR 353 Ca -0.17 -0.31 -0.21 0.00 -2.04 0.00 0.00 64.05 61.32 2qmd n THR 353 Cb 0.53 -0.75 -0.08 0.00 -1.82 0.00 0.00 70.33 68.22 2qmd n THR 353 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2qmd n ASN 354 N 1.80 -5.56 -4.22 8.00 3.02 -1.26 -4.98 115.26 112.07 2qmd n ASN 354 Ca 0.14 0.45 -0.28 0.00 -0.03 0.00 0.00 54.58 54.86 2qmd n ASN 354 Cb 0.26 -4.87 -0.16 0.00 -0.61 0.00 0.00 39.78 34.40 2qmd n ASN 354 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2qmd s GLN 355 N -3.94 1.88 0.31 3.52 0.74 -0.49 -0.57 119.66 121.11 2qmd s GLN 355 Ca 0.00 -0.75 0.03 0.00 0.05 0.00 0.00 55.36 54.69 2qmd s GLN 355 Cb 0.00 -1.73 -0.05 0.00 1.10 0.00 0.00 33.01 32.33 2qmd s GLN 355 CO 0.00 0.40 0.09 -1.54 -0.55 0.00 0.00 175.29 173.69 2qmd s SER 356 N -0.32 1.93 0.19 6.67 1.04 -0.04 -0.17 113.70 123.00 2qmd s SER 356 Ca 0.03 -1.45 -0.03 0.00 0.48 0.00 0.00 55.95 54.99 2qmd s SER 356 Cb -0.10 0.15 -0.03 0.00 0.10 0.00 0.00 66.02 66.14 2qmd s SER 356 CO 0.01 -0.73 0.17 0.72 0.98 0.00 0.00 173.24 174.38 2qmd s PHE 357 N -3.48 0.93 0.07 5.02 -0.12 -0.83 -0.94 117.98 118.63 2qmd s PHE 357 Ca 0.35 -1.21 0.06 0.00 -0.05 0.00 0.00 56.93 56.08 2qmd s PHE 357 Cb 0.07 -0.41 -0.03 0.00 -0.63 0.00 0.00 43.02 42.03 2qmd s PHE 357 CO 0.15 -0.67 -0.17 -0.98 -0.05 0.00 0.00 175.22 173.51 2qmd s ARG 358 N -4.10 0.98 -0.08 1.99 1.70 0.29 -0.65 118.95 119.09 2qmd s ARG 358 Ca 0.32 -0.97 0.03 0.00 -0.47 0.00 0.00 55.73 54.64 2qmd s ARG 358 Cb 0.06 -1.07 -0.02 0.00 -0.57 0.00 0.00 34.95 33.34 2qmd s ARG 358 CO 0.08 0.25 -0.16 0.96 -1.08 0.00 0.00 175.30 175.36 2qmd s ILE 359 N -1.10 2.87 -0.13 4.99 -4.36 -0.28 -1.35 121.20 121.84 2qmd s ILE 359 Ca 0.02 -0.77 0.03 0.00 -0.26 0.00 0.00 60.65 59.67 2qmd s ILE 359 Cb -0.09 -2.14 0.01 0.00 1.25 0.00 0.00 42.46 41.49 2qmd s ILE 359 CO 0.03 0.57 -0.22 -0.89 0.24 0.00 0.00 174.94 174.67 2qmd s THR 360 N -0.28 2.01 0.16 8.37 2.01 0.57 -0.98 115.64 127.50 2qmd s THR 360 Ca 0.02 -0.95 0.08 0.00 0.31 0.00 0.00 61.69 61.14 2qmd s THR 360 Cb -0.13 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.57 2qmd s THR 360 CO 0.03 0.54 -0.07 0.27 -0.69 0.00 0.00 174.62 174.70 2qmd s ILE 361 N 0.77 3.38 0.33 1.82 -4.36 0.11 -1.98 121.20 121.27 2qmd s ILE 361 Ca -0.09 -1.52 0.07 0.00 -0.26 0.00 0.00 60.65 58.86 2qmd s ILE 361 Cb -0.16 -2.66 -0.02 0.00 1.25 0.00 0.00 42.46 40.87 2qmd s ILE 361 CO -0.01 -0.07 0.35 -0.76 0.24 0.00 0.00 174.94 174.69 2qmd s LEU 362 N -2.75 3.77 0.59 0.37 1.43 -1.26 -1.09 118.68 119.75 2qmd s LEU 362 Ca 0.25 -0.35 0.39 0.00 -1.03 0.00 0.00 54.13 53.39 2qmd s LEU 362 Cb -0.09 -2.43 1.97 0.00 0.03 0.00 0.00 46.19 45.67 2qmd s LEU 362 CO 0.16 -0.35 2.18 1.55 0.23 0.00 0.00 176.35 180.12 2qmd h PRO 363 N 1.14 0.00 0.00 1.29 0.13 -1.88 0.16 132.00 132.85 2qmd h PRO 363 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2qmd h PRO 363 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2qmd h PRO 363 CO 0.57 0.00 0.00 1.96 -0.23 0.00 0.00 178.00 180.30 2qmd h GLN 364 N 0.00 0.00 0.03 0.86 7.50 -1.86 0.50 115.11 122.14 2qmd h GLN 364 Ca 0.00 0.00 -0.35 0.00 0.50 0.00 0.00 58.65 58.80 2qmd h GLN 364 Cb 0.17 0.00 -0.05 0.00 0.05 0.00 0.00 27.48 27.66 2qmd h GLN 364 CO 0.00 0.00 -1.97 1.04 -1.50 0.00 0.00 178.83 176.40 2qmd n GLN 365 N -2.31 0.63 0.00 1.46 3.00 0.54 -4.55 117.38 116.14 2qmd n GLN 365 Ca 0.00 0.36 0.14 0.00 -0.01 0.00 0.00 57.00 57.49 2qmd n GLN 365 Cb 0.14 -1.63 0.65 0.00 0.00 0.00 0.00 30.24 29.40 2qmd n GLN 365 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.06 179.54 2qmd n TYR 366 N -4.01 0.00 -3.74 1.08 0.18 -0.96 -4.52 117.16 105.19 2qmd n TYR 366 Ca -0.41 0.00 -0.37 0.00 1.88 0.00 0.00 57.90 59.00 2qmd n TYR 366 Cb 0.86 -0.14 -0.12 0.00 -0.38 0.00 0.00 39.34 39.56 2qmd n TYR 366 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2qmd s LEU 367 N -2.36 3.84 -0.22 -3.48 1.43 0.14 -0.65 118.68 117.38 2qmd s LEU 367 Ca 0.32 -0.60 -0.18 0.00 -1.03 0.00 0.00 54.13 52.64 2qmd s LEU 367 Cb 0.20 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.48 2qmd s LEU 367 CO 0.45 -0.17 0.50 -0.60 0.23 0.00 0.00 176.35 176.75 2qmd s ARG 368 N 1.54 4.14 0.19 1.70 3.52 0.41 -4.78 118.95 125.66 2qmd s ARG 368 Ca 0.04 0.34 -0.32 0.00 -0.13 0.00 0.00 55.73 55.65 2qmd s ARG 368 Cb -0.17 -3.59 -0.12 0.00 -1.56 0.00 0.00 34.95 29.51 2qmd s ARG 368 CO 0.03 -0.21 1.72 -2.30 -0.81 0.00 0.00 175.30 173.73 2qmd n PRO 369 N 5.04 2.69 -3.99 5.12 -0.02 -1.26 -0.90 135.00 141.68 2qmd n PRO 369 Ca -0.05 0.97 -0.09 0.00 -2.02 0.00 0.00 63.50 62.31 2qmd n PRO 369 Cb 0.50 -2.81 -0.11 0.00 -0.02 0.00 0.00 33.50 31.06 2qmd n PRO 369 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2qmd s VAL 370 N 1.29 0.15 0.15 -1.45 -7.23 -0.61 -4.70 120.40 107.99 2qmd s VAL 370 Ca 0.76 -0.94 -0.30 0.00 -1.81 0.00 0.00 61.98 59.69 2qmd s VAL 370 Cb -0.53 -0.32 -0.07 0.00 0.56 0.00 0.00 36.38 36.02 2qmd s VAL 370 CO 0.34 -0.50 1.15 -0.70 -0.31 0.00 0.00 175.10 175.07 2qmd s GLU 371 N -1.52 4.53 0.33 4.82 2.56 -1.26 -4.05 118.70 124.11 2qmd s GLU 371 Ca -0.15 1.76 -0.29 0.00 0.00 0.00 0.00 54.97 56.30 2qmd s GLU 371 Cb -0.10 -3.29 -0.11 0.00 2.00 0.00 0.00 34.13 32.64 2qmd s GLU 371 CO -0.01 -0.05 1.46 0.34 -0.56 0.00 0.00 175.26 176.44 2qmd s ASP 372 N 0.25 6.49 0.00 -1.70 2.15 -1.26 -4.82 116.67 117.79 2qmd s ASP 372 Ca 0.52 2.89 0.00 0.00 0.43 0.00 0.00 52.55 56.39 2qmd s ASP 372 Cb -0.30 -2.65 0.00 0.00 -0.30 0.00 0.00 42.92 39.67 2qmd s ASP 372 CO 0.34 -0.78 0.63 0.52 -0.17 0.00 0.00 175.17 175.71 2qmd n VAL 373 N 1.17 0.77 0.04 1.11 0.31 -1.26 0.12 118.33 120.58 2qmd n VAL 373 Ca 0.03 0.26 0.01 0.00 -0.01 0.00 0.00 64.34 64.63 2qmd n VAL 373 Cb 0.40 -1.26 0.02 0.00 -0.91 0.00 0.00 33.84 32.09 2qmd n VAL 373 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qmd n ALA 374 N -1.13 2.29 -0.90 3.52 0.00 -1.26 -4.98 120.51 118.04 2qmd n ALA 374 Ca 0.00 -0.75 -0.05 0.00 0.00 0.00 0.00 53.44 52.64 2qmd n ALA 374 Cb 0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 19.45 19.41 2qmd n ALA 374 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2qmd n THR 375 N -0.06 0.00 0.00 0.00 -2.24 0.32 -4.92 114.28 107.38 2qmd n THR 375 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2qmd n THR 375 Cb 0.16 -0.87 0.00 0.00 -2.10 0.00 0.00 70.33 67.53 2qmd n THR 375 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qmd n SER 376 N 0.08 0.00 -0.81 3.42 3.41 -1.26 -4.92 113.62 113.54 2qmd n SER 376 Ca -0.05 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.64 2qmd n SER 376 Cb 0.37 0.00 0.16 0.00 -0.26 0.00 0.00 64.21 64.47 2qmd n SER 376 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qmd n GLN 377 N 0.00 2.16 -1.75 4.33 6.02 -1.26 -4.91 117.38 121.96 2qmd n GLN 377 Ca 0.00 -1.95 -0.33 0.00 -0.01 0.00 0.00 57.00 54.72 2qmd n GLN 377 Cb 0.00 -1.35 0.05 0.00 1.02 0.00 0.00 30.24 29.95 2qmd n GLN 377 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2qmd s ASP 378 N -1.14 5.17 -0.29 1.08 1.01 -1.26 -3.67 116.67 117.57 2qmd s ASP 378 Ca 0.27 1.94 -0.14 0.00 0.71 0.00 0.00 52.55 55.34 2qmd s ASP 378 Cb 0.16 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.51 2qmd s ASP 378 CO 0.22 -1.59 0.31 -1.81 0.21 0.00 0.00 175.17 172.50 2qmd s ASP 379 N -2.73 6.16 0.17 0.27 -0.00 -0.09 -4.78 116.67 115.66 2qmd s ASP 379 Ca 0.66 0.08 0.10 0.00 -0.00 0.00 0.00 52.55 53.39 2qmd s ASP 379 Cb -0.19 -2.18 -0.04 0.00 -0.00 0.00 0.00 42.92 40.51 2qmd s ASP 379 CO 0.42 -0.17 -0.22 0.00 -0.00 0.00 0.00 175.17 175.20 2qmd s TYR 381 N -1.68 -0.00 0.07 0.00 1.51 -0.09 -1.58 117.35 115.58 2qmd s TYR 381 Ca 0.17 -0.37 0.07 0.00 -1.01 0.00 0.00 57.07 55.94 2qmd s TYR 381 Cb -0.08 0.07 -0.04 0.00 -0.11 0.00 0.00 41.96 41.81 2qmd s TYR 381 CO 0.08 -0.60 -0.15 0.15 -1.11 0.00 0.00 175.55 173.92 2qmd s LYS 382 N -3.76 2.07 -0.28 -0.62 1.02 -0.07 -1.13 119.74 116.96 2qmd s LYS 382 Ca 0.04 -1.01 -0.29 0.00 0.02 0.00 0.00 55.97 54.73 2qmd s LYS 382 Cb 0.03 -2.23 -0.01 0.00 -0.52 0.00 0.00 37.83 35.11 2qmd s LYS 382 CO -0.11 0.53 1.41 0.12 -0.92 0.00 0.00 175.35 176.37 2qmd s PHE 383 N -1.04 2.49 -0.46 3.18 5.36 -1.26 -0.45 117.98 125.80 2qmd s PHE 383 Ca 0.17 0.76 0.00 0.00 -0.96 0.00 0.00 56.93 56.90 2qmd s PHE 383 Cb -0.11 -3.94 0.42 0.00 -0.34 0.00 0.00 43.02 39.05 2qmd s PHE 383 CO 0.08 -2.11 1.91 0.00 -1.46 0.00 0.00 175.22 173.65 2qmd n ALA 384 N 7.93 5.50 -3.33 11.12 0.00 0.17 -4.31 120.51 137.59 2qmd n ALA 384 Ca 0.16 -2.55 -0.27 0.00 0.00 0.00 0.00 53.44 50.78 2qmd n ALA 384 Cb 0.46 -1.51 -0.17 0.00 0.00 0.00 0.00 19.45 18.23 2qmd n ALA 384 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2qmd s ILE 385 N -3.32 1.44 0.17 0.00 1.01 -1.26 -1.65 121.20 117.59 2qmd s ILE 385 Ca 0.48 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 60.43 2qmd s ILE 385 Cb 0.39 -1.27 -0.03 0.00 0.01 0.00 0.00 42.46 41.56 2qmd s ILE 385 CO 0.03 0.42 0.18 -0.94 0.00 0.00 0.00 174.94 174.63 2qmd s SER 386 N 0.50 0.15 0.34 3.58 1.04 -0.50 -4.68 113.70 114.13 2qmd s SER 386 Ca -0.15 -1.15 -0.26 0.00 0.48 0.00 0.00 55.95 54.88 2qmd s SER 386 Cb -0.16 0.39 -0.10 0.00 0.10 0.00 0.00 66.02 66.25 2qmd s SER 386 CO 0.05 -0.85 0.99 -1.58 0.98 0.00 0.00 173.24 172.83 2qmd s GLN 387 N -4.06 4.48 0.09 4.02 0.74 -1.26 -0.55 119.66 123.12 2qmd s GLN 387 Ca 0.26 1.42 0.07 0.00 0.05 0.00 0.00 55.36 57.16 2qmd s GLN 387 Cb 0.05 -2.76 -0.03 0.00 1.10 0.00 0.00 33.01 31.37 2qmd s GLN 387 CO 0.05 0.16 -0.17 0.45 -0.55 0.00 0.00 175.29 175.23 2qmd s SER 388 N -1.54 2.07 0.00 6.67 0.15 0.83 -4.71 113.70 117.16 2qmd s SER 388 Ca 0.52 -0.65 0.03 0.00 0.70 0.00 0.00 55.95 56.55 2qmd s SER 388 Cb -0.21 -0.09 0.06 0.00 -1.71 0.00 0.00 66.02 64.07 2qmd s SER 388 CO 0.26 -0.02 0.85 -1.54 1.20 0.00 0.00 173.24 173.99 2qmd n SER 389 N 1.19 1.79 -0.38 5.45 3.41 -1.26 -2.24 113.62 121.58 2qmd n SER 389 Ca -0.20 -1.59 0.07 0.00 -0.26 0.00 0.00 58.87 56.89 2qmd n SER 389 Cb 0.54 -0.04 0.13 0.00 -0.26 0.00 0.00 64.21 64.58 2qmd n SER 389 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2qmd n THR 390 N -0.02 1.54 0.00 6.66 -2.24 -1.26 -4.87 114.28 114.10 2qmd n THR 390 Ca 0.03 -2.08 0.00 0.00 -2.27 0.00 0.00 64.05 59.72 2qmd n THR 390 Cb 0.20 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.39 2qmd n THR 390 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qmd n GLY 391 N -0.99 0.37 3.74 3.38 0.00 -1.23 -4.52 105.19 105.94 2qmd n GLY 391 Ca 0.14 -2.03 -0.41 0.00 0.00 0.00 0.00 46.02 43.71 2qmd n GLY 391 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qmd s THR 392 N -1.20 3.50 -0.21 2.61 2.01 0.32 -4.35 115.64 118.32 2qmd s THR 392 Ca 0.00 1.32 0.01 0.00 0.31 0.00 0.00 61.69 63.33 2qmd s THR 392 Cb 0.00 -3.84 0.05 0.00 0.01 0.00 0.00 72.50 68.72 2qmd s THR 392 CO 0.00 0.24 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.38 2qmd s VAL 393 N -0.33 1.69 -0.90 3.82 1.01 0.31 -1.32 120.40 124.69 2qmd s VAL 393 Ca 0.51 -1.10 -0.19 0.00 0.00 0.00 0.00 61.98 61.19 2qmd s VAL 393 Cb -0.33 -1.79 0.12 0.00 0.00 0.00 0.00 36.38 34.38 2qmd s VAL 393 CO 0.38 0.12 1.12 -0.04 0.00 0.00 0.00 175.10 176.69 2qmd s MET 394 N 1.36 3.55 0.13 2.72 -1.94 0.28 -0.78 119.30 124.61 2qmd s MET 394 Ca -0.03 -1.65 -0.02 0.00 -1.71 0.00 0.00 55.69 52.29 2qmd s MET 394 Cb -0.17 -4.87 0.03 0.00 2.01 0.00 0.00 34.83 31.83 2qmd s MET 394 CO -0.08 -1.79 0.17 0.41 -0.01 0.00 0.00 175.02 173.73 2qmd n GLY 395 N 5.54 -1.07 0.36 -0.03 0.00 -1.04 -1.14 105.19 107.81 2qmd n GLY 395 Ca 0.21 -1.69 0.06 0.00 0.00 0.00 0.00 46.02 44.61 2qmd n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qmd h ALA 396 N -1.89 1.60 0.00 4.61 0.00 -0.12 -1.31 119.26 122.15 2qmd h ALA 396 Ca -0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2qmd h ALA 396 Cb 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2qmd h ALA 396 CO 0.04 0.23 -0.17 -0.39 0.00 0.00 0.00 179.25 178.96 2qmd h VAL 397 N 0.92 0.86 0.13 0.00 -1.51 -1.42 0.90 116.25 116.14 2qmd h VAL 397 Ca 0.41 -0.65 -0.19 0.00 -1.23 0.00 0.00 66.70 65.04 2qmd h VAL 397 Cb 0.36 1.38 0.02 0.00 -2.13 0.00 0.00 31.29 30.92 2qmd h VAL 397 CO -0.17 0.17 -0.82 0.40 -1.23 0.00 0.00 177.57 175.91 2qmd h ILE 398 N 0.00 1.50 0.00 7.19 1.08 -1.58 -3.28 117.51 122.42 2qmd h ILE 398 Ca -0.00 -2.51 -0.01 0.00 -0.39 0.00 0.00 64.86 61.95 2qmd h ILE 398 Cb 0.37 3.15 -0.00 0.00 -3.07 0.00 0.00 36.82 37.26 2qmd h ILE 398 CO 0.02 0.71 -0.04 0.24 -0.69 0.00 0.00 178.15 178.40 2qmd h MET 399 N -0.33 0.00 0.00 2.37 2.86 -0.65 -1.63 114.93 117.56 2qmd h MET 399 Ca -0.14 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 2qmd h MET 399 Cb 1.64 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.30 2qmd h MET 399 CO 0.15 0.04 0.00 0.93 1.06 0.00 0.00 176.91 179.09 2qmd h GLU 400 N 0.00 0.00 -0.00 1.72 5.08 -0.90 -1.51 114.58 118.96 2qmd h GLU 400 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2qmd h GLU 400 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2qmd h GLU 400 CO 0.01 0.00 -0.39 0.41 -1.00 0.00 0.00 179.01 178.03 2qmd n GLY 401 N -0.80 -0.96 3.09 -3.84 0.00 -0.61 -4.23 105.19 97.83 2qmd n GLY 401 Ca -0.01 -0.37 -0.08 0.00 0.00 0.00 0.00 46.02 45.56 2qmd n GLY 401 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qmd s PHE 402 N -2.77 0.57 -0.21 1.61 0.40 -0.57 -1.55 117.98 115.45 2qmd s PHE 402 Ca 0.17 -0.95 -0.18 0.00 -0.60 0.00 0.00 56.93 55.37 2qmd s PHE 402 Cb 0.18 -0.39 -0.03 0.00 0.51 0.00 0.00 43.02 43.29 2qmd s PHE 402 CO 0.62 -0.30 0.49 -0.47 0.70 0.00 0.00 175.22 176.26 2qmd s TYR 403 N -3.47 3.35 -0.19 0.36 5.04 0.73 -4.45 117.35 118.71 2qmd s TYR 403 Ca 0.05 0.71 -0.01 0.00 -2.44 0.00 0.00 57.07 55.37 2qmd s TYR 403 Cb 0.05 -2.65 0.00 0.00 0.35 0.00 0.00 41.96 39.71 2qmd s TYR 403 CO -0.08 -0.12 -0.11 0.08 -1.34 0.00 0.00 175.55 173.98 2qmd s VAL 404 N 1.70 2.84 -0.32 3.14 1.01 -0.21 -1.99 120.40 126.56 2qmd s VAL 404 Ca 0.22 -0.69 -0.11 0.00 0.00 0.00 0.00 61.98 61.40 2qmd s VAL 404 Cb -0.15 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 2qmd s VAL 404 CO 0.09 0.48 0.20 -0.69 0.00 0.00 0.00 175.10 175.18 2qmd s VAL 405 N 1.23 4.98 -0.91 2.92 1.01 0.47 -0.49 120.40 129.60 2qmd s VAL 405 Ca 0.02 -0.29 -0.16 0.00 0.00 0.00 0.00 61.98 61.55 2qmd s VAL 405 Cb -0.14 -3.54 0.17 0.00 0.00 0.00 0.00 36.38 32.87 2qmd s VAL 405 CO -0.05 0.04 1.00 -0.36 0.00 0.00 0.00 175.10 175.73 2qmd s PHE 406 N 1.68 3.44 -1.18 5.22 0.08 0.77 -0.39 117.98 127.59 2qmd s PHE 406 Ca 0.05 -1.72 -0.13 0.00 0.12 0.00 0.00 56.93 55.25 2qmd s PHE 406 Cb -0.17 -4.09 0.18 0.00 -0.57 0.00 0.00 43.02 38.37 2qmd s PHE 406 CO 0.09 -1.27 1.39 0.34 -0.10 0.00 0.00 175.22 175.66 2qmd s ASP 407 N 2.93 7.08 0.24 1.36 -1.08 -0.03 -2.39 116.67 124.78 2qmd s ASP 407 Ca 0.27 -3.02 -0.07 0.00 -0.52 0.00 0.00 52.55 49.22 2qmd s ASP 407 Cb -0.07 -2.38 0.26 0.00 -1.46 0.00 0.00 42.92 39.27 2qmd s ASP 407 CO -0.09 -0.71 1.90 0.03 0.52 0.00 0.00 175.17 176.82 2qmd h ARG 408 N 7.18 1.15 -0.85 4.34 3.08 -1.74 -0.03 114.38 127.50 2qmd h ARG 408 Ca 0.30 -0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.32 2qmd h ARG 408 Cb 0.88 -0.26 -0.05 0.00 0.08 0.00 0.00 29.97 30.62 2qmd h ARG 408 CO 1.21 0.76 0.56 0.00 -1.07 0.00 0.00 179.97 181.43 2qmd h ALA 409 N 1.36 1.51 -0.51 0.04 0.00 -1.52 -2.23 119.26 117.90 2qmd h ALA 409 Ca 0.35 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2qmd h ALA 409 Cb -0.05 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.46 2qmd h ALA 409 CO -0.10 0.39 0.00 0.54 0.00 0.00 0.00 179.25 180.08 2qmd n ARG 410 N -4.46 2.88 -3.81 0.00 1.74 -1.03 -4.99 116.66 107.00 2qmd n ARG 410 Ca 0.12 -2.37 -0.26 0.00 -0.77 0.00 0.00 57.85 54.56 2qmd n ARG 410 Cb 0.14 -1.45 0.01 0.00 -1.02 0.00 0.00 32.46 30.15 2qmd n ARG 410 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2qmd n LYS 411 N 0.95 -2.97 -3.69 5.56 4.81 -0.14 -4.92 118.16 117.75 2qmd n LYS 411 Ca 0.18 0.47 -0.12 0.00 -0.87 0.00 0.00 58.31 57.97 2qmd n LYS 411 Cb 0.55 -4.54 -0.06 0.00 0.02 0.00 0.00 35.03 31.00 2qmd n LYS 411 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 2qmd s ARG 412 N -6.24 0.91 -0.12 1.64 1.70 -0.53 -1.30 118.95 115.02 2qmd s ARG 412 Ca 0.15 -0.49 0.03 0.00 -0.47 0.00 0.00 55.73 54.95 2qmd s ARG 412 Cb -0.05 0.40 0.00 0.00 -0.57 0.00 0.00 34.95 34.73 2qmd s ARG 412 CO 0.86 -0.32 -0.23 0.42 -1.08 0.00 0.00 175.30 174.96 2qmd s ILE 413 N -2.80 2.10 0.03 4.99 1.01 0.15 -0.85 121.20 125.83 2qmd s ILE 413 Ca -0.03 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 59.64 2qmd s ILE 413 Cb -0.00 -1.82 -0.04 0.00 0.01 0.00 0.00 42.46 40.61 2qmd s ILE 413 CO -0.05 0.55 0.08 -0.83 0.00 0.00 0.00 174.94 174.70 2qmd s GLY 414 N 0.54 2.02 -0.02 6.18 0.00 0.48 -0.71 107.32 115.80 2qmd s GLY 414 Ca -0.14 -0.92 0.04 0.00 0.00 0.00 0.00 44.72 43.70 2qmd s GLY 414 CO 0.04 -0.84 -0.15 -1.36 0.00 0.00 0.00 173.10 170.80 2qmd s PHE 415 N -1.27 1.39 0.01 1.90 0.40 0.62 -0.40 117.98 120.63 2qmd s PHE 415 Ca 0.25 -0.32 -0.11 0.00 -0.60 0.00 0.00 56.93 56.15 2qmd s PHE 415 Cb -0.12 -0.92 0.01 0.00 0.51 0.00 0.00 43.02 42.50 2qmd s PHE 415 CO 0.17 -0.08 0.23 0.00 0.70 0.00 0.00 175.22 176.23 2qmd s ALA 416 N -0.12 -0.51 0.14 5.36 0.00 -0.84 -1.04 121.76 124.75 2qmd s ALA 416 Ca 0.01 -0.03 -0.32 0.00 0.00 0.00 0.00 51.96 51.62 2qmd s ALA 416 Cb -0.08 0.18 -0.12 0.00 0.00 0.00 0.00 23.12 23.09 2qmd s ALA 416 CO 0.00 -0.29 1.74 0.28 0.00 0.00 0.00 175.76 177.49 2qmd n VAL 417 N 1.06 0.17 -2.40 0.00 0.31 -1.24 -0.20 118.33 116.04 2qmd n VAL 417 Ca -0.21 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 63.68 2qmd n VAL 417 Cb 0.57 -1.91 -0.04 0.00 -0.91 0.00 0.00 33.84 31.56 2qmd n VAL 417 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2qmd s SER 418 N 1.86 7.12 0.11 4.52 0.15 -0.60 -1.47 113.70 125.40 2qmd s SER 418 Ca 0.80 2.24 0.16 0.00 0.70 0.00 0.00 55.95 59.84 2qmd s SER 418 Cb -0.56 -2.61 0.69 0.00 -1.71 0.00 0.00 66.02 61.83 2qmd s SER 418 CO 0.37 -0.32 1.49 0.00 1.20 0.00 0.00 173.24 175.97 2qmd n ALA 419 N 2.24 1.49 -0.86 5.45 0.00 -0.52 -2.29 120.51 126.02 2qmd n ALA 419 Ca 0.03 0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.58 2qmd n ALA 419 Cb 0.45 -1.25 0.16 0.00 0.00 0.00 0.00 19.45 18.81 2qmd n ALA 419 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qmd s HIS 421 N -2.51 3.12 0.03 0.00 -0.00 -0.97 -4.55 115.29 110.41 2qmd s HIS 421 Ca 0.31 1.60 -0.28 0.00 -0.00 0.00 0.00 55.06 56.70 2qmd s HIS 421 Cb 0.25 -3.18 -0.05 0.00 -0.00 0.00 0.00 32.58 29.61 2qmd s HIS 421 CO 0.05 -0.89 0.88 0.08 -0.00 0.00 0.00 174.74 174.86 2qmd s VAL 422 N -1.69 4.75 0.00 -5.38 1.01 -1.26 -5.04 120.40 112.80 2qmd s VAL 422 Ca 0.61 1.86 0.00 0.00 0.00 0.00 0.00 61.98 64.45 2qmd s VAL 422 Cb -0.23 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 31.93 2qmd s VAL 422 CO 0.28 0.27 0.00 0.00 0.00 0.00 0.00 175.10 175.65 2qmd n HIS 423 N 3.26 -0.46 -4.21 5.22 -0.00 -1.26 -4.70 115.22 113.08 2qmd n HIS 423 Ca 0.02 0.00 -0.10 0.00 -0.00 0.00 0.00 57.72 57.63 2qmd n HIS 423 Cb 0.50 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.47 2qmd n HIS 423 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 2qmd n ASP 424 N -1.50 1.25 0.03 4.39 5.68 -1.17 -5.03 116.55 120.20 2qmd n ASP 424 Ca 0.00 -1.85 0.12 0.00 -0.50 0.00 0.00 54.79 52.56 2qmd n ASP 424 Cb 0.00 0.37 0.49 0.00 -1.14 0.00 0.00 41.12 40.83 2qmd n ASP 424 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2qmd n GLU 425 N -0.37 0.06 -0.05 0.11 0.28 -1.26 -3.80 120.64 115.61 2qmd n GLU 425 Ca -0.03 0.15 -0.00 0.00 -0.16 0.00 0.00 57.16 57.11 2qmd n GLU 425 Cb 0.24 -1.59 -0.14 0.00 1.43 0.00 0.00 31.44 31.38 2qmd n GLU 425 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2qmd n PHE 426 N -1.70 0.00 -3.99 -1.84 3.01 -1.26 -5.01 117.46 106.67 2qmd n PHE 426 Ca 0.05 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.41 2qmd n PHE 426 Cb 0.30 -0.65 -0.11 0.00 -0.01 0.00 0.00 39.48 39.00 2qmd n PHE 426 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2qmd s ARG 427 N -2.80 0.34 0.10 -1.08 0.52 -1.25 -5.16 118.95 109.61 2qmd s ARG 427 Ca -0.08 -0.59 0.03 0.00 -0.52 0.00 0.00 55.73 54.58 2qmd s ARG 427 Cb 0.08 0.00 -0.04 0.00 0.52 0.00 0.00 34.95 35.52 2qmd s ARG 427 CO 0.73 -0.02 -0.09 -0.08 0.02 0.00 0.00 175.30 175.85 2qmd s THR 428 N -1.30 0.88 0.88 0.02 -1.32 -1.26 -3.05 115.64 110.49 2qmd s THR 428 Ca -0.13 -1.69 -0.11 0.00 -1.21 0.00 0.00 61.69 58.55 2qmd s THR 428 Cb -0.09 -1.41 0.12 0.00 -1.51 0.00 0.00 72.50 69.61 2qmd s THR 428 CO -0.01 -0.63 1.10 0.00 -2.21 0.00 0.00 174.62 172.88 2qmd s ALA 429 N -2.68 1.60 0.05 11.08 0.00 -1.26 -4.91 121.76 125.64 2qmd s ALA 429 Ca 0.06 0.28 -0.12 0.00 0.00 0.00 0.00 51.96 52.18 2qmd s ALA 429 Cb -0.01 -3.32 0.01 0.00 0.00 0.00 0.00 23.12 19.81 2qmd s ALA 429 CO -0.01 -2.42 0.27 0.00 0.00 0.00 0.00 175.76 173.60 2qmd s ALA 430 N -2.78 -0.57 -0.15 0.00 0.00 -0.84 -4.97 121.76 112.46 2qmd s ALA 430 Ca 0.64 -0.14 -0.03 0.00 0.00 0.00 0.00 51.96 52.43 2qmd s ALA 430 Cb -0.20 0.35 0.05 0.00 0.00 0.00 0.00 23.12 23.32 2qmd s ALA 430 CO 0.58 -0.42 0.05 0.08 0.00 0.00 0.00 175.76 176.05 2qmd s VAL 431 N -2.76 0.20 0.03 0.00 1.01 -1.26 -0.31 120.40 117.30 2qmd s VAL 431 Ca -0.03 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 61.76 2qmd s VAL 431 Cb -0.00 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 2qmd s VAL 431 CO -0.05 -0.13 -0.07 -1.61 0.00 0.00 0.00 175.10 173.24 2qmd s GLU 432 N 2.02 0.51 0.06 2.72 2.02 -0.45 -4.84 118.70 120.72 2qmd s GLU 432 Ca 0.02 -0.59 -0.27 0.00 0.02 0.00 0.00 54.97 54.15 2qmd s GLU 432 Cb -0.15 -0.35 0.09 0.00 0.10 0.00 0.00 34.13 33.82 2qmd s GLU 432 CO -0.07 0.07 1.19 0.20 0.02 0.00 0.00 175.26 176.67 2qmd s GLY 433 N -1.14 -0.15 0.35 -1.39 0.00 -1.26 -0.55 107.32 103.18 2qmd s GLY 433 Ca -0.06 0.13 0.05 0.00 0.00 0.00 0.00 44.72 44.83 2qmd s GLY 433 CO 0.00 2.65 0.50 2.56 0.00 0.00 0.00 173.10 178.82 2qmd s PRO 434 N -2.30 3.16 -0.02 2.90 0.04 -1.26 -5.08 135.00 132.44 2qmd s PRO 434 Ca 0.21 -0.83 0.05 0.00 0.04 0.00 0.00 61.00 60.48 2qmd s PRO 434 Cb 0.00 -2.76 -0.01 0.00 0.04 0.00 0.00 34.50 31.77 2qmd s PRO 434 CO 0.00 0.04 -0.18 -0.06 0.04 0.00 0.00 177.00 176.85 2qmd s PHE 435 N -2.24 1.63 -0.26 0.56 0.40 -0.11 -4.95 117.98 113.01 2qmd s PHE 435 Ca 0.44 -0.35 -0.29 0.00 -0.60 0.00 0.00 56.93 56.13 2qmd s PHE 435 Cb -0.10 -1.06 -0.00 0.00 0.51 0.00 0.00 43.02 42.37 2qmd s PHE 435 CO 0.33 -0.06 1.27 0.08 0.70 0.00 0.00 175.22 177.53 2qmd s VAL 436 N -0.30 4.22 -0.09 -0.44 1.01 -1.26 -0.86 120.40 122.67 2qmd s VAL 436 Ca 0.04 1.41 0.00 0.00 0.00 0.00 0.00 61.98 63.43 2qmd s VAL 436 Cb -0.08 -4.12 0.02 0.00 0.00 0.00 0.00 36.38 32.20 2qmd s VAL 436 CO 0.00 -0.36 -0.07 -0.89 0.00 0.00 0.00 175.10 173.78 2qmd s THR 437 N 4.04 0.88 0.21 3.92 2.01 0.27 -4.93 115.64 122.04 2qmd s THR 437 Ca 0.55 -0.24 -0.01 0.00 0.31 0.00 0.00 61.69 62.30 2qmd s THR 437 Cb -0.18 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.39 2qmd s THR 437 CO 0.20 0.33 0.41 -0.76 -0.69 0.00 0.00 174.62 174.10 2qmd s LEU 438 N 1.44 4.21 -1.24 4.42 1.43 -1.26 -4.00 118.68 123.68 2qmd s LEU 438 Ca -0.01 0.43 -0.05 0.00 -1.03 0.00 0.00 54.13 53.48 2qmd s LEU 438 Cb -0.13 -3.21 0.03 0.00 0.03 0.00 0.00 46.19 42.91 2qmd s LEU 438 CO -0.04 -0.06 0.32 0.47 0.23 0.00 0.00 176.35 177.26 2qmd n ASP 439 N -0.68 -4.18 0.32 2.29 8.00 -1.26 -4.85 116.55 116.20 2qmd n ASP 439 Ca -0.04 -0.15 0.20 0.00 0.71 0.00 0.00 54.79 55.51 2qmd n ASP 439 Cb 0.54 -3.47 1.12 0.00 -0.02 0.00 0.00 41.12 39.28 2qmd n ASP 439 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 2qmd h MET 440 N -0.65 0.00 0.00 -1.24 2.86 -2.00 -1.00 114.93 112.89 2qmd h MET 440 Ca -0.39 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.20 2qmd h MET 440 Cb 1.27 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.93 2qmd h MET 440 CO 0.47 0.00 -0.20 0.93 1.06 0.00 0.00 176.91 179.17 2qmd h GLU 441 N 0.00 0.00 0.00 1.72 4.39 -1.98 -1.43 114.58 117.29 2qmd h GLU 441 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2qmd h GLU 441 Cb 0.02 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.67 2qmd h GLU 441 CO -0.00 0.20 0.00 -0.25 -1.16 0.00 0.00 179.01 177.80 2qmd n ASP 442 N -3.73 0.00 0.14 1.42 8.00 -0.38 -2.46 116.55 119.54 2qmd n ASP 442 Ca -0.01 0.12 0.12 0.00 0.71 0.00 0.00 54.79 55.73 2qmd n ASP 442 Cb 0.31 -0.35 0.24 0.00 -0.02 0.00 0.00 41.12 41.30 2qmd n ASP 442 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qmd s GLY 444 N -3.90 2.90 0.00 0.00 0.00 -1.03 -4.02 107.32 101.27 2qmd s GLY 444 Ca 0.07 0.53 -0.16 0.00 0.00 0.00 0.00 44.72 45.17 2qmd s GLY 444 CO 0.66 1.01 0.43 -0.47 0.00 0.00 0.00 173.10 174.74 2qmd s TYR 445 N -1.46 3.73 -0.14 1.90 5.04 -1.26 -4.98 117.35 120.19 2qmd s TYR 445 Ca 0.46 1.03 0.01 0.00 -2.44 0.00 0.00 57.07 56.14 2qmd s TYR 445 Cb -0.21 -2.33 0.02 0.00 0.35 0.00 0.00 41.96 39.78 2qmd s TYR 445 CO 0.26 0.61 -0.17 -0.80 -1.34 0.00 0.00 175.55 174.12 2qmd s ASN 446 N -0.99 2.74 0.00 4.32 0.01 -1.26 -4.97 114.94 114.79 2qmd s ASN 446 Ca 0.25 -0.51 0.00 0.00 -0.71 0.00 0.00 52.86 51.89 2qmd s ASN 446 Cb -0.17 -1.24 0.00 0.00 0.41 0.00 0.00 41.25 40.25 2qmd s ASN 446 CO 0.14 0.00 0.39 -0.38 -1.51 0.00 0.00 177.10 175.75