#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qmd s SER 59 N 0.00 0.47 -0.52 1.61 1.04 -1.26 -1.50 113.70 113.54 2qmd s SER 59 Ca 0.00 0.02 0.07 0.00 0.48 0.00 0.00 55.95 56.52 2qmd s SER 59 Cb 0.00 -0.15 0.26 0.00 0.10 0.00 0.00 66.02 66.23 2qmd s SER 59 CO 0.00 -0.15 0.67 0.49 0.98 0.00 0.00 173.24 175.23 2qmd n PHE 60 N 4.44 1.88 -0.04 5.02 3.01 -1.26 -4.95 117.46 125.55 2qmd n PHE 60 Ca -0.22 -3.89 0.20 0.00 1.01 0.00 0.00 57.45 54.55 2qmd n PHE 60 Cb 0.50 -0.46 0.66 0.00 -0.01 0.00 0.00 39.48 40.17 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 2.57 0.73 0.00 -4.37 2.07 -1.97 -0.67 116.25 114.61 2qmd h VAL 61 Ca 0.14 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.63 2qmd h VAL 61 Cb 0.76 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2qmd h VAL 61 CO 0.67 0.01 0.00 1.05 0.02 0.00 0.00 177.57 179.32 2qmd h GLU 62 N 0.08 0.00 0.00 1.57 9.09 -1.96 -3.14 114.58 120.22 2qmd h GLU 62 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.70 2qmd h GLU 62 Cb 1.03 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.13 2qmd h GLU 62 CO -0.02 0.00 -0.93 -1.33 0.05 0.00 0.00 179.01 176.78 2qmd n MET 63 N -2.84 2.16 -1.79 1.06 2.81 -0.31 -4.44 117.12 113.78 2qmd n MET 63 Ca 0.01 -0.04 -0.41 0.00 -1.81 0.00 0.00 57.70 55.44 2qmd n MET 63 Cb 0.25 -1.10 -0.01 0.00 -0.71 0.00 0.00 33.22 31.65 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 -2.30 2.10 -1.15 2.03 1.01 -0.92 -2.60 120.40 118.57 2qmd s VAL 64 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.07 2qmd s VAL 64 Cb 0.07 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2qmd s VAL 64 CO 0.42 0.01 0.00 0.47 0.00 0.00 0.00 175.10 176.00 2qmd n ASP 65 N 2.03 -4.14 -0.50 3.32 10.43 -1.20 -4.92 116.55 121.56 2qmd n ASP 65 Ca 0.07 0.02 0.13 0.00 2.57 0.00 0.00 54.79 57.58 2qmd n ASP 65 Cb 0.38 -3.29 0.48 0.00 1.84 0.00 0.00 41.12 40.53 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 -0.48 1.55 -4.76 -2.24 6.94 -0.99 -4.83 115.26 110.44 2qmd n ASN 66 Ca -0.15 -1.57 -0.29 0.00 -0.02 0.00 0.00 54.58 52.55 2qmd n ASN 66 Cb 0.60 -0.04 -0.06 0.00 -2.36 0.00 0.00 39.78 37.92 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 -1.85 3.72 0.13 -4.53 1.43 -0.53 -4.42 118.68 112.62 2qmd s LEU 67 Ca 0.36 -0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.38 2qmd s LEU 67 Cb 0.20 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 2qmd s LEU 67 CO 0.31 0.14 -0.04 -0.13 0.23 0.00 0.00 176.35 176.86 2qmd s ARG 68 N -2.62 0.94 0.00 1.70 0.52 -0.85 -0.03 118.95 118.61 2qmd s ARG 68 Ca 0.29 -1.41 0.00 0.00 -0.52 0.00 0.00 55.73 54.09 2qmd s ARG 68 Cb -0.11 -0.22 0.00 0.00 0.52 0.00 0.00 34.95 35.14 2qmd s ARG 68 CO 0.22 -0.06 0.00 0.41 0.02 0.00 0.00 175.30 175.88 2qmd n GLY 69 N -0.12 0.51 3.47 -3.53 0.00 -1.26 -0.42 105.19 103.85 2qmd n GLY 69 Ca -0.10 -2.21 -0.11 0.00 0.00 0.00 0.00 46.02 43.60 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 -0.44 1.34 0.31 1.61 -2.85 -1.08 -4.72 119.74 113.91 2qmd s LYS 70 Ca 0.00 -0.54 0.03 0.00 -1.00 0.00 0.00 55.97 54.46 2qmd s LYS 70 Cb 0.00 0.59 0.63 0.00 -2.06 0.00 0.00 37.83 36.99 2qmd s LYS 70 CO 0.00 -0.59 1.87 0.66 0.10 0.00 0.00 175.35 177.39 2qmd h SER 71 N 2.01 0.84 0.92 0.03 4.64 -1.93 0.99 113.55 121.04 2qmd h SER 71 Ca -0.32 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.02 2qmd h SER 71 Cb 1.30 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2qmd h SER 71 CO 0.36 0.47 -0.05 1.23 -0.87 0.00 0.00 176.83 177.97 2qmd h GLY 72 N 0.91 0.00 0.00 -0.77 0.00 -1.96 -3.28 103.07 97.98 2qmd h GLY 72 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 2qmd h GLY 72 CO -0.21 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.27 2qmd n GLN 73 N -3.18 -0.50 0.00 4.80 6.02 -0.83 -4.98 117.38 118.71 2qmd n GLN 73 Ca 0.00 -0.36 0.00 0.00 -0.01 0.00 0.00 57.00 56.63 2qmd n GLN 73 Cb 0.31 -0.86 0.00 0.00 1.02 0.00 0.00 30.24 30.72 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 0.03 0.89 3.72 1.08 0.00 0.28 -4.89 105.19 106.32 2qmd n GLY 74 Ca 0.00 -1.71 -0.35 0.00 0.00 0.00 0.00 46.02 43.95 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 -2.81 3.35 0.15 1.61 1.51 -1.26 -2.63 117.35 117.27 2qmd s TYR 75 Ca 0.00 0.26 0.06 0.00 -1.01 0.00 0.00 57.07 56.38 2qmd s TYR 75 Cb 0.00 -2.00 -0.04 0.00 -0.11 0.00 0.00 41.96 39.81 2qmd s TYR 75 CO 0.00 0.39 -0.13 1.52 -1.11 0.00 0.00 175.55 176.22 2qmd s TYR 76 N -0.25 1.43 0.07 2.71 -0.85 0.44 -0.74 117.35 120.16 2qmd s TYR 76 Ca 0.09 -0.62 0.08 0.00 -0.52 0.00 0.00 57.07 56.10 2qmd s TYR 76 Cb -0.12 -0.72 -0.03 0.00 0.38 0.00 0.00 41.96 41.47 2qmd s TYR 76 CO 0.01 0.18 -0.20 0.54 -1.52 0.00 0.00 175.55 174.55 2qmd s VAL 77 N -2.67 1.66 0.17 -3.49 0.11 -0.29 -2.00 120.40 113.90 2qmd s VAL 77 Ca 0.14 -1.36 -0.30 0.00 -2.93 0.00 0.00 61.98 57.53 2qmd s VAL 77 Cb -0.02 -1.48 -0.07 0.00 -1.53 0.00 0.00 36.38 33.28 2qmd s VAL 77 CO 0.03 0.06 1.01 -0.70 -3.33 0.00 0.00 175.10 172.18 2qmd s GLU 78 N -1.54 4.70 0.14 1.54 2.12 -1.26 -0.68 118.70 123.71 2qmd s GLU 78 Ca 0.07 1.57 0.01 0.00 0.36 0.00 0.00 54.97 56.98 2qmd s GLU 78 Cb -0.09 -3.31 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 2qmd s GLU 78 CO 0.03 0.24 -0.00 -1.64 -0.54 0.00 0.00 175.26 173.34 2qmd s MET 79 N -0.48 0.96 0.00 4.30 -1.94 0.08 -4.05 119.30 118.17 2qmd s MET 79 Ca 0.46 -1.44 0.06 0.00 -1.71 0.00 0.00 55.69 53.06 2qmd s MET 79 Cb -0.27 -0.08 -0.02 0.00 2.01 0.00 0.00 34.83 36.48 2qmd s MET 79 CO 0.33 -0.14 -0.20 0.95 -0.01 0.00 0.00 175.02 175.95 2qmd s THR 80 N -3.77 1.55 -0.00 2.05 -4.23 0.23 -1.31 115.64 110.15 2qmd s THR 80 Ca 0.20 -0.93 0.04 0.00 -1.18 0.00 0.00 61.69 59.82 2qmd s THR 80 Cb 0.06 -1.31 -0.01 0.00 1.34 0.00 0.00 72.50 72.59 2qmd s THR 80 CO 0.00 0.36 -0.14 0.68 -0.54 0.00 0.00 174.62 174.98 2qmd s VAL 81 N -0.56 1.09 0.00 2.29 -7.23 0.19 -1.51 120.40 114.67 2qmd s VAL 81 Ca 0.07 -0.64 0.00 0.00 -1.81 0.00 0.00 61.98 59.60 2qmd s VAL 81 Cb -0.08 -0.92 0.00 0.00 0.56 0.00 0.00 36.38 35.94 2qmd s VAL 81 CO -0.00 0.27 0.00 0.61 -0.31 0.00 0.00 175.10 175.67 2qmd n GLY 82 N 2.63 -0.95 2.72 2.32 0.00 -0.36 -0.57 105.19 110.98 2qmd n GLY 82 Ca -0.15 -1.66 -0.25 0.00 0.00 0.00 0.00 46.02 43.97 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 -2.15 2.08 0.79 1.61 0.01 -1.26 -2.83 113.70 111.95 2qmd s SER 83 Ca 0.00 -0.38 -0.11 0.00 1.31 0.00 0.00 55.95 56.76 2qmd s SER 83 Cb 0.00 -0.43 0.07 0.00 0.21 0.00 0.00 66.02 65.87 2qmd s SER 83 CO 0.00 -0.26 1.11 -2.16 0.41 0.00 0.00 173.24 172.34 2qmd s PRO 84 N 1.98 2.03 0.12 12.44 0.04 -1.26 -0.87 135.00 149.48 2qmd s PRO 84 Ca 0.03 1.33 -0.35 0.00 0.04 0.00 0.00 61.00 62.04 2qmd s PRO 84 Cb -0.14 -1.86 -0.14 0.00 0.04 0.00 0.00 34.50 32.39 2qmd s PRO 84 CO -0.06 -1.84 1.54 -2.30 0.04 0.00 0.00 177.00 174.38 2qmd n PRO 85 N -3.49 1.88 -3.81 0.56 -0.02 -1.13 -4.90 135.00 124.08 2qmd n PRO 85 Ca 0.10 0.68 -0.36 0.00 -2.02 0.00 0.00 63.50 61.90 2qmd n PRO 85 Cb 0.52 -2.42 -0.13 0.00 -0.02 0.00 0.00 33.50 31.46 2qmd n PRO 85 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2qmd s GLN 86 N 1.05 3.40 -0.00 -0.52 -0.21 0.27 -4.89 119.66 118.75 2qmd s GLN 86 Ca 0.81 -0.64 -0.28 0.00 0.02 0.00 0.00 55.36 55.28 2qmd s GLN 86 Cb -0.76 -3.23 -0.04 0.00 1.00 0.00 0.00 33.01 29.98 2qmd s GLN 86 CO 0.42 -0.26 0.88 0.99 -2.12 0.00 0.00 175.29 175.19 2qmd s THR 87 N 1.54 4.86 -0.01 -0.19 2.01 -1.26 -0.64 115.64 121.94 2qmd s THR 87 Ca 0.05 1.86 -0.04 0.00 0.31 0.00 0.00 61.69 63.86 2qmd s THR 87 Cb -0.15 -4.23 0.00 0.00 0.01 0.00 0.00 72.50 68.13 2qmd s THR 87 CO 0.01 0.22 0.09 -0.76 -0.69 0.00 0.00 174.62 173.49 2qmd s LEU 88 N 0.73 1.71 -0.10 4.42 1.43 -0.43 -4.96 118.68 121.49 2qmd s LEU 88 Ca 0.46 -0.06 -0.20 0.00 -1.03 0.00 0.00 54.13 53.31 2qmd s LEU 88 Cb -0.20 0.41 -0.04 0.00 0.03 0.00 0.00 46.19 46.38 2qmd s LEU 88 CO 0.25 -0.19 0.55 0.20 0.23 0.00 0.00 176.35 177.39 2qmd s ASN 89 N -0.68 6.79 -0.13 2.29 0.02 -1.26 -0.74 114.94 121.22 2qmd s ASN 89 Ca -0.08 0.94 0.01 0.00 -1.02 0.00 0.00 52.86 52.71 2qmd s ASN 89 Cb -0.05 -2.33 0.02 0.00 0.02 0.00 0.00 41.25 38.91 2qmd s ASN 89 CO 0.00 -0.04 -0.15 -0.63 0.02 0.00 0.00 177.10 176.31 2qmd s ILE 90 N 0.67 1.58 0.07 0.60 -1.09 0.14 -0.20 121.20 122.98 2qmd s ILE 90 Ca 0.30 -0.66 -0.33 0.00 -2.23 0.00 0.00 60.65 57.73 2qmd s ILE 90 Cb -0.16 -1.46 -0.12 0.00 -1.58 0.00 0.00 42.46 39.14 2qmd s ILE 90 CO 0.13 0.46 1.79 -0.11 -1.23 0.00 0.00 174.94 175.98 2qmd n LEU 91 N 4.51 3.63 -4.60 2.97 7.94 0.21 -1.13 117.00 130.53 2qmd n LEU 91 Ca -0.18 1.01 -0.43 0.00 -1.11 0.00 0.00 56.01 55.30 2qmd n LEU 91 Cb 0.51 -1.47 -0.03 0.00 0.53 0.00 0.00 43.42 42.96 2qmd n LEU 91 CO 0.23 -0.01 0.88 -0.69 -1.11 0.00 0.00 177.39 176.69 2qmd s VAL 92 N 2.67 4.44 -0.31 1.96 1.01 0.08 -0.13 120.40 130.12 2qmd s VAL 92 Ca 0.84 1.25 0.01 0.00 0.00 0.00 0.00 61.98 64.09 2qmd s VAL 92 Cb -0.59 -4.45 0.09 0.00 0.00 0.00 0.00 36.38 31.43 2qmd s VAL 92 CO 0.42 -0.71 0.05 -0.62 0.00 0.00 0.00 175.10 174.23 2qmd s ASP 93 N 2.06 4.27 0.00 3.32 2.15 -0.58 -4.20 116.67 123.69 2qmd s ASP 93 Ca 0.42 -1.74 0.31 0.00 0.43 0.00 0.00 52.55 51.98 2qmd s ASP 93 Cb -0.10 -1.23 1.83 0.00 -0.30 0.00 0.00 42.92 43.12 2qmd s ASP 93 CO 0.23 -0.36 2.18 0.35 -0.17 0.00 0.00 175.17 177.40 2qmd n THR 94 N 4.58 0.00 -0.19 1.71 -2.24 -1.26 -0.82 114.28 116.06 2qmd n THR 94 Ca -0.02 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.87 2qmd n THR 94 Cb 0.42 -0.51 0.30 0.00 -2.10 0.00 0.00 70.33 68.45 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 1.02 2.22 3.62 3.38 0.00 -1.26 -4.22 105.19 109.95 2qmd n GLY 95 Ca 0.22 -0.74 -0.12 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.00 0.42 -0.01 1.61 1.04 -1.23 -5.00 113.70 109.53 2qmd s SER 96 Ca 0.46 -1.25 0.02 0.00 0.48 0.00 0.00 55.95 55.65 2qmd s SER 96 Cb 0.24 0.71 0.03 0.00 0.10 0.00 0.00 66.02 67.10 2qmd s SER 96 CO 0.31 -1.40 0.78 -1.20 0.98 0.00 0.00 173.24 172.72 2qmd n SER 97 N -1.21 0.86 -4.71 7.02 7.64 -1.26 -1.06 113.62 120.91 2qmd n SER 97 Ca -0.03 -1.64 -0.35 0.00 1.01 0.00 0.00 58.87 57.86 2qmd n SER 97 Cb 0.61 -0.06 -0.09 0.00 -1.01 0.00 0.00 64.21 63.66 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 -0.71 5.56 -0.29 6.43 -0.87 -1.26 -4.53 114.94 119.28 2qmd s ASN 98 Ca 0.03 0.20 -0.15 0.00 -1.57 0.00 0.00 52.86 51.36 2qmd s ASN 98 Cb 0.02 -1.73 -0.03 0.00 -0.02 0.00 0.00 41.25 39.50 2qmd s ASN 98 CO 0.00 0.34 0.38 0.12 -2.57 0.00 0.00 177.10 175.37 2qmd s PHE 99 N -0.61 3.23 -0.01 2.20 5.99 -1.26 -1.47 117.98 126.05 2qmd s PHE 99 Ca 0.11 0.30 -0.05 0.00 0.00 0.00 0.00 56.93 57.29 2qmd s PHE 99 Cb -0.12 -2.63 0.00 0.00 0.00 0.00 0.00 43.02 40.28 2qmd s PHE 99 CO 0.02 -0.30 0.10 0.00 -0.00 0.00 0.00 175.22 175.04 2qmd s ALA 100 N 2.09 -0.23 0.00 11.12 0.00 -0.38 -1.40 121.76 132.96 2qmd s ALA 100 Ca 0.15 -0.03 0.01 0.00 0.00 0.00 0.00 51.96 52.08 2qmd s ALA 100 Cb -0.16 -0.00 -0.00 0.00 0.00 0.00 0.00 23.12 22.96 2qmd s ALA 100 CO 0.11 -0.14 -0.03 0.14 0.00 0.00 0.00 175.76 175.84 2qmd s VAL 101 N -0.83 0.19 0.27 0.00 -7.23 -0.40 0.29 120.40 112.68 2qmd s VAL 101 Ca -0.09 -0.22 -0.30 0.00 -1.81 0.00 0.00 61.98 59.56 2qmd s VAL 101 Cb -0.05 -0.19 -0.13 0.00 0.56 0.00 0.00 36.38 36.56 2qmd s VAL 101 CO 0.01 -0.02 1.33 0.61 -0.31 0.00 0.00 175.10 176.71 2qmd n GLY 102 N 2.82 0.59 0.31 2.32 0.00 0.08 -0.47 105.19 110.85 2qmd n GLY 102 Ca -0.14 0.44 0.03 0.00 0.00 0.00 0.00 46.02 46.34 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 1.33 1.96 -3.50 4.61 0.00 -0.42 -0.78 120.51 123.71 2qmd n ALA 103 Ca 0.10 -1.36 -0.17 0.00 0.00 0.00 0.00 53.44 52.01 2qmd n ALA 103 Cb 0.32 -0.39 -0.05 0.00 0.00 0.00 0.00 19.45 19.33 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 -0.79 -1.73 0.25 0.00 0.00 -1.24 -4.80 121.76 113.45 2qmd s ALA 104 Ca 0.08 1.14 -0.29 0.00 0.00 0.00 0.00 51.96 52.90 2qmd s ALA 104 Cb 0.07 0.19 -0.15 0.00 0.00 0.00 0.00 23.12 23.23 2qmd s ALA 104 CO 0.01 -0.46 0.90 -2.30 0.00 0.00 0.00 175.76 173.91 2qmd n PRO 105 N 0.63 0.96 -3.74 0.00 -0.02 -1.26 -4.97 135.00 126.61 2qmd n PRO 105 Ca -0.19 0.34 -0.12 0.00 -2.02 0.00 0.00 63.50 61.51 2qmd n PRO 105 Cb 0.59 -1.63 -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 -0.94 -0.44 0.12 6.00 2.46 -1.26 -5.05 115.29 116.19 2qmd s HIS 106 Ca 0.62 1.02 0.24 0.00 0.47 0.00 0.00 55.06 57.41 2qmd s HIS 106 Cb -0.78 0.16 1.29 0.00 -0.13 0.00 0.00 32.58 33.11 2qmd s HIS 106 CO 0.58 -0.23 1.69 -1.00 -2.47 0.00 0.00 174.74 173.32 2qmd h PRO 107 N 6.06 0.00 -0.02 2.88 0.13 -2.04 -0.42 132.00 138.59 2qmd h PRO 107 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2qmd h PRO 107 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2qmd h PRO 107 CO 0.29 0.00 -0.22 1.19 -0.23 0.00 0.00 178.00 179.03 2qmd n PHE 108 N -2.41 0.00 -4.30 1.56 0.99 -1.26 -4.92 117.46 107.13 2qmd n PHE 108 Ca -0.02 0.00 -0.34 0.00 -0.00 0.00 0.00 57.45 57.09 2qmd n PHE 108 Cb 0.18 -0.01 -0.10 0.00 -1.00 0.00 0.00 39.48 38.54 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 -2.24 3.55 0.00 4.37 1.43 -0.17 -4.66 118.68 120.95 2qmd s LEU 109 Ca 0.25 0.06 0.15 0.00 -1.03 0.00 0.00 54.13 53.56 2qmd s LEU 109 Cb 0.19 -1.84 0.21 0.00 0.03 0.00 0.00 46.19 44.78 2qmd s LEU 109 CO 0.44 0.28 1.09 0.00 0.23 0.00 0.00 176.35 178.38 2qmd n HIS 110 N 2.82 0.18 -3.47 0.29 1.44 -1.26 -4.61 115.22 110.61 2qmd n HIS 110 Ca -0.18 -0.14 -0.14 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 30.60 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 -1.21 1.13 0.20 -1.40 1.70 -1.26 -5.18 118.95 112.92 2qmd s ARG 111 Ca 0.22 -0.17 -0.20 0.00 -0.47 0.00 0.00 55.73 55.10 2qmd s ARG 111 Cb 0.14 0.52 0.04 0.00 -0.57 0.00 0.00 34.95 35.09 2qmd s ARG 111 CO 0.20 -0.44 0.59 1.52 -1.08 0.00 0.00 175.30 176.09 2qmd s TYR 112 N -2.68 -0.31 -0.07 5.89 -0.85 -1.26 -4.92 117.35 113.15 2qmd s TYR 112 Ca -0.03 -0.00 -0.30 0.00 -0.52 0.00 0.00 57.07 56.22 2qmd s TYR 112 Cb -0.01 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 42.81 2qmd s TYR 112 CO -0.04 -0.95 1.47 -0.47 -1.52 0.00 0.00 175.55 174.04 2qmd s TYR 113 N -3.83 2.50 -0.59 -3.49 5.04 0.04 -4.95 117.35 112.06 2qmd s TYR 113 Ca 0.06 0.61 -0.06 0.00 -2.44 0.00 0.00 57.07 55.24 2qmd s TYR 113 Cb -0.02 -3.72 0.15 0.00 0.35 0.00 0.00 41.96 38.72 2qmd s TYR 113 CO -0.05 -2.82 0.44 -0.65 -1.34 0.00 0.00 175.55 171.13 2qmd s GLN 114 N 3.36 2.64 0.32 4.97 -0.21 -1.26 -4.43 119.66 125.05 2qmd s GLN 114 Ca 0.65 -2.22 0.04 0.00 0.02 0.00 0.00 55.36 53.86 2qmd s GLN 114 Cb -0.30 -3.88 0.67 0.00 1.00 0.00 0.00 33.01 30.50 2qmd s GLN 114 CO 0.24 -1.19 1.88 0.00 -2.12 0.00 0.00 175.29 174.10 2qmd h ARG 115 N 7.67 0.84 0.00 2.91 3.08 -1.93 -1.82 114.38 125.13 2qmd h ARG 115 Ca -0.06 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.94 2qmd h ARG 115 Cb 1.01 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.87 2qmd h ARG 115 CO 0.76 0.56 0.00 0.00 -1.07 0.00 0.00 179.97 180.22 2qmd n GLN 116 N -4.56 0.15 -0.00 0.04 0.00 -1.26 -2.00 117.38 109.75 2qmd n GLN 116 Ca 0.16 0.43 0.12 0.00 0.00 0.00 0.00 57.00 57.71 2qmd n GLN 116 Cb 0.35 -1.81 0.17 0.00 0.00 0.00 0.00 30.24 28.95 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 -2.09 2.76 -4.45 2.61 4.77 -0.69 -4.87 117.00 115.04 2qmd n LEU 117 Ca 0.02 -0.92 -0.38 0.00 -0.03 0.00 0.00 56.01 54.70 2qmd n LEU 117 Cb 0.19 -0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.16 2qmd n LEU 117 CO 0.17 0.46 -0.23 -0.55 -1.33 0.00 0.00 177.39 175.90 2qmd s SER 118 N -2.00 5.42 0.35 -1.43 0.15 -0.85 -4.22 113.70 111.12 2qmd s SER 118 Ca 0.30 -0.36 0.27 0.00 0.70 0.00 0.00 55.95 56.85 2qmd s SER 118 Cb 0.20 -1.98 1.04 0.00 -1.71 0.00 0.00 66.02 63.57 2qmd s SER 118 CO 0.31 -0.12 1.80 0.77 1.20 0.00 0.00 173.24 177.19 2qmd h SER 119 N 8.30 0.00 -0.25 5.45 4.64 -1.30 -2.92 113.55 127.47 2qmd h SER 119 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2qmd h SER 119 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2qmd h SER 119 CO 0.59 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.90 2qmd n THR 120 N -2.56 0.32 -1.84 2.95 -2.24 -1.26 -4.96 114.28 104.69 2qmd n THR 120 Ca 0.02 -0.66 -0.42 0.00 -2.27 0.00 0.00 64.05 60.73 2qmd n THR 120 Cb 0.30 1.17 -0.03 0.00 -2.10 0.00 0.00 70.33 69.68 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 -1.64 2.94 -0.11 4.78 5.04 -1.10 -4.49 117.35 122.76 2qmd s TYR 121 Ca 0.34 0.59 0.01 0.00 -2.44 0.00 0.00 57.07 55.57 2qmd s TYR 121 Cb 0.21 -4.02 0.02 0.00 0.35 0.00 0.00 41.96 38.52 2qmd s TYR 121 CO 0.30 -3.71 -0.13 1.03 -1.34 0.00 0.00 175.55 171.70 2qmd s ARG 122 N 0.69 2.03 -0.23 4.97 0.52 -0.55 -4.99 118.95 121.39 2qmd s ARG 122 Ca 0.69 -0.48 -0.23 0.00 -0.52 0.00 0.00 55.73 55.19 2qmd s ARG 122 Cb -0.47 -1.82 -0.01 0.00 0.52 0.00 0.00 34.95 33.18 2qmd s ARG 122 CO 0.36 -0.13 0.77 0.34 0.02 0.00 0.00 175.30 176.66 2qmd s ASP 123 N 1.21 6.79 0.00 0.23 2.15 -1.26 -0.74 116.67 125.05 2qmd s ASP 123 Ca -0.03 0.98 0.29 0.00 0.43 0.00 0.00 52.55 54.22 2qmd s ASP 123 Cb -0.14 -2.41 1.28 0.00 -0.30 0.00 0.00 42.92 41.35 2qmd s ASP 123 CO -0.04 -0.44 1.89 0.18 -0.17 0.00 0.00 175.17 176.59 2qmd n LEU 124 N 5.71 0.41 -3.84 -1.34 4.77 -0.66 -4.95 117.00 117.10 2qmd n LEU 124 Ca 0.03 0.03 -0.29 0.00 -0.03 0.00 0.00 56.01 55.76 2qmd n LEU 124 Cb 0.48 -0.18 0.04 0.00 -2.33 0.00 0.00 43.42 41.43 2qmd n LEU 124 CO 0.46 0.08 0.14 0.54 -1.33 0.00 0.00 177.39 177.28 2qmd n ARG 125 N -0.98 -6.14 -3.79 3.23 1.74 -1.25 -4.97 116.66 104.49 2qmd n ARG 125 Ca 0.15 0.65 -0.13 0.00 -0.77 0.00 0.00 57.85 57.76 2qmd n ARG 125 Cb 0.27 -5.59 -0.11 0.00 -1.02 0.00 0.00 32.46 26.01 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 -6.56 0.34 0.63 5.56 2.20 -1.26 -5.05 119.74 115.60 2qmd s LYS 126 Ca 0.65 0.23 -0.07 0.00 -0.36 0.00 0.00 55.97 56.42 2qmd s LYS 126 Cb -0.32 0.16 0.02 0.00 -1.51 0.00 0.00 37.83 36.18 2qmd s LYS 126 CO 0.81 -0.06 0.95 0.20 -0.36 0.00 0.00 175.35 176.89 2qmd s GLY 127 N -0.14 1.63 -0.16 5.54 0.00 -1.26 -0.67 107.32 112.25 2qmd s GLY 127 Ca -0.03 -0.70 -0.10 0.00 0.00 0.00 0.00 44.72 43.89 2qmd s GLY 127 CO 0.01 -0.38 0.39 0.54 0.00 0.00 0.00 173.10 173.66 2qmd s VAL 128 N -3.10 -0.02 -0.12 1.40 0.11 -0.31 -4.78 120.40 113.58 2qmd s VAL 128 Ca 0.56 0.07 0.02 0.00 -2.93 0.00 0.00 61.98 59.70 2qmd s VAL 128 Cb -0.11 -0.57 0.01 0.00 -1.53 0.00 0.00 36.38 34.19 2qmd s VAL 128 CO 0.46 0.03 -0.17 -0.47 -3.33 0.00 0.00 175.10 171.61 2qmd s TYR 129 N 1.06 2.21 -0.22 1.54 5.04 -1.26 -0.14 117.35 125.57 2qmd s TYR 129 Ca -0.07 -1.07 -0.00 0.00 -2.44 0.00 0.00 57.07 53.49 2qmd s TYR 129 Cb -0.07 -1.55 0.06 0.00 0.35 0.00 0.00 41.96 40.74 2qmd s TYR 129 CO -0.09 -0.52 -0.03 0.08 -1.34 0.00 0.00 175.55 173.65 2qmd s VAL 130 N 0.93 1.23 -0.43 3.14 1.01 -0.58 -4.88 120.40 120.81 2qmd s VAL 130 Ca -0.07 -1.01 -0.13 0.00 0.00 0.00 0.00 61.98 60.77 2qmd s VAL 130 Cb -0.15 -1.56 0.05 0.00 0.00 0.00 0.00 36.38 34.72 2qmd s VAL 130 CO -0.02 -0.12 0.32 -2.16 0.00 0.00 0.00 175.10 173.12 2qmd s PRO 131 N 1.53 2.88 0.00 2.72 0.04 -1.26 -1.77 135.00 139.14 2qmd s PRO 131 Ca -0.04 -1.25 0.00 0.00 0.04 0.00 0.00 61.00 59.75 2qmd s PRO 131 Cb -0.18 -3.96 0.00 0.00 0.04 0.00 0.00 34.50 30.40 2qmd s PRO 131 CO -0.07 -0.89 0.00 0.66 0.04 0.00 0.00 177.00 176.74 2qmd n TYR 132 N 5.10 -3.17 0.00 0.56 4.01 0.33 -4.99 117.16 119.00 2qmd n TYR 132 Ca -0.12 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.45 2qmd n TYR 132 Cb 0.45 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.37 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 -0.66 1.38 0.00 -0.72 2.02 -2.00 -3.39 112.91 109.54 2qmd h THR 133 Ca 0.00 -2.06 -0.00 0.00 0.77 0.00 0.00 66.41 65.12 2qmd h THR 133 Cb 0.00 2.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.85 2qmd h THR 133 CO 0.00 0.61 -0.00 -0.61 0.37 0.00 0.00 175.52 175.89 2qmd h GLN 134 N 0.08 -0.00 0.00 6.66 5.75 -1.94 -3.50 115.11 122.16 2qmd h GLN 134 Ca -0.08 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.42 2qmd h GLN 134 Cb 1.37 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.92 2qmd h GLN 134 CO 0.14 0.91 0.00 0.41 -2.65 0.00 0.00 178.83 177.63 2qmd n GLY 135 N 1.45 3.34 3.36 2.39 0.00 -1.25 -4.90 105.19 109.58 2qmd n GLY 135 Ca -0.10 -1.41 -0.11 0.00 0.00 0.00 0.00 46.02 44.41 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 -1.83 1.15 0.04 1.61 -2.85 -0.58 -0.52 119.74 116.76 2qmd s LYS 136 Ca 0.00 -0.63 -0.06 0.00 -1.00 0.00 0.00 55.97 54.28 2qmd s LYS 136 Cb 0.00 0.51 -0.01 0.00 -2.06 0.00 0.00 37.83 36.27 2qmd s LYS 136 CO 0.00 -0.47 0.11 1.67 0.10 0.00 0.00 175.35 176.75 2qmd s TRP 137 N -3.79 0.18 -0.06 1.78 1.48 -0.73 -0.86 118.94 116.94 2qmd s TRP 137 Ca 0.03 -0.47 0.05 0.00 -1.06 0.00 0.00 56.10 54.64 2qmd s TRP 137 Cb 0.01 -0.13 -0.02 0.00 -1.16 0.00 0.00 33.47 32.17 2qmd s TRP 137 CO -0.12 -0.37 -0.21 -2.00 -4.06 0.00 0.00 176.95 170.19 2qmd s GLU 138 N -2.57 2.61 0.34 3.25 2.56 0.88 -1.53 118.70 124.24 2qmd s GLU 138 Ca -0.05 -0.83 -0.03 0.00 0.00 0.00 0.00 54.97 54.05 2qmd s GLU 138 Cb -0.01 -2.27 0.01 0.00 2.00 0.00 0.00 34.13 33.87 2qmd s GLU 138 CO -0.04 0.43 0.50 0.41 -0.56 0.00 0.00 175.26 176.00 2qmd n GLY 139 N 2.83 2.00 3.15 -1.50 0.00 0.80 -1.26 105.19 111.20 2qmd n GLY 139 Ca -0.17 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 43.98 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 -2.66 2.86 0.28 1.61 2.02 -0.24 -1.17 118.70 121.41 2qmd s GLU 140 Ca 0.26 -0.80 -0.29 0.00 0.02 0.00 0.00 54.97 54.16 2qmd s GLU 140 Cb -0.01 -2.32 -0.09 0.00 0.10 0.00 0.00 34.13 31.80 2qmd s GLU 140 CO 0.18 -0.01 1.01 -0.51 0.02 0.00 0.00 175.26 175.95 2qmd s LEU 141 N 0.82 4.54 0.00 1.80 1.43 0.15 -0.59 118.68 126.84 2qmd s LEU 141 Ca -0.08 2.06 -0.12 0.00 -1.03 0.00 0.00 54.13 54.97 2qmd s LEU 141 Cb -0.16 -3.70 0.05 0.00 0.03 0.00 0.00 46.19 42.41 2qmd s LEU 141 CO -0.01 -0.02 0.61 0.61 0.23 0.00 0.00 176.35 177.76 2qmd n GLY 142 N 1.19 1.10 3.20 -3.19 0.00 -0.74 -1.65 105.19 105.10 2qmd n GLY 142 Ca -0.01 -1.14 -0.12 0.00 0.00 0.00 0.00 46.02 44.76 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 -2.32 0.86 0.19 2.61 -4.23 0.08 -0.61 115.64 112.23 2qmd s THR 143 Ca 0.13 -1.96 -0.23 0.00 -1.18 0.00 0.00 61.69 58.45 2qmd s THR 143 Cb -0.03 -1.71 0.06 0.00 1.34 0.00 0.00 72.50 72.16 2qmd s THR 143 CO 0.06 -0.81 0.95 -0.62 -0.54 0.00 0.00 174.62 173.66 2qmd s ASP 144 N -3.04 -0.12 0.04 3.99 -1.08 -0.87 -1.49 116.67 114.11 2qmd s ASP 144 Ca 0.13 -0.56 -0.28 0.00 -0.52 0.00 0.00 52.55 51.32 2qmd s ASP 144 Cb 0.04 0.54 -0.05 0.00 -1.46 0.00 0.00 42.92 41.99 2qmd s ASP 144 CO -0.03 -1.03 0.89 -0.76 0.52 0.00 0.00 175.17 174.76 2qmd s LEU 145 N -3.08 4.43 -0.02 -1.34 1.43 -1.26 -1.58 118.68 117.26 2qmd s LEU 145 Ca 0.15 1.60 0.05 0.00 -1.03 0.00 0.00 54.13 54.90 2qmd s LEU 145 Cb -0.02 -3.44 -0.01 0.00 0.03 0.00 0.00 46.19 42.75 2qmd s LEU 145 CO 0.04 -0.11 -0.17 -0.69 0.23 0.00 0.00 176.35 175.65 2qmd s VAL 146 N 0.39 1.34 0.10 -1.59 1.01 0.12 -1.23 120.40 120.54 2qmd s VAL 146 Ca 0.45 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.74 2qmd s VAL 146 Cb -0.21 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 2qmd s VAL 146 CO 0.26 0.38 -0.07 -0.44 0.00 0.00 0.00 175.10 175.24 2qmd s SER 147 N -0.26 1.16 -0.32 3.32 0.01 -0.57 -0.98 113.70 116.06 2qmd s SER 147 Ca 0.03 -1.00 0.02 0.00 1.31 0.00 0.00 55.95 56.32 2qmd s SER 147 Cb -0.08 0.09 0.10 0.00 0.21 0.00 0.00 66.02 66.34 2qmd s SER 147 CO 0.00 -0.45 0.05 -0.63 0.41 0.00 0.00 173.24 172.62 2qmd s ILE 148 N -3.55 1.84 0.28 1.44 1.01 -1.26 -0.60 121.20 120.35 2qmd s ILE 148 Ca 0.11 -1.98 -0.03 0.00 0.00 0.00 0.00 60.65 58.76 2qmd s ILE 148 Cb 0.05 -2.33 0.38 0.00 0.01 0.00 0.00 42.46 40.56 2qmd s ILE 148 CO -0.04 -0.56 1.59 -0.65 0.00 0.00 0.00 174.94 175.27 2qmd h PRO 149 N 7.77 0.04 -1.90 2.79 0.11 -1.91 0.57 132.00 139.48 2qmd h PRO 149 Ca -0.08 -0.00 -0.70 0.00 0.11 0.00 0.00 66.00 65.33 2qmd h PRO 149 Cb 1.02 -0.01 -0.33 0.00 0.11 0.00 0.00 31.00 31.79 2qmd h PRO 149 CO 0.50 0.03 0.31 0.72 -0.21 0.00 0.00 178.00 179.34 2qmd n HIS 150 N -5.46 3.20 -2.26 0.65 8.25 -1.26 -4.93 115.22 113.41 2qmd n HIS 150 Ca 0.19 -2.77 0.00 0.00 -0.26 0.00 0.00 57.72 54.88 2qmd n HIS 150 Cb 0.62 -0.76 0.00 0.00 1.12 0.00 0.00 29.99 30.98 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 -0.44 5.19 3.77 -1.41 0.00 0.19 -4.44 105.19 108.06 2qmd n GLY 151 Ca 0.46 -1.19 -0.40 0.00 0.00 0.00 0.00 46.02 44.90 2qmd n GLY 151 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2qmd s PRO 152 N 1.66 3.87 -1.36 1.61 0.02 -1.26 -4.86 135.00 134.68 2qmd s PRO 152 Ca 0.00 2.28 -0.15 0.00 0.02 0.00 0.00 61.00 63.15 2qmd s PRO 152 Cb 0.00 -2.73 -0.00 0.00 0.02 0.00 0.00 34.50 31.79 2qmd s PRO 152 CO 0.00 -0.62 2.24 -1.71 -0.33 0.00 0.00 177.00 176.58 2qmd n ASN 153 N 0.03 4.04 -4.03 2.53 5.15 -1.26 -4.66 115.26 117.05 2qmd n ASN 153 Ca 0.04 -2.79 -0.08 0.00 -0.60 0.00 0.00 54.58 51.16 2qmd n ASN 153 Cb 0.43 -1.56 -0.09 0.00 -0.53 0.00 0.00 39.78 38.03 2qmd n ASN 153 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2qmd s VAL 154 N 3.41 0.20 -0.07 3.44 -7.23 -1.26 -5.15 120.40 113.73 2qmd s VAL 154 Ca 0.50 -1.64 0.03 0.00 -1.81 0.00 0.00 61.98 59.06 2qmd s VAL 154 Cb 0.14 -1.48 0.01 0.00 0.56 0.00 0.00 36.38 35.61 2qmd s VAL 154 CO -0.05 -0.89 -0.14 -0.89 -0.31 0.00 0.00 175.10 172.82 2qmd s THR 155 N -3.91 1.24 0.02 5.32 2.01 -1.26 -4.45 115.64 114.61 2qmd s THR 155 Ca 0.07 -0.55 0.08 0.00 0.31 0.00 0.00 61.69 61.60 2qmd s THR 155 Cb 0.07 -1.12 -0.02 0.00 0.01 0.00 0.00 72.50 71.44 2qmd s THR 155 CO -0.10 0.38 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.29 2qmd s VAL 156 N 0.59 1.85 -0.24 3.82 1.01 -0.16 -4.92 120.40 122.35 2qmd s VAL 156 Ca -0.14 -1.17 -0.20 0.00 0.00 0.00 0.00 61.98 60.47 2qmd s VAL 156 Cb -0.16 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 2qmd s VAL 156 CO 0.04 0.36 0.62 -0.60 0.00 0.00 0.00 175.10 175.52 2qmd s ARG 157 N -0.96 4.14 0.12 2.72 3.52 -1.26 0.14 118.95 127.37 2qmd s ARG 157 Ca 0.09 0.54 0.03 0.00 -0.13 0.00 0.00 55.73 56.27 2qmd s ARG 157 Cb -0.09 -3.63 -0.04 0.00 -1.56 0.00 0.00 34.95 29.63 2qmd s ARG 157 CO 0.01 -0.35 -0.09 0.00 -0.81 0.00 0.00 175.30 174.06 2qmd s ALA 158 N 2.30 1.25 0.26 6.12 0.00 -0.61 -4.93 121.76 126.14 2qmd s ALA 158 Ca 0.26 -1.40 -0.30 0.00 0.00 0.00 0.00 51.96 50.53 2qmd s ALA 158 Cb -0.16 0.08 -0.09 0.00 0.00 0.00 0.00 23.12 22.95 2qmd s ALA 158 CO 0.09 -0.13 1.27 -0.80 0.00 0.00 0.00 175.76 176.19 2qmd s ASN 159 N -3.02 6.92 -0.05 0.00 0.01 -1.26 -2.04 114.94 115.50 2qmd s ASN 159 Ca 0.13 2.48 -0.00 0.00 -0.71 0.00 0.00 52.86 54.76 2qmd s ASN 159 Cb 0.03 -2.63 0.03 0.00 0.41 0.00 0.00 41.25 39.09 2qmd s ASN 159 CO -0.01 -0.46 -0.01 -0.63 -1.51 0.00 0.00 177.10 174.48 2qmd s ILE 160 N -0.55 0.32 -0.33 0.60 1.01 0.22 -4.64 121.20 117.84 2qmd s ILE 160 Ca 0.52 0.07 -0.18 0.00 0.00 0.00 0.00 60.65 61.06 2qmd s ILE 160 Cb -0.37 -0.43 -0.01 0.00 0.01 0.00 0.00 42.46 41.66 2qmd s ILE 160 CO 0.44 0.21 0.49 0.00 0.00 0.00 0.00 174.94 176.08 2qmd s ALA 161 N 1.41 3.50 -0.49 9.38 0.00 -0.50 -1.80 121.76 133.28 2qmd s ALA 161 Ca -0.04 -0.94 -0.24 0.00 0.00 0.00 0.00 51.96 50.74 2qmd s ALA 161 Cb -0.13 -2.96 0.03 0.00 0.00 0.00 0.00 23.12 20.06 2qmd s ALA 161 CO -0.03 -1.08 0.89 0.00 0.00 0.00 0.00 175.76 175.54 2qmd s ALA 162 N 2.33 3.23 -0.12 0.00 0.00 0.25 -1.28 121.76 126.17 2qmd s ALA 162 Ca 0.18 -0.99 -0.29 0.00 0.00 0.00 0.00 51.96 50.86 2qmd s ALA 162 Cb -0.16 -3.62 -0.03 0.00 0.00 0.00 0.00 23.12 19.31 2qmd s ALA 162 CO 0.12 -2.12 1.41 0.42 0.00 0.00 0.00 175.76 175.59 2qmd s ILE 163 N 3.68 4.01 -0.02 0.00 1.01 0.38 -1.07 121.20 129.19 2qmd s ILE 163 Ca 0.33 1.23 0.11 0.00 0.00 0.00 0.00 60.65 62.32 2qmd s ILE 163 Cb -0.11 -3.79 -0.17 0.00 0.01 0.00 0.00 42.46 38.40 2qmd s ILE 163 CO 0.23 -0.10 0.23 0.35 0.00 0.00 0.00 174.94 175.65 2qmd n THR 164 N 5.36 0.02 -3.81 2.92 -2.24 -0.39 -1.30 114.28 114.84 2qmd n THR 164 Ca 0.15 -0.25 -0.12 0.00 -2.27 0.00 0.00 64.05 61.56 2qmd n THR 164 Cb 0.44 0.23 -0.11 0.00 -2.10 0.00 0.00 70.33 68.79 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 -2.74 0.34 0.07 -0.78 2.02 -1.08 -4.92 118.70 111.60 2qmd s GLU 165 Ca -0.04 0.09 -0.18 0.00 0.02 0.00 0.00 54.97 54.86 2qmd s GLU 165 Cb 0.07 0.15 0.04 0.00 0.10 0.00 0.00 34.13 34.49 2qmd s GLU 165 CO 0.45 -0.06 0.43 -1.54 0.02 0.00 0.00 175.26 174.55 2qmd s SER 166 N -0.36 -0.30 -0.16 -0.19 1.04 -1.26 -0.09 113.70 112.38 2qmd s SER 166 Ca -0.05 -0.07 -0.05 0.00 0.48 0.00 0.00 55.95 56.27 2qmd s SER 166 Cb -0.03 0.45 0.06 0.00 0.10 0.00 0.00 66.02 66.60 2qmd s SER 166 CO 0.01 -0.73 0.10 -0.62 0.98 0.00 0.00 173.24 172.98 2qmd s ASP 167 N -2.25 2.13 -1.77 7.02 -1.08 -0.04 -4.86 116.67 115.83 2qmd s ASP 167 Ca -0.03 -0.51 0.00 0.00 -0.52 0.00 0.00 52.55 51.49 2qmd s ASP 167 Cb 0.00 -0.16 0.00 0.00 -1.46 0.00 0.00 42.92 41.30 2qmd s ASP 167 CO -0.05 -0.34 0.00 0.29 0.52 0.00 0.00 175.17 175.59 2qmd n LYS 168 N 5.29 -1.70 -0.04 4.34 5.02 -1.26 -1.53 118.16 128.27 2qmd n LYS 168 Ca -0.07 1.00 -0.04 0.00 -2.02 0.00 0.00 58.31 57.19 2qmd n LYS 168 Cb 0.49 -5.64 -0.01 0.00 -0.02 0.00 0.00 35.03 29.85 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 -3.82 0.20 -2.05 2.13 7.35 -1.26 -3.97 117.46 116.04 2qmd n PHE 169 Ca -0.24 0.09 -0.38 0.00 -0.76 0.00 0.00 57.45 56.16 2qmd n PHE 169 Cb 0.68 -0.36 0.01 0.00 0.35 0.00 0.00 39.48 40.16 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 -1.82 2.64 -0.19 -5.13 0.40 -1.26 -5.01 117.98 107.61 2qmd s PHE 170 Ca -0.12 1.46 -0.03 0.00 -0.60 0.00 0.00 56.93 57.64 2qmd s PHE 170 Cb 0.02 -3.58 -0.01 0.00 0.51 0.00 0.00 43.02 39.95 2qmd s PHE 170 CO 0.17 -2.12 -0.06 0.42 0.70 0.00 0.00 175.22 174.33 2qmd s ILE 171 N -1.41 3.41 0.05 0.64 1.01 -1.26 -5.06 121.20 118.59 2qmd s ILE 171 Ca 0.66 -0.50 -0.30 0.00 0.00 0.00 0.00 60.65 60.50 2qmd s ILE 171 Cb -0.34 -2.52 -0.09 0.00 0.01 0.00 0.00 42.46 39.52 2qmd s ILE 171 CO 0.42 0.46 1.90 0.21 0.00 0.00 0.00 174.94 177.93 2qmd s ASN 172 N 1.05 6.46 0.00 3.58 3.04 -1.26 -2.20 114.94 125.61 2qmd s ASN 172 Ca 0.01 2.66 0.00 0.00 0.04 0.00 0.00 52.86 55.57 2qmd s ASN 172 Cb -0.15 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 37.02 2qmd s ASN 172 CO -0.00 -1.03 0.00 0.61 -3.04 0.00 0.00 177.10 173.64 2qmd n GLY 173 N 4.42 0.67 0.24 1.21 0.00 -1.26 -4.93 105.19 105.54 2qmd n GLY 173 Ca 0.19 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.35 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 -1.79 -3.47 113.55 114.54 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 0.02 0.00 -3.20 -0.87 0.00 0.00 176.83 172.78 2qmd n ASN 175 N -3.11 -4.07 -4.60 4.97 5.15 -1.26 -4.94 115.26 107.40 2qmd n ASN 175 Ca 0.02 0.00 -0.31 0.00 -0.60 0.00 0.00 54.58 53.70 2qmd n ASN 175 Cb 0.44 -1.58 -0.10 0.00 -0.53 0.00 0.00 39.78 38.01 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 -1.64 2.83 -0.24 1.20 1.48 -1.26 -4.62 118.94 116.69 2qmd s TRP 176 Ca 0.00 -0.10 0.02 0.00 -1.06 0.00 0.00 56.10 54.96 2qmd s TRP 176 Cb 0.00 -1.51 0.02 0.00 -1.16 0.00 0.00 33.47 30.82 2qmd s TRP 176 CO 0.00 0.42 0.60 0.39 -4.06 0.00 0.00 176.95 174.30 2qmd n GLU 177 N 0.96 -0.41 -3.37 3.25 4.71 0.72 -4.87 120.64 121.63 2qmd n GLU 177 Ca -0.14 -0.70 -0.08 0.00 -0.01 0.00 0.00 57.16 56.23 2qmd n GLU 177 Cb 0.52 -1.04 0.02 0.00 -1.01 0.00 0.00 31.44 29.93 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 0.07 1.27 2.97 0.62 0.00 -1.11 -0.74 105.19 108.27 2qmd n GLY 178 Ca 0.01 -1.26 -0.17 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.30 0.50 -0.45 -0.61 2.07 0.15 -0.62 121.20 119.94 2qmd s ILE 179 Ca 0.15 -0.25 -0.03 0.00 -1.41 0.00 0.00 60.65 59.11 2qmd s ILE 179 Cb -0.04 -0.43 0.12 0.00 0.13 0.00 0.00 42.46 42.24 2qmd s ILE 179 CO 0.11 0.15 0.24 -0.22 -1.91 0.00 0.00 174.94 173.31 2qmd s LEU 180 N -0.04 5.23 -0.40 8.50 2.96 0.82 -1.25 118.68 134.50 2qmd s LEU 180 Ca 0.01 -2.19 -0.29 0.00 -0.22 0.00 0.00 54.13 51.44 2qmd s LEU 180 Cb -0.04 -1.83 0.02 0.00 0.50 0.00 0.00 46.19 44.85 2qmd s LEU 180 CO -0.00 -0.51 1.17 -0.83 -1.32 0.00 0.00 176.35 174.86 2qmd s GLY 181 N 1.59 1.36 0.00 7.98 0.00 -0.54 -1.53 107.32 116.18 2qmd s GLY 181 Ca 0.10 -0.23 0.27 0.00 0.00 0.00 0.00 44.72 44.86 2qmd s GLY 181 CO -0.04 2.44 1.60 1.04 0.00 0.00 0.00 173.10 178.13 2qmd n LEU 182 N 7.63 1.85 0.00 0.66 4.77 0.00 -4.22 117.00 127.69 2qmd n LEU 182 Ca 0.13 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.50 2qmd n LEU 182 Cb 0.48 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2qmd n LEU 182 CO 0.67 0.31 0.00 0.00 -1.33 0.00 0.00 177.39 177.04 2qmd n ALA 183 N 0.40 0.00 -2.11 -1.18 0.00 -0.22 -4.94 120.51 112.46 2qmd n ALA 183 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.32 2qmd n ALA 183 Cb 0.42 0.00 -0.00 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 -0.76 3.56 0.57 0.00 1.51 -0.60 -4.68 117.35 116.95 2qmd s TYR 184 Ca 0.00 1.03 0.27 0.00 -1.01 0.00 0.00 57.07 57.36 2qmd s TYR 184 Cb 0.00 -2.48 1.54 0.00 -0.11 0.00 0.00 41.96 40.91 2qmd s TYR 184 CO 0.00 -0.38 2.05 0.00 -1.11 0.00 0.00 175.55 176.10 2qmd h ALA 185 N 0.25 2.05 -0.70 3.71 0.00 -1.87 -2.55 119.26 120.15 2qmd h ALA 185 Ca -0.46 -0.01 0.20 0.00 0.00 0.00 0.00 54.91 54.64 2qmd h ALA 185 Cb 1.20 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 2qmd h ALA 185 CO 0.62 -0.43 0.50 1.49 0.00 0.00 0.00 179.25 181.44 2qmd h GLU 186 N 0.00 0.01 -0.46 0.00 4.81 -1.88 -0.44 114.58 116.62 2qmd h GLU 186 Ca 0.14 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2qmd h GLU 186 Cb 0.69 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.06 2qmd h GLU 186 CO -0.00 0.01 0.00 0.44 -0.73 0.00 0.00 179.01 178.73 2qmd n ILE 187 N -4.33 1.13 -2.38 2.32 -5.35 -0.96 -4.67 119.36 105.12 2qmd n ILE 187 Ca 0.14 -1.07 -0.37 0.00 -0.27 0.00 0.00 62.75 61.18 2qmd n ILE 187 Cb 0.76 0.43 -0.02 0.00 -1.74 0.00 0.00 39.64 39.07 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 -1.17 3.07 -0.00 -1.28 0.00 -0.17 -4.59 121.76 117.61 2qmd s ALA 188 Ca 0.33 0.85 -0.00 0.00 0.00 0.00 0.00 51.96 53.14 2qmd s ALA 188 Cb 0.18 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 2qmd s ALA 188 CO 0.20 -0.45 0.06 1.03 0.00 0.00 0.00 175.76 176.61 2qmd s ARG 189 N -2.51 3.00 0.48 0.00 1.81 -1.26 -2.65 118.95 117.82 2qmd s ARG 189 Ca 0.59 -0.51 0.29 0.00 -1.72 0.00 0.00 55.73 54.38 2qmd s ARG 189 Cb -0.27 -2.82 0.92 0.00 -0.45 0.00 0.00 34.95 32.34 2qmd s ARG 189 CO 0.33 0.64 1.81 -1.00 -0.68 0.00 0.00 175.30 176.40 2qmd h PRO 190 N 4.16 0.00 -2.83 3.54 0.13 -1.90 -3.47 132.00 131.64 2qmd h PRO 190 Ca -0.49 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.70 2qmd h PRO 190 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 2qmd h PRO 190 CO 0.61 0.00 0.35 0.16 -0.23 0.00 0.00 178.00 178.89 2qmd s ASP 191 N -5.77 -0.08 0.00 1.44 -4.77 -1.08 -5.03 116.67 101.38 2qmd s ASP 191 Ca 0.04 -0.85 0.10 0.00 -3.30 0.00 0.00 52.55 48.54 2qmd s ASP 191 Cb 0.08 0.71 0.59 0.00 -1.09 0.00 0.00 42.92 43.21 2qmd s ASP 191 CO 0.59 -1.39 1.04 -0.90 0.70 0.00 0.00 175.17 175.21 2qmd n ASP 192 N -1.05 0.00 0.01 2.11 5.68 -1.25 -2.10 116.55 119.94 2qmd n ASP 192 Ca -0.06 -0.31 0.13 0.00 -0.50 0.00 0.00 54.79 54.05 2qmd n ASP 192 Cb 0.60 0.00 0.50 0.00 -1.14 0.00 0.00 41.12 41.08 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 -1.00 0.19 -4.43 -1.12 3.41 -1.26 -4.57 113.62 104.84 2qmd n SER 193 Ca 0.07 0.29 -0.44 0.00 -0.26 0.00 0.00 58.87 58.54 2qmd n SER 193 Cb 0.03 -0.29 -0.04 0.00 -0.26 0.00 0.00 64.21 63.65 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 -3.10 4.79 0.06 1.04 2.96 -0.89 -4.99 118.68 118.54 2qmd s LEU 194 Ca 0.13 -1.26 -0.32 0.00 -0.22 0.00 0.00 54.13 52.45 2qmd s LEU 194 Cb 0.18 -2.38 -0.11 0.00 0.50 0.00 0.00 46.19 44.38 2qmd s LEU 194 CO 0.58 -1.29 1.83 1.21 -1.32 0.00 0.00 176.35 177.36 2qmd n GLU 195 N 7.13 2.54 -1.51 1.98 2.13 -1.26 -4.88 120.64 126.77 2qmd n GLU 195 Ca -0.02 0.92 -0.33 0.00 0.66 0.00 0.00 57.16 58.39 2qmd n GLU 195 Cb 0.45 -2.80 0.08 0.00 0.27 0.00 0.00 31.44 29.44 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 3.09 2.36 0.20 5.31 0.02 -1.26 -4.53 135.00 140.19 2qmd s PRO 196 Ca 0.86 1.51 -0.12 0.00 0.02 0.00 0.00 61.00 63.27 2qmd s PRO 196 Cb -0.56 -1.89 0.24 0.00 0.02 0.00 0.00 34.50 32.31 2qmd s PRO 196 CO 0.42 -1.61 1.69 0.35 -0.33 0.00 0.00 177.00 177.52 2qmd h PHE 197 N -0.35 0.09 0.00 6.54 3.57 -1.82 -2.01 116.94 122.96 2qmd h PHE 197 Ca -0.46 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 60.98 2qmd h PHE 197 Cb 1.26 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 2qmd h PHE 197 CO 0.52 -0.07 -0.42 0.35 -2.23 0.00 0.00 178.31 176.46 2qmd h PHE 198 N 0.19 0.00 -0.59 0.41 3.57 -1.92 0.25 116.94 118.84 2qmd h PHE 198 Ca 0.28 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.69 2qmd h PHE 198 Cb 0.42 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 2qmd h PHE 198 CO -0.28 0.42 0.01 -0.44 -2.23 0.00 0.00 178.31 175.79 2qmd h ASP 199 N 0.00 1.02 -0.60 0.41 3.32 -1.77 -1.51 116.42 117.30 2qmd h ASP 199 Ca -0.00 -0.30 -0.08 0.00 0.02 0.00 0.00 57.03 56.66 2qmd h ASP 199 Cb 0.76 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 2qmd h ASP 199 CO 0.05 1.07 0.04 0.28 -1.72 0.00 0.00 179.24 178.97 2qmd h SER 200 N 0.94 0.99 -0.04 6.45 0.02 -0.64 -1.38 113.55 119.90 2qmd h SER 200 Ca 0.17 -0.29 0.02 0.00 -0.84 0.00 0.00 61.79 60.86 2qmd h SER 200 Cb 0.54 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.79 2qmd h SER 200 CO 0.03 1.03 -0.10 0.25 -1.14 0.00 0.00 176.83 176.90 2qmd h LEU 201 N 0.92 -0.31 -0.68 5.07 5.85 -0.70 -0.57 115.31 124.89 2qmd h LEU 201 Ca 0.17 0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.83 2qmd h LEU 201 Cb 0.50 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 2qmd h LEU 201 CO 0.02 -0.15 -0.25 0.58 -0.34 0.00 0.00 178.44 178.30 2qmd h VAL 202 N -0.16 1.27 -0.18 1.05 2.07 -1.19 -2.03 116.25 117.09 2qmd h VAL 202 Ca 0.05 -1.37 -0.13 0.00 0.82 0.00 0.00 66.70 66.07 2qmd h VAL 202 Cb 0.23 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 2qmd h VAL 202 CO -0.13 0.45 -0.45 0.50 0.02 0.00 0.00 177.57 177.96 2qmd h LYS 203 N 0.65 0.43 0.00 1.57 3.64 -1.02 -3.24 116.57 118.61 2qmd h LYS 203 Ca 0.09 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2qmd h LYS 203 Cb 0.76 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 2qmd h LYS 203 CO 0.06 0.80 -0.64 1.04 -2.27 0.00 0.00 179.45 178.44 2qmd n GLN 204 N -4.00 0.11 -2.68 1.90 6.02 -0.24 -4.97 117.38 113.52 2qmd n GLN 204 Ca -0.02 0.02 -0.07 0.00 -0.01 0.00 0.00 57.00 56.92 2qmd n GLN 204 Cb 0.53 -1.55 -0.02 0.00 1.02 0.00 0.00 30.24 30.21 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 -1.71 0.00 -0.10 5.09 -2.24 -0.77 -5.04 114.28 109.51 2qmd n THR 205 Ca 0.04 -0.70 0.12 0.00 -2.27 0.00 0.00 64.05 61.24 2qmd n THR 205 Cb 0.37 0.29 0.29 0.00 -2.10 0.00 0.00 70.33 69.18 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 -0.23 0.81 -1.69 4.78 8.25 -1.26 -4.79 115.22 121.09 2qmd n HIS 206 Ca -0.00 -0.40 -0.44 0.00 -0.26 0.00 0.00 57.72 56.61 2qmd n HIS 206 Cb 0.18 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.25 2qmd n HIS 206 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2qmd n VAL 207 N 1.60 0.14 -1.68 1.59 0.31 -1.26 -4.91 118.33 114.12 2qmd n VAL 207 Ca 0.23 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 64.13 2qmd n VAL 207 Cb 0.62 -1.83 0.02 0.00 -0.91 0.00 0.00 33.84 31.73 2qmd n VAL 207 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2qmd n PRO 208 N 4.40 1.71 -1.72 5.55 -0.02 -1.26 -4.70 135.00 138.96 2qmd n PRO 208 Ca 0.17 0.61 -0.42 0.00 -2.02 0.00 0.00 63.50 61.85 2qmd n PRO 208 Cb 0.32 -2.31 -0.01 0.00 -0.02 0.00 0.00 33.50 31.48 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 0.10 3.70 -3.61 2.55 5.15 -1.26 -4.26 115.26 117.64 2qmd n ASN 209 Ca 0.08 -2.81 -0.11 0.00 -0.60 0.00 0.00 54.58 51.14 2qmd n ASN 209 Cb 0.40 -1.57 -0.06 0.00 -0.53 0.00 0.00 39.78 38.02 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 2.48 -0.48 0.05 1.20 0.20 -1.26 -1.38 118.68 119.48 2qmd s LEU 210 Ca 0.50 0.78 -0.06 0.00 0.69 0.00 0.00 54.13 56.04 2qmd s LEU 210 Cb 0.13 2.01 -0.01 0.00 -0.43 0.00 0.00 46.19 47.89 2qmd s LEU 210 CO -0.02 -0.27 0.11 0.72 -0.29 0.00 0.00 176.35 176.60 2qmd s PHE 211 N -0.31 0.20 0.02 5.38 -0.71 -1.02 0.25 117.98 121.78 2qmd s PHE 211 Ca -0.00 -0.53 0.03 0.00 -1.04 0.00 0.00 56.93 55.39 2qmd s PHE 211 Cb -0.03 -0.14 -0.01 0.00 -1.21 0.00 0.00 43.02 41.63 2qmd s PHE 211 CO -0.01 -0.40 -0.09 -1.54 -1.34 0.00 0.00 175.22 171.84 2qmd s SER 212 N -2.27 1.07 -0.11 1.98 1.04 -0.23 -0.24 113.70 114.93 2qmd s SER 212 Ca -0.03 -0.31 0.03 0.00 0.48 0.00 0.00 55.95 56.13 2qmd s SER 212 Cb 0.00 -0.07 0.00 0.00 0.10 0.00 0.00 66.02 66.06 2qmd s SER 212 CO -0.06 0.01 -0.22 -0.76 0.98 0.00 0.00 173.24 173.19 2qmd s LEU 213 N -0.72 2.04 -0.33 2.42 1.43 0.22 -0.76 118.68 122.98 2qmd s LEU 213 Ca -0.00 -0.55 0.02 0.00 -1.03 0.00 0.00 54.13 52.57 2qmd s LEU 213 Cb -0.06 -1.36 0.09 0.00 0.03 0.00 0.00 46.19 44.89 2qmd s LEU 213 CO 0.00 0.12 0.04 -1.58 0.23 0.00 0.00 176.35 175.17 2qmd s GLN 214 N 0.51 1.84 -0.21 1.70 0.74 0.03 -1.20 119.66 123.06 2qmd s GLN 214 Ca -0.15 -1.69 -0.12 0.00 0.05 0.00 0.00 55.36 53.44 2qmd s GLN 214 Cb -0.17 -3.22 -0.05 0.00 1.10 0.00 0.00 33.01 30.67 2qmd s GLN 214 CO 0.05 -0.86 0.24 -0.51 -0.55 0.00 0.00 175.29 173.67 2qmd s LEU 215 N 1.03 4.15 -0.39 3.68 1.43 -1.26 -0.76 118.68 126.56 2qmd s LEU 215 Ca 0.05 0.29 -0.06 0.00 -1.03 0.00 0.00 54.13 53.37 2qmd s LEU 215 Cb -0.20 -2.25 0.08 0.00 0.03 0.00 0.00 46.19 43.85 2qmd s LEU 215 CO -0.06 0.04 0.20 0.00 0.23 0.00 0.00 176.35 176.76 2qmd s GLY 217 N 1.88 3.06 0.39 0.00 0.00 -1.26 -4.77 107.32 106.62 2qmd s GLY 217 Ca 0.03 0.73 0.21 0.00 0.00 0.00 0.00 44.72 45.69 2qmd s GLY 217 CO -0.00 1.30 1.63 0.00 0.00 0.00 0.00 173.10 176.03 2qmd h ALA 218 N 3.85 0.89 0.00 3.20 0.00 -1.94 -3.43 119.26 121.83 2qmd h ALA 218 Ca -0.46 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2qmd h ALA 218 Cb 1.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2qmd h ALA 218 CO 0.67 0.29 0.00 0.41 0.00 0.00 0.00 179.25 180.62 2qmd n GLY 219 N 0.84 1.09 3.48 0.00 0.00 -1.26 -5.00 105.19 104.34 2qmd n GLY 219 Ca 0.02 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 -2.88 0.14 0.32 1.61 -0.71 -1.26 -4.86 117.98 110.34 2qmd s PHE 220 Ca 0.00 -0.50 -0.29 0.00 -1.04 0.00 0.00 56.93 55.10 2qmd s PHE 220 Cb 0.00 0.21 -0.10 0.00 -1.21 0.00 0.00 43.02 41.92 2qmd s PHE 220 CO 0.00 -0.87 1.40 -2.14 -1.34 0.00 0.00 175.22 172.26 2qmd s PRO 221 N -3.93 4.26 -0.20 1.99 0.02 -1.26 -4.90 135.00 130.98 2qmd s PRO 221 Ca 0.14 2.34 -0.03 0.00 0.02 0.00 0.00 61.00 63.48 2qmd s PRO 221 Cb 0.00 -3.05 -0.01 0.00 0.02 0.00 0.00 34.50 31.46 2qmd s PRO 221 CO 0.01 -0.35 -0.06 -0.51 -0.33 0.00 0.00 177.00 175.75 2qmd s LEU 222 N -1.45 2.87 0.00 -5.54 1.43 -1.26 -5.07 118.68 109.66 2qmd s LEU 222 Ca 0.53 -0.36 -0.14 0.00 -1.03 0.00 0.00 54.13 53.13 2qmd s LEU 222 Cb -0.42 -1.71 0.20 0.00 0.03 0.00 0.00 46.19 44.29 2qmd s LEU 222 CO 0.53 0.03 0.93 -0.46 0.23 0.00 0.00 176.35 177.61 2qmd n ASN 223 N 4.43 -0.79 -0.24 2.29 0.23 -1.26 -4.60 115.26 115.32 2qmd n ASN 223 Ca -0.18 -1.20 0.03 0.00 -0.53 0.00 0.00 54.58 52.69 2qmd n ASN 223 Cb 0.51 -0.77 0.15 0.00 -2.08 0.00 0.00 39.78 37.60 2qmd n ASN 223 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 2qmd h GLN 224 N 0.00 0.44 0.03 -3.83 4.15 -1.99 -1.16 115.11 112.75 2qmd h GLN 224 Ca -0.32 -0.03 -0.24 0.00 0.77 0.00 0.00 58.65 58.83 2qmd h GLN 224 Cb 0.92 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.49 2qmd h GLN 224 CO 0.22 0.29 -1.17 0.66 -1.93 0.00 0.00 178.83 176.90 2qmd h SER 225 N 0.45 0.12 -0.58 -0.69 4.64 -2.00 -3.28 113.55 112.21 2qmd h SER 225 Ca 0.37 -0.13 -0.10 0.00 -0.47 0.00 0.00 61.79 61.46 2qmd h SER 225 Cb 0.50 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.53 2qmd h SER 225 CO -0.35 1.11 -0.01 -0.33 -0.87 0.00 0.00 176.83 176.37 2qmd h GLU 226 N 0.02 1.03 0.00 4.77 5.08 -1.80 -2.53 114.58 121.15 2qmd h GLU 226 Ca -0.08 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2qmd h GLU 226 Cb 1.86 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 31.02 2qmd h GLU 226 CO 0.14 1.02 0.00 -0.24 -1.00 0.00 0.00 179.01 178.93 2qmd h VAL 227 N 0.92 0.00 0.00 3.13 3.04 -1.32 -0.36 116.25 121.66 2qmd h VAL 227 Ca 0.16 -0.53 -0.15 0.00 -1.01 0.00 0.00 66.70 65.17 2qmd h VAL 227 Cb 0.57 1.50 -0.02 0.00 -2.01 0.00 0.00 31.29 31.33 2qmd h VAL 227 CO 0.03 0.00 -0.79 -0.07 -1.01 0.00 0.00 177.57 175.73 2qmd h LEU 228 N 0.00 0.00 -0.30 3.16 3.38 -1.52 -3.33 115.31 116.70 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 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2qmd h LEU 228 CO 0.00 0.70 -0.84 0.00 0.09 0.00 0.00 178.44 178.39 2qmd n ALA 229 N -2.29 4.40 -2.21 1.53 0.00 -0.85 -4.97 120.51 116.11 2qmd n ALA 229 Ca -0.00 -0.61 -0.38 0.00 0.00 0.00 0.00 53.44 52.45 2qmd n ALA 229 Cb 0.83 -0.77 -0.06 0.00 0.00 0.00 0.00 19.45 19.44 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 -2.84 7.08 -0.17 0.00 0.15 -0.20 -5.04 113.70 112.67 2qmd s SER 230 Ca 0.11 1.32 -0.29 0.00 0.70 0.00 0.00 55.95 57.79 2qmd s SER 230 Cb 0.17 -2.38 -0.01 0.00 -1.71 0.00 0.00 66.02 62.09 2qmd s SER 230 CO 0.78 0.20 1.16 -0.69 1.20 0.00 0.00 173.24 175.88 2qmd s VAL 231 N -1.24 4.46 -1.45 4.45 1.01 -1.26 -4.68 120.40 121.69 2qmd s VAL 231 Ca 0.34 1.76 0.24 0.00 0.00 0.00 0.00 61.98 64.32 2qmd s VAL 231 Cb -0.19 -4.14 0.01 0.00 0.00 0.00 0.00 36.38 32.06 2qmd s VAL 231 CO 0.20 -0.13 1.24 0.61 0.00 0.00 0.00 175.10 177.03 2qmd n GLY 232 N 3.44 -0.70 0.00 4.51 0.00 0.95 -4.92 105.19 108.47 2qmd n GLY 232 Ca 0.13 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 1.44 0.19 2.90 -0.02 0.00 -1.15 -0.40 105.19 108.15 2qmd n GLY 233 Ca 0.08 -1.58 -0.15 0.00 0.00 0.00 0.00 46.02 44.36 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 0.43 -0.28 1.61 0.01 0.07 -1.46 113.70 110.09 2qmd s SER 234 Ca 0.00 -0.06 0.02 0.00 1.31 0.00 0.00 55.95 57.22 2qmd s SER 234 Cb 0.00 -0.11 0.06 0.00 0.21 0.00 0.00 66.02 66.18 2qmd s SER 234 CO 0.00 0.00 -0.07 -0.32 0.41 0.00 0.00 173.24 173.26 2qmd s MET 235 N 0.24 2.20 -0.37 12.44 0.00 -1.26 -0.79 119.30 131.76 2qmd s MET 235 Ca -0.02 -1.39 -0.16 0.00 0.00 0.00 0.00 55.69 54.12 2qmd s MET 235 Cb -0.05 -2.98 0.00 0.00 0.00 0.00 0.00 34.83 31.80 2qmd s MET 235 CO -0.01 -0.62 0.38 0.42 0.00 0.00 0.00 175.02 175.20 2qmd s ILE 236 N 1.11 5.15 -0.32 10.11 -1.09 0.06 -4.84 121.20 131.39 2qmd s ILE 236 Ca -0.06 -0.12 -0.18 0.00 -2.23 0.00 0.00 60.65 58.06 2qmd s ILE 236 Cb -0.20 -3.90 -0.01 0.00 -1.58 0.00 0.00 42.46 36.77 2qmd s ILE 236 CO -0.05 -0.21 0.51 -0.63 -1.23 0.00 0.00 174.94 173.33 2qmd s ILE 237 N 2.04 5.04 0.00 2.92 1.01 -1.26 -1.07 121.20 129.88 2qmd s ILE 237 Ca 0.11 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.30 2qmd s ILE 237 Cb -0.17 -3.90 0.00 0.00 0.01 0.00 0.00 42.46 38.40 2qmd s ILE 237 CO 0.12 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.58 2qmd n GLY 238 N 4.66 0.79 0.95 6.18 0.00 0.14 -4.80 105.19 113.11 2qmd n GLY 238 Ca -0.05 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.39 0.84 3.04 -0.02 0.00 -1.24 -4.40 105.19 101.02 2qmd n GLY 239 Ca 0.00 -0.93 -0.28 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.29 1.47 -0.30 -0.61 1.01 -1.26 -4.03 121.20 115.19 2qmd s ILE 240 Ca 0.06 -0.62 -0.10 0.00 0.00 0.00 0.00 60.65 60.00 2qmd s ILE 240 Cb -0.00 -1.35 -0.02 0.00 0.01 0.00 0.00 42.46 41.10 2qmd s ILE 240 CO 0.01 0.44 0.15 -0.62 0.00 0.00 0.00 174.94 174.91 2qmd s ASP 241 N 1.04 5.61 0.21 3.58 3.68 -1.26 -4.36 116.67 125.17 2qmd s ASP 241 Ca -0.06 -0.38 0.19 0.00 2.13 0.00 0.00 52.55 54.44 2qmd s ASP 241 Cb -0.15 -2.02 0.88 0.00 -1.45 0.00 0.00 42.92 40.18 2qmd s ASP 241 CO -0.02 -0.15 1.58 1.41 0.13 0.00 0.00 175.17 178.12 2qmd n HIS 242 N 5.00 0.58 0.74 -5.34 8.25 -0.56 -2.41 115.22 121.48 2qmd n HIS 242 Ca -0.14 0.25 0.13 0.00 -0.26 0.00 0.00 57.72 57.70 2qmd n HIS 242 Cb 0.50 -0.91 0.49 0.00 1.12 0.00 0.00 29.99 31.19 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 -2.05 0.43 -0.17 0.41 3.41 -1.26 -3.56 113.62 110.84 2qmd n SER 243 Ca 0.01 0.55 0.14 0.00 -0.26 0.00 0.00 58.87 59.31 2qmd n SER 243 Cb 0.14 -0.66 0.57 0.00 -0.26 0.00 0.00 64.21 64.00 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 -1.92 0.65 -3.98 1.04 4.77 -1.01 -4.81 117.00 111.73 2qmd n LEU 244 Ca 0.06 -0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 55.85 2qmd n LEU 244 Cb 0.36 -0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 41.23 2qmd n LEU 244 CO 0.27 0.12 -0.06 -0.72 -1.33 0.00 0.00 177.39 175.67 2qmd s TYR 245 N -2.42 0.45 0.16 -1.77 1.13 -1.23 -1.56 117.35 112.11 2qmd s TYR 245 Ca 0.30 -0.82 0.09 0.00 -1.41 0.00 0.00 57.07 55.23 2qmd s TYR 245 Cb 0.20 -0.11 -0.04 0.00 -1.10 0.00 0.00 41.96 40.91 2qmd s TYR 245 CO 0.47 -0.69 -0.21 0.95 -2.51 0.00 0.00 175.55 173.56 2qmd s THR 246 N -3.98 1.97 0.00 -3.49 -4.23 -0.63 -4.79 115.64 100.50 2qmd s THR 246 Ca 0.18 -1.86 0.00 0.00 -1.18 0.00 0.00 61.69 58.82 2qmd s THR 246 Cb 0.04 -1.87 0.00 0.00 1.34 0.00 0.00 72.50 72.01 2qmd s THR 246 CO -0.00 -0.19 0.00 0.61 -0.54 0.00 0.00 174.62 174.50 2qmd n GLY 247 N 0.48 -0.80 3.92 3.99 0.00 -1.26 -3.63 105.19 107.88 2qmd n GLY 247 Ca -0.15 -1.17 -0.31 0.00 0.00 0.00 0.00 46.02 44.40 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 -0.03 1.61 0.01 -1.26 -4.96 113.70 111.44 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 -1.98 -0.04 0.00 0.21 0.00 0.00 66.02 64.22 2qmd s SER 248 CO 0.00 0.16 0.78 -0.76 0.41 0.00 0.00 173.24 173.83 2qmd s LEU 249 N -2.50 4.35 -0.09 2.44 1.43 -1.26 -4.51 118.68 118.54 2qmd s LEU 249 Ca 0.35 1.35 0.02 0.00 -1.03 0.00 0.00 54.13 54.83 2qmd s LEU 249 Cb -0.13 -3.23 -0.02 0.00 0.03 0.00 0.00 46.19 42.84 2qmd s LEU 249 CO 0.27 -0.13 -0.16 0.26 0.23 0.00 0.00 176.35 176.83 2qmd s TRP 250 N 0.70 2.71 -0.09 0.29 0.52 -0.35 -4.91 118.94 117.82 2qmd s TRP 250 Ca 0.41 -0.52 -0.01 0.00 0.02 0.00 0.00 56.10 56.01 2qmd s TRP 250 Cb -0.19 -1.73 -0.03 0.00 -1.15 0.00 0.00 33.47 30.37 2qmd s TRP 250 CO 0.21 -0.09 -0.04 0.71 0.02 0.00 0.00 176.95 177.76 2qmd s TYR 251 N -0.08 3.02 0.00 -1.98 1.51 -1.26 -0.43 117.35 118.13 2qmd s TYR 251 Ca -0.03 0.02 0.07 0.00 -1.01 0.00 0.00 57.07 56.13 2qmd s TYR 251 Cb -0.14 -1.77 -0.03 0.00 -0.11 0.00 0.00 41.96 39.91 2qmd s TYR 251 CO 0.04 0.32 -0.22 -0.08 -1.11 0.00 0.00 175.55 174.49 2qmd s THR 252 N -0.64 2.43 0.41 -0.71 -1.32 -0.07 -3.34 115.64 112.40 2qmd s THR 252 Ca 0.10 -1.11 -0.26 0.00 -1.21 0.00 0.00 61.69 59.21 2qmd s THR 252 Cb -0.12 -1.93 -0.09 0.00 -1.51 0.00 0.00 72.50 68.86 2qmd s THR 252 CO 0.02 0.49 1.33 -2.84 -2.21 0.00 0.00 174.62 171.40 2qmd s PRO 253 N -0.95 3.94 -0.35 7.08 0.02 -1.26 -0.47 135.00 143.02 2qmd s PRO 253 Ca 0.12 2.22 -0.28 0.00 0.02 0.00 0.00 61.00 63.07 2qmd s PRO 253 Cb -0.10 -2.76 0.02 0.00 0.02 0.00 0.00 34.50 31.67 2qmd s PRO 253 CO 0.01 -0.53 1.05 0.42 -0.33 0.00 0.00 177.00 177.62 2qmd s ILE 254 N -1.24 4.48 0.21 2.83 1.01 -0.44 -4.57 121.20 123.47 2qmd s ILE 254 Ca 0.57 1.53 -0.09 0.00 0.00 0.00 0.00 60.65 62.66 2qmd s ILE 254 Cb -0.39 -4.42 0.15 0.00 0.01 0.00 0.00 42.46 37.80 2qmd s ILE 254 CO 0.51 -0.57 1.81 -0.09 0.00 0.00 0.00 174.94 176.59 2qmd h ARG 255 N 8.35 1.08 -2.47 2.79 2.43 -1.13 -3.45 114.38 121.98 2qmd h ARG 255 Ca -0.21 -0.15 -0.09 0.00 -0.81 0.00 0.00 59.98 58.72 2qmd h ARG 255 Cb 1.06 -0.20 -0.23 0.00 -0.42 0.00 0.00 29.97 30.18 2qmd h ARG 255 CO 1.03 0.82 -0.12 0.50 -1.51 0.00 0.00 179.97 180.70 2qmd s ARG 256 N -5.76 0.59 -1.10 0.20 3.52 -1.26 -5.08 118.95 110.06 2qmd s ARG 256 Ca -0.13 0.75 -0.18 0.00 -0.13 0.00 0.00 55.73 56.04 2qmd s ARG 256 Cb 0.15 0.27 0.12 0.00 -1.56 0.00 0.00 34.95 33.93 2qmd s ARG 256 CO 0.81 -0.08 1.39 -1.21 -0.81 0.00 0.00 175.30 175.40 2qmd s GLU 257 N 0.41 3.83 0.00 5.12 2.02 -1.26 -3.99 118.70 124.83 2qmd s GLU 257 Ca -0.01 -1.96 0.00 0.00 0.02 0.00 0.00 54.97 53.01 2qmd s GLU 257 Cb -0.04 -5.15 0.00 0.00 0.10 0.00 0.00 34.13 29.04 2qmd s GLU 257 CO -0.01 -1.93 0.00 -2.67 0.02 0.00 0.00 175.26 170.67 2qmd n TRP 258 N 6.96 0.00 -2.16 1.61 4.27 -1.26 -4.60 117.44 122.25 2qmd n TRP 258 Ca 0.34 0.00 -0.27 0.00 -3.89 0.00 0.00 57.50 53.68 2qmd n TRP 258 Cb 0.47 0.00 0.14 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 1.87 -1.09 -2.67 2.02 -1.26 -1.55 117.35 114.67 2qmd s TYR 259 Ca 0.00 0.19 -0.19 0.00 -0.37 0.00 0.00 57.07 56.69 2qmd s TYR 259 Cb 0.00 -3.61 0.10 0.00 -0.40 0.00 0.00 41.96 38.04 2qmd s TYR 259 CO 0.00 -2.14 1.42 0.71 -1.57 0.00 0.00 175.55 173.97 2qmd s TYR 260 N -3.56 2.91 -0.01 2.71 1.51 -1.26 -4.84 117.35 114.82 2qmd s TYR 260 Ca 0.69 -1.38 -0.23 0.00 -1.01 0.00 0.00 57.07 55.14 2qmd s TYR 260 Cb -0.06 -4.53 -0.05 0.00 -0.11 0.00 0.00 41.96 37.21 2qmd s TYR 260 CO 0.49 -1.69 0.67 -2.00 -1.11 0.00 0.00 175.55 171.91 2qmd s GLU 261 N 3.60 4.41 0.31 -0.62 2.12 -1.26 -1.87 118.70 125.39 2qmd s GLU 261 Ca 0.43 0.87 0.03 0.00 0.36 0.00 0.00 54.97 56.66 2qmd s GLU 261 Cb -0.01 -3.38 -0.05 0.00 0.26 0.00 0.00 34.13 30.96 2qmd s GLU 261 CO -0.04 0.26 0.10 0.14 -0.54 0.00 0.00 175.26 175.18 2qmd s VAL 262 N 0.11 0.75 -0.16 3.70 -7.23 -0.38 -0.52 120.40 116.66 2qmd s VAL 262 Ca 0.35 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.52 2qmd s VAL 262 Cb -0.19 -2.63 0.02 0.00 0.56 0.00 0.00 36.38 34.15 2qmd s VAL 262 CO 0.19 0.00 -0.15 -0.63 -0.31 0.00 0.00 175.10 174.20 2qmd s ILE 263 N -3.49 1.67 -0.16 -0.62 1.01 -1.26 -4.01 121.20 114.34 2qmd s ILE 263 Ca 0.35 -0.70 -0.18 0.00 0.00 0.00 0.00 60.65 60.12 2qmd s ILE 263 Cb 0.07 -1.56 -0.04 0.00 0.01 0.00 0.00 42.46 40.94 2qmd s ILE 263 CO 0.15 0.47 0.49 -0.63 0.00 0.00 0.00 174.94 175.42 2qmd s ILE 264 N 1.45 5.15 -0.54 2.92 1.01 -1.26 -2.05 121.20 127.88 2qmd s ILE 264 Ca 0.05 0.93 0.12 0.00 0.00 0.00 0.00 60.65 61.76 2qmd s ILE 264 Cb -0.13 -3.82 -0.14 0.00 0.01 0.00 0.00 42.46 38.38 2qmd s ILE 264 CO -0.11 0.25 0.50 1.33 0.00 0.00 0.00 174.94 176.92 2qmd n VAL 265 N 4.11 0.00 -3.60 2.92 0.24 0.68 -4.75 118.33 117.93 2qmd n VAL 265 Ca -0.06 -0.22 -0.13 0.00 -2.04 0.00 0.00 64.34 61.90 2qmd n VAL 265 Cb 0.51 0.95 -0.06 0.00 -1.47 0.00 0.00 33.84 33.76 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 -2.21 0.74 -0.04 7.34 3.52 -1.23 -4.78 118.95 122.28 2qmd s ARG 266 Ca 0.04 0.56 0.03 0.00 -0.13 0.00 0.00 55.73 56.22 2qmd s ARG 266 Cb 0.09 0.36 0.01 0.00 -1.56 0.00 0.00 34.95 33.84 2qmd s ARG 266 CO 0.50 -0.15 -0.11 0.08 -0.81 0.00 0.00 175.30 174.81 2qmd s VAL 267 N -0.29 1.02 0.04 7.11 1.01 -1.26 -0.72 120.40 127.30 2qmd s VAL 267 Ca -0.02 -0.45 0.06 0.00 0.00 0.00 0.00 61.98 61.57 2qmd s VAL 267 Cb -0.03 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 2qmd s VAL 267 CO 0.01 0.32 -0.16 -1.61 0.00 0.00 0.00 175.10 173.65 2qmd s GLU 268 N 0.39 1.12 -0.24 2.72 2.02 -0.37 -0.84 118.70 123.50 2qmd s GLU 268 Ca -0.08 -0.80 0.02 0.00 0.02 0.00 0.00 54.97 54.13 2qmd s GLU 268 Cb -0.12 -1.16 0.05 0.00 0.10 0.00 0.00 34.13 32.99 2qmd s GLU 268 CO 0.02 0.30 -0.12 0.42 0.02 0.00 0.00 175.26 175.89 2qmd s ILE 269 N -0.78 2.23 -1.52 -1.63 -1.09 -0.37 -0.92 121.20 117.12 2qmd s ILE 269 Ca 0.04 -1.43 -0.11 0.00 -2.23 0.00 0.00 60.65 56.91 2qmd s ILE 269 Cb -0.08 -2.22 0.08 0.00 -1.58 0.00 0.00 42.46 38.66 2qmd s ILE 269 CO 0.01 0.11 0.84 0.59 -1.23 0.00 0.00 174.94 175.26 2qmd n ASN 270 N 4.50 -3.48 0.00 3.58 3.02 0.28 -1.24 115.26 121.92 2qmd n ASN 270 Ca -0.16 -0.86 0.00 0.00 -0.03 0.00 0.00 54.58 53.54 2qmd n ASN 270 Cb 0.44 -3.59 0.00 0.00 -0.61 0.00 0.00 39.78 36.02 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 -1.65 2.87 3.65 7.41 0.00 -1.26 -4.98 105.19 111.23 2qmd n GLY 271 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 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 4.19 0.17 1.61 0.74 -0.38 -4.98 119.66 121.01 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 -3.60 -0.11 0.00 1.10 0.00 0.00 33.01 30.40 2qmd s GLN 272 CO 0.00 -0.30 1.77 0.34 -0.55 0.00 0.00 175.29 176.55 2qmd s ASP 273 N 1.27 6.40 0.38 6.67 2.15 -1.26 -1.24 116.67 131.04 2qmd s ASP 273 Ca 0.29 2.82 0.28 0.00 0.43 0.00 0.00 52.55 56.37 2qmd s ASP 273 Cb -0.16 -2.59 1.17 0.00 -0.30 0.00 0.00 42.92 41.04 2qmd s ASP 273 CO 0.10 -0.98 1.83 0.25 -0.17 0.00 0.00 175.17 176.20 2qmd h LEU 274 N 7.59 0.00 -0.40 -1.34 5.85 -1.36 -3.47 115.31 122.19 2qmd h LEU 274 Ca -0.44 0.00 -0.45 0.00 0.84 0.00 0.00 57.88 57.83 2qmd h LEU 274 Cb 1.21 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.18 2qmd h LEU 274 CO 0.95 0.00 -0.70 1.17 -0.34 0.00 0.00 178.44 179.53 2qmd n LYS 275 N -2.60 -4.67 -3.67 1.25 4.81 -1.26 -5.01 118.16 107.00 2qmd n LYS 275 Ca 0.01 0.57 -0.23 0.00 -0.87 0.00 0.00 58.31 57.80 2qmd n LYS 275 Cb 0.25 -5.40 -0.02 0.00 0.02 0.00 0.00 35.03 29.89 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 -6.41 3.47 0.11 1.64 -1.94 -1.26 -5.03 119.30 109.88 2qmd s MET 276 Ca 0.57 -0.53 -0.32 0.00 -1.71 0.00 0.00 55.69 53.71 2qmd s MET 276 Cb -0.29 -2.78 -0.11 0.00 2.01 0.00 0.00 34.83 33.66 2qmd s MET 276 CO 0.71 0.30 1.82 -3.47 -0.01 0.00 0.00 175.02 174.36 2qmd n ASP 277 N -1.54 3.90 0.16 3.03 -0.08 -1.26 -4.81 116.55 115.96 2qmd n ASP 277 Ca -0.07 1.00 0.11 0.00 -1.51 0.00 0.00 54.79 54.32 2qmd n ASP 277 Cb 0.56 -1.52 0.59 0.00 2.34 0.00 0.00 41.12 43.09 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 -0.11 0.00 3.64 -1.78 -2.50 116.57 115.82 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 0.02 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2qmd h LYS 279 CO 0.00 0.32 -0.12 0.93 -2.27 0.00 0.00 179.45 178.32 2qmd h GLU 280 N 0.00 0.16 0.00 1.90 4.39 -1.21 -2.21 114.58 117.61 2qmd h GLU 280 Ca -0.00 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2qmd h GLU 280 Cb 0.73 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 2qmd h GLU 280 CO 0.04 0.29 0.00 1.88 -1.16 0.00 0.00 179.01 180.06 2qmd h TYR 281 N 0.15 0.00 0.00 4.33 0.99 -1.59 -3.09 116.97 117.77 2qmd h TYR 281 Ca 0.03 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.75 2qmd h TYR 281 Cb 0.31 0.00 -0.04 0.00 1.00 0.00 0.00 36.73 38.00 2qmd h TYR 281 CO 0.00 0.00 -0.40 0.09 -0.00 0.00 0.00 178.16 177.85 2qmd n ASN 282 N -3.04 1.75 -4.50 3.88 3.02 -0.86 -4.44 115.26 111.06 2qmd n ASN 282 Ca 0.01 -3.39 -0.43 0.00 -0.03 0.00 0.00 54.58 50.74 2qmd n ASN 282 Cb 0.29 -0.46 -0.08 0.00 -0.61 0.00 0.00 39.78 38.92 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 -2.66 3.16 -2.65 3.10 5.04 -1.03 -0.64 117.35 121.67 2qmd s TYR 283 Ca 0.34 -0.22 0.24 0.00 -2.44 0.00 0.00 57.07 54.98 2qmd s TYR 283 Cb 0.33 -2.94 0.44 0.00 0.35 0.00 0.00 41.96 40.13 2qmd s TYR 283 CO -0.05 -0.68 1.40 -0.40 -1.34 0.00 0.00 175.55 174.49 2qmd n ASP 284 N 5.69 2.89 -3.60 4.32 3.85 -1.26 -3.56 116.55 124.88 2qmd n ASP 284 Ca -0.06 -1.92 -0.04 0.00 -0.71 0.00 0.00 54.79 52.06 2qmd n ASP 284 Cb 0.48 -0.12 -0.02 0.00 -1.35 0.00 0.00 41.12 40.12 2qmd n ASP 284 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.20 174.60 2qmd s LYS 285 N -1.77 0.58 -0.07 0.11 -2.85 0.19 -4.72 119.74 111.20 2qmd s LYS 285 Ca 0.34 -0.26 0.02 0.00 -1.00 0.00 0.00 55.97 55.08 2qmd s LYS 285 Cb 0.21 0.24 0.01 0.00 -2.06 0.00 0.00 37.83 36.23 2qmd s LYS 285 CO 0.31 -0.26 -0.14 -1.12 0.10 0.00 0.00 175.35 174.24 2qmd s SER 286 N -2.53 1.99 0.11 0.03 0.01 -1.26 -0.30 113.70 111.75 2qmd s SER 286 Ca 0.10 -0.34 0.04 0.00 1.31 0.00 0.00 55.95 57.05 2qmd s SER 286 Cb 0.00 -0.92 -0.04 0.00 0.21 0.00 0.00 66.02 65.27 2qmd s SER 286 CO -0.05 0.05 -0.10 0.27 0.41 0.00 0.00 173.24 173.82 2qmd s ILE 287 N 0.64 1.00 -0.30 1.44 -4.36 -0.60 -1.25 121.20 117.77 2qmd s ILE 287 Ca -0.15 -1.76 -0.11 0.00 -0.26 0.00 0.00 60.65 58.36 2qmd s ILE 287 Cb -0.16 -1.51 -0.03 0.00 1.25 0.00 0.00 42.46 42.01 2qmd s ILE 287 CO 0.04 -0.62 0.20 -0.69 0.24 0.00 0.00 174.94 174.12 2qmd s VAL 288 N -2.71 5.18 -0.29 8.37 1.01 -0.78 -0.67 120.40 130.50 2qmd s VAL 288 Ca 0.09 -0.06 -0.02 0.00 0.00 0.00 0.00 61.98 61.99 2qmd s VAL 288 Cb -0.01 -3.55 0.10 0.00 0.00 0.00 0.00 36.38 32.91 2qmd s VAL 288 CO -0.00 0.14 0.11 -0.62 0.00 0.00 0.00 175.10 174.72 2qmd s ASP 289 N 1.72 3.73 0.10 3.32 2.15 -0.32 -4.44 116.67 122.93 2qmd s ASP 289 Ca 0.06 -1.42 0.17 0.00 0.43 0.00 0.00 52.55 51.79 2qmd s ASP 289 Cb -0.17 -0.62 0.73 0.00 -0.30 0.00 0.00 42.92 42.56 2qmd s ASP 289 CO 0.10 -0.42 1.53 -1.54 -0.17 0.00 0.00 175.17 174.67 2qmd n SER 290 N 5.04 0.25 -0.81 -0.34 3.41 -1.26 -2.94 113.62 116.96 2qmd n SER 290 Ca -0.04 0.57 0.06 0.00 -0.26 0.00 0.00 58.87 59.20 2qmd n SER 290 Cb 0.42 -0.62 0.19 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.14 1.07 2.99 5.00 0.00 -1.26 -4.59 105.19 108.26 2qmd n GLY 291 Ca 0.03 -0.45 -0.22 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.50 0.86 0.02 2.61 2.01 -1.15 -5.03 115.64 113.46 2qmd s THR 292 Ca 0.28 -0.37 -0.27 0.00 0.31 0.00 0.00 61.69 61.64 2qmd s THR 292 Cb 0.15 -0.79 -0.16 0.00 0.01 0.00 0.00 72.50 71.71 2qmd s THR 292 CO 0.18 0.28 1.18 0.74 -0.69 0.00 0.00 174.62 176.31 2qmd h THR 293 N 5.68 0.21 -4.42 -0.82 2.02 -1.87 0.37 112.91 114.09 2qmd h THR 293 Ca -0.34 -0.35 -0.49 0.00 0.77 0.00 0.00 66.41 66.01 2qmd h THR 293 Cb 1.17 0.28 0.09 0.00 -1.74 0.00 0.00 68.15 67.96 2qmd h THR 293 CO 0.48 0.03 0.38 0.20 0.37 0.00 0.00 175.52 176.98 2qmd s ASN 294 N -4.61 5.01 -0.35 4.18 0.01 -1.26 -1.04 114.94 116.88 2qmd s ASN 294 Ca -0.14 1.17 -0.26 0.00 -0.71 0.00 0.00 52.86 52.92 2qmd s ASN 294 Cb 0.02 -1.92 0.01 0.00 0.41 0.00 0.00 41.25 39.77 2qmd s ASN 294 CO 0.47 -1.62 0.92 -0.22 -1.51 0.00 0.00 177.10 175.13 2qmd s LEU 295 N -5.54 4.01 -0.14 0.60 2.96 -0.47 -2.36 118.68 117.74 2qmd s LEU 295 Ca 0.59 0.63 -0.04 0.00 -0.22 0.00 0.00 54.13 55.10 2qmd s LEU 295 Cb -0.12 -3.26 -0.03 0.00 0.50 0.00 0.00 46.19 43.28 2qmd s LEU 295 CO 0.52 -0.82 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.59 2qmd s ARG 296 N 3.40 3.55 0.03 1.98 0.52 -0.13 -1.48 118.95 126.82 2qmd s ARG 296 Ca 0.38 -0.47 0.09 0.00 -0.52 0.00 0.00 55.73 55.21 2qmd s ARG 296 Cb -0.12 -2.93 -0.03 0.00 0.52 0.00 0.00 34.95 32.39 2qmd s ARG 296 CO 0.17 0.36 -0.25 -0.51 0.02 0.00 0.00 175.30 175.09 2qmd s LEU 297 N 0.05 2.14 0.37 2.53 1.43 0.19 -0.33 118.68 125.06 2qmd s LEU 297 Ca 0.01 -0.55 -0.26 0.00 -1.03 0.00 0.00 54.13 52.31 2qmd s LEU 297 Cb -0.13 -1.24 -0.12 0.00 0.03 0.00 0.00 46.19 44.72 2qmd s LEU 297 CO 0.02 0.25 0.94 -2.65 0.23 0.00 0.00 176.35 175.15 2qmd n PRO 298 N 1.93 1.24 -0.34 1.29 -0.02 -1.26 -0.33 135.00 137.51 2qmd n PRO 298 Ca -0.17 0.44 -0.04 0.00 -2.02 0.00 0.00 63.50 61.72 2qmd n PRO 298 Cb 0.52 -1.88 -0.00 0.00 -0.02 0.00 0.00 33.50 32.11 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 0.44 -0.26 -0.03 -0.52 4.81 -0.97 -0.16 118.16 121.48 2qmd n LYS 299 Ca 0.10 1.30 -0.02 0.00 -0.87 0.00 0.00 58.31 58.82 2qmd n LYS 299 Cb 0.36 -1.92 0.24 0.00 0.02 0.00 0.00 35.03 33.74 2qmd n LYS 299 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 2qmd h LYS 300 N 0.00 0.60 -0.12 1.64 3.64 -1.91 -1.05 116.57 119.36 2qmd h LYS 300 Ca 0.24 -0.15 -0.21 0.00 -1.27 0.00 0.00 60.65 59.26 2qmd h LYS 300 Cb 0.45 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2qmd h LYS 300 CO -0.83 0.64 -0.75 0.28 -2.27 0.00 0.00 179.45 176.52 2qmd h VAL 301 N 0.56 1.30 -0.35 2.00 2.07 -1.30 -2.57 116.25 117.96 2qmd h VAL 301 Ca 0.11 -1.98 0.03 0.00 0.82 0.00 0.00 66.70 65.68 2qmd h VAL 301 Cb 0.41 2.08 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 2qmd h VAL 301 CO 0.02 0.62 0.17 0.15 0.02 0.00 0.00 177.57 178.55 2qmd h PHE 302 N 0.43 0.32 -0.65 1.57 3.57 -0.17 0.19 116.94 122.20 2qmd h PHE 302 Ca -0.06 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.45 2qmd h PHE 302 Cb 1.39 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 40.01 2qmd h PHE 302 CO 0.10 0.17 0.39 0.93 -2.23 0.00 0.00 178.31 177.67 2qmd h GLU 303 N 0.36 0.88 -0.37 1.11 5.08 -1.21 -0.02 114.58 120.42 2qmd h GLU 303 Ca 0.15 -0.08 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 2qmd h GLU 303 Cb 0.06 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 2qmd h GLU 303 CO -0.11 0.62 -0.29 0.00 -1.00 0.00 0.00 179.01 178.24 2qmd h ALA 304 N 1.20 0.53 -0.53 3.43 0.00 -1.08 -2.48 119.26 120.33 2qmd h ALA 304 Ca 0.23 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 2qmd h ALA 304 Cb -0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2qmd h ALA 304 CO -0.04 0.56 0.11 0.00 0.00 0.00 0.00 179.25 179.87 2qmd h ALA 305 N 0.77 0.70 -0.53 0.00 0.00 -0.34 -1.96 119.26 117.90 2qmd h ALA 305 Ca 0.07 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2qmd h ALA 305 Cb 0.87 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2qmd h ALA 305 CO 0.08 0.42 0.07 0.28 0.00 0.00 0.00 179.25 180.09 2qmd h VAL 306 N 0.75 1.24 -0.77 0.00 2.07 -0.98 0.87 116.25 119.43 2qmd h VAL 306 Ca 0.16 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.71 2qmd h VAL 306 Cb 0.37 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 2qmd h VAL 306 CO 0.01 0.34 0.36 0.11 0.02 0.00 0.00 177.57 178.41 2qmd h LYS 307 N 0.81 1.11 -0.31 1.57 1.57 -1.18 0.26 116.57 120.40 2qmd h LYS 307 Ca 0.17 -0.17 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 2qmd h LYS 307 Cb 0.39 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 2qmd h LYS 307 CO 0.01 0.87 -0.51 1.03 -0.57 0.00 0.00 179.45 180.28 2qmd h SER 308 N 1.09 0.97 -0.00 0.86 0.87 -0.79 -1.64 113.55 114.90 2qmd h SER 308 Ca 0.26 -0.50 -0.11 0.00 -1.23 0.00 0.00 61.79 60.21 2qmd h SER 308 Cb 0.13 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.80 2qmd h SER 308 CO -0.03 1.30 -0.34 0.40 -0.53 0.00 0.00 176.83 177.62 2qmd h ILE 309 N 0.68 1.29 -0.58 2.23 2.04 -0.64 -1.16 117.51 121.37 2qmd h ILE 309 Ca 0.03 -1.45 -0.08 0.00 1.00 0.00 0.00 64.86 64.36 2qmd h ILE 309 Cb 1.11 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 38.66 2qmd h ILE 309 CO 0.12 0.45 0.03 0.11 0.00 0.00 0.00 178.15 178.86 2qmd h LYS 310 N 0.41 1.00 -0.62 2.37 1.57 -0.84 -1.61 116.57 118.85 2qmd h LYS 310 Ca 0.05 -0.30 -0.05 0.00 -1.87 0.00 0.00 60.65 58.47 2qmd h LYS 310 Cb 0.80 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.98 2qmd h LYS 310 CO 0.06 0.98 0.19 0.00 -0.57 0.00 0.00 179.45 180.11 2qmd h ALA 311 N 0.98 0.81 -0.05 3.86 0.00 -0.94 -0.85 119.26 123.07 2qmd h ALA 311 Ca 0.17 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 2qmd h ALA 311 Cb 0.50 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2qmd h ALA 311 CO 0.02 0.49 -0.45 0.00 0.00 0.00 0.00 179.25 179.31 2qmd h ALA 312 N 1.06 1.15 -0.66 0.00 0.00 -1.07 -2.88 119.26 116.86 2qmd h ALA 312 Ca 0.20 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2qmd h ALA 312 Cb 0.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2qmd h ALA 312 CO -0.00 0.60 0.00 -1.13 0.00 0.00 0.00 179.25 178.71 2qmd n SER 313 N -3.99 4.92 0.10 0.00 3.41 -0.62 -4.69 113.62 112.74 2qmd n SER 313 Ca -0.02 -2.49 0.06 0.00 -0.26 0.00 0.00 58.87 56.16 2qmd n SER 313 Cb 0.49 -0.60 0.30 0.00 -0.26 0.00 0.00 64.21 64.14 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 1.12 0.28 0.16 4.04 3.41 -0.35 -2.00 113.62 120.29 2qmd n SER 314 Ca 0.26 0.58 0.12 0.00 -0.26 0.00 0.00 58.87 59.58 2qmd n SER 314 Cb 0.93 -0.59 0.56 0.00 -0.26 0.00 0.00 64.21 64.84 2qmd n SER 314 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2qmd h THR 315 N 0.00 0.00 -3.56 6.66 1.35 -1.87 -3.40 112.91 112.09 2qmd h THR 315 Ca 0.00 -0.18 -0.44 0.00 -0.55 0.00 0.00 66.41 65.23 2qmd h THR 315 Cb 0.20 0.88 -0.33 0.00 -1.73 0.00 0.00 68.15 67.16 2qmd h THR 315 CO 0.00 0.00 -0.79 -1.61 -0.25 0.00 0.00 175.52 172.87 2qmd s GLU 316 N -3.43 1.11 -0.14 4.72 2.02 -0.84 -5.14 118.70 116.99 2qmd s GLU 316 Ca 0.02 -0.25 -0.10 0.00 0.02 0.00 0.00 54.97 54.66 2qmd s GLU 316 Cb 0.09 -1.01 -0.05 0.00 0.10 0.00 0.00 34.13 33.26 2qmd s GLU 316 CO 0.35 0.01 0.19 0.15 0.02 0.00 0.00 175.26 175.98 2qmd s LYS 317 N 0.60 3.83 0.05 1.61 -0.14 -1.26 -4.95 119.74 119.48 2qmd s LYS 317 Ca -0.10 -0.07 0.09 0.00 -1.36 0.00 0.00 55.97 54.53 2qmd s LYS 317 Cb -0.13 -3.30 -0.03 0.00 -1.68 0.00 0.00 37.83 32.70 2qmd s LYS 317 CO 0.01 0.55 -0.24 -0.06 -0.76 0.00 0.00 175.35 174.85 2qmd s PHE 318 N -0.41 2.15 0.71 3.18 0.40 -1.26 -5.12 117.98 117.62 2qmd s PHE 318 Ca 0.14 -0.40 -0.16 0.00 -0.60 0.00 0.00 56.93 55.91 2qmd s PHE 318 Cb -0.12 -1.28 0.03 0.00 0.51 0.00 0.00 43.02 42.16 2qmd s PHE 318 CO 0.03 0.13 1.27 -0.35 0.70 0.00 0.00 175.22 176.99 2qmd n PRO 319 N 1.74 0.76 -0.18 0.24 -0.04 -1.26 -4.89 135.00 131.38 2qmd n PRO 319 Ca -0.17 0.33 0.16 0.00 -0.04 0.00 0.00 63.50 63.78 2qmd n PRO 319 Cb 0.52 -2.50 0.51 0.00 -0.04 0.00 0.00 33.50 31.99 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 -0.02 0.39 -0.54 3.54 3.32 -2.00 -0.86 116.42 120.24 2qmd h ASP 320 Ca -0.49 0.03 0.06 0.00 0.02 0.00 0.00 57.03 56.65 2qmd h ASP 320 Cb 1.32 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.79 2qmd h ASP 320 CO 0.50 0.19 0.36 1.23 -1.72 0.00 0.00 179.24 179.81 2qmd h GLY 321 N 0.41 0.60 0.89 2.75 0.00 -1.94 -1.65 103.07 104.12 2qmd h GLY 321 Ca 0.39 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 2qmd h GLY 321 CO -0.13 0.14 0.01 -2.75 0.00 0.00 0.00 176.54 173.81 2qmd h PHE 322 N 0.48 0.02 0.00 5.60 3.57 -1.32 -2.30 116.94 122.99 2qmd h PHE 322 Ca 0.24 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.74 2qmd h PHE 322 Cb 0.32 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.06 2qmd h PHE 322 CO -0.00 0.13 0.00 -1.49 -2.23 0.00 0.00 178.31 174.72 2qmd h TRP 323 N -0.09 0.00 -0.03 0.41 4.06 -1.36 -0.82 115.95 118.12 2qmd h TRP 323 Ca 0.01 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.96 2qmd h TRP 323 Cb 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.27 2qmd h TRP 323 CO -0.04 0.00 0.00 1.28 -3.56 0.00 0.00 178.44 176.12 2qmd n LEU 324 N -2.80 1.05 -0.24 -4.49 4.77 -0.77 -4.91 117.00 109.61 2qmd n LEU 324 Ca 0.00 -0.37 -0.03 0.00 -0.03 0.00 0.00 56.01 55.58 2qmd n LEU 324 Cb 0.22 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.28 2qmd n LEU 324 CO 0.22 0.19 -0.03 0.61 -1.33 0.00 0.00 177.39 177.05 2qmd n GLY 325 N 1.10 0.55 0.11 -0.72 0.00 -0.31 -4.89 105.19 101.03 2qmd n GLY 325 Ca 0.19 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.73 0.68 -4.62 1.61 1.02 -0.92 -4.73 120.64 111.95 2qmd n GLU 326 Ca -0.03 0.04 -0.30 0.00 -0.02 0.00 0.00 57.16 56.85 2qmd n GLU 326 Cb 0.25 -1.54 -0.13 0.00 -0.02 0.00 0.00 31.44 30.00 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 -2.50 1.85 0.57 3.49 -2.07 -0.91 -4.99 119.66 115.09 2qmd s GLN 327 Ca -0.15 -1.10 -0.12 0.00 -1.82 0.00 0.00 55.36 52.17 2qmd s GLN 327 Cb 0.07 -2.08 -0.05 0.00 -1.09 0.00 0.00 33.01 29.86 2qmd s GLN 327 CO 0.78 0.51 0.98 -0.48 -1.32 0.00 0.00 175.29 175.76 2qmd s LEU 328 N -1.60 3.40 -0.02 2.60 0.05 -1.26 -4.21 118.68 117.64 2qmd s LEU 328 Ca 0.14 1.39 0.06 0.00 0.05 0.00 0.00 54.13 55.77 2qmd s LEU 328 Cb -0.10 -4.39 -0.01 0.00 -2.05 0.00 0.00 46.19 39.63 2qmd s LEU 328 CO 0.05 -0.74 -0.20 -0.69 -0.55 0.00 0.00 176.35 174.22 2qmd s VAL 329 N -2.95 1.58 0.06 1.48 1.01 -0.51 -4.94 120.40 116.12 2qmd s VAL 329 Ca 0.55 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.76 2qmd s VAL 329 Cb -0.11 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 2qmd s VAL 329 CO 0.46 0.45 -0.18 0.00 0.00 0.00 0.00 175.10 175.83 2qmd s TRP 331 N -0.96 1.40 0.39 0.00 0.51 -0.37 -4.97 118.94 114.96 2qmd s TRP 331 Ca 0.04 -0.48 -0.25 0.00 -2.12 0.00 0.00 56.10 53.29 2qmd s TRP 331 Cb -0.09 -0.76 -0.11 0.00 -0.81 0.00 0.00 33.47 31.70 2qmd s TRP 331 CO 0.02 0.12 1.03 0.94 -0.51 0.00 0.00 176.95 178.56 2qmd n GLN 332 N 0.97 1.42 -1.53 4.98 7.27 -1.26 -0.79 117.38 128.43 2qmd n GLN 332 Ca -0.19 0.50 -0.60 0.00 0.07 0.00 0.00 57.00 56.79 2qmd n GLN 332 Cb 0.55 -2.03 -0.09 0.00 2.41 0.00 0.00 30.24 31.08 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 -0.32 -1.85 -0.85 1.69 0.00 -1.24 -0.80 120.51 117.14 2qmd n ALA 333 Ca 0.09 0.48 0.00 0.00 0.00 0.00 0.00 53.44 54.01 2qmd n ALA 333 Cb 0.38 -1.71 0.00 0.00 0.00 0.00 0.00 19.45 18.12 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 2.99 1.07 1.25 0.00 0.00 -1.26 -4.90 105.19 104.34 2qmd n GLY 334 Ca 0.25 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.39 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 0.85 -1.67 2.61 -2.24 0.02 -4.98 114.28 106.88 2qmd n THR 335 Ca 0.00 -0.93 -0.55 0.00 -2.27 0.00 0.00 64.05 60.31 2qmd n THR 335 Cb 0.00 0.65 -0.06 0.00 -2.10 0.00 0.00 70.33 68.81 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 1.53 0.21 -1.42 4.28 -1.04 -1.26 -4.79 114.28 111.78 2qmd n THR 336 Ca 0.22 -0.04 -0.40 0.00 -2.04 0.00 0.00 64.05 61.80 2qmd n THR 336 Cb 0.60 -1.14 -0.02 0.00 -1.82 0.00 0.00 70.33 67.95 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 4.38 3.57 -0.34 -2.82 -0.04 -1.26 -4.74 135.00 133.75 2qmd n PRO 337 Ca 0.23 -2.33 0.19 0.00 -0.04 0.00 0.00 63.50 61.56 2qmd n PRO 337 Cb 0.17 -2.89 0.41 0.00 -0.04 0.00 0.00 33.50 31.15 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 5.19 0.98 0.00 0.54 4.06 -1.95 -1.08 115.95 123.69 2qmd h TRP 338 Ca 0.81 0.04 0.00 0.00 2.06 0.00 0.00 58.89 61.80 2qmd h TRP 338 Cb 0.35 -0.27 0.00 0.00 -1.00 0.00 0.00 29.16 28.24 2qmd h TRP 338 CO 1.79 -0.01 0.00 -2.95 -3.56 0.00 0.00 178.44 173.71 2qmd h ASN 339 N 0.50 0.00 1.44 -3.49 7.08 -2.00 -1.67 115.58 117.45 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 1.36 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.60 2qmd h ASN 339 CO -0.52 0.00 -0.24 0.16 -2.08 0.00 0.00 177.43 174.75 2qmd h ILE 340 N 0.00 0.00 -3.25 6.14 3.07 -1.56 -3.44 117.51 118.47 2qmd h ILE 340 Ca 0.00 -0.69 -0.57 0.00 1.55 0.00 0.00 64.86 65.15 2qmd h ILE 340 Cb 0.24 1.54 -0.04 0.00 -0.27 0.00 0.00 36.82 38.29 2qmd h ILE 340 CO 0.00 0.00 -0.03 -0.36 -1.05 0.00 0.00 178.15 176.71 2qmd s PHE 341 N -3.18 3.80 0.56 0.16 0.08 -0.63 -3.58 117.98 115.20 2qmd s PHE 341 Ca 0.07 1.28 -0.14 0.00 0.12 0.00 0.00 56.93 58.27 2qmd s PHE 341 Cb 0.10 -2.52 -0.06 0.00 -0.57 0.00 0.00 43.02 39.98 2qmd s PHE 341 CO 0.67 0.57 1.00 -1.25 -0.10 0.00 0.00 175.22 176.10 2qmd s PRO 342 N -1.03 3.77 0.47 0.24 0.04 -1.26 -4.82 135.00 132.41 2qmd s PRO 342 Ca 0.29 0.83 -0.10 0.00 0.04 0.00 0.00 61.00 62.06 2qmd s PRO 342 Cb -0.20 -2.12 -0.06 0.00 0.04 0.00 0.00 34.50 32.17 2qmd s PRO 342 CO 0.19 -0.40 0.84 0.14 0.04 0.00 0.00 177.00 177.81 2qmd s VAL 343 N -2.88 4.77 -0.10 -0.36 -7.23 -1.26 -4.28 120.40 109.06 2qmd s VAL 343 Ca 0.57 0.64 0.03 0.00 -1.81 0.00 0.00 61.98 61.41 2qmd s VAL 343 Cb -0.10 -3.78 0.01 0.00 0.56 0.00 0.00 36.38 33.06 2qmd s VAL 343 CO 0.42 -0.71 -0.20 -0.63 -0.31 0.00 0.00 175.10 173.67 2qmd s ILE 344 N -2.61 1.80 -0.13 -0.62 1.01 -0.13 -0.56 121.20 119.97 2qmd s ILE 344 Ca 0.52 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 60.32 2qmd s ILE 344 Cb -0.10 -1.58 -0.01 0.00 0.01 0.00 0.00 42.46 40.77 2qmd s ILE 344 CO 0.38 0.50 -0.15 -0.44 0.00 0.00 0.00 174.94 175.23 2qmd s SER 345 N 0.54 3.81 -0.22 3.58 0.01 -0.09 -0.29 113.70 121.04 2qmd s SER 345 Ca -0.15 -0.38 -0.03 0.00 1.31 0.00 0.00 55.95 56.69 2qmd s SER 345 Cb -0.17 -1.57 -0.00 0.00 0.21 0.00 0.00 66.02 64.49 2qmd s SER 345 CO 0.05 0.16 -0.07 -0.76 0.41 0.00 0.00 173.24 173.03 2qmd s LEU 346 N 0.40 2.79 -0.12 2.44 1.43 -0.19 -1.24 118.68 124.18 2qmd s LEU 346 Ca -0.12 -0.46 -0.18 0.00 -1.03 0.00 0.00 54.13 52.34 2qmd s LEU 346 Cb -0.16 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 2qmd s LEU 346 CO 0.06 -0.02 0.48 -0.31 0.23 0.00 0.00 176.35 176.79 2qmd s TYR 347 N 1.44 3.51 0.04 0.29 1.51 0.10 -0.91 117.35 123.33 2qmd s TYR 347 Ca 0.05 0.89 0.05 0.00 -1.01 0.00 0.00 57.07 57.06 2qmd s TYR 347 Cb -0.14 -2.56 -0.03 0.00 -0.11 0.00 0.00 41.96 39.11 2qmd s TYR 347 CO -0.05 0.16 -0.11 -0.51 -1.11 0.00 0.00 175.55 173.92 2qmd s LEU 348 N 0.67 2.95 0.26 -1.29 1.43 0.19 -0.23 118.68 122.66 2qmd s LEU 348 Ca 0.26 -0.29 -0.31 0.00 -1.03 0.00 0.00 54.13 52.76 2qmd s LEU 348 Cb -0.15 -1.72 -0.12 0.00 0.03 0.00 0.00 46.19 44.22 2qmd s LEU 348 CO 0.10 0.25 1.53 0.80 0.23 0.00 0.00 176.35 179.27 2qmd n MET 349 N 1.37 2.44 -2.48 1.70 0.00 -0.87 -1.92 117.12 117.36 2qmd n MET 349 Ca -0.15 0.87 -0.23 0.00 -0.00 0.00 0.00 57.70 58.19 2qmd n MET 349 Cb 0.52 -2.61 0.12 0.00 0.00 0.00 0.00 33.22 31.26 2qmd n MET 349 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2qmd n GLY 350 N 2.31 0.48 0.07 -5.12 0.00 0.77 -4.02 105.19 99.68 2qmd n GLY 350 Ca 0.10 -2.00 0.12 0.00 0.00 0.00 0.00 46.02 44.24 2qmd n GLY 350 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qmd n GLU 351 N -2.89 0.27 -3.37 1.61 1.02 -1.21 -4.57 120.64 111.50 2qmd n GLU 351 Ca 0.16 0.12 -0.38 0.00 -0.02 0.00 0.00 57.16 57.04 2qmd n GLU 351 Cb 0.58 -1.71 -0.06 0.00 -0.02 0.00 0.00 31.44 30.23 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 -3.14 4.98 0.14 2.62 1.01 -1.26 -5.01 120.40 119.74 2qmd s VAL 352 Ca 0.08 1.00 -0.34 0.00 0.00 0.00 0.00 61.98 62.72 2qmd s VAL 352 Cb 0.13 -3.81 -0.16 0.00 0.00 0.00 0.00 36.38 32.55 2qmd s VAL 352 CO 0.69 0.50 1.20 0.41 0.00 0.00 0.00 175.10 177.89 2qmd n THR 353 N 2.34 0.64 -1.84 3.92 -1.04 -1.26 -1.42 114.28 115.63 2qmd n THR 353 Ca -0.11 -0.16 -0.21 0.00 -2.04 0.00 0.00 64.05 61.54 2qmd n THR 353 Cb 0.52 -0.80 -0.07 0.00 -1.82 0.00 0.00 70.33 68.16 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 2.14 -5.62 -4.25 8.00 3.02 -1.26 -4.98 115.26 112.31 2qmd n ASN 354 Ca 0.16 0.36 -0.28 0.00 -0.03 0.00 0.00 54.58 54.79 2qmd n ASN 354 Cb 0.23 -4.85 -0.16 0.00 -0.61 0.00 0.00 39.78 34.39 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 -4.13 1.77 0.29 3.52 0.74 -0.50 -0.91 119.66 120.43 2qmd s GLN 355 Ca 0.00 -0.80 0.02 0.00 0.05 0.00 0.00 55.36 54.63 2qmd s GLN 355 Cb 0.00 -1.72 -0.05 0.00 1.10 0.00 0.00 33.01 32.34 2qmd s GLN 355 CO 0.00 0.47 0.10 -1.54 -0.55 0.00 0.00 175.29 173.77 2qmd s SER 356 N -0.56 1.57 0.17 6.67 1.04 0.02 -0.17 113.70 122.44 2qmd s SER 356 Ca 0.09 -1.42 -0.02 0.00 0.48 0.00 0.00 55.95 55.08 2qmd s SER 356 Cb -0.09 0.16 -0.04 0.00 0.10 0.00 0.00 66.02 66.15 2qmd s SER 356 CO -0.01 -0.74 0.12 0.72 0.98 0.00 0.00 173.24 174.32 2qmd s PHE 357 N -3.61 0.98 0.07 5.02 -0.12 -0.81 -0.91 117.98 118.61 2qmd s PHE 357 Ca 0.37 -1.28 0.06 0.00 -0.05 0.00 0.00 56.93 56.03 2qmd s PHE 357 Cb 0.07 -0.48 -0.03 0.00 -0.63 0.00 0.00 43.02 41.95 2qmd s PHE 357 CO 0.15 -0.61 -0.17 -0.98 -0.05 0.00 0.00 175.22 173.56 2qmd s ARG 358 N -4.10 1.01 -0.09 1.99 1.70 0.29 -0.63 118.95 119.11 2qmd s ARG 358 Ca 0.32 -0.97 0.02 0.00 -0.47 0.00 0.00 55.73 54.62 2qmd s ARG 358 Cb 0.07 -1.11 -0.02 0.00 -0.57 0.00 0.00 34.95 33.31 2qmd s ARG 358 CO 0.07 0.26 -0.14 0.96 -1.08 0.00 0.00 175.30 175.38 2qmd s ILE 359 N -1.08 3.05 -0.13 4.99 -4.36 -0.09 -1.17 121.20 122.41 2qmd s ILE 359 Ca 0.03 -0.69 0.02 0.00 -0.26 0.00 0.00 60.65 59.74 2qmd s ILE 359 Cb -0.09 -2.24 -0.00 0.00 1.25 0.00 0.00 42.46 41.38 2qmd s ILE 359 CO 0.03 0.56 -0.20 -0.89 0.24 0.00 0.00 174.94 174.68 2qmd s THR 360 N -0.15 2.36 -0.07 8.37 2.01 0.73 -1.03 115.64 127.87 2qmd s THR 360 Ca -0.01 -0.89 -0.02 0.00 0.31 0.00 0.00 61.69 61.08 2qmd s THR 360 Cb -0.14 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.39 2qmd s THR 360 CO 0.03 0.54 0.02 -0.63 -0.69 0.00 0.00 174.62 173.89 2qmd s ILE 361 N 0.59 4.43 0.31 1.82 1.01 0.60 -2.12 121.20 127.84 2qmd s ILE 361 Ca -0.11 -0.28 0.07 0.00 0.00 0.00 0.00 60.65 60.33 2qmd s ILE 361 Cb -0.16 -2.90 -0.02 0.00 0.01 0.00 0.00 42.46 39.38 2qmd s ILE 361 CO 0.03 0.55 0.33 -0.76 0.00 0.00 0.00 174.94 175.09 2qmd s LEU 362 N -1.08 3.80 0.62 2.97 1.43 -1.26 -0.95 118.68 124.21 2qmd s LEU 362 Ca 0.15 -0.32 0.40 0.00 -1.03 0.00 0.00 54.13 53.33 2qmd s LEU 362 Cb -0.11 -2.44 2.05 0.00 0.03 0.00 0.00 46.19 45.72 2qmd s LEU 362 CO 0.05 -0.29 2.24 1.55 0.23 0.00 0.00 176.35 180.13 2qmd h PRO 363 N 1.19 0.00 0.00 1.29 0.13 -1.88 0.18 132.00 132.91 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 0.58 0.01 0.00 1.04 -0.23 0.00 0.00 178.00 179.40 2qmd n GLN 364 N -3.18 0.16 -0.11 0.86 3.00 -1.26 -0.74 117.38 116.12 2qmd n GLN 364 Ca -0.02 0.56 -0.24 0.00 -0.01 0.00 0.00 57.00 57.29 2qmd n GLN 364 Cb 0.15 -1.93 -0.11 0.00 0.00 0.00 0.00 30.24 28.34 2qmd n GLN 364 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2qmd n GLN 365 N -2.25 0.63 0.00 -1.09 3.00 0.59 -4.56 117.38 113.68 2qmd n GLN 365 Ca -0.00 0.31 0.14 0.00 -0.01 0.00 0.00 57.00 57.44 2qmd n GLN 365 Cb 0.11 -1.59 0.61 0.00 0.00 0.00 0.00 30.24 29.37 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 -3.95 0.00 -3.72 1.08 0.18 -0.97 -4.51 117.16 105.28 2qmd n TYR 366 Ca -0.44 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 58.96 2qmd n TYR 366 Cb 0.89 -0.17 -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 -2.44 4.05 -0.22 -3.48 1.43 0.08 -0.36 118.68 117.74 2qmd s LEU 367 Ca 0.30 -0.75 -0.19 0.00 -1.03 0.00 0.00 54.13 52.46 2qmd s LEU 367 Cb 0.20 -1.92 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 2qmd s LEU 367 CO 0.47 -0.23 0.56 -0.60 0.23 0.00 0.00 176.35 176.78 2qmd s ARG 368 N 1.52 4.16 0.19 1.70 3.52 0.42 -4.77 118.95 125.69 2qmd s ARG 368 Ca 0.02 0.46 -0.32 0.00 -0.13 0.00 0.00 55.73 55.77 2qmd s ARG 368 Cb -0.18 -3.59 -0.12 0.00 -1.56 0.00 0.00 34.95 29.50 2qmd s ARG 368 CO 0.04 -0.24 1.76 -2.30 -0.81 0.00 0.00 175.30 173.75 2qmd n PRO 369 N 5.10 2.79 -4.03 5.12 -0.02 -1.26 -0.78 135.00 141.93 2qmd n PRO 369 Ca -0.03 1.01 -0.09 0.00 -2.02 0.00 0.00 63.50 62.36 2qmd n PRO 369 Cb 0.50 -2.87 -0.11 0.00 -0.02 0.00 0.00 33.50 31.00 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 1.61 0.24 0.03 -1.45 -7.23 -0.72 -4.67 120.40 108.22 2qmd s VAL 370 Ca 0.77 -1.19 -0.29 0.00 -1.81 0.00 0.00 61.98 59.46 2qmd s VAL 370 Cb -0.50 -0.68 -0.04 0.00 0.56 0.00 0.00 36.38 35.73 2qmd s VAL 370 CO 0.34 -0.61 0.92 -0.70 -0.31 0.00 0.00 175.10 174.74 2qmd s GLU 371 N -2.15 4.58 0.33 4.82 2.56 -1.26 -4.07 118.70 123.51 2qmd s GLU 371 Ca -0.08 1.33 -0.29 0.00 0.00 0.00 0.00 54.97 55.93 2qmd s GLU 371 Cb -0.05 -3.42 -0.11 0.00 2.00 0.00 0.00 34.13 32.55 2qmd s GLU 371 CO -0.03 0.08 1.43 0.34 -0.56 0.00 0.00 175.26 176.52 2qmd s ASP 372 N 0.55 6.55 0.00 -1.70 2.15 -1.26 -4.83 116.67 118.13 2qmd s ASP 372 Ca 0.47 2.84 0.00 0.00 0.43 0.00 0.00 52.55 56.29 2qmd s ASP 372 Cb -0.21 -2.65 0.00 0.00 -0.30 0.00 0.00 42.92 39.76 2qmd s ASP 372 CO 0.27 -0.73 0.62 0.52 -0.17 0.00 0.00 175.17 175.68 2qmd n VAL 373 N 1.12 0.76 0.36 1.11 0.31 -1.26 0.91 118.33 121.64 2qmd n VAL 373 Ca 0.03 0.27 0.04 0.00 -0.01 0.00 0.00 64.34 64.66 2qmd n VAL 373 Cb 0.40 -1.27 0.02 0.00 -0.91 0.00 0.00 33.84 32.08 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 -1.12 2.59 -1.05 3.52 0.00 -1.26 -4.97 120.51 118.22 2qmd n ALA 374 Ca 0.00 -0.50 -0.02 0.00 0.00 0.00 0.00 53.44 52.93 2qmd n ALA 374 Cb 0.08 -0.29 -0.01 0.00 0.00 0.00 0.00 19.45 19.23 2qmd n ALA 374 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2qmd n THR 375 N 0.15 0.00 0.00 0.00 -1.04 0.26 -4.94 114.28 108.71 2qmd n THR 375 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 2qmd n THR 375 Cb 0.20 -0.99 0.00 0.00 -1.82 0.00 0.00 70.33 67.71 2qmd n THR 375 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2qmd n SER 376 N -0.93 -0.98 -1.09 8.00 3.41 -1.26 -4.91 113.62 115.86 2qmd n SER 376 Ca -0.02 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.71 2qmd n SER 376 Cb 0.47 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.59 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 -0.98 2.45 -1.49 4.33 6.02 -1.26 -4.90 117.38 121.55 2qmd n GLN 377 Ca 0.00 -2.17 -0.33 0.00 -0.01 0.00 0.00 57.00 54.49 2qmd n GLN 377 Cb 0.00 -1.50 0.08 0.00 1.02 0.00 0.00 30.24 29.84 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 -1.68 4.58 -0.31 1.08 1.01 -1.26 -3.71 116.67 116.38 2qmd s ASP 378 Ca 0.35 2.08 -0.13 0.00 0.71 0.00 0.00 52.55 55.56 2qmd s ASP 378 Cb 0.22 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.56 2qmd s ASP 378 CO 0.31 -1.99 0.26 -1.81 0.21 0.00 0.00 175.17 172.15 2qmd s ASP 379 N -2.59 6.09 0.20 0.27 -0.00 0.03 -4.82 116.67 115.83 2qmd s ASP 379 Ca 0.68 -0.18 0.11 0.00 -0.00 0.00 0.00 52.55 53.15 2qmd s ASP 379 Cb -0.22 -2.15 -0.04 0.00 -0.00 0.00 0.00 42.92 40.50 2qmd s ASP 379 CO 0.46 -0.19 -0.23 0.00 -0.00 0.00 0.00 175.17 175.22 2qmd s TYR 381 N -1.79 -0.05 0.07 0.00 1.51 -0.11 -1.76 117.35 115.23 2qmd s TYR 381 Ca 0.21 -0.25 0.06 0.00 -1.01 0.00 0.00 57.07 56.08 2qmd s TYR 381 Cb -0.07 0.10 -0.04 0.00 -0.11 0.00 0.00 41.96 41.84 2qmd s TYR 381 CO 0.10 -0.59 -0.11 0.15 -1.11 0.00 0.00 175.55 173.99 2qmd s LYS 382 N -3.44 2.20 -0.30 -0.62 1.02 0.04 -1.43 119.74 117.22 2qmd s LYS 382 Ca 0.01 -0.96 -0.29 0.00 0.02 0.00 0.00 55.97 54.76 2qmd s LYS 382 Cb 0.02 -2.32 -0.00 0.00 -0.52 0.00 0.00 37.83 35.01 2qmd s LYS 382 CO -0.09 0.53 1.36 0.12 -0.92 0.00 0.00 175.35 176.35 2qmd s PHE 383 N -1.11 2.57 -0.42 3.18 5.36 -1.26 -0.43 117.98 125.86 2qmd s PHE 383 Ca 0.19 0.80 0.01 0.00 -0.96 0.00 0.00 56.93 56.97 2qmd s PHE 383 Cb -0.11 -3.95 0.43 0.00 -0.34 0.00 0.00 43.02 39.05 2qmd s PHE 383 CO 0.11 -1.93 1.86 0.00 -1.46 0.00 0.00 175.22 173.80 2qmd n ALA 384 N 7.86 5.31 -3.48 11.12 0.00 0.52 -4.34 120.51 137.49 2qmd n ALA 384 Ca 0.16 -2.42 -0.29 0.00 0.00 0.00 0.00 53.44 50.89 2qmd n ALA 384 Cb 0.46 -1.46 -0.17 0.00 0.00 0.00 0.00 19.45 18.29 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 -3.07 1.62 0.17 0.00 1.01 -1.26 -1.36 121.20 118.31 2qmd s ILE 385 Ca 0.46 -0.74 -0.03 0.00 0.00 0.00 0.00 60.65 60.34 2qmd s ILE 385 Cb 0.38 -1.44 -0.03 0.00 0.01 0.00 0.00 42.46 41.37 2qmd s ILE 385 CO 0.04 0.46 0.15 -0.94 0.00 0.00 0.00 174.94 174.65 2qmd s SER 386 N 0.70 0.18 0.29 3.58 1.04 -0.55 -4.69 113.70 114.26 2qmd s SER 386 Ca -0.12 -1.19 -0.28 0.00 0.48 0.00 0.00 55.95 54.84 2qmd s SER 386 Cb -0.16 0.37 -0.09 0.00 0.10 0.00 0.00 66.02 66.23 2qmd s SER 386 CO 0.03 -0.82 0.97 -1.58 0.98 0.00 0.00 173.24 172.82 2qmd s GLN 387 N -4.07 4.66 0.09 4.02 0.74 -1.26 -0.63 119.66 123.21 2qmd s GLN 387 Ca 0.27 1.48 0.08 0.00 0.05 0.00 0.00 55.36 57.24 2qmd s GLN 387 Cb 0.06 -3.02 -0.03 0.00 1.10 0.00 0.00 33.01 31.11 2qmd s GLN 387 CO 0.05 0.33 -0.20 0.45 -0.55 0.00 0.00 175.29 175.37 2qmd s SER 388 N -1.33 2.45 0.00 6.67 0.15 0.56 -4.74 113.70 117.45 2qmd s SER 388 Ca 0.46 -0.66 0.05 0.00 0.70 0.00 0.00 55.95 56.50 2qmd s SER 388 Cb -0.24 -0.14 0.08 0.00 -1.71 0.00 0.00 66.02 64.01 2qmd s SER 388 CO 0.30 0.06 0.86 -1.54 1.20 0.00 0.00 173.24 174.12 2qmd n SER 389 N 1.20 1.85 -0.50 5.45 3.41 -1.26 -2.28 113.62 121.49 2qmd n SER 389 Ca -0.19 -1.57 0.07 0.00 -0.26 0.00 0.00 58.87 56.91 2qmd n SER 389 Cb 0.54 -0.05 0.13 0.00 -0.26 0.00 0.00 64.21 64.57 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 0.11 1.54 -0.10 6.66 -2.24 -1.26 -4.87 114.28 114.11 2qmd n THR 390 Ca 0.04 -2.19 0.00 0.00 -2.27 0.00 0.00 64.05 59.63 2qmd n THR 390 Cb 0.21 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 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 -0.90 -3.70 3.74 3.38 0.00 -1.23 -4.52 105.19 101.96 2qmd n GLY 391 Ca 0.14 -2.02 -0.41 0.00 0.00 0.00 0.00 46.02 43.73 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 -0.84 3.75 -0.23 2.61 2.01 0.58 -4.29 115.64 119.23 2qmd s THR 392 Ca 0.00 1.52 0.02 0.00 0.31 0.00 0.00 61.69 63.54 2qmd s THR 392 Cb 0.00 -3.97 0.05 0.00 0.01 0.00 0.00 72.50 68.59 2qmd s THR 392 CO 0.00 0.27 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.40 2qmd s VAL 393 N -0.30 1.91 -0.89 3.82 1.01 0.55 -1.55 120.40 124.95 2qmd s VAL 393 Ca 0.50 -1.32 -0.20 0.00 0.00 0.00 0.00 61.98 60.96 2qmd s VAL 393 Cb -0.30 -2.00 0.11 0.00 0.00 0.00 0.00 36.38 34.19 2qmd s VAL 393 CO 0.36 0.08 1.12 -0.04 0.00 0.00 0.00 175.10 176.62 2qmd s MET 394 N 1.25 3.51 0.06 2.72 -1.94 0.16 -0.96 119.30 124.10 2qmd s MET 394 Ca -0.05 -1.55 -0.01 0.00 -1.71 0.00 0.00 55.69 52.37 2qmd s MET 394 Cb -0.18 -4.83 0.01 0.00 2.01 0.00 0.00 34.83 31.85 2qmd s MET 394 CO -0.07 -1.81 0.08 0.41 -0.01 0.00 0.00 175.02 173.62 2qmd n GLY 395 N 5.57 -1.10 0.33 -0.03 0.00 -1.00 -1.18 105.19 107.79 2qmd n GLY 395 Ca 0.19 -1.68 0.05 0.00 0.00 0.00 0.00 46.02 44.58 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 -1.95 1.70 0.00 4.61 0.00 0.31 -1.24 119.26 122.70 2qmd h ALA 396 Ca -0.02 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2qmd h ALA 396 Cb 0.07 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2qmd h ALA 396 CO 0.02 0.24 -0.19 -0.39 0.00 0.00 0.00 179.25 178.93 2qmd h VAL 397 N 0.67 0.68 0.13 0.00 -1.51 -1.33 0.56 116.25 115.44 2qmd h VAL 397 Ca 0.22 -0.79 -0.20 0.00 -1.23 0.00 0.00 66.70 64.70 2qmd h VAL 397 Cb 0.07 1.50 0.02 0.00 -2.13 0.00 0.00 31.29 30.74 2qmd h VAL 397 CO -0.06 0.18 -0.94 0.40 -1.23 0.00 0.00 177.57 175.92 2qmd h ILE 398 N 0.00 1.40 -0.00 7.19 1.08 -1.53 -3.30 117.51 122.36 2qmd h ILE 398 Ca -0.00 -2.50 0.00 0.00 -0.39 0.00 0.00 64.86 61.97 2qmd h ILE 398 Cb 0.48 3.09 -0.00 0.00 -3.07 0.00 0.00 36.82 37.32 2qmd h ILE 398 CO 0.02 0.71 0.00 0.24 -0.69 0.00 0.00 178.15 178.43 2qmd h MET 399 N -0.38 0.00 0.00 2.37 2.86 -0.80 -1.72 114.93 117.26 2qmd h MET 399 Ca -0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 2qmd h MET 399 Cb 1.66 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.32 2qmd h MET 399 CO 0.12 0.00 0.00 0.93 1.06 0.00 0.00 176.91 179.02 2qmd h GLU 400 N 0.00 0.00 -0.00 1.72 5.08 -0.97 -1.29 114.58 119.11 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 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2qmd h GLU 400 CO -0.00 0.00 -0.41 0.41 -1.00 0.00 0.00 179.01 178.01 2qmd n GLY 401 N -0.86 -1.16 3.16 -3.84 0.00 -0.64 -4.25 105.19 97.59 2qmd n GLY 401 Ca -0.01 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.90 0.84 -0.23 1.61 0.40 -0.49 -1.66 117.98 115.54 2qmd s PHE 402 Ca 0.14 -0.93 -0.16 0.00 -0.60 0.00 0.00 56.93 55.37 2qmd s PHE 402 Cb 0.18 -0.50 -0.04 0.00 0.51 0.00 0.00 43.02 43.18 2qmd s PHE 402 CO 0.65 -0.18 0.43 -0.47 0.70 0.00 0.00 175.22 176.35 2qmd s TYR 403 N -3.63 3.32 -0.20 0.36 5.04 0.48 -4.45 117.35 118.28 2qmd s TYR 403 Ca 0.11 0.60 -0.02 0.00 -2.44 0.00 0.00 57.07 55.31 2qmd s TYR 403 Cb 0.05 -2.59 -0.00 0.00 0.35 0.00 0.00 41.96 39.77 2qmd s TYR 403 CO -0.05 -0.12 -0.09 0.08 -1.34 0.00 0.00 175.55 174.02 2qmd s VAL 404 N 1.71 3.03 -0.32 3.14 1.01 -0.34 -1.95 120.40 126.67 2qmd s VAL 404 Ca 0.19 -0.62 -0.11 0.00 0.00 0.00 0.00 61.98 61.44 2qmd s VAL 404 Cb -0.15 -2.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 2qmd s VAL 404 CO 0.09 0.47 0.19 -0.69 0.00 0.00 0.00 175.10 175.15 2qmd s VAL 405 N 1.23 4.88 -0.97 2.92 1.01 0.35 -0.61 120.40 129.21 2qmd s VAL 405 Ca 0.03 -0.34 -0.16 0.00 0.00 0.00 0.00 61.98 61.51 2qmd s VAL 405 Cb -0.14 -3.50 0.18 0.00 0.00 0.00 0.00 36.38 32.92 2qmd s VAL 405 CO -0.04 0.03 1.09 -0.36 0.00 0.00 0.00 175.10 175.83 2qmd s PHE 406 N 1.66 3.47 -1.21 5.22 0.08 0.67 -0.46 117.98 127.41 2qmd s PHE 406 Ca 0.05 -1.82 -0.15 0.00 0.12 0.00 0.00 56.93 55.14 2qmd s PHE 406 Cb -0.17 -4.13 0.15 0.00 -0.57 0.00 0.00 43.02 38.30 2qmd s PHE 406 CO 0.08 -1.29 1.48 0.34 -0.10 0.00 0.00 175.22 175.72 2qmd s ASP 407 N 2.87 7.00 0.23 1.36 -1.08 -0.37 -2.43 116.67 124.25 2qmd s ASP 407 Ca 0.31 -2.83 -0.08 0.00 -0.52 0.00 0.00 52.55 49.43 2qmd s ASP 407 Cb -0.06 -2.44 0.23 0.00 -1.46 0.00 0.00 42.92 39.19 2qmd s ASP 407 CO -0.07 -0.85 1.90 0.03 0.52 0.00 0.00 175.17 176.70 2qmd h ARG 408 N 7.35 1.16 -0.61 4.34 3.08 -1.75 -0.45 114.38 127.50 2qmd h ARG 408 Ca 0.33 -0.07 0.02 0.00 0.07 0.00 0.00 59.98 60.33 2qmd h ARG 408 Cb 0.88 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 30.64 2qmd h ARG 408 CO 1.28 0.77 0.40 0.00 -1.07 0.00 0.00 179.97 181.35 2qmd h ALA 409 N 1.34 1.63 -0.41 0.04 0.00 -1.54 -2.48 119.26 117.84 2qmd h ALA 409 Ca 0.33 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2qmd h ALA 409 Cb -0.11 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.46 2qmd h ALA 409 CO -0.08 0.32 0.00 0.54 0.00 0.00 0.00 179.25 180.03 2qmd n ARG 410 N -4.46 2.96 -3.87 0.00 1.74 -1.04 -4.99 116.66 107.00 2qmd n ARG 410 Ca 0.07 -2.34 -0.28 0.00 -0.77 0.00 0.00 57.85 54.53 2qmd n ARG 410 Cb 0.09 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 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 0.54 -2.70 -3.71 5.56 4.81 -0.26 -4.93 118.16 117.46 2qmd n LYS 411 Ca 0.16 0.42 -0.11 0.00 -0.87 0.00 0.00 58.31 57.91 2qmd n LYS 411 Cb 0.57 -4.38 -0.06 0.00 0.02 0.00 0.00 35.03 31.19 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 -6.40 0.96 -0.12 1.64 1.70 -0.69 -1.33 118.95 114.71 2qmd s ARG 412 Ca 0.15 -0.69 0.03 0.00 -0.47 0.00 0.00 55.73 54.75 2qmd s ARG 412 Cb -0.06 0.41 0.01 0.00 -0.57 0.00 0.00 34.95 34.74 2qmd s ARG 412 CO 0.88 -0.34 -0.22 0.42 -1.08 0.00 0.00 175.30 174.96 2qmd s ILE 413 N -3.44 1.99 -0.00 4.99 1.01 0.38 -1.24 121.20 124.89 2qmd s ILE 413 Ca 0.01 -0.95 -0.02 0.00 0.00 0.00 0.00 60.65 59.69 2qmd s ILE 413 Cb 0.02 -1.75 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 2qmd s ILE 413 CO -0.09 0.54 0.14 -0.83 0.00 0.00 0.00 174.94 174.70 2qmd s GLY 414 N 0.67 2.11 -0.04 6.18 0.00 0.39 -0.89 107.32 115.74 2qmd s GLY 414 Ca -0.11 -0.81 0.03 0.00 0.00 0.00 0.00 44.72 43.83 2qmd s GLY 414 CO 0.02 -0.70 -0.13 -1.36 0.00 0.00 0.00 173.10 170.92 2qmd s PHE 415 N -1.28 1.37 0.02 1.90 0.40 0.42 -0.49 117.98 120.33 2qmd s PHE 415 Ca 0.26 -0.40 -0.05 0.00 -0.60 0.00 0.00 56.93 56.14 2qmd s PHE 415 Cb -0.12 -0.96 -0.01 0.00 0.51 0.00 0.00 43.02 42.44 2qmd s PHE 415 CO 0.17 -0.16 0.09 0.00 0.70 0.00 0.00 175.22 176.02 2qmd s ALA 416 N 0.20 -0.13 0.16 5.36 0.00 -0.82 -1.21 121.76 125.31 2qmd s ALA 416 Ca -0.05 -0.39 -0.33 0.00 0.00 0.00 0.00 51.96 51.19 2qmd s ALA 416 Cb -0.11 0.17 -0.13 0.00 0.00 0.00 0.00 23.12 23.06 2qmd s ALA 416 CO 0.02 -0.24 1.68 0.28 0.00 0.00 0.00 175.76 177.50 2qmd n VAL 417 N 1.20 0.09 -2.42 0.00 0.31 -1.24 -0.39 118.33 115.89 2qmd n VAL 417 Ca -0.21 -0.02 -0.41 0.00 -0.01 0.00 0.00 64.34 63.69 2qmd n VAL 417 Cb 0.57 -1.80 -0.04 0.00 -0.91 0.00 0.00 33.84 31.66 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 1.46 7.14 0.00 4.52 0.15 -0.67 -1.61 113.70 124.70 2qmd s SER 418 Ca 0.79 2.19 0.11 0.00 0.70 0.00 0.00 55.95 59.73 2qmd s SER 418 Cb -0.59 -2.61 0.49 0.00 -1.71 0.00 0.00 66.02 61.60 2qmd s SER 418 CO 0.37 -0.32 1.32 0.00 1.20 0.00 0.00 173.24 175.81 2qmd n ALA 419 N 2.46 1.54 -0.79 5.45 0.00 -0.60 -2.38 120.51 126.19 2qmd n ALA 419 Ca 0.04 -0.04 0.07 0.00 0.00 0.00 0.00 53.44 53.51 2qmd n ALA 419 Cb 0.45 -1.18 0.11 0.00 0.00 0.00 0.00 19.45 18.83 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 -2.39 3.08 0.04 0.00 -0.00 -1.00 -4.56 115.29 110.46 2qmd s HIS 421 Ca 0.24 1.60 -0.26 0.00 -0.00 0.00 0.00 55.06 56.64 2qmd s HIS 421 Cb 0.21 -3.12 -0.05 0.00 -0.00 0.00 0.00 32.58 29.62 2qmd s HIS 421 CO 0.03 -0.82 0.83 0.08 -0.00 0.00 0.00 174.74 174.86 2qmd s VAL 422 N -1.82 4.73 0.00 -5.38 1.01 -1.26 -5.04 120.40 112.64 2qmd s VAL 422 Ca 0.63 1.76 0.00 0.00 0.00 0.00 0.00 61.98 64.37 2qmd s VAL 422 Cb -0.20 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.01 2qmd s VAL 422 CO 0.24 0.32 0.00 0.00 0.00 0.00 0.00 175.10 175.66 2qmd n HIS 423 N 3.04 -0.28 -4.24 5.22 -0.00 -1.26 -4.72 115.22 112.98 2qmd n HIS 423 Ca -0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 57.60 2qmd n HIS 423 Cb 0.50 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 30.46 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 -0.97 0.94 0.01 4.39 5.68 -1.18 -5.04 116.55 120.38 2qmd n ASP 424 Ca 0.00 -2.07 0.11 0.00 -0.50 0.00 0.00 54.79 52.33 2qmd n ASP 424 Cb 0.00 0.54 0.47 0.00 -1.14 0.00 0.00 41.12 40.99 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 -0.44 0.02 -0.05 0.11 0.00 -1.26 -3.80 120.64 115.22 2qmd n GLU 425 Ca -0.02 0.14 -0.02 0.00 0.00 0.00 0.00 57.16 57.26 2qmd n GLU 425 Cb 0.30 -1.53 -0.13 0.00 0.00 0.00 0.00 31.44 30.08 2qmd n GLU 425 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2qmd n PHE 426 N -1.57 0.00 -4.06 -1.84 3.01 -1.26 -5.02 117.46 106.71 2qmd n PHE 426 Ca 0.05 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.40 2qmd n PHE 426 Cb 0.27 -0.63 -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 -2.68 0.54 0.04 -1.08 0.52 -1.25 -5.16 118.95 109.88 2qmd s ARG 427 Ca -0.07 -0.89 0.00 0.00 -0.52 0.00 0.00 55.73 54.26 2qmd s ARG 427 Cb 0.07 -0.11 -0.03 0.00 0.52 0.00 0.00 34.95 35.40 2qmd s ARG 427 CO 0.66 -0.01 -0.04 -0.08 0.02 0.00 0.00 175.30 175.85 2qmd s THR 428 N -2.14 0.30 0.82 0.02 -1.32 -1.26 -3.11 115.64 108.94 2qmd s THR 428 Ca -0.05 -1.36 -0.10 0.00 -1.21 0.00 0.00 61.69 58.96 2qmd s THR 428 Cb -0.05 -0.91 0.09 0.00 -1.51 0.00 0.00 72.50 70.12 2qmd s THR 428 CO -0.02 -0.69 1.11 0.00 -2.21 0.00 0.00 174.62 172.81 2qmd s ALA 429 N -2.52 1.97 0.05 11.08 0.00 -1.26 -4.92 121.76 126.16 2qmd s ALA 429 Ca -0.04 0.39 -0.11 0.00 0.00 0.00 0.00 51.96 52.20 2qmd s ALA 429 Cb -0.02 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.77 2qmd s ALA 429 CO -0.04 -2.12 0.24 0.00 0.00 0.00 0.00 175.76 173.83 2qmd s ALA 430 N -2.80 -0.48 -0.15 0.00 0.00 -0.90 -4.96 121.76 112.48 2qmd s ALA 430 Ca 0.63 -0.20 -0.02 0.00 0.00 0.00 0.00 51.96 52.37 2qmd s ALA 430 Cb -0.19 0.33 0.05 0.00 0.00 0.00 0.00 23.12 23.30 2qmd s ALA 430 CO 0.56 -0.40 0.03 0.08 0.00 0.00 0.00 175.76 176.03 2qmd s VAL 431 N -2.72 0.43 0.02 0.00 1.01 -1.26 -0.20 120.40 117.68 2qmd s VAL 431 Ca -0.04 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.68 2qmd s VAL 431 Cb -0.00 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.55 2qmd s VAL 431 CO -0.05 -0.03 -0.04 -1.61 0.00 0.00 0.00 175.10 173.37 2qmd s GLU 432 N 1.92 0.34 0.07 2.72 2.02 -0.32 -4.87 118.70 120.57 2qmd s GLU 432 Ca 0.02 -0.42 -0.26 0.00 0.02 0.00 0.00 54.97 54.32 2qmd s GLU 432 Cb -0.15 -0.17 0.09 0.00 0.10 0.00 0.00 34.13 34.01 2qmd s GLU 432 CO -0.07 0.03 1.17 0.20 0.02 0.00 0.00 175.26 176.61 2qmd s GLY 433 N -0.85 -0.12 0.36 -1.39 0.00 -1.26 -0.55 107.32 103.50 2qmd s GLY 433 Ca -0.06 0.07 0.06 0.00 0.00 0.00 0.00 44.72 44.79 2qmd s GLY 433 CO -0.00 2.78 0.50 2.56 0.00 0.00 0.00 173.10 178.94 2qmd s PRO 434 N -2.29 3.07 -0.02 2.90 0.04 -1.26 -5.08 135.00 132.36 2qmd s PRO 434 Ca 0.22 -1.02 0.05 0.00 0.04 0.00 0.00 61.00 60.29 2qmd s PRO 434 Cb -0.00 -2.80 -0.01 0.00 0.04 0.00 0.00 34.50 31.73 2qmd s PRO 434 CO 0.01 -0.01 -0.16 -0.06 0.04 0.00 0.00 177.00 176.81 2qmd s PHE 435 N -2.23 1.50 -0.19 0.56 0.40 -0.08 -4.95 117.98 112.99 2qmd s PHE 435 Ca 0.47 -0.31 -0.29 0.00 -0.60 0.00 0.00 56.93 56.19 2qmd s PHE 435 Cb -0.10 -0.98 -0.01 0.00 0.51 0.00 0.00 43.02 42.45 2qmd s PHE 435 CO 0.32 -0.05 1.23 0.08 0.70 0.00 0.00 175.22 177.50 2qmd s VAL 436 N -0.29 4.33 -0.07 -0.44 1.01 -1.26 -0.80 120.40 122.87 2qmd s VAL 436 Ca 0.04 1.60 -0.01 0.00 0.00 0.00 0.00 61.98 63.62 2qmd s VAL 436 Cb -0.07 -4.06 0.03 0.00 0.00 0.00 0.00 36.38 32.27 2qmd s VAL 436 CO -0.00 -0.17 -0.02 -0.89 0.00 0.00 0.00 175.10 174.02 2qmd s THR 437 N 3.53 0.49 0.22 3.92 2.01 -0.09 -4.92 115.64 120.80 2qmd s THR 437 Ca 0.53 0.01 -0.05 0.00 0.31 0.00 0.00 61.69 62.49 2qmd s THR 437 Cb -0.20 -0.60 -0.06 0.00 0.01 0.00 0.00 72.50 71.65 2qmd s THR 437 CO 0.14 0.26 0.48 -0.76 -0.69 0.00 0.00 174.62 174.06 2qmd s LEU 438 N 1.68 4.16 -1.35 4.42 1.43 -1.26 -4.14 118.68 123.62 2qmd s LEU 438 Ca 0.01 0.69 -0.06 0.00 -1.03 0.00 0.00 54.13 53.74 2qmd s LEU 438 Cb -0.13 -3.46 0.03 0.00 0.03 0.00 0.00 46.19 42.66 2qmd s LEU 438 CO -0.04 -0.08 0.42 0.47 0.23 0.00 0.00 176.35 177.35 2qmd n ASP 439 N -0.42 -4.63 0.21 2.29 10.43 -1.26 -4.84 116.55 118.34 2qmd n ASP 439 Ca -0.02 -0.23 0.14 0.00 2.57 0.00 0.00 54.79 57.25 2qmd n ASP 439 Cb 0.53 -3.81 0.77 0.00 1.84 0.00 0.00 41.12 40.45 2qmd n ASP 439 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 2qmd h MET 440 N -0.88 0.00 0.00 -1.24 2.86 -2.00 -0.86 114.93 112.80 2qmd h MET 440 Ca -0.44 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.18 2qmd h MET 440 Cb 1.30 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.96 2qmd h MET 440 CO 0.51 0.00 -0.09 0.93 1.06 0.00 0.00 176.91 179.32 2qmd h GLU 441 N 0.00 0.00 0.00 1.72 5.08 -1.97 -2.40 114.58 117.01 2qmd h GLU 441 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2qmd h GLU 441 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2qmd h GLU 441 CO 0.00 0.09 0.00 -0.25 -1.00 0.00 0.00 179.01 177.85 2qmd n ASP 442 N -3.16 0.00 0.18 1.42 8.00 -0.33 -2.28 116.55 120.38 2qmd n ASP 442 Ca 0.02 0.44 0.12 0.00 0.71 0.00 0.00 54.79 56.09 2qmd n ASP 442 Cb 0.46 -0.48 0.24 0.00 -0.02 0.00 0.00 41.12 41.31 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 -4.01 3.09 -0.02 0.00 0.00 -0.97 -4.03 107.32 101.38 2qmd s GLY 444 Ca 0.08 0.65 -0.17 0.00 0.00 0.00 0.00 44.72 45.27 2qmd s GLY 444 CO 0.65 1.21 0.48 -0.47 0.00 0.00 0.00 173.10 174.98 2qmd s TYR 445 N -1.21 3.68 -1.21 1.90 5.04 -1.26 -4.98 117.35 119.30 2qmd s TYR 445 Ca 0.42 1.04 0.10 0.00 -2.44 0.00 0.00 57.07 56.19 2qmd s TYR 445 Cb -0.26 -2.44 0.08 0.00 0.35 0.00 0.00 41.96 39.68 2qmd s TYR 445 CO 0.33 0.46 0.81 0.09 -1.34 0.00 0.00 175.55 175.89