#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kmy s SER 59 N 0.00 -0.19 -0.56 1.61 1.04 -1.26 -2.30 113.70 112.04 3kmy s SER 59 Ca 0.00 0.42 0.07 0.00 0.48 0.00 0.00 55.95 56.92 3kmy s SER 59 Cb 0.00 0.31 0.27 0.00 0.10 0.00 0.00 66.02 66.70 3kmy s SER 59 CO 0.00 -0.16 0.74 0.49 0.98 0.00 0.00 173.24 175.29 3kmy n PHE 60 N 4.23 2.75 -0.35 5.02 3.01 -1.26 -4.95 117.46 125.92 3kmy n PHE 60 Ca -0.26 -3.99 0.26 0.00 1.01 0.00 0.00 57.45 54.47 3kmy n PHE 60 Cb 0.52 -0.50 0.55 0.00 -0.01 0.00 0.00 39.48 40.04 3kmy n PHE 60 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3kmy h VAL 61 N 2.77 0.43 0.00 -4.37 2.07 -1.97 0.90 116.25 116.08 3kmy h VAL 61 Ca 0.16 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.57 3kmy h VAL 61 Cb 0.69 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 3kmy h VAL 61 CO 0.74 0.06 0.00 1.05 0.02 0.00 0.00 177.57 179.44 3kmy h GLU 62 N 0.31 0.00 0.00 1.57 9.09 -1.96 -3.10 114.58 120.49 3kmy h GLU 62 Ca 0.64 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.05 3kmy h GLU 62 Cb 1.77 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.87 3kmy h GLU 62 CO -0.32 0.00 -1.08 -1.33 0.05 0.00 0.00 179.01 176.33 3kmy n MET 63 N -2.66 1.67 -1.89 1.06 2.81 0.27 -4.45 117.12 113.93 3kmy n MET 63 Ca 0.01 -0.06 -0.41 0.00 -1.81 0.00 0.00 57.70 55.43 3kmy n MET 63 Cb 0.22 -1.17 -0.01 0.00 -0.71 0.00 0.00 33.22 31.55 3kmy n MET 63 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3kmy s VAL 64 N -2.49 2.29 -1.37 2.03 1.01 -0.97 -2.60 120.40 118.30 3kmy s VAL 64 Ca -0.00 0.26 -0.03 0.00 0.00 0.00 0.00 61.98 62.22 3kmy s VAL 64 Cb 0.08 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.30 3kmy s VAL 64 CO 0.49 0.05 0.34 0.47 0.00 0.00 0.00 175.10 176.45 3kmy n ASP 65 N 1.37 -5.29 -0.77 3.32 10.43 -1.19 -4.91 116.55 119.51 3kmy n ASP 65 Ca 0.04 -0.16 0.10 0.00 2.57 0.00 0.00 54.79 57.34 3kmy n ASP 65 Cb 0.39 -4.22 0.29 0.00 1.84 0.00 0.00 41.12 39.43 3kmy n ASP 65 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 3kmy n ASN 66 N -1.64 2.29 -4.66 -2.24 6.94 -0.96 -4.85 115.26 110.14 3kmy n ASN 66 Ca -0.13 -1.85 -0.26 0.00 -0.02 0.00 0.00 54.58 52.32 3kmy n ASN 66 Cb 0.62 -0.18 -0.08 0.00 -2.36 0.00 0.00 39.78 37.78 3kmy n ASN 66 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3kmy s LEU 67 N -1.42 3.30 0.12 -4.53 1.43 -0.58 -4.44 118.68 112.56 3kmy s LEU 67 Ca 0.33 -0.43 -0.04 0.00 -1.03 0.00 0.00 54.13 52.96 3kmy s LEU 67 Cb 0.18 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 3kmy s LEU 67 CO 0.26 0.07 0.12 -0.13 0.23 0.00 0.00 176.35 176.91 3kmy s ARG 68 N -3.06 0.94 0.00 1.70 0.52 -0.95 -0.06 118.95 118.04 3kmy s ARG 68 Ca 0.28 -1.28 0.00 0.00 -0.52 0.00 0.00 55.73 54.21 3kmy s ARG 68 Cb -0.09 0.29 0.00 0.00 0.52 0.00 0.00 34.95 35.67 3kmy s ARG 68 CO 0.19 -0.29 0.00 0.41 0.02 0.00 0.00 175.30 175.63 3kmy n GLY 69 N -0.10 0.40 3.57 -3.53 0.00 -1.26 -0.79 105.19 103.48 3kmy n GLY 69 Ca -0.08 -2.29 -0.10 0.00 0.00 0.00 0.00 46.02 43.55 3kmy n GLY 69 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kmy s LYS 70 N -0.05 1.44 0.35 1.61 -2.85 -1.04 -4.71 119.74 114.50 3kmy s LYS 70 Ca 0.00 -0.77 0.09 0.00 -1.00 0.00 0.00 55.97 54.30 3kmy s LYS 70 Cb 0.00 0.56 0.84 0.00 -2.06 0.00 0.00 37.83 37.17 3kmy s LYS 70 CO 0.00 -0.63 1.85 0.66 0.10 0.00 0.00 175.35 177.33 3kmy h SER 71 N 2.09 0.65 0.63 0.03 4.64 -1.93 0.59 113.55 120.24 3kmy h SER 71 Ca -0.28 0.05 -0.09 0.00 -0.47 0.00 0.00 61.79 61.00 3kmy h SER 71 Cb 1.27 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 3kmy h SER 71 CO 0.34 0.31 -0.42 1.23 -0.87 0.00 0.00 176.83 177.42 3kmy h GLY 72 N 0.67 0.00 0.00 -0.77 0.00 -1.96 -3.33 103.07 97.69 3kmy h GLY 72 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 3kmy h GLY 72 CO -0.23 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.25 3kmy n GLN 73 N -3.75 0.81 0.00 4.80 6.02 -0.89 -5.00 117.38 119.37 3kmy n GLN 73 Ca -0.01 -0.34 0.00 0.00 -0.01 0.00 0.00 57.00 56.64 3kmy n GLN 73 Cb 0.49 -0.82 0.00 0.00 1.02 0.00 0.00 30.24 30.93 3kmy n GLN 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kmy n GLY 74 N 0.21 1.83 3.72 1.08 0.00 0.20 -4.87 105.19 107.36 3kmy n GLY 74 Ca 0.00 -1.78 -0.35 0.00 0.00 0.00 0.00 46.02 43.89 3kmy n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kmy s TYR 75 N -2.53 3.32 0.14 1.61 1.51 -1.26 -2.49 117.35 117.65 3kmy s TYR 75 Ca 0.00 0.24 0.04 0.00 -1.01 0.00 0.00 57.07 56.34 3kmy s TYR 75 Cb 0.00 -1.95 -0.04 0.00 -0.11 0.00 0.00 41.96 39.85 3kmy s TYR 75 CO 0.00 0.41 -0.09 1.52 -1.11 0.00 0.00 175.55 176.28 3kmy s TYR 76 N -0.40 1.18 0.08 2.71 -0.85 0.03 -0.81 117.35 119.30 3kmy s TYR 76 Ca 0.09 -0.79 0.07 0.00 -0.52 0.00 0.00 57.07 55.92 3kmy s TYR 76 Cb -0.12 -0.62 -0.03 0.00 0.38 0.00 0.00 41.96 41.57 3kmy s TYR 76 CO 0.02 0.03 -0.19 0.54 -1.52 0.00 0.00 175.55 174.43 3kmy s VAL 77 N -3.39 1.52 0.24 -3.49 0.11 -0.05 -2.23 120.40 113.11 3kmy s VAL 77 Ca 0.16 -1.41 -0.30 0.00 -2.93 0.00 0.00 61.98 57.50 3kmy s VAL 77 Cb 0.03 -1.39 -0.09 0.00 -1.53 0.00 0.00 36.38 33.40 3kmy s VAL 77 CO -0.01 -0.06 0.93 -0.70 -3.33 0.00 0.00 175.10 171.93 3kmy s GLU 78 N -1.73 4.84 0.13 1.54 2.12 -1.26 -0.69 118.70 123.65 3kmy s GLU 78 Ca 0.04 1.47 -0.03 0.00 0.36 0.00 0.00 54.97 56.81 3kmy s GLU 78 Cb -0.10 -3.26 -0.03 0.00 0.26 0.00 0.00 34.13 31.00 3kmy s GLU 78 CO 0.03 0.51 0.10 -1.64 -0.54 0.00 0.00 175.26 173.72 3kmy s MET 79 N -1.22 0.94 0.02 4.30 -1.94 0.08 -4.12 119.30 117.37 3kmy s MET 79 Ca 0.41 -1.35 0.05 0.00 -1.71 0.00 0.00 55.69 53.09 3kmy s MET 79 Cb -0.26 0.27 -0.02 0.00 2.01 0.00 0.00 34.83 36.84 3kmy s MET 79 CO 0.31 -0.28 -0.14 0.95 -0.01 0.00 0.00 175.02 175.85 3kmy s THR 80 N -4.01 1.13 0.03 2.05 -4.23 -0.49 -0.71 115.64 109.40 3kmy s THR 80 Ca 0.21 -0.88 0.03 0.00 -1.18 0.00 0.00 61.69 59.87 3kmy s THR 80 Cb 0.07 -1.00 -0.02 0.00 1.34 0.00 0.00 72.50 72.89 3kmy s THR 80 CO -0.00 0.11 -0.10 0.68 -0.54 0.00 0.00 174.62 174.77 3kmy s VAL 81 N -0.68 0.75 0.00 2.29 -7.23 -0.05 -1.86 120.40 113.62 3kmy s VAL 81 Ca 0.03 -0.79 0.00 0.00 -1.81 0.00 0.00 61.98 59.41 3kmy s VAL 81 Cb -0.07 -0.70 0.00 0.00 0.56 0.00 0.00 36.38 36.17 3kmy s VAL 81 CO 0.01 -0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.34 3kmy n GLY 82 N 2.10 -1.26 2.76 2.32 0.00 -0.58 -0.59 105.19 109.94 3kmy n GLY 82 Ca -0.18 -1.59 -0.25 0.00 0.00 0.00 0.00 46.02 44.00 3kmy n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kmy s SER 83 N -3.03 2.11 0.82 1.61 0.01 -1.26 -2.79 113.70 111.16 3kmy s SER 83 Ca 0.00 -0.37 -0.12 0.00 1.31 0.00 0.00 55.95 56.77 3kmy s SER 83 Cb 0.00 -0.51 0.09 0.00 0.21 0.00 0.00 66.02 65.80 3kmy s SER 83 CO 0.00 -0.23 1.14 -2.16 0.41 0.00 0.00 173.24 172.40 3kmy s PRO 84 N 1.92 1.75 0.15 12.44 0.04 -1.26 -0.94 135.00 149.09 3kmy s PRO 84 Ca 0.03 1.46 -0.33 0.00 0.04 0.00 0.00 61.00 62.20 3kmy s PRO 84 Cb -0.14 -1.82 -0.13 0.00 0.04 0.00 0.00 34.50 32.45 3kmy s PRO 84 CO -0.06 -2.07 1.64 -2.30 0.04 0.00 0.00 177.00 174.24 3kmy n PRO 85 N -3.59 2.31 -3.81 0.56 -0.02 -1.12 -4.91 135.00 124.42 3kmy n PRO 85 Ca 0.11 0.84 -0.36 0.00 -2.02 0.00 0.00 63.50 62.06 3kmy n PRO 85 Cb 0.52 -2.63 -0.13 0.00 -0.02 0.00 0.00 33.50 31.24 3kmy n PRO 85 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3kmy s GLN 86 N 1.27 3.19 0.09 -0.52 -0.21 0.25 -4.89 119.66 118.84 3kmy s GLN 86 Ca 0.79 -0.78 -0.30 0.00 0.02 0.00 0.00 55.36 55.09 3kmy s GLN 86 Cb -0.63 -3.25 -0.05 0.00 1.00 0.00 0.00 33.01 30.07 3kmy s GLN 86 CO 0.38 -0.36 0.96 0.99 -2.12 0.00 0.00 175.29 175.13 3kmy s THR 87 N 1.49 4.57 -0.02 -0.19 2.01 -1.26 -0.87 115.64 121.37 3kmy s THR 87 Ca 0.03 2.05 -0.07 0.00 0.31 0.00 0.00 61.69 64.02 3kmy s THR 87 Cb -0.16 -4.31 0.01 0.00 0.01 0.00 0.00 72.50 68.04 3kmy s THR 87 CO 0.01 0.29 0.14 -0.76 -0.69 0.00 0.00 174.62 173.61 3kmy s LEU 88 N 0.15 1.51 -0.17 4.42 1.43 0.11 -4.95 118.68 121.18 3kmy s LEU 88 Ca 0.47 -0.03 -0.17 0.00 -1.03 0.00 0.00 54.13 53.37 3kmy s LEU 88 Cb -0.23 0.62 -0.04 0.00 0.03 0.00 0.00 46.19 46.57 3kmy s LEU 88 CO 0.29 -0.26 0.44 0.20 0.23 0.00 0.00 176.35 177.25 3kmy s ASN 89 N -0.88 6.55 -0.12 2.29 0.02 -1.26 -0.74 114.94 120.80 3kmy s ASN 89 Ca -0.10 0.65 0.03 0.00 -1.02 0.00 0.00 52.86 52.43 3kmy s ASN 89 Cb -0.05 -2.26 0.01 0.00 0.02 0.00 0.00 41.25 38.96 3kmy s ASN 89 CO 0.01 -0.06 -0.21 -0.63 0.02 0.00 0.00 177.10 176.23 3kmy s ILE 90 N 1.07 1.94 0.15 0.60 -1.09 0.14 -0.12 121.20 123.89 3kmy s ILE 90 Ca 0.22 -0.93 -0.31 0.00 -2.23 0.00 0.00 60.65 57.40 3kmy s ILE 90 Cb -0.15 -1.71 -0.10 0.00 -1.58 0.00 0.00 42.46 38.92 3kmy s ILE 90 CO 0.09 0.53 1.63 -0.22 -1.23 0.00 0.00 174.94 175.73 3kmy s LEU 91 N 0.67 4.37 -0.39 2.97 2.96 0.18 -0.87 118.68 128.56 3kmy s LEU 91 Ca -0.11 2.64 -0.25 0.00 -0.22 0.00 0.00 54.13 56.18 3kmy s LEU 91 Cb -0.16 -3.59 0.02 0.00 0.50 0.00 0.00 46.19 42.96 3kmy s LEU 91 CO 0.02 -0.87 0.91 -0.69 -1.32 0.00 0.00 176.35 174.40 3kmy s VAL 92 N 1.57 4.56 -0.27 1.68 1.01 0.01 0.16 120.40 129.12 3kmy s VAL 92 Ca 0.72 1.04 0.00 0.00 0.00 0.00 0.00 61.98 63.75 3kmy s VAL 92 Cb -0.44 -4.35 0.08 0.00 0.00 0.00 0.00 36.38 31.67 3kmy s VAL 92 CO 0.32 -0.61 0.02 -0.62 0.00 0.00 0.00 175.10 174.21 3kmy s ASP 93 N 1.99 3.92 0.00 3.32 2.15 -0.70 -4.37 116.67 122.98 3kmy s ASP 93 Ca 0.37 -1.43 0.27 0.00 0.43 0.00 0.00 52.55 52.20 3kmy s ASP 93 Cb -0.11 -1.06 1.62 0.00 -0.30 0.00 0.00 42.92 43.06 3kmy s ASP 93 CO 0.21 -0.33 2.04 0.35 -0.17 0.00 0.00 175.17 177.27 3kmy n THR 94 N 4.72 0.00 0.16 1.71 -2.24 -1.26 -0.87 114.28 116.50 3kmy n THR 94 Ca -0.06 -0.01 0.12 0.00 -2.27 0.00 0.00 64.05 61.83 3kmy n THR 94 Cb 0.43 -0.41 0.25 0.00 -2.10 0.00 0.00 70.33 68.51 3kmy n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kmy n GLY 95 N 0.93 1.88 3.47 3.38 0.00 -1.26 -4.22 105.19 109.37 3kmy n GLY 95 Ca 0.20 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.35 3kmy n GLY 95 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3kmy s SER 96 N -1.34 0.58 -0.03 1.61 1.04 -1.23 -4.98 113.70 109.34 3kmy s SER 96 Ca 0.42 -1.34 0.05 0.00 0.48 0.00 0.00 55.95 55.56 3kmy s SER 96 Cb 0.23 0.61 0.08 0.00 0.10 0.00 0.00 66.02 67.03 3kmy s SER 96 CO 0.32 -1.19 0.92 -1.20 0.98 0.00 0.00 173.24 173.07 3kmy n SER 97 N -1.00 1.10 -4.60 7.02 7.64 -1.26 -0.56 113.62 121.95 3kmy n SER 97 Ca 0.01 -2.05 -0.33 0.00 1.01 0.00 0.00 58.87 57.51 3kmy n SER 97 Cb 0.62 -0.16 -0.10 0.00 -1.01 0.00 0.00 64.21 63.55 3kmy n SER 97 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3kmy s ASN 98 N -1.26 4.71 -0.41 6.43 -0.87 -1.26 -4.49 114.94 117.79 3kmy s ASN 98 Ca 0.08 -0.08 -0.16 0.00 -1.57 0.00 0.00 52.86 51.14 3kmy s ASN 98 Cb 0.07 -1.15 0.02 0.00 -0.02 0.00 0.00 41.25 40.17 3kmy s ASN 98 CO 0.01 0.31 0.35 0.12 -2.57 0.00 0.00 177.10 175.32 3kmy s PHE 99 N -0.94 3.22 -0.01 2.20 5.99 -1.26 -1.13 117.98 126.05 3kmy s PHE 99 Ca 0.16 -0.51 0.03 0.00 0.00 0.00 0.00 56.93 56.60 3kmy s PHE 99 Cb -0.11 -2.69 -0.00 0.00 0.00 0.00 0.00 43.02 40.21 3kmy s PHE 99 CO 0.06 -0.63 -0.09 0.00 -0.00 0.00 0.00 175.22 174.56 3kmy s ALA 100 N 1.84 0.75 0.04 11.12 0.00 -0.73 -1.33 121.76 133.45 3kmy s ALA 100 Ca 0.07 -0.37 0.02 0.00 0.00 0.00 0.00 51.96 51.69 3kmy s ALA 100 Cb -0.18 -0.21 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 3kmy s ALA 100 CO 0.11 0.17 -0.07 0.14 0.00 0.00 0.00 175.76 176.11 3kmy s VAL 101 N -0.13 0.52 0.30 0.00 -7.23 -0.43 0.06 120.40 113.49 3kmy s VAL 101 Ca 0.02 -0.99 -0.30 0.00 -1.81 0.00 0.00 61.98 58.91 3kmy s VAL 101 Cb -0.04 -0.58 -0.11 0.00 0.56 0.00 0.00 36.38 36.21 3kmy s VAL 101 CO -0.00 -0.33 1.60 -0.83 -0.31 0.00 0.00 175.10 175.23 3kmy s GLY 102 N -1.42 2.16 -0.03 2.32 0.00 0.23 -0.41 107.32 110.17 3kmy s GLY 102 Ca -0.09 1.60 0.05 0.00 0.00 0.00 0.00 44.72 46.28 3kmy s GLY 102 CO 0.00 2.55 0.95 0.00 0.00 0.00 0.00 173.10 176.60 3kmy n ALA 103 N 2.02 1.88 -3.28 3.20 0.00 -0.52 -0.54 120.51 123.26 3kmy n ALA 103 Ca 0.08 -1.32 -0.14 0.00 0.00 0.00 0.00 53.44 52.05 3kmy n ALA 103 Cb 0.37 -0.32 -0.06 0.00 0.00 0.00 0.00 19.45 19.44 3kmy n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kmy s ALA 104 N -0.84 -1.23 0.31 0.00 0.00 -1.24 -4.78 121.76 113.98 3kmy s ALA 104 Ca 0.08 0.57 -0.28 0.00 0.00 0.00 0.00 51.96 52.33 3kmy s ALA 104 Cb 0.07 0.30 -0.13 0.00 0.00 0.00 0.00 23.12 23.36 3kmy s ALA 104 CO 0.01 -0.45 1.11 -2.30 0.00 0.00 0.00 175.76 174.13 3kmy n PRO 105 N 0.58 1.63 -3.76 0.00 -0.02 -1.26 -4.96 135.00 127.22 3kmy n PRO 105 Ca -0.19 0.57 -0.13 0.00 -2.02 0.00 0.00 63.50 61.74 3kmy n PRO 105 Cb 0.59 -2.03 -0.11 0.00 -0.02 0.00 0.00 33.50 31.94 3kmy n PRO 105 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3kmy s HIS 106 N -1.08 -0.37 0.55 6.00 2.46 -1.26 -5.05 115.29 116.54 3kmy s HIS 106 Ca 0.58 0.89 0.29 0.00 0.47 0.00 0.00 55.06 57.28 3kmy s HIS 106 Cb -0.65 0.13 1.46 0.00 -0.13 0.00 0.00 32.58 33.39 3kmy s HIS 106 CO 0.61 -0.19 1.93 -1.00 -2.47 0.00 0.00 174.74 173.61 3kmy h PRO 107 N 5.50 0.00 -0.02 2.88 0.13 -2.04 -1.13 132.00 137.32 3kmy h PRO 107 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3kmy h PRO 107 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3kmy h PRO 107 CO 0.30 0.00 -0.09 1.19 -0.23 0.00 0.00 178.00 179.17 3kmy n PHE 108 N -4.11 0.00 -4.91 1.56 0.99 -1.26 -4.89 117.46 104.84 3kmy n PHE 108 Ca 0.12 0.00 -0.33 0.00 -0.00 0.00 0.00 57.45 57.24 3kmy n PHE 108 Cb 0.74 -0.03 -0.13 0.00 -1.00 0.00 0.00 39.48 39.06 3kmy n PHE 108 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3kmy s LEU 109 N -2.15 2.68 -0.02 4.37 1.43 -0.43 -4.70 118.68 119.86 3kmy s LEU 109 Ca 0.32 -0.23 0.12 0.00 -1.03 0.00 0.00 54.13 53.31 3kmy s LEU 109 Cb 0.20 -1.54 0.36 0.00 0.03 0.00 0.00 46.19 45.24 3kmy s LEU 109 CO 0.39 0.32 1.30 0.00 0.23 0.00 0.00 176.35 178.59 3kmy n HIS 110 N 2.45 0.57 -3.57 0.29 1.44 -1.26 -4.58 115.22 110.56 3kmy n HIS 110 Ca -0.17 -0.53 -0.08 0.00 -2.01 0.00 0.00 57.72 54.93 3kmy n HIS 110 Cb 0.52 -0.05 -0.03 0.00 0.12 0.00 0.00 29.99 30.54 3kmy n HIS 110 CO 0.00 0.00 0.00 -0.98 -2.81 0.00 0.00 176.34 172.55 3kmy s ARG 111 N -1.17 0.52 0.27 -1.40 1.70 -1.26 -5.18 118.95 112.42 3kmy s ARG 111 Ca 0.27 -0.04 -0.21 0.00 -0.47 0.00 0.00 55.73 55.28 3kmy s ARG 111 Cb 0.15 0.24 0.03 0.00 -0.57 0.00 0.00 34.95 34.80 3kmy s ARG 111 CO 0.17 -0.20 0.71 1.52 -1.08 0.00 0.00 175.30 176.42 3kmy s TYR 112 N -1.91 -0.22 -0.11 5.89 -0.85 -1.26 -4.92 117.35 113.98 3kmy s TYR 112 Ca 0.04 -0.21 -0.29 0.00 -0.52 0.00 0.00 57.07 56.08 3kmy s TYR 112 Cb -0.01 0.70 -0.04 0.00 0.38 0.00 0.00 41.96 42.99 3kmy s TYR 112 CO -0.04 -1.20 1.45 -0.47 -1.52 0.00 0.00 175.55 173.78 3kmy s TYR 113 N -3.90 2.43 -0.66 -3.49 5.04 0.29 -4.94 117.35 112.13 3kmy s TYR 113 Ca 0.10 0.61 -0.06 0.00 -2.44 0.00 0.00 57.07 55.28 3kmy s TYR 113 Cb -0.05 -3.71 0.17 0.00 0.35 0.00 0.00 41.96 38.72 3kmy s TYR 113 CO 0.05 -2.75 0.51 -0.65 -1.34 0.00 0.00 175.55 171.37 3kmy s GLN 114 N 3.70 2.81 0.27 4.97 -0.21 -1.26 -4.37 119.66 125.57 3kmy s GLN 114 Ca 0.64 -2.44 0.00 0.00 0.02 0.00 0.00 55.36 53.58 3kmy s GLN 114 Cb -0.28 -3.92 0.57 0.00 1.00 0.00 0.00 33.01 30.38 3kmy s GLN 114 CO 0.22 -1.20 1.77 0.00 -2.12 0.00 0.00 175.29 173.96 3kmy h ARG 115 N 7.36 0.65 0.00 2.91 3.08 -1.93 -1.34 114.38 125.11 3kmy h ARG 115 Ca -0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3kmy h ARG 115 Cb 0.99 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.89 3kmy h ARG 115 CO 0.74 0.43 0.00 0.00 -1.07 0.00 0.00 179.97 180.07 3kmy n GLN 116 N -4.83 0.05 -0.05 0.04 0.00 -1.26 -1.78 117.38 109.54 3kmy n GLN 116 Ca 0.18 0.37 0.12 0.00 0.00 0.00 0.00 57.00 57.67 3kmy n GLN 116 Cb 0.45 -1.62 0.15 0.00 0.00 0.00 0.00 30.24 29.22 3kmy n GLN 116 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3kmy n LEU 117 N -1.72 3.06 -4.39 2.61 4.77 -0.51 -4.88 117.00 115.95 3kmy n LEU 117 Ca 0.02 -1.11 -0.36 0.00 -0.03 0.00 0.00 56.01 54.53 3kmy n LEU 117 Cb 0.14 -0.07 -0.13 0.00 -2.33 0.00 0.00 43.42 41.03 3kmy n LEU 117 CO 0.12 0.56 -0.31 -0.55 -1.33 0.00 0.00 177.39 175.87 3kmy s SER 118 N -1.86 4.90 0.46 -1.43 0.15 -0.74 -4.25 113.70 110.93 3kmy s SER 118 Ca 0.31 -0.36 0.30 0.00 0.70 0.00 0.00 55.95 56.90 3kmy s SER 118 Cb 0.21 -1.86 1.15 0.00 -1.71 0.00 0.00 66.02 63.81 3kmy s SER 118 CO 0.31 -0.06 1.88 0.77 1.20 0.00 0.00 173.24 177.33 3kmy h SER 119 N 8.20 0.00 -0.60 5.45 4.64 -1.34 -2.93 113.55 126.97 3kmy h SER 119 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3kmy h SER 119 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3kmy h SER 119 CO 0.59 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.90 3kmy n THR 120 N -2.86 0.82 -2.23 2.95 -2.24 -1.26 -4.97 114.28 104.49 3kmy n THR 120 Ca 0.01 -0.91 -0.41 0.00 -2.27 0.00 0.00 64.05 60.48 3kmy n THR 120 Cb 0.32 0.67 -0.03 0.00 -2.10 0.00 0.00 70.33 69.19 3kmy n THR 120 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3kmy s TYR 121 N -1.16 3.24 -0.11 4.78 5.04 -1.11 -4.42 117.35 123.60 3kmy s TYR 121 Ca 0.44 1.41 -0.00 0.00 -2.44 0.00 0.00 57.07 56.47 3kmy s TYR 121 Cb 0.24 -3.57 0.02 0.00 0.35 0.00 0.00 41.96 39.01 3kmy s TYR 121 CO 0.32 -1.58 -0.07 1.03 -1.34 0.00 0.00 175.55 173.91 3kmy s ARG 122 N -1.11 1.47 -0.13 4.97 0.52 -0.13 -4.99 118.95 119.56 3kmy s ARG 122 Ca 0.51 -0.23 -0.28 0.00 -0.52 0.00 0.00 55.73 55.20 3kmy s ARG 122 Cb -0.37 -1.54 -0.01 0.00 0.52 0.00 0.00 34.95 33.55 3kmy s ARG 122 CO 0.45 -0.26 0.94 0.34 0.02 0.00 0.00 175.30 176.79 3kmy s ASP 123 N 1.70 7.14 0.00 0.23 2.15 -1.26 -0.62 116.67 126.00 3kmy s ASP 123 Ca 0.05 1.40 0.27 0.00 0.43 0.00 0.00 52.55 54.70 3kmy s ASP 123 Cb -0.13 -2.52 0.91 0.00 -0.30 0.00 0.00 42.92 40.89 3kmy s ASP 123 CO -0.08 -0.43 1.66 0.18 -0.17 0.00 0.00 175.17 176.33 3kmy n LEU 124 N 5.12 0.83 -3.85 -1.34 4.77 -0.82 -4.95 117.00 116.75 3kmy n LEU 124 Ca 0.07 -0.17 -0.28 0.00 -0.03 0.00 0.00 56.01 55.61 3kmy n LEU 124 Cb 0.49 -0.15 0.03 0.00 -2.33 0.00 0.00 43.42 41.46 3kmy n LEU 124 CO 0.51 0.16 0.07 0.54 -1.33 0.00 0.00 177.39 177.33 3kmy n ARG 125 N -0.76 -5.44 -3.78 3.23 1.74 -1.25 -4.98 116.66 105.41 3kmy n ARG 125 Ca 0.13 0.61 -0.13 0.00 -0.77 0.00 0.00 57.85 57.69 3kmy n ARG 125 Cb 0.32 -5.41 -0.11 0.00 -1.02 0.00 0.00 32.46 26.25 3kmy n ARG 125 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 3kmy s LYS 126 N -6.46 0.42 0.49 5.56 2.20 -1.26 -5.05 119.74 115.64 3kmy s LYS 126 Ca 0.49 0.18 0.04 0.00 -0.36 0.00 0.00 55.97 56.32 3kmy s LYS 126 Cb -0.25 0.19 0.02 0.00 -1.51 0.00 0.00 37.83 36.29 3kmy s LYS 126 CO 0.82 -0.08 0.68 0.20 -0.36 0.00 0.00 175.35 176.62 3kmy s GLY 127 N -0.34 1.88 -0.17 5.54 0.00 -1.26 -0.38 107.32 112.59 3kmy s GLY 127 Ca -0.05 -1.50 -0.08 0.00 0.00 0.00 0.00 44.72 43.10 3kmy s GLY 127 CO 0.01 -1.26 0.39 0.54 0.00 0.00 0.00 173.10 172.79 3kmy s VAL 128 N -2.57 -0.21 -0.18 1.40 0.11 -0.32 -4.81 120.40 113.83 3kmy s VAL 128 Ca 0.56 0.13 -0.00 0.00 -2.93 0.00 0.00 61.98 59.74 3kmy s VAL 128 Cb -0.10 -0.60 0.01 0.00 -1.53 0.00 0.00 36.38 34.16 3kmy s VAL 128 CO 0.36 0.05 -0.15 -0.47 -3.33 0.00 0.00 175.10 171.56 3kmy s TYR 129 N 1.76 2.81 -0.50 1.54 5.04 -1.26 -0.96 117.35 125.78 3kmy s TYR 129 Ca -0.07 -1.26 0.04 0.00 -2.44 0.00 0.00 57.07 53.34 3kmy s TYR 129 Cb -0.10 -1.94 0.13 0.00 0.35 0.00 0.00 41.96 40.40 3kmy s TYR 129 CO -0.12 -0.62 0.25 0.08 -1.34 0.00 0.00 175.55 173.80 3kmy s VAL 130 N 1.13 2.46 -0.02 3.14 1.01 -0.39 -4.97 120.40 122.76 3kmy s VAL 130 Ca 0.01 -3.21 -0.16 0.00 0.00 0.00 0.00 61.98 58.62 3kmy s VAL 130 Cb -0.14 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.47 3kmy s VAL 130 CO -0.06 -0.80 0.44 -2.16 0.00 0.00 0.00 175.10 172.53 3kmy s PRO 131 N -0.18 4.06 0.26 2.72 0.04 -1.26 -2.07 135.00 138.57 3kmy s PRO 131 Ca 0.17 0.45 0.05 0.00 0.04 0.00 0.00 61.00 61.71 3kmy s PRO 131 Cb -0.26 -3.28 -0.06 0.00 0.04 0.00 0.00 34.50 30.95 3kmy s PRO 131 CO -0.00 0.55 -0.03 0.71 0.04 0.00 0.00 177.00 178.26 3kmy s TYR 132 N -0.66 1.81 0.23 0.56 2.02 0.29 -4.98 117.35 116.63 3kmy s TYR 132 Ca 0.25 -0.79 -0.06 0.00 -0.37 0.00 0.00 57.07 56.10 3kmy s TYR 132 Cb -0.17 -1.05 0.22 0.00 -0.40 0.00 0.00 41.96 40.56 3kmy s TYR 132 CO 0.13 0.16 1.75 1.15 -1.57 0.00 0.00 175.55 177.17 3kmy h THR 133 N 2.34 1.25 0.00 -0.71 2.02 -2.03 -2.97 112.91 112.81 3kmy h THR 133 Ca -0.39 -0.94 0.00 0.00 0.77 0.00 0.00 66.41 65.85 3kmy h THR 133 Cb 1.23 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 3kmy h THR 133 CO 0.66 0.36 -0.38 0.00 0.37 0.00 0.00 175.52 176.53 3kmy n GLN 134 N -4.24 0.03 -3.16 6.66 0.00 -1.26 -5.02 117.38 110.39 3kmy n GLN 134 Ca 0.05 0.01 0.00 0.00 0.00 0.00 0.00 57.00 57.06 3kmy n GLN 134 Cb 0.26 -1.52 0.00 0.00 0.00 0.00 0.00 30.24 28.97 3kmy n GLN 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3kmy n GLY 135 N 1.48 -1.30 3.51 2.61 0.00 -1.12 -4.85 105.19 105.52 3kmy n GLY 135 Ca 0.06 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 45.01 3kmy n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kmy s LYS 136 N -0.87 0.94 0.00 1.61 -2.85 -0.27 0.11 119.74 118.41 3kmy s LYS 136 Ca 0.00 -0.02 -0.02 0.00 -1.00 0.00 0.00 55.97 54.93 3kmy s LYS 136 Cb 0.00 0.44 -0.01 0.00 -2.06 0.00 0.00 37.83 36.20 3kmy s LYS 136 CO 0.00 -0.34 0.03 1.67 0.10 0.00 0.00 175.35 176.81 3kmy s TRP 137 N -2.04 0.12 -0.05 1.78 1.48 -0.88 0.13 118.94 119.48 3kmy s TRP 137 Ca -0.03 -0.25 0.06 0.00 -1.06 0.00 0.00 56.10 54.82 3kmy s TRP 137 Cb -0.00 -0.10 -0.01 0.00 -1.16 0.00 0.00 33.47 32.20 3kmy s TRP 137 CO -0.00 -0.16 -0.25 -2.00 -4.06 0.00 0.00 176.95 170.47 3kmy s GLU 138 N -1.01 2.50 0.31 3.25 2.56 0.23 -1.26 118.70 125.28 3kmy s GLU 138 Ca -0.11 -0.91 -0.08 0.00 0.00 0.00 0.00 54.97 53.87 3kmy s GLU 138 Cb -0.07 -2.14 0.01 0.00 2.00 0.00 0.00 34.13 33.93 3kmy s GLU 138 CO -0.00 0.40 0.51 0.20 -0.56 0.00 0.00 175.26 175.81 3kmy s GLY 139 N -0.21 0.97 -0.14 -1.50 0.00 -0.13 -0.71 107.32 105.60 3kmy s GLY 139 Ca -0.02 -1.17 0.01 0.00 0.00 0.00 0.00 44.72 43.54 3kmy s GLY 139 CO 0.03 -0.77 -0.18 -0.54 0.00 0.00 0.00 173.10 171.64 3kmy s GLU 140 N -3.33 3.17 0.38 2.90 2.02 -0.14 -1.17 118.70 122.53 3kmy s GLU 140 Ca 0.25 -0.79 -0.21 0.00 0.02 0.00 0.00 54.97 54.25 3kmy s GLU 140 Cb -0.01 -2.52 -0.10 0.00 0.10 0.00 0.00 34.13 31.59 3kmy s GLU 140 CO 0.15 0.07 0.90 -0.51 0.02 0.00 0.00 175.26 175.89 3kmy s LEU 141 N 0.66 4.05 0.00 1.80 1.43 0.49 -0.42 118.68 126.69 3kmy s LEU 141 Ca -0.09 1.63 -0.15 0.00 -1.03 0.00 0.00 54.13 54.49 3kmy s LEU 141 Cb -0.16 -4.32 0.05 0.00 0.03 0.00 0.00 46.19 41.79 3kmy s LEU 141 CO 0.02 -0.26 0.71 0.61 0.23 0.00 0.00 176.35 177.66 3kmy n GLY 142 N -0.31 0.52 3.20 -3.19 0.00 -0.78 -1.95 105.19 102.67 3kmy n GLY 142 Ca 0.05 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 3kmy n GLY 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kmy s THR 143 N -2.13 0.86 0.18 2.61 -4.23 0.20 -0.28 115.64 112.86 3kmy s THR 143 Ca 0.16 -1.98 -0.24 0.00 -1.18 0.00 0.00 61.69 58.46 3kmy s THR 143 Cb -0.01 -1.74 0.06 0.00 1.34 0.00 0.00 72.50 72.15 3kmy s THR 143 CO 0.01 -0.83 0.95 -0.62 -0.54 0.00 0.00 174.62 173.59 3kmy s ASP 144 N -3.09 -0.13 0.03 3.99 -1.08 -1.03 -0.95 116.67 114.42 3kmy s ASP 144 Ca 0.14 -0.53 -0.28 0.00 -0.52 0.00 0.00 52.55 51.36 3kmy s ASP 144 Cb 0.04 0.53 -0.05 0.00 -1.46 0.00 0.00 42.92 41.99 3kmy s ASP 144 CO -0.03 -1.01 0.87 -0.76 0.52 0.00 0.00 175.17 174.77 3kmy s LEU 145 N -3.04 4.42 0.02 -1.34 1.43 -1.26 -2.01 118.68 116.89 3kmy s LEU 145 Ca 0.14 1.57 0.05 0.00 -1.03 0.00 0.00 54.13 54.86 3kmy s LEU 145 Cb -0.02 -3.41 -0.02 0.00 0.03 0.00 0.00 46.19 42.78 3kmy s LEU 145 CO 0.04 -0.10 -0.16 -0.69 0.23 0.00 0.00 176.35 175.66 3kmy s VAL 146 N 0.39 1.27 0.11 -1.59 1.01 0.15 -1.52 120.40 120.21 3kmy s VAL 146 Ca 0.45 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.53 3kmy s VAL 146 Cb -0.21 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 35.04 3kmy s VAL 146 CO 0.26 0.21 0.07 -0.44 0.00 0.00 0.00 175.10 175.20 3kmy s SER 147 N -0.77 0.31 -0.35 3.32 0.01 -0.78 -1.39 113.70 114.05 3kmy s SER 147 Ca 0.05 -1.07 0.02 0.00 1.31 0.00 0.00 55.95 56.26 3kmy s SER 147 Cb -0.07 0.29 0.11 0.00 0.21 0.00 0.00 66.02 66.56 3kmy s SER 147 CO 0.00 -0.71 0.10 -0.63 0.41 0.00 0.00 173.24 172.41 3kmy s ILE 148 N -3.99 1.65 0.28 1.44 1.01 -1.26 -1.39 121.20 118.94 3kmy s ILE 148 Ca 0.17 -2.07 -0.06 0.00 0.00 0.00 0.00 60.65 58.70 3kmy s ILE 148 Cb 0.07 -2.22 0.43 0.00 0.01 0.00 0.00 42.46 40.75 3kmy s ILE 148 CO -0.03 -0.68 1.57 -0.65 0.00 0.00 0.00 174.94 175.16 3kmy h PRO 149 N 7.62 0.00 -2.09 2.79 0.11 -1.91 -0.16 132.00 138.36 3kmy h PRO 149 Ca -0.08 -0.00 -0.74 0.00 0.11 0.00 0.00 66.00 65.29 3kmy h PRO 149 Cb 1.00 -0.00 -0.31 0.00 0.11 0.00 0.00 31.00 31.80 3kmy h PRO 149 CO 0.51 0.00 0.61 0.72 -0.21 0.00 0.00 178.00 179.64 3kmy n HIS 150 N -5.58 3.10 -2.30 0.65 8.25 -1.26 -4.92 115.22 113.16 3kmy n HIS 150 Ca 0.17 -2.75 0.00 0.00 -0.26 0.00 0.00 57.72 54.88 3kmy n HIS 150 Cb 0.56 -0.97 0.00 0.00 1.12 0.00 0.00 29.99 30.70 3kmy n HIS 150 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kmy n GLY 151 N -0.29 4.14 3.71 -1.41 0.00 -0.07 -4.46 105.19 106.82 3kmy n GLY 151 Ca 0.46 -1.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.06 3kmy n GLY 151 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3kmy n PRO 152 N 0.00 1.53 -1.57 1.61 -0.04 -1.26 -4.83 135.00 130.44 3kmy n PRO 152 Ca 0.00 0.57 -0.41 0.00 -0.04 0.00 0.00 63.50 63.62 3kmy n PRO 152 Cb 0.00 -2.46 -0.01 0.00 -0.04 0.00 0.00 33.50 30.99 3kmy n PRO 152 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 3kmy n ASN 153 N -0.81 5.93 -4.14 3.54 5.15 -1.26 -4.66 115.26 119.02 3kmy n ASN 153 Ca 0.11 -2.74 -0.10 0.00 -0.60 0.00 0.00 54.58 51.25 3kmy n ASN 153 Cb 0.44 -1.61 -0.10 0.00 -0.53 0.00 0.00 39.78 37.98 3kmy n ASN 153 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3kmy s VAL 154 N 2.71 0.10 -0.04 3.44 -7.23 -1.26 -5.15 120.40 112.96 3kmy s VAL 154 Ca 0.56 -1.88 0.01 0.00 -1.81 0.00 0.00 61.98 58.86 3kmy s VAL 154 Cb 0.16 -2.05 0.02 0.00 0.56 0.00 0.00 36.38 35.07 3kmy s VAL 154 CO -0.08 -0.44 -0.04 -0.89 -0.31 0.00 0.00 175.10 173.34 3kmy s THR 155 N -4.05 0.50 0.12 5.32 2.01 -1.26 -4.47 115.64 113.80 3kmy s THR 155 Ca 0.24 -0.12 0.04 0.00 0.31 0.00 0.00 61.69 62.16 3kmy s THR 155 Cb 0.07 -0.52 -0.04 0.00 0.01 0.00 0.00 72.50 72.03 3kmy s THR 155 CO 0.02 0.21 -0.11 0.68 -0.69 0.00 0.00 174.62 174.73 3kmy s VAL 156 N 0.78 1.09 -0.29 3.82 -7.23 -0.49 -4.92 120.40 113.16 3kmy s VAL 156 Ca -0.10 -1.76 -0.14 0.00 -1.81 0.00 0.00 61.98 58.16 3kmy s VAL 156 Cb -0.13 -1.52 -0.03 0.00 0.56 0.00 0.00 36.38 35.26 3kmy s VAL 156 CO 0.00 -0.57 0.34 -0.60 -0.31 0.00 0.00 175.10 173.97 3kmy s ARG 157 N -2.99 3.87 0.28 4.82 3.52 -1.26 0.33 118.95 127.53 3kmy s ARG 157 Ca 0.09 -0.15 0.04 0.00 -0.13 0.00 0.00 55.73 55.58 3kmy s ARG 157 Cb -0.02 -3.70 -0.06 0.00 -1.56 0.00 0.00 34.95 29.61 3kmy s ARG 157 CO 0.01 -0.34 0.03 0.00 -0.81 0.00 0.00 175.30 174.19 3kmy s ALA 158 N 2.02 2.10 0.34 6.12 0.00 -0.85 -4.94 121.76 126.55 3kmy s ALA 158 Ca 0.13 -1.93 -0.27 0.00 0.00 0.00 0.00 51.96 49.89 3kmy s ALA 158 Cb -0.16 0.62 -0.09 0.00 0.00 0.00 0.00 23.12 23.49 3kmy s ALA 158 CO 0.11 -0.29 1.05 -0.80 0.00 0.00 0.00 175.76 175.82 3kmy s ASN 159 N -3.40 7.06 -0.03 0.00 0.01 -1.26 -2.45 114.94 114.86 3kmy s ASN 159 Ca 0.34 2.10 -0.00 0.00 -0.71 0.00 0.00 52.86 54.58 3kmy s ASN 159 Cb 0.07 -2.60 0.03 0.00 0.41 0.00 0.00 41.25 39.16 3kmy s ASN 159 CO 0.13 -0.28 0.02 -0.63 -1.51 0.00 0.00 177.10 174.83 3kmy s ILE 160 N -1.44 0.04 -0.36 0.60 1.01 0.61 -4.62 121.20 117.04 3kmy s ILE 160 Ca 0.51 0.21 -0.16 0.00 0.00 0.00 0.00 60.65 61.21 3kmy s ILE 160 Cb -0.26 -0.19 -0.00 0.00 0.01 0.00 0.00 42.46 42.02 3kmy s ILE 160 CO 0.32 0.14 0.41 0.00 0.00 0.00 0.00 174.94 175.81 3kmy s ALA 161 N 1.33 3.48 -0.59 9.38 0.00 -0.44 -1.87 121.76 133.04 3kmy s ALA 161 Ca -0.06 -1.24 -0.25 0.00 0.00 0.00 0.00 51.96 50.41 3kmy s ALA 161 Cb -0.13 -2.91 0.04 0.00 0.00 0.00 0.00 23.12 20.12 3kmy s ALA 161 CO -0.03 -1.22 1.02 0.00 0.00 0.00 0.00 175.76 175.53 3kmy s ALA 162 N 2.12 3.08 -0.07 0.00 0.00 0.44 -1.32 121.76 126.02 3kmy s ALA 162 Ca 0.13 -1.30 -0.30 0.00 0.00 0.00 0.00 51.96 50.50 3kmy s ALA 162 Cb -0.16 -3.86 -0.05 0.00 0.00 0.00 0.00 23.12 19.05 3kmy s ALA 162 CO 0.12 -2.59 1.55 0.42 0.00 0.00 0.00 175.76 175.26 3kmy s ILE 163 N 4.32 3.72 -0.03 0.00 1.01 0.45 -0.96 121.20 129.70 3kmy s ILE 163 Ca 0.31 0.91 0.10 0.00 0.00 0.00 0.00 60.65 61.97 3kmy s ILE 163 Cb -0.12 -3.59 -0.14 0.00 0.01 0.00 0.00 42.46 38.62 3kmy s ILE 163 CO 0.18 -0.07 0.17 0.35 0.00 0.00 0.00 174.94 175.57 3kmy n THR 164 N 5.34 0.16 -3.83 2.92 -2.24 0.11 -1.44 114.28 115.31 3kmy n THR 164 Ca 0.16 -0.27 -0.12 0.00 -2.27 0.00 0.00 64.05 61.55 3kmy n THR 164 Cb 0.43 0.01 -0.12 0.00 -2.10 0.00 0.00 70.33 68.56 3kmy n THR 164 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3kmy s GLU 165 N -2.57 0.29 0.08 -0.78 2.02 -1.06 -4.92 118.70 111.77 3kmy s GLU 165 Ca -0.04 0.02 -0.21 0.00 0.02 0.00 0.00 54.97 54.76 3kmy s GLU 165 Cb 0.05 0.13 0.05 0.00 0.10 0.00 0.00 34.13 34.47 3kmy s GLU 165 CO 0.40 -0.05 0.52 -1.54 0.02 0.00 0.00 175.26 174.61 3kmy s SER 166 N -0.40 -0.43 -0.19 -0.19 1.04 -1.26 0.76 113.70 113.03 3kmy s SER 166 Ca -0.05 0.05 -0.03 0.00 0.48 0.00 0.00 55.95 56.40 3kmy s SER 166 Cb -0.03 0.51 0.06 0.00 0.10 0.00 0.00 66.02 66.66 3kmy s SER 166 CO 0.01 -0.80 0.05 -0.62 0.98 0.00 0.00 173.24 172.86 3kmy s ASP 167 N -2.29 2.79 -1.59 7.02 -1.08 0.12 -4.83 116.67 116.82 3kmy s ASP 167 Ca -0.02 -0.78 -0.01 0.00 -0.52 0.00 0.00 52.55 51.21 3kmy s ASP 167 Cb -0.00 -0.52 0.00 0.00 -1.46 0.00 0.00 42.92 40.95 3kmy s ASP 167 CO -0.06 -0.32 0.08 0.29 0.52 0.00 0.00 175.17 175.69 3kmy n LYS 168 N 5.10 -2.23 -0.07 4.34 5.02 -1.26 -1.12 118.16 127.94 3kmy n LYS 168 Ca -0.08 0.90 -0.05 0.00 -2.02 0.00 0.00 58.31 57.05 3kmy n LYS 168 Cb 0.47 -5.58 -0.02 0.00 -0.02 0.00 0.00 35.03 29.89 3kmy n LYS 168 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 3kmy h PHE 169 N -0.19 0.00 -3.97 2.13 3.57 -1.88 -3.45 116.94 113.15 3kmy h PHE 169 Ca -0.46 0.00 -0.49 0.00 3.53 0.00 0.00 57.97 60.55 3kmy h PHE 169 Cb 1.33 0.00 0.03 0.00 2.79 0.00 0.00 35.95 40.11 3kmy h PHE 169 CO 0.59 0.08 0.44 -0.06 -2.23 0.00 0.00 178.31 177.13 3kmy s PHE 170 N -2.23 3.13 -0.17 0.41 0.40 -1.26 -5.03 117.98 113.22 3kmy s PHE 170 Ca -0.15 1.60 -0.01 0.00 -0.60 0.00 0.00 56.93 57.77 3kmy s PHE 170 Cb 0.02 -3.23 -0.01 0.00 0.51 0.00 0.00 43.02 40.32 3kmy s PHE 170 CO 0.23 -0.96 -0.12 0.42 0.70 0.00 0.00 175.22 175.49 3kmy s ILE 171 N -1.61 2.91 0.04 0.64 1.01 -1.26 -5.06 121.20 117.87 3kmy s ILE 171 Ca 0.60 -0.68 -0.31 0.00 0.00 0.00 0.00 60.65 60.26 3kmy s ILE 171 Cb -0.25 -2.25 -0.10 0.00 0.01 0.00 0.00 42.46 39.88 3kmy s ILE 171 CO 0.31 0.50 1.95 -3.20 0.00 0.00 0.00 174.94 174.49 3kmy n ASN 172 N 4.14 4.10 0.00 3.58 4.05 -1.26 -1.93 115.26 127.93 3kmy n ASN 172 Ca -0.19 0.92 0.00 0.00 0.45 0.00 0.00 54.58 55.76 3kmy n ASN 172 Cb 0.52 -1.52 0.00 0.00 1.23 0.00 0.00 39.78 40.01 3kmy n ASN 172 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3kmy n GLY 173 N 4.49 0.74 0.15 8.20 0.00 -1.26 -4.94 105.19 112.57 3kmy n GLY 173 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.21 3kmy n GLY 173 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3kmy h SER 174 N 0.00 0.03 -0.01 1.61 4.64 -1.74 -3.47 113.55 114.61 3kmy h SER 174 Ca 0.00 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3kmy h SER 174 Cb 0.00 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3kmy h SER 174 CO 0.00 0.60 -0.00 -3.20 -0.87 0.00 0.00 176.83 173.35 3kmy n ASN 175 N -3.86 -3.30 -4.47 4.97 5.15 -1.26 -4.94 115.26 107.54 3kmy n ASN 175 Ca -0.01 0.01 -0.30 0.00 -0.60 0.00 0.00 54.58 53.67 3kmy n ASN 175 Cb 0.58 -0.82 -0.12 0.00 -0.53 0.00 0.00 39.78 38.89 3kmy n ASN 175 CO 0.00 0.00 0.00 -1.66 1.40 0.00 0.00 177.26 177.00 3kmy s TRP 176 N -1.92 2.52 -0.35 1.20 1.48 -1.26 -4.63 118.94 115.99 3kmy s TRP 176 Ca 0.00 -0.27 0.04 0.00 -1.06 0.00 0.00 56.10 54.81 3kmy s TRP 176 Cb 0.00 -1.37 0.09 0.00 -1.16 0.00 0.00 33.47 31.03 3kmy s TRP 176 CO 0.00 0.35 0.99 0.39 -4.06 0.00 0.00 176.95 174.62 3kmy n GLU 177 N 0.99 2.23 -3.61 3.25 4.71 0.83 -4.88 120.64 124.17 3kmy n GLU 177 Ca -0.16 -1.48 -0.07 0.00 -0.01 0.00 0.00 57.16 55.44 3kmy n GLU 177 Cb 0.53 -1.09 0.03 0.00 -1.01 0.00 0.00 31.44 29.89 3kmy n GLU 177 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3kmy n GLY 178 N -0.08 0.94 2.98 0.62 0.00 -1.12 -0.60 105.19 107.93 3kmy n GLY 178 Ca 0.04 -1.21 -0.17 0.00 0.00 0.00 0.00 46.02 44.68 3kmy n GLY 178 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3kmy s ILE 179 N -2.14 0.50 -0.43 -0.61 2.07 0.11 -0.65 121.20 120.04 3kmy s ILE 179 Ca 0.17 -0.28 -0.03 0.00 -1.41 0.00 0.00 60.65 59.09 3kmy s ILE 179 Cb -0.04 -0.42 0.11 0.00 0.13 0.00 0.00 42.46 42.24 3kmy s ILE 179 CO 0.09 0.13 0.24 -0.22 -1.91 0.00 0.00 174.94 173.27 3kmy s LEU 180 N -0.16 5.30 -0.40 8.50 2.96 0.12 -1.77 118.68 133.23 3kmy s LEU 180 Ca 0.02 -2.08 -0.29 0.00 -0.22 0.00 0.00 54.13 51.56 3kmy s LEU 180 Cb -0.03 -1.85 0.01 0.00 0.50 0.00 0.00 46.19 44.83 3kmy s LEU 180 CO -0.00 -0.55 1.32 -0.83 -1.32 0.00 0.00 176.35 174.98 3kmy s GLY 181 N 1.83 1.21 0.00 7.98 0.00 -0.28 -1.71 107.32 116.34 3kmy s GLY 181 Ca 0.09 -0.16 0.26 0.00 0.00 0.00 0.00 44.72 44.90 3kmy s GLY 181 CO -0.04 2.65 1.49 1.04 0.00 0.00 0.00 173.10 178.24 3kmy n LEU 182 N 8.31 2.30 0.00 0.66 4.77 -0.05 -4.18 117.00 128.81 3kmy n LEU 182 Ca 0.15 -0.78 -0.11 0.00 -0.03 0.00 0.00 56.01 55.24 3kmy n LEU 182 Cb 0.48 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.63 3kmy n LEU 182 CO 0.69 0.39 0.33 0.00 -1.33 0.00 0.00 177.39 177.46 3kmy n ALA 183 N 0.79 -0.56 -1.97 -1.18 0.00 0.28 -4.95 120.51 112.92 3kmy n ALA 183 Ca 0.16 -0.64 -0.29 0.00 0.00 0.00 0.00 53.44 52.67 3kmy n ALA 183 Cb 0.48 -0.03 0.03 0.00 0.00 0.00 0.00 19.45 19.93 3kmy n ALA 183 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3kmy s TYR 184 N -2.07 3.38 0.51 0.00 1.51 -0.68 -4.63 117.35 115.37 3kmy s TYR 184 Ca 0.28 0.96 0.20 0.00 -1.01 0.00 0.00 57.07 57.50 3kmy s TYR 184 Cb -0.01 -2.85 1.27 0.00 -0.11 0.00 0.00 41.96 40.26 3kmy s TYR 184 CO 0.20 -0.92 2.05 0.00 -1.11 0.00 0.00 175.55 175.76 3kmy h ALA 185 N -0.39 2.23 -0.91 3.71 0.00 -1.87 -2.65 119.26 119.37 3kmy h ALA 185 Ca -0.45 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 54.67 3kmy h ALA 185 Cb 1.24 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.97 3kmy h ALA 185 CO 0.62 -0.32 0.62 1.49 0.00 0.00 0.00 179.25 181.66 3kmy h GLU 186 N 0.09 0.28 -0.50 0.00 4.81 -1.88 0.31 114.58 117.70 3kmy h GLU 186 Ca 0.17 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3kmy h GLU 186 Cb 0.57 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.88 3kmy h GLU 186 CO -0.02 0.19 0.00 0.44 -0.73 0.00 0.00 179.01 178.89 3kmy n ILE 187 N -4.46 1.79 -2.50 2.32 -5.35 -1.00 -4.61 119.36 105.55 3kmy n ILE 187 Ca 0.20 -1.31 -0.36 0.00 -0.27 0.00 0.00 62.75 61.01 3kmy n ILE 187 Cb 0.79 0.11 -0.03 0.00 -1.74 0.00 0.00 39.64 38.77 3kmy n ILE 187 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3kmy s ALA 188 N -1.91 3.00 -0.10 -1.28 0.00 0.10 -4.55 121.76 117.03 3kmy s ALA 188 Ca 0.43 0.71 -0.04 0.00 0.00 0.00 0.00 51.96 53.06 3kmy s ALA 188 Cb 0.29 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 20.09 3kmy s ALA 188 CO 0.19 -0.31 0.07 1.03 0.00 0.00 0.00 175.76 176.74 3kmy s ARG 189 N -2.76 3.21 0.43 0.00 1.81 -1.26 -2.55 118.95 117.83 3kmy s ARG 189 Ca 0.62 -0.28 0.24 0.00 -1.72 0.00 0.00 55.73 54.58 3kmy s ARG 189 Cb -0.21 -2.99 0.66 0.00 -0.45 0.00 0.00 34.95 31.96 3kmy s ARG 189 CO 0.26 0.74 1.71 -1.00 -0.68 0.00 0.00 175.30 176.33 3kmy h PRO 190 N 4.99 0.00 -3.04 3.54 0.13 -1.93 -3.47 132.00 132.22 3kmy h PRO 190 Ca -0.53 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.60 3kmy h PRO 190 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 3kmy h PRO 190 CO 0.57 0.18 0.24 0.16 -0.23 0.00 0.00 178.00 178.92 3kmy s ASP 191 N -6.16 -0.04 0.00 1.44 -4.77 -1.06 -5.03 116.67 101.05 3kmy s ASP 191 Ca 0.03 -1.01 0.08 0.00 -3.30 0.00 0.00 52.55 48.36 3kmy s ASP 191 Cb 0.08 0.81 0.48 0.00 -1.09 0.00 0.00 42.92 43.20 3kmy s ASP 191 CO 0.65 -1.58 0.90 -0.90 0.70 0.00 0.00 175.17 174.94 3kmy n ASP 192 N -1.13 0.00 0.06 2.11 5.68 -1.25 -2.37 116.55 119.65 3kmy n ASP 192 Ca -0.07 -0.56 0.13 0.00 -0.50 0.00 0.00 54.79 53.80 3kmy n ASP 192 Cb 0.60 0.00 0.40 0.00 -1.14 0.00 0.00 41.12 40.98 3kmy n ASP 192 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3kmy n SER 193 N -0.81 0.56 -4.44 -1.12 3.41 -1.26 -4.55 113.62 105.41 3kmy n SER 193 Ca 0.06 0.39 -0.44 0.00 -0.26 0.00 0.00 58.87 58.62 3kmy n SER 193 Cb 0.03 -0.43 -0.03 0.00 -0.26 0.00 0.00 64.21 63.51 3kmy n SER 193 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3kmy s LEU 194 N -3.94 4.91 -0.03 1.04 2.96 -1.00 -5.00 118.68 117.62 3kmy s LEU 194 Ca 0.11 -1.61 -0.35 0.00 -0.22 0.00 0.00 54.13 52.06 3kmy s LEU 194 Cb 0.15 -2.39 -0.13 0.00 0.50 0.00 0.00 46.19 44.32 3kmy s LEU 194 CO 0.61 -1.19 1.76 1.21 -1.32 0.00 0.00 176.35 177.43 3kmy n GLU 195 N 6.86 2.04 -1.24 1.98 2.13 -1.26 -4.89 120.64 126.26 3kmy n GLU 195 Ca 0.10 0.74 -0.32 0.00 0.66 0.00 0.00 57.16 58.34 3kmy n GLU 195 Cb 0.47 -2.54 0.11 0.00 0.27 0.00 0.00 31.44 29.74 3kmy n GLU 195 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 3kmy s PRO 196 N 3.00 1.97 0.14 5.31 0.02 -1.26 -4.50 135.00 139.68 3kmy s PRO 196 Ca 0.89 1.48 -0.22 0.00 0.02 0.00 0.00 61.00 63.17 3kmy s PRO 196 Cb -0.73 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 31.95 3kmy s PRO 196 CO 0.49 -1.91 1.65 0.35 -0.33 0.00 0.00 177.00 177.25 3kmy h PHE 197 N -0.90 -0.47 -0.55 6.54 3.57 -1.81 -2.27 116.94 121.05 3kmy h PHE 197 Ca -0.45 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.12 3kmy h PHE 197 Cb 1.26 0.24 -0.03 0.00 2.79 0.00 0.00 35.95 40.21 3kmy h PHE 197 CO 0.52 -0.26 0.36 0.35 -2.23 0.00 0.00 178.31 177.06 3kmy h PHE 198 N -0.21 0.56 -0.64 0.41 3.57 -1.93 0.00 116.94 118.72 3kmy h PHE 198 Ca 0.11 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 3kmy h PHE 198 Cb 0.38 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 3kmy h PHE 198 CO -0.32 0.32 0.04 -0.44 -2.23 0.00 0.00 178.31 175.68 3kmy h ASP 199 N 0.58 1.07 -0.55 0.41 3.32 -1.79 -1.46 116.42 118.00 3kmy h ASP 199 Ca 0.23 -0.29 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 3kmy h ASP 199 Cb 0.18 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 3kmy h ASP 199 CO -0.06 1.10 0.03 0.28 -1.72 0.00 0.00 179.24 178.86 3kmy h SER 200 N 1.01 0.93 0.17 6.45 0.02 -0.69 -1.60 113.55 119.83 3kmy h SER 200 Ca 0.19 -0.29 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 3kmy h SER 200 Cb 0.52 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 3kmy h SER 200 CO 0.03 0.99 -0.14 0.25 -1.14 0.00 0.00 176.83 176.82 3kmy h LEU 201 N 0.83 -0.36 -0.76 5.07 5.85 -0.75 -0.37 115.31 124.83 3kmy h LEU 201 Ca 0.16 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.83 3kmy h LEU 201 Cb 0.50 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 3kmy h LEU 201 CO 0.02 -0.21 0.08 0.58 -0.34 0.00 0.00 178.44 178.57 3kmy h VAL 202 N -0.32 1.26 -0.30 1.05 2.07 -1.23 -1.69 116.25 117.09 3kmy h VAL 202 Ca -0.01 -1.03 -0.13 0.00 0.82 0.00 0.00 66.70 66.36 3kmy h VAL 202 Cb 0.29 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 3kmy h VAL 202 CO -0.02 0.38 -0.35 0.50 0.02 0.00 0.00 177.57 178.11 3kmy h LYS 203 N 0.96 0.67 0.00 1.57 3.64 -1.14 -3.25 116.57 119.01 3kmy h LYS 203 Ca 0.19 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 3kmy h LYS 203 Cb 0.44 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 3kmy h LYS 203 CO 0.01 0.92 -0.52 1.04 -2.27 0.00 0.00 179.45 178.63 3kmy n GLN 204 N -4.06 0.12 -2.84 1.90 6.02 -0.16 -4.96 117.38 113.40 3kmy n GLN 204 Ca -0.01 0.03 -0.08 0.00 -0.01 0.00 0.00 57.00 56.93 3kmy n GLN 204 Cb 0.49 -1.58 -0.03 0.00 1.02 0.00 0.00 30.24 30.15 3kmy n GLN 204 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3kmy n THR 205 N -1.75 0.00 -0.65 5.09 -2.24 -0.64 -5.04 114.28 109.04 3kmy n THR 205 Ca 0.05 -0.86 0.09 0.00 -2.27 0.00 0.00 64.05 61.06 3kmy n THR 205 Cb 0.38 0.35 0.35 0.00 -2.10 0.00 0.00 70.33 69.30 3kmy n THR 205 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3kmy n HIS 206 N -0.29 1.45 -2.03 4.78 8.25 -1.26 -4.78 115.22 121.33 3kmy n HIS 206 Ca -0.00 -0.64 -0.42 0.00 -0.26 0.00 0.00 57.72 56.40 3kmy n HIS 206 Cb 0.22 -0.26 -0.03 0.00 1.12 0.00 0.00 29.99 31.04 3kmy n HIS 206 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3kmy s VAL 207 N -1.96 3.13 0.47 1.59 1.01 -1.26 -4.94 120.40 118.44 3kmy s VAL 207 Ca 0.49 0.68 -0.23 0.00 0.00 0.00 0.00 61.98 62.92 3kmy s VAL 207 Cb 0.33 -3.43 -0.09 0.00 0.00 0.00 0.00 36.38 33.19 3kmy s VAL 207 CO 0.22 0.02 1.09 -2.65 0.00 0.00 0.00 175.10 173.78 3kmy n PRO 208 N 4.93 1.42 -1.54 2.72 -0.02 -1.26 -4.67 135.00 136.59 3kmy n PRO 208 Ca 0.14 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.71 3kmy n PRO 208 Cb 0.41 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.68 3kmy n PRO 208 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3kmy n ASN 209 N 0.05 3.45 -3.58 2.55 5.15 -1.26 -4.26 115.26 117.35 3kmy n ASN 209 Ca 0.10 -2.79 -0.10 0.00 -0.60 0.00 0.00 54.58 51.19 3kmy n ASN 209 Cb 0.41 -1.48 -0.05 0.00 -0.53 0.00 0.00 39.78 38.13 3kmy n ASN 209 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3kmy s LEU 210 N 1.85 -0.36 0.02 1.20 0.20 -1.26 -1.29 118.68 119.04 3kmy s LEU 210 Ca 0.50 0.40 -0.13 0.00 0.69 0.00 0.00 54.13 55.59 3kmy s LEU 210 Cb 0.14 1.83 0.02 0.00 -0.43 0.00 0.00 46.19 47.75 3kmy s LEU 210 CO -0.02 -0.33 0.28 0.72 -0.29 0.00 0.00 176.35 176.71 3kmy s PHE 211 N -1.07 -0.10 0.07 5.38 -0.71 -1.07 0.35 117.98 120.82 3kmy s PHE 211 Ca -0.01 0.04 0.06 0.00 -1.04 0.00 0.00 56.93 55.98 3kmy s PHE 211 Cb -0.01 0.07 -0.03 0.00 -1.21 0.00 0.00 43.02 41.84 3kmy s PHE 211 CO 0.01 -0.43 -0.16 -1.54 -1.34 0.00 0.00 175.22 171.76 3kmy s SER 212 N -1.73 1.88 -0.06 1.98 1.04 -0.54 -0.20 113.70 116.07 3kmy s SER 212 Ca -0.09 -0.59 0.03 0.00 0.48 0.00 0.00 55.95 55.79 3kmy s SER 212 Cb -0.03 -0.09 0.01 0.00 0.10 0.00 0.00 66.02 66.01 3kmy s SER 212 CO -0.00 -0.01 -0.15 -0.76 0.98 0.00 0.00 173.24 173.30 3kmy s LEU 213 N -1.59 1.79 -0.32 2.42 1.43 0.69 -1.33 118.68 121.78 3kmy s LEU 213 Ca 0.01 -0.35 0.04 0.00 -1.03 0.00 0.00 54.13 52.80 3kmy s LEU 213 Cb -0.09 -0.94 0.09 0.00 0.03 0.00 0.00 46.19 45.28 3kmy s LEU 213 CO 0.02 0.09 0.02 -1.58 0.23 0.00 0.00 176.35 175.13 3kmy s GLN 214 N 0.42 1.58 -0.22 1.70 0.74 0.48 -1.25 119.66 123.10 3kmy s GLN 214 Ca -0.12 -1.73 -0.13 0.00 0.05 0.00 0.00 55.36 53.43 3kmy s GLN 214 Cb -0.15 -3.08 -0.04 0.00 1.10 0.00 0.00 33.01 30.84 3kmy s GLN 214 CO 0.04 -0.87 0.29 -0.51 -0.55 0.00 0.00 175.29 173.69 3kmy s LEU 215 N 0.98 4.13 -0.38 3.68 1.43 -1.26 -0.82 118.68 126.43 3kmy s LEU 215 Ca 0.07 0.33 -0.07 0.00 -1.03 0.00 0.00 54.13 53.43 3kmy s LEU 215 Cb -0.19 -2.33 0.07 0.00 0.03 0.00 0.00 46.19 43.76 3kmy s LEU 215 CO -0.08 -0.02 0.19 0.00 0.23 0.00 0.00 176.35 176.67 3kmy s GLY 217 N 1.79 3.01 0.31 0.00 0.00 -1.26 -4.74 107.32 106.43 3kmy s GLY 217 Ca 0.02 0.64 0.15 0.00 0.00 0.00 0.00 44.72 45.53 3kmy s GLY 217 CO 0.02 1.18 1.61 0.00 0.00 0.00 0.00 173.10 175.90 3kmy h ALA 218 N 3.76 0.86 0.00 3.20 0.00 -1.94 -3.43 119.26 121.71 3kmy h ALA 218 Ca -0.46 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 53.98 3kmy h ALA 218 Cb 1.20 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3kmy h ALA 218 CO 0.67 0.65 0.00 0.41 0.00 0.00 0.00 179.25 180.98 3kmy n GLY 219 N 0.54 0.79 3.38 0.00 0.00 -1.26 -5.01 105.19 103.63 3kmy n GLY 219 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 3kmy n GLY 219 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3kmy s PHE 220 N -2.24 0.50 0.33 1.61 -0.71 -1.26 -4.84 117.98 111.38 3kmy s PHE 220 Ca 0.00 -0.85 -0.28 0.00 -1.04 0.00 0.00 56.93 54.76 3kmy s PHE 220 Cb 0.00 -0.07 -0.10 0.00 -1.21 0.00 0.00 43.02 41.64 3kmy s PHE 220 CO 0.00 -0.78 1.26 -2.14 -1.34 0.00 0.00 175.22 172.22 3kmy s PRO 221 N -4.01 4.35 -0.18 1.99 0.02 -1.26 -4.91 135.00 131.01 3kmy s PRO 221 Ca 0.22 2.11 -0.02 0.00 0.02 0.00 0.00 61.00 63.33 3kmy s PRO 221 Cb 0.03 -3.04 -0.01 0.00 0.02 0.00 0.00 34.50 31.50 3kmy s PRO 221 CO 0.04 -0.15 -0.10 -0.51 -0.33 0.00 0.00 177.00 175.95 3kmy s LEU 222 N -1.83 2.74 1.03 -5.54 1.43 -1.26 -5.05 118.68 110.20 3kmy s LEU 222 Ca 0.49 -0.38 -0.17 0.00 -1.03 0.00 0.00 54.13 53.04 3kmy s LEU 222 Cb -0.38 -1.66 0.23 0.00 0.03 0.00 0.00 46.19 44.42 3kmy s LEU 222 CO 0.50 0.07 1.29 0.54 0.23 0.00 0.00 176.35 178.98 3kmy s ASN 223 N 0.94 2.51 0.17 2.29 2.20 -1.26 -4.60 114.94 117.18 3kmy s ASN 223 Ca -0.02 0.28 -0.23 0.00 -0.94 0.00 0.00 52.86 51.95 3kmy s ASN 223 Cb -0.15 -0.32 0.06 0.00 -2.00 0.00 0.00 41.25 38.84 3kmy s ASN 223 CO -0.00 -3.11 1.59 -0.61 -2.94 0.00 0.00 177.10 172.02 3kmy h GLN 224 N -1.90 -0.24 -0.43 3.55 4.15 -1.99 -0.30 115.11 117.94 3kmy h GLN 224 Ca -0.44 0.02 -0.14 0.00 0.77 0.00 0.00 58.65 58.86 3kmy h GLN 224 Cb 1.24 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.97 3kmy h GLN 224 CO 0.34 -0.16 -0.27 0.66 -1.93 0.00 0.00 178.83 177.47 3kmy h SER 225 N -0.25 0.99 -0.14 -0.69 4.64 -2.00 -3.14 113.55 112.96 3kmy h SER 225 Ca 0.18 -0.42 0.01 0.00 -0.47 0.00 0.00 61.79 61.08 3kmy h SER 225 Cb 0.55 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 3kmy h SER 225 CO -0.58 1.20 0.07 -0.33 -0.87 0.00 0.00 176.83 176.31 3kmy h GLU 226 N 0.78 0.15 0.00 4.77 5.08 -1.77 -2.30 114.58 121.29 3kmy h GLU 226 Ca 0.09 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3kmy h GLU 226 Cb 0.85 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.07 3kmy h GLU 226 CO 0.08 0.10 -0.07 -0.24 -1.00 0.00 0.00 179.01 177.87 3kmy h VAL 227 N 0.15 0.44 0.00 3.13 3.04 -1.12 0.13 116.25 122.02 3kmy h VAL 227 Ca 0.06 -0.35 -0.11 0.00 -1.01 0.00 0.00 66.70 65.28 3kmy h VAL 227 Cb 0.01 1.24 -0.02 0.00 -2.01 0.00 0.00 31.29 30.51 3kmy h VAL 227 CO -0.03 0.07 -0.58 -0.07 -1.01 0.00 0.00 177.57 175.94 3kmy h LEU 228 N 0.00 0.00 0.00 3.16 3.38 -1.38 -3.34 115.31 117.13 3kmy h LEU 228 Ca -0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 3kmy h LEU 228 Cb 0.24 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 3kmy h LEU 228 CO 0.01 0.53 -1.99 0.00 0.09 0.00 0.00 178.44 177.07 3kmy n ALA 229 N -2.24 2.15 -1.79 1.53 0.00 -0.63 -4.99 120.51 114.54 3kmy n ALA 229 Ca 0.01 -0.81 -0.35 0.00 0.00 0.00 0.00 53.44 52.28 3kmy n ALA 229 Cb 0.75 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 19.58 3kmy n ALA 229 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3kmy s SER 230 N -5.15 6.34 -0.25 0.00 0.15 0.35 -5.01 113.70 110.13 3kmy s SER 230 Ca -0.07 2.05 -0.24 0.00 0.70 0.00 0.00 55.95 58.39 3kmy s SER 230 Cb 0.10 -2.58 -0.01 0.00 -1.71 0.00 0.00 66.02 61.83 3kmy s SER 230 CO 0.86 -0.78 0.78 -0.69 1.20 0.00 0.00 173.24 174.61 3kmy s VAL 231 N -1.80 4.86 -2.44 4.45 1.01 -1.26 -4.69 120.40 120.54 3kmy s VAL 231 Ca 0.65 1.44 0.26 0.00 0.00 0.00 0.00 61.98 64.33 3kmy s VAL 231 Cb -0.21 -4.08 0.38 0.00 0.00 0.00 0.00 36.38 32.47 3kmy s VAL 231 CO 0.25 -0.07 1.56 0.61 0.00 0.00 0.00 175.10 177.45 3kmy n GLY 232 N 3.88 0.11 0.00 4.51 0.00 0.92 -4.90 105.19 109.71 3kmy n GLY 232 Ca 0.04 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.56 3kmy n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kmy n GLY 233 N 1.26 0.91 2.92 -0.02 0.00 -1.17 -0.42 105.19 108.67 3kmy n GLY 233 Ca 0.16 -1.85 -0.11 0.00 0.00 0.00 0.00 46.02 44.21 3kmy n GLY 233 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kmy s SER 234 N -4.00 0.14 -0.27 1.61 0.01 -0.00 -1.53 113.70 109.65 3kmy s SER 234 Ca 0.00 -0.20 0.01 0.00 1.31 0.00 0.00 55.95 57.07 3kmy s SER 234 Cb 0.00 0.03 0.08 0.00 0.21 0.00 0.00 66.02 66.34 3kmy s SER 234 CO 0.00 -0.11 0.00 -0.32 0.41 0.00 0.00 173.24 173.22 3kmy s MET 235 N -0.58 1.36 -0.38 12.44 0.00 -1.26 -0.39 119.30 130.49 3kmy s MET 235 Ca -0.06 -1.16 -0.19 0.00 0.00 0.00 0.00 55.69 54.28 3kmy s MET 235 Cb -0.04 -2.57 0.01 0.00 0.00 0.00 0.00 34.83 32.23 3kmy s MET 235 CO -0.00 -0.75 0.55 0.42 0.00 0.00 0.00 175.02 175.24 3kmy s ILE 236 N 1.36 4.96 -0.29 10.11 -1.09 -0.44 -4.85 121.20 130.97 3kmy s ILE 236 Ca 0.01 0.22 -0.20 0.00 -2.23 0.00 0.00 60.65 58.45 3kmy s ILE 236 Cb -0.18 -4.05 -0.01 0.00 -1.58 0.00 0.00 42.46 36.63 3kmy s ILE 236 CO -0.11 -0.35 0.62 -0.63 -1.23 0.00 0.00 174.94 173.24 3kmy s ILE 237 N 2.51 4.96 0.00 2.92 -1.09 -1.26 -1.46 121.20 127.78 3kmy s ILE 237 Ca 0.19 0.94 0.00 0.00 -2.23 0.00 0.00 60.65 59.56 3kmy s ILE 237 Cb -0.15 -3.96 0.00 0.00 -1.58 0.00 0.00 42.46 36.76 3kmy s ILE 237 CO 0.15 -0.07 0.00 0.61 -1.23 0.00 0.00 174.94 174.40 3kmy n GLY 238 N 4.34 0.70 0.24 6.18 0.00 0.15 -4.78 105.19 112.03 3kmy n GLY 238 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 46.02 46.00 3kmy n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kmy n GLY 239 N -2.60 1.13 2.92 -0.02 0.00 -1.25 -4.41 105.19 100.96 3kmy n GLY 239 Ca 0.00 -0.92 -0.26 0.00 0.00 0.00 0.00 46.02 44.85 3kmy n GLY 239 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kmy s ILE 240 N -2.46 0.97 -0.31 -0.61 1.01 -1.26 -4.03 121.20 114.51 3kmy s ILE 240 Ca 0.02 -0.29 -0.12 0.00 0.00 0.00 0.00 60.65 60.26 3kmy s ILE 240 Cb -0.00 -0.97 -0.03 0.00 0.01 0.00 0.00 42.46 41.47 3kmy s ILE 240 CO 0.00 0.35 0.21 -0.62 0.00 0.00 0.00 174.94 174.88 3kmy s ASP 241 N 1.45 6.00 0.34 3.58 2.15 -1.26 -4.40 116.67 124.53 3kmy s ASP 241 Ca -0.00 -0.23 0.26 0.00 0.43 0.00 0.00 52.55 53.00 3kmy s ASP 241 Cb -0.13 -2.12 1.19 0.00 -0.30 0.00 0.00 42.92 41.55 3kmy s ASP 241 CO -0.05 -0.14 1.77 0.45 -0.17 0.00 0.00 175.17 177.03 3kmy h HIS 242 N 8.42 0.00 0.00 -5.34 3.86 -1.85 -2.82 115.15 117.42 3kmy h HIS 242 Ca -0.33 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.88 3kmy h HIS 242 Cb 1.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.64 3kmy h HIS 242 CO 0.71 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 178.37 3kmy n SER 243 N -2.40 0.54 -0.15 2.45 3.41 -1.26 -3.47 113.62 112.73 3kmy n SER 243 Ca 0.00 0.57 0.15 0.00 -0.26 0.00 0.00 58.87 59.33 3kmy n SER 243 Cb 0.17 -0.71 0.69 0.00 -0.26 0.00 0.00 64.21 64.10 3kmy n SER 243 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3kmy n LEU 244 N -2.02 0.53 -3.98 1.04 4.77 -1.07 -4.81 117.00 111.46 3kmy n LEU 244 Ca 0.05 -0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 55.85 3kmy n LEU 244 Cb 0.35 -0.10 -0.06 0.00 -2.33 0.00 0.00 43.42 41.28 3kmy n LEU 244 CO 0.26 0.09 0.07 -0.72 -1.33 0.00 0.00 177.39 175.76 3kmy s TYR 245 N -2.26 0.42 0.18 -1.77 1.13 -1.23 -1.50 117.35 112.33 3kmy s TYR 245 Ca 0.36 -0.77 0.08 0.00 -1.41 0.00 0.00 57.07 55.33 3kmy s TYR 245 Cb 0.21 0.03 -0.04 0.00 -1.10 0.00 0.00 41.96 41.06 3kmy s TYR 245 CO 0.42 -0.85 -0.15 0.95 -2.51 0.00 0.00 175.55 173.41 3kmy s THR 246 N -4.00 1.68 0.00 -3.49 -4.23 -0.77 -4.79 115.64 100.03 3kmy s THR 246 Ca 0.21 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 3kmy s THR 246 Cb 0.02 -1.92 0.00 0.00 1.34 0.00 0.00 72.50 71.94 3kmy s THR 246 CO 0.05 -0.51 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 3kmy n GLY 247 N -0.09 -1.06 3.97 3.99 0.00 -1.26 -3.62 105.19 107.11 3kmy n GLY 247 Ca -0.10 -1.21 -0.21 0.00 0.00 0.00 0.00 46.02 44.50 3kmy n GLY 247 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kmy s SER 248 N -4.00 6.32 -0.10 1.61 0.01 -1.26 -4.95 113.70 111.33 3kmy s SER 248 Ca 0.00 0.09 -0.15 0.00 1.31 0.00 0.00 55.95 57.20 3kmy s SER 248 Cb 0.00 -1.87 -0.05 0.00 0.21 0.00 0.00 66.02 64.31 3kmy s SER 248 CO 0.00 -0.08 0.37 -0.76 0.41 0.00 0.00 173.24 173.18 3kmy s LEU 249 N -3.99 4.33 -0.07 2.44 1.43 -1.26 -4.48 118.68 117.08 3kmy s LEU 249 Ca 0.34 0.73 0.05 0.00 -1.03 0.00 0.00 54.13 54.22 3kmy s LEU 249 Cb -0.09 -2.50 -0.01 0.00 0.03 0.00 0.00 46.19 43.62 3kmy s LEU 249 CO 0.29 0.16 -0.23 0.26 0.23 0.00 0.00 176.35 177.07 3kmy s TRP 250 N -0.07 2.50 -0.07 0.29 0.52 -0.29 -4.89 118.94 116.93 3kmy s TRP 250 Ca 0.21 -0.72 0.00 0.00 0.02 0.00 0.00 56.10 55.61 3kmy s TRP 250 Cb -0.15 -1.63 -0.03 0.00 -1.15 0.00 0.00 33.47 30.51 3kmy s TRP 250 CO 0.08 -0.21 -0.05 0.71 0.02 0.00 0.00 176.95 177.50 3kmy s TYR 251 N -0.10 3.01 0.04 -1.98 1.51 -1.26 -0.40 117.35 118.16 3kmy s TYR 251 Ca -0.05 0.08 0.07 0.00 -1.01 0.00 0.00 57.07 56.16 3kmy s TYR 251 Cb -0.14 -1.73 -0.03 0.00 -0.11 0.00 0.00 41.96 39.94 3kmy s TYR 251 CO 0.04 0.38 -0.19 -0.08 -1.11 0.00 0.00 175.55 174.59 3kmy s THR 252 N -0.84 2.75 0.50 -0.71 -1.32 -0.08 -3.45 115.64 112.50 3kmy s THR 252 Ca 0.13 -1.18 -0.21 0.00 -1.21 0.00 0.00 61.69 59.22 3kmy s THR 252 Cb -0.11 -2.14 -0.07 0.00 -1.51 0.00 0.00 72.50 68.67 3kmy s THR 252 CO 0.02 0.35 1.12 -2.84 -2.21 0.00 0.00 174.62 171.07 3kmy s PRO 253 N -1.38 3.57 -0.54 7.08 0.02 -1.26 -0.49 135.00 142.00 3kmy s PRO 253 Ca 0.14 1.62 -0.24 0.00 0.02 0.00 0.00 61.00 62.54 3kmy s PRO 253 Cb -0.10 -2.16 0.04 0.00 0.02 0.00 0.00 34.50 32.30 3kmy s PRO 253 CO 0.05 -0.67 0.94 0.42 -0.33 0.00 0.00 177.00 177.40 3kmy s ILE 254 N -1.73 4.40 0.18 2.83 1.01 -0.63 -4.57 121.20 122.69 3kmy s ILE 254 Ca 0.69 0.35 -0.16 0.00 0.00 0.00 0.00 60.65 61.52 3kmy s ILE 254 Cb -0.24 -4.53 0.12 0.00 0.01 0.00 0.00 42.46 37.83 3kmy s ILE 254 CO 0.28 -1.08 1.66 -0.09 0.00 0.00 0.00 174.94 175.72 3kmy h ARG 255 N 9.28 -0.00 -3.26 2.79 2.43 -1.35 -3.44 114.38 120.84 3kmy h ARG 255 Ca -0.26 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 58.76 3kmy h ARG 255 Cb 1.07 0.00 -0.23 0.00 -0.42 0.00 0.00 29.97 30.39 3kmy h ARG 255 CO 1.08 -0.00 -0.43 0.50 -1.51 0.00 0.00 179.97 179.61 3kmy s ARG 256 N -6.22 0.42 -1.19 0.20 3.52 -1.26 -5.09 118.95 109.32 3kmy s ARG 256 Ca -0.14 -0.01 -0.14 0.00 -0.13 0.00 0.00 55.73 55.31 3kmy s ARG 256 Cb 0.15 0.19 0.17 0.00 -1.56 0.00 0.00 34.95 33.90 3kmy s ARG 256 CO 0.71 -0.09 1.42 -1.21 -0.81 0.00 0.00 175.30 175.32 3kmy s GLU 257 N -0.65 4.06 0.00 5.12 2.02 -1.26 -4.04 118.70 123.95 3kmy s GLU 257 Ca -0.07 -2.54 0.00 0.00 0.02 0.00 0.00 54.97 52.38 3kmy s GLU 257 Cb -0.04 -5.05 0.00 0.00 0.10 0.00 0.00 34.13 29.13 3kmy s GLU 257 CO 0.01 -1.76 0.00 -2.67 0.02 0.00 0.00 175.26 170.86 3kmy n TRP 258 N 5.69 -0.03 -2.56 1.61 4.27 -1.26 -4.64 117.44 120.51 3kmy n TRP 258 Ca 0.36 0.00 -0.23 0.00 -3.89 0.00 0.00 57.50 53.74 3kmy n TRP 258 Cb 0.43 0.07 0.09 0.00 -1.36 0.00 0.00 31.31 30.54 3kmy n TRP 258 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 3kmy s TYR 259 N -0.13 1.98 -1.12 -2.67 2.02 -1.26 -1.68 117.35 114.49 3kmy s TYR 259 Ca 0.00 -0.15 -0.16 0.00 -0.37 0.00 0.00 57.07 56.39 3kmy s TYR 259 Cb 0.00 -2.97 0.14 0.00 -0.40 0.00 0.00 41.96 38.73 3kmy s TYR 259 CO 0.00 -1.51 1.37 0.71 -1.57 0.00 0.00 175.55 174.56 3kmy s TYR 260 N -3.07 3.25 0.03 2.71 1.51 -1.26 -4.85 117.35 115.67 3kmy s TYR 260 Ca 0.64 -1.78 -0.24 0.00 -1.01 0.00 0.00 57.07 54.68 3kmy s TYR 260 Cb -0.07 -4.38 -0.05 0.00 -0.11 0.00 0.00 41.96 37.35 3kmy s TYR 260 CO 0.43 -1.50 0.73 -2.00 -1.11 0.00 0.00 175.55 172.10 3kmy s GLU 261 N 2.40 4.46 0.36 -0.62 2.12 -1.26 -2.29 118.70 123.88 3kmy s GLU 261 Ca 0.41 1.00 0.04 0.00 0.36 0.00 0.00 54.97 56.78 3kmy s GLU 261 Cb -0.02 -3.36 -0.03 0.00 0.26 0.00 0.00 34.13 30.97 3kmy s GLU 261 CO -0.03 0.29 0.13 0.14 -0.54 0.00 0.00 175.26 175.25 3kmy s VAL 262 N -0.04 0.60 -0.12 3.70 -7.23 -0.27 -0.91 120.40 116.13 3kmy s VAL 262 Ca 0.37 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.55 3kmy s VAL 262 Cb -0.20 -2.47 0.02 0.00 0.56 0.00 0.00 36.38 34.30 3kmy s VAL 262 CO 0.22 0.00 -0.13 -0.63 -0.31 0.00 0.00 175.10 174.25 3kmy s ILE 263 N -3.34 1.37 -0.12 -0.62 1.01 -1.26 -4.07 121.20 114.18 3kmy s ILE 263 Ca 0.29 -0.53 -0.16 0.00 0.00 0.00 0.00 60.65 60.25 3kmy s ILE 263 Cb 0.04 -1.30 -0.04 0.00 0.01 0.00 0.00 42.46 41.17 3kmy s ILE 263 CO 0.16 0.42 0.40 -0.63 0.00 0.00 0.00 174.94 175.29 3kmy s ILE 264 N 1.36 5.22 -0.41 2.92 1.01 -1.26 -2.17 121.20 127.86 3kmy s ILE 264 Ca 0.01 0.79 0.09 0.00 0.00 0.00 0.00 60.65 61.54 3kmy s ILE 264 Cb -0.13 -3.74 -0.11 0.00 0.01 0.00 0.00 42.46 38.49 3kmy s ILE 264 CO -0.07 0.38 0.39 1.33 0.00 0.00 0.00 174.94 176.97 3kmy n VAL 265 N 3.44 0.00 -3.58 2.92 0.24 0.26 -4.72 118.33 116.89 3kmy n VAL 265 Ca -0.10 -0.27 -0.13 0.00 -2.04 0.00 0.00 64.34 61.80 3kmy n VAL 265 Cb 0.52 0.94 -0.06 0.00 -1.47 0.00 0.00 33.84 33.77 3kmy n VAL 265 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3kmy s ARG 266 N -1.95 0.78 -0.04 7.34 3.52 -1.24 -4.76 118.95 122.60 3kmy s ARG 266 Ca 0.03 0.42 0.02 0.00 -0.13 0.00 0.00 55.73 56.07 3kmy s ARG 266 Cb 0.07 0.37 0.01 0.00 -1.56 0.00 0.00 34.95 33.84 3kmy s ARG 266 CO 0.39 -0.19 -0.08 0.08 -0.81 0.00 0.00 175.30 174.68 3kmy s VAL 267 N -0.62 0.77 0.06 7.11 1.01 -1.26 -0.78 120.40 126.68 3kmy s VAL 267 Ca -0.04 -0.31 0.07 0.00 0.00 0.00 0.00 61.98 61.71 3kmy s VAL 267 Cb -0.02 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 3kmy s VAL 267 CO 0.03 0.26 -0.19 -1.61 0.00 0.00 0.00 175.10 173.59 3kmy s GLU 268 N 0.50 1.15 -0.27 2.72 2.02 -0.47 -0.85 118.70 123.50 3kmy s GLU 268 Ca -0.08 -0.97 0.02 0.00 0.02 0.00 0.00 54.97 53.96 3kmy s GLU 268 Cb -0.12 -1.27 0.07 0.00 0.10 0.00 0.00 34.13 32.91 3kmy s GLU 268 CO 0.01 0.31 -0.06 0.42 0.02 0.00 0.00 175.26 175.97 3kmy s ILE 269 N -0.97 1.93 -1.38 -1.63 -1.09 -0.10 -1.33 121.20 116.63 3kmy s ILE 269 Ca 0.05 -1.62 -0.06 0.00 -2.23 0.00 0.00 60.65 56.79 3kmy s ILE 269 Cb -0.09 -2.17 0.03 0.00 -1.58 0.00 0.00 42.46 38.65 3kmy s ILE 269 CO 0.02 -0.18 0.87 0.59 -1.23 0.00 0.00 174.94 175.01 3kmy n ASN 270 N 4.49 -2.98 0.00 3.58 4.13 0.04 -1.30 115.26 123.23 3kmy n ASN 270 Ca -0.10 -0.76 0.00 0.00 1.68 0.00 0.00 54.58 55.40 3kmy n ASN 270 Cb 0.43 -4.17 0.00 0.00 -1.54 0.00 0.00 39.78 34.49 3kmy n ASN 270 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3kmy n GLY 271 N -1.62 2.89 3.65 7.41 0.00 -1.26 -4.99 105.19 111.26 3kmy n GLY 271 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 3kmy n GLY 271 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3kmy s GLN 272 N 0.00 4.19 0.14 1.61 0.74 -0.42 -4.98 119.66 120.93 3kmy s GLN 272 Ca 0.00 0.69 -0.31 0.00 0.05 0.00 0.00 55.36 55.78 3kmy s GLN 272 Cb 0.00 -3.61 -0.10 0.00 1.10 0.00 0.00 33.01 30.40 3kmy s GLN 272 CO 0.00 -0.34 1.63 0.34 -0.55 0.00 0.00 175.29 176.37 3kmy s ASP 273 N 1.30 6.56 0.51 6.67 2.15 -1.26 -0.92 116.67 131.68 3kmy s ASP 273 Ca 0.30 2.62 0.34 0.00 0.43 0.00 0.00 52.55 56.24 3kmy s ASP 273 Cb -0.16 -2.58 1.61 0.00 -0.30 0.00 0.00 42.92 41.49 3kmy s ASP 273 CO 0.10 -0.87 2.02 0.25 -0.17 0.00 0.00 175.17 176.49 3kmy h LEU 274 N 7.47 0.00 -1.11 -1.34 5.85 -1.36 -3.47 115.31 121.36 3kmy h LEU 274 Ca -0.43 0.00 -0.45 0.00 0.84 0.00 0.00 57.88 57.84 3kmy h LEU 274 Cb 1.20 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.24 3kmy h LEU 274 CO 0.93 0.00 -0.76 1.17 -0.34 0.00 0.00 178.44 179.44 3kmy n LYS 275 N -2.86 -5.79 -4.01 1.25 4.81 -1.26 -5.01 118.16 105.29 3kmy n LYS 275 Ca -0.00 0.64 -0.22 0.00 -0.87 0.00 0.00 58.31 57.86 3kmy n LYS 275 Cb 0.19 -5.50 -0.04 0.00 0.02 0.00 0.00 35.03 29.70 3kmy n LYS 275 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 3kmy s MET 276 N -6.46 2.84 0.12 1.64 -1.94 -1.26 -5.04 119.30 109.20 3kmy s MET 276 Ca 0.53 -1.15 -0.31 0.00 -1.71 0.00 0.00 55.69 53.06 3kmy s MET 276 Cb -0.26 -2.52 -0.10 0.00 2.01 0.00 0.00 34.83 33.95 3kmy s MET 276 CO 0.81 0.29 1.77 0.34 -0.01 0.00 0.00 175.02 178.23 3kmy s ASP 277 N -3.89 6.47 0.28 3.03 -1.08 -1.26 -4.81 116.67 115.41 3kmy s ASP 277 Ca 0.36 2.70 0.17 0.00 -0.52 0.00 0.00 52.55 55.25 3kmy s ASP 277 Cb -0.07 -2.57 0.90 0.00 -1.46 0.00 0.00 42.92 39.72 3kmy s ASP 277 CO 0.25 -0.97 1.47 0.00 0.52 0.00 0.00 175.17 176.44 3kmy h LYS 279 N 0.00 0.00 -0.33 0.00 3.64 -1.82 -2.73 116.57 115.34 3kmy h LYS 279 Ca 0.00 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 3kmy h LYS 279 Cb 0.19 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 3kmy h LYS 279 CO 0.00 0.48 0.08 0.93 -2.27 0.00 0.00 179.45 178.66 3kmy h GLU 280 N 0.00 0.47 0.00 1.90 4.39 -1.13 -2.26 114.58 117.94 3kmy h GLU 280 Ca -0.00 -0.07 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 3kmy h GLU 280 Cb 0.89 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.45 3kmy h GLU 280 CO 0.06 0.44 -0.20 1.88 -1.16 0.00 0.00 179.01 180.03 3kmy h TYR 281 N 0.47 0.00 -0.15 4.33 0.99 -1.61 -3.11 116.97 117.88 3kmy h TYR 281 Ca 0.11 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.79 3kmy h TYR 281 Cb 0.18 0.00 -0.03 0.00 1.00 0.00 0.00 36.73 37.88 3kmy h TYR 281 CO 0.01 0.20 -0.16 0.09 -0.00 0.00 0.00 178.16 178.29 3kmy n ASN 282 N -3.59 2.48 -4.50 3.88 3.02 -0.88 -4.34 115.26 111.33 3kmy n ASN 282 Ca -0.01 -3.50 -0.43 0.00 -0.03 0.00 0.00 54.58 50.61 3kmy n ASN 282 Cb 0.34 -0.54 -0.08 0.00 -0.61 0.00 0.00 39.78 38.89 3kmy n ASN 282 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3kmy s TYR 283 N -3.08 3.16 -2.00 3.10 5.04 -1.02 0.02 117.35 122.58 3kmy s TYR 283 Ca 0.39 -0.28 0.19 0.00 -2.44 0.00 0.00 57.07 54.93 3kmy s TYR 283 Cb 0.35 -2.95 0.36 0.00 0.35 0.00 0.00 41.96 40.06 3kmy s TYR 283 CO 0.00 -0.70 1.29 -0.40 -1.34 0.00 0.00 175.55 174.40 3kmy n ASP 284 N 5.70 3.15 -3.58 4.32 3.85 -1.26 -3.39 116.55 125.33 3kmy n ASP 284 Ca -0.06 -1.91 -0.05 0.00 -0.71 0.00 0.00 54.79 52.05 3kmy n ASP 284 Cb 0.48 -0.22 -0.02 0.00 -1.35 0.00 0.00 41.12 40.01 3kmy n ASP 284 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.20 174.60 3kmy s LYS 285 N -1.29 0.38 -0.08 0.11 -2.85 0.10 -4.68 119.74 111.43 3kmy s LYS 285 Ca 0.32 -0.12 0.03 0.00 -1.00 0.00 0.00 55.97 55.20 3kmy s LYS 285 Cb 0.19 0.17 0.01 0.00 -2.06 0.00 0.00 37.83 36.14 3kmy s LYS 285 CO 0.26 -0.16 -0.16 -1.12 0.10 0.00 0.00 175.35 174.27 3kmy s SER 286 N -2.10 2.26 0.14 0.03 0.01 -1.26 -0.46 113.70 112.33 3kmy s SER 286 Ca 0.08 -0.39 0.01 0.00 1.31 0.00 0.00 55.95 56.96 3kmy s SER 286 Cb -0.01 -1.04 -0.04 0.00 0.21 0.00 0.00 66.02 65.14 3kmy s SER 286 CO -0.05 0.07 0.01 0.27 0.41 0.00 0.00 173.24 173.95 3kmy s ILE 287 N 0.59 0.49 -0.31 1.44 -4.36 -0.56 -1.11 121.20 117.39 3kmy s ILE 287 Ca -0.15 -1.94 -0.09 0.00 -0.26 0.00 0.00 60.65 58.21 3kmy s ILE 287 Cb -0.16 -2.00 -0.00 0.00 1.25 0.00 0.00 42.46 41.55 3kmy s ILE 287 CO 0.05 -0.56 0.13 -0.69 0.24 0.00 0.00 174.94 174.10 3kmy s VAL 288 N -3.78 4.38 -0.33 8.37 1.01 -0.97 -0.67 120.40 128.41 3kmy s VAL 288 Ca 0.21 -0.53 -0.00 0.00 0.00 0.00 0.00 61.98 61.66 3kmy s VAL 288 Cb 0.06 -3.25 0.11 0.00 0.00 0.00 0.00 36.38 33.30 3kmy s VAL 288 CO 0.01 0.06 0.12 -0.62 0.00 0.00 0.00 175.10 174.67 3kmy s ASP 289 N 1.57 3.97 0.00 3.32 2.15 -0.35 -4.41 116.67 122.92 3kmy s ASP 289 Ca 0.04 -1.77 0.15 0.00 0.43 0.00 0.00 52.55 51.39 3kmy s ASP 289 Cb -0.17 -0.88 0.73 0.00 -0.30 0.00 0.00 42.92 42.30 3kmy s ASP 289 CO 0.05 -0.40 1.43 -1.54 -0.17 0.00 0.00 175.17 174.54 3kmy n SER 290 N 4.67 0.00 -0.41 -0.34 3.41 -1.26 -2.13 113.62 117.55 3kmy n SER 290 Ca -0.00 0.16 0.14 0.00 -0.26 0.00 0.00 58.87 58.90 3kmy n SER 290 Cb 0.41 -0.33 0.52 0.00 -0.26 0.00 0.00 64.21 64.56 3kmy n SER 290 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kmy n GLY 291 N -0.00 -0.16 3.37 5.00 0.00 -1.26 -4.57 105.19 107.57 3kmy n GLY 291 Ca 0.06 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 3kmy n GLY 291 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kmy s THR 292 N -2.09 2.58 -0.03 2.61 2.01 -0.91 -5.03 115.64 114.79 3kmy s THR 292 Ca 0.36 -0.88 -0.21 0.00 0.31 0.00 0.00 61.69 61.27 3kmy s THR 292 Cb 0.21 -1.99 -0.13 0.00 0.01 0.00 0.00 72.50 70.60 3kmy s THR 292 CO 0.37 0.57 0.89 0.74 -0.69 0.00 0.00 174.62 176.50 3kmy h THR 293 N 4.76 0.43 -4.19 -0.82 2.02 -1.86 0.48 112.91 113.72 3kmy h THR 293 Ca -0.38 -0.74 -0.46 0.00 0.77 0.00 0.00 66.41 65.60 3kmy h THR 293 Cb 1.16 0.68 0.10 0.00 -1.74 0.00 0.00 68.15 68.36 3kmy h THR 293 CO 0.50 0.10 0.35 0.20 0.37 0.00 0.00 175.52 177.03 3kmy s ASN 294 N -5.09 4.40 -0.31 4.18 0.01 -1.26 -0.62 114.94 116.25 3kmy s ASN 294 Ca -0.12 0.57 -0.19 0.00 -0.71 0.00 0.00 52.86 52.41 3kmy s ASN 294 Cb 0.01 -1.04 -0.01 0.00 0.41 0.00 0.00 41.25 40.62 3kmy s ASN 294 CO 0.40 -1.93 0.57 -0.22 -1.51 0.00 0.00 177.10 174.41 3kmy s LEU 295 N -5.51 4.19 -0.09 0.60 2.96 -0.60 -2.17 118.68 118.06 3kmy s LEU 295 Ca 0.63 0.28 0.00 0.00 -0.22 0.00 0.00 54.13 54.82 3kmy s LEU 295 Cb -0.10 -2.71 -0.03 0.00 0.50 0.00 0.00 46.19 43.86 3kmy s LEU 295 CO 0.48 -0.45 -0.08 -0.13 -1.32 0.00 0.00 176.35 174.85 3kmy s ARG 296 N 2.49 2.98 0.09 1.98 0.52 0.02 -1.66 118.95 125.37 3kmy s ARG 296 Ca 0.22 -0.58 0.09 0.00 -0.52 0.00 0.00 55.73 54.94 3kmy s ARG 296 Cb -0.15 -2.63 -0.03 0.00 0.52 0.00 0.00 34.95 32.65 3kmy s ARG 296 CO 0.12 0.52 -0.23 -0.51 0.02 0.00 0.00 175.30 175.22 3kmy s LEU 297 N -0.42 2.26 0.46 2.53 1.43 -0.33 -0.02 118.68 124.58 3kmy s LEU 297 Ca 0.06 -0.65 -0.23 0.00 -1.03 0.00 0.00 54.13 52.27 3kmy s LEU 297 Cb -0.12 -1.02 -0.09 0.00 0.03 0.00 0.00 46.19 44.99 3kmy s LEU 297 CO 0.02 0.13 1.08 -2.65 0.23 0.00 0.00 176.35 175.16 3kmy n PRO 298 N 1.28 1.43 -0.30 1.29 -0.02 -1.26 -0.25 135.00 137.17 3kmy n PRO 298 Ca -0.18 0.52 -0.08 0.00 -2.02 0.00 0.00 63.50 61.73 3kmy n PRO 298 Cb 0.53 -2.16 -0.07 0.00 -0.02 0.00 0.00 33.50 31.78 3kmy n PRO 298 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3kmy n LYS 299 N -0.11 -0.32 -0.29 -0.52 4.81 -1.01 -0.08 118.16 120.64 3kmy n LYS 299 Ca 0.09 1.12 -0.01 0.00 -0.87 0.00 0.00 58.31 58.65 3kmy n LYS 299 Cb 0.41 -1.65 0.18 0.00 0.02 0.00 0.00 35.03 33.99 3kmy n LYS 299 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 3kmy h LYS 300 N 0.00 1.14 -0.30 1.64 3.64 -1.91 -0.75 116.57 120.01 3kmy h LYS 300 Ca 0.11 -0.08 -0.15 0.00 -1.27 0.00 0.00 60.65 59.27 3kmy h LYS 300 Cb 0.29 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 3kmy h LYS 300 CO -0.67 0.76 -0.38 0.28 -2.27 0.00 0.00 179.45 177.17 3kmy h VAL 301 N 1.17 1.29 -0.33 2.00 2.07 -1.17 -2.56 116.25 118.72 3kmy h VAL 301 Ca 0.31 -1.56 0.01 0.00 0.82 0.00 0.00 66.70 66.28 3kmy h VAL 301 Cb -0.11 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 3kmy h VAL 301 CO -0.07 0.51 0.21 0.15 0.02 0.00 0.00 177.57 178.39 3kmy h PHE 302 N 0.56 0.39 -0.75 1.57 3.57 -0.02 0.74 116.94 123.00 3kmy h PHE 302 Ca 0.04 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.55 3kmy h PHE 302 Cb 0.97 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.54 3kmy h PHE 302 CO 0.07 0.24 0.47 0.93 -2.23 0.00 0.00 178.31 177.80 3kmy h GLU 303 N 0.42 1.01 -0.41 1.11 5.08 -1.13 -0.03 114.58 120.63 3kmy h GLU 303 Ca 0.12 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.25 3kmy h GLU 303 Cb -0.03 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 3kmy h GLU 303 CO -0.04 0.70 -0.34 0.00 -1.00 0.00 0.00 179.01 178.32 3kmy h ALA 304 N 1.26 0.59 -0.39 3.43 0.00 -1.15 -2.58 119.26 120.42 3kmy h ALA 304 Ca 0.27 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3kmy h ALA 304 Cb -0.07 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3kmy h ALA 304 CO -0.05 0.67 0.07 0.00 0.00 0.00 0.00 179.25 179.93 3kmy h ALA 305 N 0.79 0.52 -0.56 0.00 0.00 -0.50 -1.91 119.26 117.60 3kmy h ALA 305 Ca 0.07 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 3kmy h ALA 305 Cb 0.94 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 3kmy h ALA 305 CO 0.09 0.23 0.15 0.28 0.00 0.00 0.00 179.25 180.00 3kmy h VAL 306 N 0.49 1.23 -0.35 0.00 2.07 -1.01 0.20 116.25 118.87 3kmy h VAL 306 Ca 0.12 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 3kmy h VAL 306 Cb 0.36 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 3kmy h VAL 306 CO 0.01 0.30 0.19 0.11 0.02 0.00 0.00 177.57 178.20 3kmy h LYS 307 N 0.83 0.50 -0.39 1.57 1.57 -1.25 0.13 116.57 119.52 3kmy h LYS 307 Ca 0.18 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.83 3kmy h LYS 307 Cb 0.27 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3kmy h LYS 307 CO -0.00 0.41 -0.07 1.03 -0.57 0.00 0.00 179.45 180.25 3kmy h SER 308 N 0.45 0.73 -0.42 0.86 0.87 -0.85 -1.36 113.55 113.83 3kmy h SER 308 Ca 0.12 -0.35 -0.07 0.00 -1.23 0.00 0.00 61.79 60.26 3kmy h SER 308 Cb 0.06 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 3kmy h SER 308 CO -0.02 0.91 0.02 0.40 -0.53 0.00 0.00 176.83 177.61 3kmy h ILE 309 N 0.54 1.24 -0.52 2.23 2.04 -0.46 -1.03 117.51 121.55 3kmy h ILE 309 Ca 0.10 -0.99 -0.05 0.00 1.00 0.00 0.00 64.86 64.92 3kmy h ILE 309 Cb 0.58 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 3kmy h ILE 309 CO 0.03 0.35 0.11 0.11 0.00 0.00 0.00 178.15 178.76 3kmy h LYS 310 N 0.76 0.84 -0.46 2.37 1.57 -0.60 -2.02 116.57 119.04 3kmy h LYS 310 Ca 0.15 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 3kmy h LYS 310 Cb 0.44 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 3kmy h LYS 310 CO 0.02 0.81 0.20 0.00 -0.57 0.00 0.00 179.45 179.91 3kmy h ALA 311 N 1.00 0.60 -0.12 3.86 0.00 -0.87 -0.95 119.26 122.78 3kmy h ALA 311 Ca 0.16 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3kmy h ALA 311 Cb 0.36 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3kmy h ALA 311 CO 0.00 0.18 -0.18 0.00 0.00 0.00 0.00 179.25 179.26 3kmy h ALA 312 N 1.05 1.48 -0.53 0.00 0.00 -1.06 -2.90 119.26 117.30 3kmy h ALA 312 Ca 0.16 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3kmy h ALA 312 Cb 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3kmy h ALA 312 CO -0.02 0.37 0.00 -1.13 0.00 0.00 0.00 179.25 178.47 3kmy n SER 313 N -4.24 4.46 0.14 0.00 3.41 -0.77 -4.73 113.62 111.89 3kmy n SER 313 Ca -0.01 -2.55 0.06 0.00 -0.26 0.00 0.00 58.87 56.12 3kmy n SER 313 Cb 0.30 -0.54 0.34 0.00 -0.26 0.00 0.00 64.21 64.05 3kmy n SER 313 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3kmy n SER 314 N 0.68 0.32 0.21 4.04 3.41 -0.38 -1.91 113.62 119.99 3kmy n SER 314 Ca 0.23 0.56 0.15 0.00 -0.26 0.00 0.00 58.87 59.55 3kmy n SER 314 Cb 0.86 -0.53 0.69 0.00 -0.26 0.00 0.00 64.21 64.97 3kmy n SER 314 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3kmy h THR 315 N 0.00 0.00 -3.69 6.66 1.35 -1.87 -3.40 112.91 111.96 3kmy h THR 315 Ca 0.00 -0.21 -0.43 0.00 -0.55 0.00 0.00 66.41 65.22 3kmy h THR 315 Cb 0.45 0.99 -0.32 0.00 -1.73 0.00 0.00 68.15 67.55 3kmy h THR 315 CO 0.00 0.00 -0.79 -1.61 -0.25 0.00 0.00 175.52 172.87 3kmy s GLU 316 N -3.60 1.02 -0.15 4.72 2.02 -0.80 -5.14 118.70 116.77 3kmy s GLU 316 Ca 0.00 -0.28 -0.08 0.00 0.02 0.00 0.00 54.97 54.64 3kmy s GLU 316 Cb 0.09 -0.94 -0.04 0.00 0.10 0.00 0.00 34.13 33.33 3kmy s GLU 316 CO 0.39 0.06 0.12 0.15 0.02 0.00 0.00 175.26 176.00 3kmy s LYS 317 N 0.39 3.69 0.06 1.61 -0.14 -1.26 -4.95 119.74 119.13 3kmy s LYS 317 Ca -0.06 -0.20 0.09 0.00 -1.36 0.00 0.00 55.97 54.43 3kmy s LYS 317 Cb -0.11 -3.23 -0.03 0.00 -1.68 0.00 0.00 37.83 32.79 3kmy s LYS 317 CO 0.01 0.57 -0.24 -0.06 -0.76 0.00 0.00 175.35 174.86 3kmy s PHE 318 N -0.44 2.13 0.78 3.18 0.40 -1.26 -5.13 117.98 117.64 3kmy s PHE 318 Ca 0.11 -0.40 -0.14 0.00 -0.60 0.00 0.00 56.93 55.91 3kmy s PHE 318 Cb -0.12 -1.25 0.06 0.00 0.51 0.00 0.00 43.02 42.23 3kmy s PHE 318 CO 0.02 0.15 1.20 -1.25 0.70 0.00 0.00 175.22 176.04 3kmy s PRO 319 N -1.36 1.85 0.34 0.24 0.04 -1.26 -4.89 135.00 129.95 3kmy s PRO 319 Ca 0.10 1.75 0.06 0.00 0.04 0.00 0.00 61.00 62.95 3kmy s PRO 319 Cb -0.10 -1.80 0.72 0.00 0.04 0.00 0.00 34.50 33.36 3kmy s PRO 319 CO 0.03 -2.05 1.89 -0.44 0.04 0.00 0.00 177.00 176.46 3kmy h ASP 320 N -0.66 0.74 -0.33 6.66 3.32 -2.00 -0.78 116.42 123.37 3kmy h ASP 320 Ca -0.47 0.03 0.09 0.00 0.02 0.00 0.00 57.03 56.71 3kmy h ASP 320 Cb 1.29 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 3kmy h ASP 320 CO 0.48 0.42 0.24 1.23 -1.72 0.00 0.00 179.24 179.88 3kmy h GLY 321 N 0.81 0.01 0.68 2.75 0.00 -1.94 -1.61 103.07 103.76 3kmy h GLY 321 Ca 0.42 -0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.74 3kmy h GLY 321 CO -0.18 0.00 -0.05 -2.75 0.00 0.00 0.00 176.54 173.56 3kmy h PHE 322 N 0.01 -0.12 0.00 5.60 3.57 -1.31 -1.92 116.94 122.78 3kmy h PHE 322 Ca 0.16 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.65 3kmy h PHE 322 Cb 0.62 0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.40 3kmy h PHE 322 CO -0.00 0.21 0.00 -1.49 -2.23 0.00 0.00 178.31 174.80 3kmy h TRP 323 N -0.45 0.00 -0.06 0.41 4.06 -1.39 0.10 115.95 118.61 3kmy h TRP 323 Ca -0.01 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.94 3kmy h TRP 323 Cb 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.54 3kmy h TRP 323 CO 0.03 0.00 0.00 1.28 -3.56 0.00 0.00 178.44 176.19 3kmy n LEU 324 N -2.74 1.13 -0.56 -4.49 4.77 -0.68 -4.90 117.00 109.53 3kmy n LEU 324 Ca -0.00 -0.43 -0.07 0.00 -0.03 0.00 0.00 56.01 55.48 3kmy n LEU 324 Cb 0.18 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 3kmy n LEU 324 CO 0.20 0.21 -0.07 0.61 -1.33 0.00 0.00 177.39 177.02 3kmy n GLY 325 N 1.08 0.82 0.13 -0.72 0.00 0.35 -4.88 105.19 101.98 3kmy n GLY 325 Ca 0.18 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 3kmy n GLY 325 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kmy n GLU 326 N -1.39 0.71 -4.23 1.61 1.02 -0.78 -4.71 120.64 112.87 3kmy n GLU 326 Ca -0.07 0.25 -0.30 0.00 -0.02 0.00 0.00 57.16 57.02 3kmy n GLU 326 Cb 0.41 -1.65 -0.10 0.00 -0.02 0.00 0.00 31.44 30.09 3kmy n GLU 326 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 3kmy s GLN 327 N -2.53 2.09 0.58 3.49 -2.07 -0.86 -5.01 119.66 115.36 3kmy s GLN 327 Ca -0.27 -1.04 -0.05 0.00 -1.82 0.00 0.00 55.36 52.17 3kmy s GLN 327 Cb 0.08 -2.29 0.01 0.00 -1.09 0.00 0.00 33.01 29.72 3kmy s GLN 327 CO 0.70 0.50 0.88 -0.48 -1.32 0.00 0.00 175.29 175.57 3kmy s LEU 328 N -2.22 3.26 -0.02 2.60 0.05 -1.26 -4.22 118.68 116.87 3kmy s LEU 328 Ca 0.21 0.67 0.04 0.00 0.05 0.00 0.00 54.13 55.10 3kmy s LEU 328 Cb -0.11 -3.50 -0.01 0.00 -2.05 0.00 0.00 46.19 40.52 3kmy s LEU 328 CO 0.13 -1.04 -0.14 -0.69 -0.55 0.00 0.00 176.35 174.06 3kmy s VAL 329 N -2.96 1.11 0.16 1.48 1.01 -0.50 -4.95 120.40 115.76 3kmy s VAL 329 Ca 0.54 -0.59 0.08 0.00 0.00 0.00 0.00 61.98 62.01 3kmy s VAL 329 Cb -0.10 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 3kmy s VAL 329 CO 0.44 0.32 -0.18 0.00 0.00 0.00 0.00 175.10 175.69 3kmy s TRP 331 N -2.05 0.64 0.48 0.00 0.51 -0.67 -4.97 118.94 112.89 3kmy s TRP 331 Ca 0.15 -0.59 -0.22 0.00 -2.12 0.00 0.00 56.10 53.32 3kmy s TRP 331 Cb -0.06 -0.39 -0.09 0.00 -0.81 0.00 0.00 33.47 32.13 3kmy s TRP 331 CO 0.06 -0.12 1.03 0.94 -0.51 0.00 0.00 176.95 178.35 3kmy n GLN 332 N 1.21 1.29 -1.63 4.98 7.27 -1.26 -0.98 117.38 128.26 3kmy n GLN 332 Ca -0.21 0.47 -0.63 0.00 0.07 0.00 0.00 57.00 56.70 3kmy n GLN 332 Cb 0.56 -2.13 -0.09 0.00 2.41 0.00 0.00 30.24 30.98 3kmy n GLN 332 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3kmy n ALA 333 N -0.86 -1.96 -0.89 1.69 0.00 -1.24 -0.94 120.51 116.32 3kmy n ALA 333 Ca 0.10 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.05 3kmy n ALA 333 Cb 0.42 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 18.05 3kmy n ALA 333 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kmy n GLY 334 N 3.19 0.91 1.27 0.00 0.00 -1.26 -4.90 105.19 104.40 3kmy n GLY 334 Ca 0.27 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.40 3kmy n GLY 334 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kmy n THR 335 N -2.00 0.96 -1.67 2.61 -2.24 -0.12 -4.98 114.28 106.84 3kmy n THR 335 Ca 0.00 -0.98 -0.55 0.00 -2.27 0.00 0.00 64.05 60.25 3kmy n THR 335 Cb 0.00 0.54 -0.07 0.00 -2.10 0.00 0.00 70.33 68.71 3kmy n THR 335 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3kmy n THR 336 N 1.53 0.22 -1.37 4.28 -1.04 -1.26 -4.79 114.28 111.85 3kmy n THR 336 Ca 0.23 -0.04 -0.39 0.00 -2.04 0.00 0.00 64.05 61.81 3kmy n THR 336 Cb 0.60 -1.15 -0.03 0.00 -1.82 0.00 0.00 70.33 67.94 3kmy n THR 336 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3kmy n PRO 337 N 4.50 3.58 -0.30 -2.82 -0.04 -1.26 -4.75 135.00 133.91 3kmy n PRO 337 Ca 0.23 -2.26 0.13 0.00 -0.04 0.00 0.00 63.50 61.56 3kmy n PRO 337 Cb 0.16 -2.87 0.29 0.00 -0.04 0.00 0.00 33.50 31.05 3kmy n PRO 337 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3kmy h TRP 338 N 5.15 0.50 -0.00 0.54 4.06 -1.95 -1.39 115.95 122.86 3kmy h TRP 338 Ca 0.83 0.04 0.00 0.00 2.06 0.00 0.00 58.89 61.83 3kmy h TRP 338 Cb 0.33 -0.08 -0.00 0.00 -1.00 0.00 0.00 29.16 28.41 3kmy h TRP 338 CO 1.83 -0.12 0.01 -2.95 -3.56 0.00 0.00 178.44 173.64 3kmy h ASN 339 N 0.30 0.00 1.52 -3.49 7.08 -2.00 -1.80 115.58 117.19 3kmy h ASN 339 Ca 0.55 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.77 3kmy h ASN 339 Cb 1.08 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.32 3kmy h ASN 339 CO -0.58 0.00 -0.26 0.16 -2.08 0.00 0.00 177.43 174.67 3kmy h ILE 340 N 0.00 0.00 -3.25 6.14 3.07 -1.61 -3.44 117.51 118.41 3kmy h ILE 340 Ca 0.00 -0.78 -0.57 0.00 1.55 0.00 0.00 64.86 65.06 3kmy h ILE 340 Cb 0.01 1.63 -0.04 0.00 -0.27 0.00 0.00 36.82 38.15 3kmy h ILE 340 CO -0.00 0.00 -0.04 -0.36 -1.05 0.00 0.00 178.15 176.70 3kmy s PHE 341 N -3.20 3.78 0.57 0.16 0.08 -0.68 -3.59 117.98 115.10 3kmy s PHE 341 Ca 0.07 1.25 -0.10 0.00 0.12 0.00 0.00 56.93 58.27 3kmy s PHE 341 Cb 0.09 -2.48 -0.04 0.00 -0.57 0.00 0.00 43.02 40.01 3kmy s PHE 341 CO 0.68 0.56 0.96 -1.25 -0.10 0.00 0.00 175.22 176.07 3kmy s PRO 342 N -1.23 3.61 0.43 0.24 0.04 -1.26 -4.83 135.00 132.00 3kmy s PRO 342 Ca 0.30 0.62 -0.06 0.00 0.04 0.00 0.00 61.00 61.90 3kmy s PRO 342 Cb -0.19 -2.16 -0.05 0.00 0.04 0.00 0.00 34.50 32.14 3kmy s PRO 342 CO 0.19 -0.45 0.74 0.14 0.04 0.00 0.00 177.00 177.66 3kmy s VAL 343 N -3.02 4.90 -0.08 -0.36 -7.23 -1.26 -4.36 120.40 108.99 3kmy s VAL 343 Ca 0.53 0.26 0.03 0.00 -1.81 0.00 0.00 61.98 60.99 3kmy s VAL 343 Cb -0.11 -3.82 0.01 0.00 0.56 0.00 0.00 36.38 33.02 3kmy s VAL 343 CO 0.50 -0.69 -0.19 -0.63 -0.31 0.00 0.00 175.10 173.78 3kmy s ILE 344 N -2.55 1.63 -0.11 -0.62 1.01 -0.53 -0.78 121.20 119.25 3kmy s ILE 344 Ca 0.48 -0.77 0.02 0.00 0.00 0.00 0.00 60.65 60.38 3kmy s ILE 344 Cb -0.10 -1.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.93 3kmy s ILE 344 CO 0.39 0.46 -0.20 -0.44 0.00 0.00 0.00 174.94 175.16 3kmy s SER 345 N 0.45 3.47 -0.20 3.58 0.01 -0.44 -0.71 113.70 119.86 3kmy s SER 345 Ca -0.16 -0.46 -0.02 0.00 1.31 0.00 0.00 55.95 56.63 3kmy s SER 345 Cb -0.17 -1.45 0.00 0.00 0.21 0.00 0.00 66.02 64.62 3kmy s SER 345 CO 0.06 0.17 -0.12 -0.76 0.41 0.00 0.00 173.24 173.01 3kmy s LEU 346 N 0.30 2.54 -0.11 2.44 1.43 -0.28 -1.37 118.68 123.63 3kmy s LEU 346 Ca -0.14 -0.51 -0.19 0.00 -1.03 0.00 0.00 54.13 52.26 3kmy s LEU 346 Cb -0.17 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.39 3kmy s LEU 346 CO 0.07 -0.01 0.50 -0.31 0.23 0.00 0.00 176.35 176.84 3kmy s TYR 347 N 1.38 3.53 0.13 0.29 1.51 0.04 -1.37 117.35 122.85 3kmy s TYR 347 Ca 0.05 0.94 0.09 0.00 -1.01 0.00 0.00 57.07 57.14 3kmy s TYR 347 Cb -0.14 -2.57 -0.04 0.00 -0.11 0.00 0.00 41.96 39.10 3kmy s TYR 347 CO -0.08 0.18 -0.17 -0.51 -1.11 0.00 0.00 175.55 173.86 3kmy s LEU 348 N 0.57 2.74 0.35 -1.29 1.43 0.75 -0.57 118.68 122.66 3kmy s LEU 348 Ca 0.27 -0.56 -0.29 0.00 -1.03 0.00 0.00 54.13 52.53 3kmy s LEU 348 Cb -0.16 -1.56 -0.11 0.00 0.03 0.00 0.00 46.19 44.40 3kmy s LEU 348 CO 0.11 0.17 1.50 -0.32 0.23 0.00 0.00 176.35 178.04 3kmy s MET 349 N -2.24 4.13 0.60 1.70 -2.45 -0.92 -1.98 119.30 118.15 3kmy s MET 349 Ca 0.19 2.54 0.07 0.00 -1.25 0.00 0.00 55.69 57.24 3kmy s MET 349 Cb -0.10 -2.99 0.09 0.00 1.25 0.00 0.00 34.83 33.08 3kmy s MET 349 CO 0.11 -0.53 0.83 0.20 1.05 0.00 0.00 175.02 176.68 3kmy s GLY 350 N -0.00 1.75 0.24 2.11 0.00 0.30 -4.04 107.32 107.67 3kmy s GLY 350 Ca 0.55 -2.02 0.25 0.00 0.00 0.00 0.00 44.72 43.49 3kmy s GLY 350 CO 0.58 -1.55 1.58 0.83 0.00 0.00 0.00 173.10 174.55 3kmy h GLU 351 N 0.02 0.00 -6.04 2.90 5.08 -1.81 -3.42 114.58 111.31 3kmy h GLU 351 Ca -0.32 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.44 3kmy h GLU 351 Cb 1.28 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.48 3kmy h GLU 351 CO 0.41 0.00 -0.16 0.08 -1.00 0.00 0.00 179.01 178.33 3kmy s VAL 352 N -3.16 4.97 0.20 3.13 1.01 -1.26 -5.02 120.40 120.27 3kmy s VAL 352 Ca 0.08 0.92 -0.32 0.00 0.00 0.00 0.00 61.98 62.66 3kmy s VAL 352 Cb 0.11 -3.76 -0.15 0.00 0.00 0.00 0.00 36.38 32.59 3kmy s VAL 352 CO 0.66 0.56 1.28 0.41 0.00 0.00 0.00 175.10 178.01 3kmy n THR 353 N 1.89 0.88 -2.19 3.92 -1.04 -1.26 -1.52 114.28 114.97 3kmy n THR 353 Ca -0.13 -0.22 -0.17 0.00 -2.04 0.00 0.00 64.05 61.49 3kmy n THR 353 Cb 0.52 -1.13 -0.02 0.00 -1.82 0.00 0.00 70.33 67.87 3kmy n THR 353 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3kmy n ASN 354 N 2.11 -4.99 -4.21 8.00 3.02 -1.26 -4.98 115.26 112.96 3kmy n ASN 354 Ca 0.14 0.16 -0.26 0.00 -0.03 0.00 0.00 54.58 54.58 3kmy n ASN 354 Cb 0.28 -4.25 -0.15 0.00 -0.61 0.00 0.00 39.78 35.04 3kmy n ASN 354 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3kmy s GLN 355 N -4.65 1.58 0.24 3.52 0.74 -0.57 -1.37 119.66 119.15 3kmy s GLN 355 Ca 0.00 -0.74 0.01 0.00 0.05 0.00 0.00 55.36 54.67 3kmy s GLN 355 Cb 0.00 -1.55 -0.04 0.00 1.10 0.00 0.00 33.01 32.52 3kmy s GLN 355 CO 0.00 0.42 0.14 -1.54 -0.55 0.00 0.00 175.29 173.76 3kmy s SER 356 N -0.57 0.78 0.20 6.67 1.04 0.10 -0.54 113.70 121.38 3kmy s SER 356 Ca 0.08 -1.44 -0.05 0.00 0.48 0.00 0.00 55.95 55.01 3kmy s SER 356 Cb -0.08 0.33 -0.03 0.00 0.10 0.00 0.00 66.02 66.35 3kmy s SER 356 CO -0.00 -0.83 0.24 0.72 0.98 0.00 0.00 173.24 174.34 3kmy s PHE 357 N -3.90 0.84 0.06 5.02 -0.12 -0.84 -0.38 117.98 118.65 3kmy s PHE 357 Ca 0.38 -1.13 0.04 0.00 -0.05 0.00 0.00 56.93 56.18 3kmy s PHE 357 Cb 0.07 -0.30 -0.03 0.00 -0.63 0.00 0.00 43.02 42.13 3kmy s PHE 357 CO 0.14 -0.74 -0.12 -0.98 -0.05 0.00 0.00 175.22 173.47 3kmy s ARG 358 N -4.09 0.77 -0.07 1.99 1.70 0.28 -0.17 118.95 119.35 3kmy s ARG 358 Ca 0.31 -0.84 0.04 0.00 -0.47 0.00 0.00 55.73 54.77 3kmy s ARG 358 Cb 0.05 -0.72 -0.02 0.00 -0.57 0.00 0.00 34.95 33.68 3kmy s ARG 358 CO 0.09 0.16 -0.19 0.96 -1.08 0.00 0.00 175.30 175.24 3kmy s ILE 359 N -1.16 2.57 -0.11 4.99 -4.36 -0.47 -1.06 121.20 121.59 3kmy s ILE 359 Ca -0.03 -0.88 0.03 0.00 -0.26 0.00 0.00 60.65 59.51 3kmy s ILE 359 Cb -0.09 -1.99 0.00 0.00 1.25 0.00 0.00 42.46 41.64 3kmy s ILE 359 CO 0.02 0.57 -0.22 -0.89 0.24 0.00 0.00 174.94 174.65 3kmy s THR 360 N -0.26 1.97 0.19 8.37 2.01 0.70 -1.13 115.64 127.50 3kmy s THR 360 Ca 0.00 -0.95 0.09 0.00 0.31 0.00 0.00 61.69 61.13 3kmy s THR 360 Cb -0.13 -1.72 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 3kmy s THR 360 CO 0.03 0.54 -0.06 0.27 -0.69 0.00 0.00 174.62 174.71 3kmy s ILE 361 N 0.54 3.36 0.43 1.82 -4.36 0.11 -2.06 121.20 121.04 3kmy s ILE 361 Ca -0.15 -1.65 0.08 0.00 -0.26 0.00 0.00 60.65 58.67 3kmy s ILE 361 Cb -0.17 -2.69 -0.00 0.00 1.25 0.00 0.00 42.46 40.85 3kmy s ILE 361 CO 0.05 -0.16 0.46 -0.76 0.24 0.00 0.00 174.94 174.77 3kmy s LEU 362 N -3.00 3.41 0.60 0.37 1.43 -1.26 -1.46 118.68 118.77 3kmy s LEU 362 Ca 0.27 -0.69 0.38 0.00 -1.03 0.00 0.00 54.13 53.06 3kmy s LEU 362 Cb -0.08 -2.16 1.87 0.00 0.03 0.00 0.00 46.19 45.85 3kmy s LEU 362 CO 0.17 -0.75 2.18 1.55 0.23 0.00 0.00 176.35 179.72 3kmy h PRO 363 N 0.85 0.00 0.00 1.29 0.13 -1.88 0.22 132.00 132.61 3kmy h PRO 363 Ca -0.40 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.73 3kmy h PRO 363 Cb 1.27 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 3kmy h PRO 363 CO 0.53 0.02 -0.01 1.96 -0.23 0.00 0.00 178.00 180.27 3kmy h GLN 364 N 0.00 0.00 0.00 0.86 7.50 -1.86 0.64 115.11 122.24 3kmy h GLN 364 Ca -0.00 0.00 -0.27 0.00 0.50 0.00 0.00 58.65 58.88 3kmy h GLN 364 Cb 0.24 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.73 3kmy h GLN 364 CO 0.00 0.01 -1.55 1.04 -1.50 0.00 0.00 178.83 176.84 3kmy n GLN 365 N -3.36 0.56 0.00 1.46 3.00 0.75 -4.50 117.38 115.30 3kmy n GLN 365 Ca -0.03 0.48 0.15 0.00 -0.01 0.00 0.00 57.00 57.60 3kmy n GLN 365 Cb 0.10 -1.67 0.85 0.00 0.00 0.00 0.00 30.24 29.52 3kmy n GLN 365 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.06 179.54 3kmy n TYR 366 N -4.40 0.00 -3.76 1.08 0.18 -0.98 -4.49 117.16 104.79 3kmy n TYR 366 Ca -0.36 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.04 3kmy n TYR 366 Cb 0.71 -0.06 -0.12 0.00 -0.38 0.00 0.00 39.34 39.48 3kmy n TYR 366 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3kmy s LEU 367 N -2.13 4.27 -0.25 -3.48 1.43 0.20 -0.24 118.68 118.49 3kmy s LEU 367 Ca 0.42 -1.11 -0.22 0.00 -1.03 0.00 0.00 54.13 52.20 3kmy s LEU 367 Cb 0.21 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.55 3kmy s LEU 367 CO 0.39 -0.31 0.69 -0.60 0.23 0.00 0.00 176.35 176.74 3kmy s ARG 368 N 1.41 4.14 0.17 1.70 3.52 0.08 -4.78 118.95 125.19 3kmy s ARG 368 Ca -0.01 0.67 -0.32 0.00 -0.13 0.00 0.00 55.73 55.93 3kmy s ARG 368 Cb -0.19 -3.64 -0.12 0.00 -1.56 0.00 0.00 34.95 29.44 3kmy s ARG 368 CO 0.03 -0.43 1.75 -2.30 -0.81 0.00 0.00 175.30 173.54 3kmy n PRO 369 N 5.73 2.73 -4.04 5.12 -0.02 -1.26 -1.08 135.00 142.18 3kmy n PRO 369 Ca 0.01 0.99 -0.10 0.00 -2.02 0.00 0.00 63.50 62.38 3kmy n PRO 369 Cb 0.49 -2.85 -0.11 0.00 -0.02 0.00 0.00 33.50 31.01 3kmy n PRO 369 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3kmy s VAL 370 N 1.69 0.30 0.22 -1.45 -7.23 -0.60 -4.61 120.40 108.72 3kmy s VAL 370 Ca 0.78 -1.24 -0.30 0.00 -1.81 0.00 0.00 61.98 59.41 3kmy s VAL 370 Cb -0.51 -0.75 -0.08 0.00 0.56 0.00 0.00 36.38 35.59 3kmy s VAL 370 CO 0.34 -0.61 1.00 -0.70 -0.31 0.00 0.00 175.10 174.83 3kmy s GLU 371 N -2.23 4.75 0.43 4.82 2.56 -1.26 -4.11 118.70 123.65 3kmy s GLU 371 Ca -0.07 1.59 -0.23 0.00 0.00 0.00 0.00 54.97 56.26 3kmy s GLU 371 Cb -0.05 -3.28 -0.08 0.00 2.00 0.00 0.00 34.13 32.72 3kmy s GLU 371 CO -0.03 0.34 1.09 0.34 -0.56 0.00 0.00 175.26 176.44 3kmy s ASP 372 N -0.77 6.48 0.43 -1.70 2.15 -1.26 -4.91 116.67 117.09 3kmy s ASP 372 Ca 0.44 2.12 0.18 0.00 0.43 0.00 0.00 52.55 55.72 3kmy s ASP 372 Cb -0.27 -2.59 1.11 0.00 -0.30 0.00 0.00 42.92 40.87 3kmy s ASP 372 CO 0.34 -0.69 1.85 0.58 -0.17 0.00 0.00 175.17 177.09 3kmy h VAL 373 N 1.98 0.66 -0.04 1.11 2.07 -1.99 0.49 116.25 120.54 3kmy h VAL 373 Ca -0.49 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 66.90 3kmy h VAL 373 Cb 1.23 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 3kmy h VAL 373 CO 0.61 0.07 0.00 0.00 0.02 0.00 0.00 177.57 178.27 3kmy n ALA 374 N -2.53 2.57 -2.28 1.67 0.00 -1.26 -4.91 120.51 113.77 3kmy n ALA 374 Ca 0.19 -0.46 -0.14 0.00 0.00 0.00 0.00 53.44 53.03 3kmy n ALA 374 Cb 0.72 -1.16 -0.01 0.00 0.00 0.00 0.00 19.45 19.00 3kmy n ALA 374 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3kmy n THR 375 N 0.19 -0.58 -0.24 0.00 -1.04 0.17 -4.93 114.28 107.85 3kmy n THR 375 Ca 0.19 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 62.13 3kmy n THR 375 Cb 0.35 -1.94 0.06 0.00 -1.82 0.00 0.00 70.33 66.97 3kmy n THR 375 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 3kmy n SER 376 N -1.68 -2.03 -1.12 8.00 3.41 -1.26 -4.92 113.62 114.03 3kmy n SER 376 Ca -0.17 -0.34 0.09 0.00 -0.26 0.00 0.00 58.87 58.20 3kmy n SER 376 Cb 0.61 -0.21 0.27 0.00 -0.26 0.00 0.00 64.21 64.62 3kmy n SER 376 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kmy n GLN 377 N -2.58 2.45 -1.81 4.33 6.02 -1.26 -4.87 117.38 119.65 3kmy n GLN 377 Ca 0.03 -2.16 -0.32 0.00 -0.01 0.00 0.00 57.00 54.54 3kmy n GLN 377 Cb 0.12 -1.49 0.04 0.00 1.02 0.00 0.00 30.24 29.93 3kmy n GLN 377 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3kmy s ASP 378 N -0.99 5.38 -0.32 1.08 1.01 -1.26 -3.62 116.67 117.95 3kmy s ASP 378 Ca 0.40 1.85 -0.12 0.00 0.71 0.00 0.00 52.55 55.40 3kmy s ASP 378 Cb 0.21 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.59 3kmy s ASP 378 CO 0.27 -1.44 0.21 -1.81 0.21 0.00 0.00 175.17 172.60 3kmy s ASP 379 N -2.90 5.90 0.23 0.27 -0.00 -0.15 -4.84 116.67 115.17 3kmy s ASP 379 Ca 0.64 -0.38 0.11 0.00 -0.00 0.00 0.00 52.55 52.92 3kmy s ASP 379 Cb -0.17 -2.10 -0.05 0.00 -0.00 0.00 0.00 42.92 40.60 3kmy s ASP 379 CO 0.43 -0.19 -0.20 0.00 -0.00 0.00 0.00 175.17 175.21 3kmy s TYR 381 N -1.99 0.07 0.12 0.00 1.51 -0.50 -1.55 117.35 115.00 3kmy s TYR 381 Ca 0.25 -0.42 0.10 0.00 -1.01 0.00 0.00 57.07 55.99 3kmy s TYR 381 Cb -0.07 0.16 -0.04 0.00 -0.11 0.00 0.00 41.96 41.90 3kmy s TYR 381 CO 0.13 -0.76 -0.25 0.15 -1.11 0.00 0.00 175.55 173.71 3kmy s LYS 382 N -3.89 1.53 -0.25 -0.62 1.02 -0.24 -1.40 119.74 115.89 3kmy s LYS 382 Ca 0.10 -1.29 -0.29 0.00 0.02 0.00 0.00 55.97 54.51 3kmy s LYS 382 Cb 0.02 -1.96 -0.01 0.00 -0.52 0.00 0.00 37.83 35.36 3kmy s LYS 382 CO -0.05 0.46 1.38 0.12 -0.92 0.00 0.00 175.35 176.35 3kmy s PHE 383 N -1.06 2.54 -0.41 3.18 5.36 -1.26 -0.74 117.98 125.59 3kmy s PHE 383 Ca 0.15 0.79 0.01 0.00 -0.96 0.00 0.00 56.93 56.92 3kmy s PHE 383 Cb -0.10 -3.87 0.44 0.00 -0.34 0.00 0.00 43.02 39.15 3kmy s PHE 383 CO 0.07 -2.08 1.83 0.00 -1.46 0.00 0.00 175.22 173.58 3kmy n ALA 384 N 7.67 5.23 -3.57 11.12 0.00 0.67 -4.34 120.51 137.29 3kmy n ALA 384 Ca 0.16 -2.38 -0.28 0.00 0.00 0.00 0.00 53.44 50.94 3kmy n ALA 384 Cb 0.46 -1.44 -0.17 0.00 0.00 0.00 0.00 19.45 18.30 3kmy n ALA 384 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3kmy s ILE 385 N -2.97 1.44 0.18 0.00 1.01 -1.26 -1.56 121.20 118.04 3kmy s ILE 385 Ca 0.46 -0.62 -0.00 0.00 0.00 0.00 0.00 60.65 60.48 3kmy s ILE 385 Cb 0.37 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.49 3kmy s ILE 385 CO 0.05 0.43 0.09 -0.94 0.00 0.00 0.00 174.94 174.56 3kmy s SER 386 N 0.86 0.44 0.35 3.58 1.04 -0.67 -4.72 113.70 114.58 3kmy s SER 386 Ca -0.10 -1.30 -0.26 0.00 0.48 0.00 0.00 55.95 54.77 3kmy s SER 386 Cb -0.15 0.30 -0.09 0.00 0.10 0.00 0.00 66.02 66.17 3kmy s SER 386 CO 0.01 -0.76 1.05 -1.58 0.98 0.00 0.00 173.24 172.93 3kmy s GLN 387 N -4.08 4.39 0.09 4.02 0.74 -1.26 -1.19 119.66 122.37 3kmy s GLN 387 Ca 0.32 1.57 0.05 0.00 0.05 0.00 0.00 55.36 57.36 3kmy s GLN 387 Cb 0.07 -2.80 -0.03 0.00 1.10 0.00 0.00 33.01 31.35 3kmy s GLN 387 CO 0.08 0.05 -0.14 0.45 -0.55 0.00 0.00 175.29 175.17 3kmy s SER 388 N -1.35 1.80 0.00 6.67 0.15 0.65 -4.75 113.70 116.87 3kmy s SER 388 Ca 0.52 -0.69 0.04 0.00 0.70 0.00 0.00 55.95 56.53 3kmy s SER 388 Cb -0.25 -0.06 0.04 0.00 -1.71 0.00 0.00 66.02 64.05 3kmy s SER 388 CO 0.31 -0.10 0.68 -1.54 1.20 0.00 0.00 173.24 173.79 3kmy n SER 389 N 1.02 1.45 -0.94 5.45 3.41 -1.26 -2.40 113.62 120.34 3kmy n SER 389 Ca -0.19 -1.26 0.03 0.00 -0.26 0.00 0.00 58.87 57.19 3kmy n SER 389 Cb 0.55 -0.01 0.15 0.00 -0.26 0.00 0.00 64.21 64.65 3kmy n SER 389 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3kmy n THR 390 N 0.20 1.81 -0.19 6.66 -2.24 -1.26 -4.83 114.28 114.43 3kmy n THR 390 Ca 0.03 -2.92 0.00 0.00 -2.27 0.00 0.00 64.05 58.89 3kmy n THR 390 Cb 0.13 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 3kmy n THR 390 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kmy n GLY 391 N -0.77 -3.48 3.75 3.38 0.00 -1.22 -4.47 105.19 102.37 3kmy n GLY 391 Ca 0.19 -1.97 -0.40 0.00 0.00 0.00 0.00 46.02 43.83 3kmy n GLY 391 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kmy s THR 392 N -0.80 3.97 -0.19 2.61 2.01 0.40 -4.25 115.64 119.39 3kmy s THR 392 Ca 0.00 1.86 -0.00 0.00 0.31 0.00 0.00 61.69 63.86 3kmy s THR 392 Cb 0.00 -4.19 0.05 0.00 0.01 0.00 0.00 72.50 68.37 3kmy s THR 392 CO 0.00 0.40 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.59 3kmy s VAL 393 N -0.81 1.21 -0.90 3.82 1.01 0.96 -1.49 120.40 124.21 3kmy s VAL 393 Ca 0.44 -0.80 -0.20 0.00 0.00 0.00 0.00 61.98 61.42 3kmy s VAL 393 Cb -0.28 -1.43 0.11 0.00 0.00 0.00 0.00 36.38 34.78 3kmy s VAL 393 CO 0.34 0.05 1.16 -0.04 0.00 0.00 0.00 175.10 176.61 3kmy s MET 394 N 1.57 3.51 0.09 2.72 -1.94 0.15 -0.80 119.30 124.60 3kmy s MET 394 Ca -0.01 -1.47 -0.01 0.00 -1.71 0.00 0.00 55.69 52.48 3kmy s MET 394 Cb -0.16 -4.87 0.02 0.00 2.01 0.00 0.00 34.83 31.83 3kmy s MET 394 CO -0.07 -1.86 0.12 0.41 -0.01 0.00 0.00 175.02 173.60 3kmy n GLY 395 N 5.71 -0.77 0.35 -0.03 0.00 -0.92 -1.21 105.19 108.32 3kmy n GLY 395 Ca 0.21 -1.73 0.14 0.00 0.00 0.00 0.00 46.02 44.63 3kmy n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kmy h ALA 396 N -1.67 1.70 -0.58 4.61 0.00 0.33 -1.49 119.26 122.16 3kmy h ALA 396 Ca -0.04 0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.07 3kmy h ALA 396 Cb 0.11 -0.07 -0.11 0.00 0.00 0.00 0.00 17.79 17.72 3kmy h ALA 396 CO 0.03 -0.09 -0.12 0.28 0.00 0.00 0.00 179.25 179.35 3kmy h VAL 397 N 0.74 0.43 -0.07 0.00 2.07 -1.10 -0.77 116.25 117.55 3kmy h VAL 397 Ca 0.59 -0.01 -0.17 0.00 0.82 0.00 0.00 66.70 67.93 3kmy h VAL 397 Cb 0.95 0.41 0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3kmy h VAL 397 CO -0.39 0.00 -0.63 0.40 0.02 0.00 0.00 177.57 176.97 3kmy h ILE 398 N 0.02 1.36 0.00 4.57 1.08 -1.56 -3.25 117.51 119.73 3kmy h ILE 398 Ca 0.29 -1.96 -0.01 0.00 -0.39 0.00 0.00 64.86 62.79 3kmy h ILE 398 Cb 0.44 2.29 -0.00 0.00 -3.07 0.00 0.00 36.82 36.48 3kmy h ILE 398 CO -0.58 0.59 -0.03 0.24 -0.69 0.00 0.00 178.15 177.67 3kmy h MET 399 N 0.15 0.00 0.00 2.37 2.86 -0.97 -1.88 114.93 117.46 3kmy h MET 399 Ca -0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 3kmy h MET 399 Cb 1.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.95 3kmy h MET 399 CO 0.13 0.03 0.00 0.93 1.06 0.00 0.00 176.91 179.06 3kmy h GLU 400 N 0.00 0.00 0.00 1.72 5.08 -1.18 -1.20 114.58 119.01 3kmy h GLU 400 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3kmy h GLU 400 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 3kmy h GLU 400 CO 0.00 0.00 -0.49 0.41 -1.00 0.00 0.00 179.01 177.94 3kmy n GLY 401 N -0.85 -1.36 3.18 -3.84 0.00 -0.71 -4.21 105.19 97.40 3kmy n GLY 401 Ca -0.02 -0.27 -0.11 0.00 0.00 0.00 0.00 46.02 45.62 3kmy n GLY 401 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kmy s PHE 402 N -3.08 0.97 -0.27 1.61 0.40 -0.45 -1.73 117.98 115.43 3kmy s PHE 402 Ca 0.09 -1.09 -0.14 0.00 -0.60 0.00 0.00 56.93 55.19 3kmy s PHE 402 Cb 0.16 -0.56 -0.04 0.00 0.51 0.00 0.00 43.02 43.09 3kmy s PHE 402 CO 0.69 -0.33 0.35 -0.47 0.70 0.00 0.00 175.22 176.16 3kmy s TYR 403 N -3.82 3.24 -0.21 0.36 5.04 0.15 -4.45 117.35 117.66 3kmy s TYR 403 Ca 0.20 0.36 -0.04 0.00 -2.44 0.00 0.00 57.07 55.15 3kmy s TYR 403 Cb 0.07 -2.55 -0.01 0.00 0.35 0.00 0.00 41.96 39.81 3kmy s TYR 403 CO 0.00 -0.23 -0.03 0.08 -1.34 0.00 0.00 175.55 174.03 3kmy s VAL 404 N 2.03 3.53 -0.31 3.14 1.01 -0.38 -2.27 120.40 127.15 3kmy s VAL 404 Ca 0.14 -0.45 -0.11 0.00 0.00 0.00 0.00 61.98 61.56 3kmy s VAL 404 Cb -0.16 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 3kmy s VAL 404 CO 0.10 0.43 0.19 -0.69 0.00 0.00 0.00 175.10 175.13 3kmy s VAL 405 N 1.30 5.04 -1.07 2.92 1.01 -0.02 -0.22 120.40 129.37 3kmy s VAL 405 Ca 0.04 -0.17 -0.12 0.00 0.00 0.00 0.00 61.98 61.72 3kmy s VAL 405 Cb -0.14 -3.52 0.22 0.00 0.00 0.00 0.00 36.38 32.94 3kmy s VAL 405 CO -0.01 0.10 1.14 -0.36 0.00 0.00 0.00 175.10 175.97 3kmy s PHE 406 N 1.70 3.85 -1.33 5.22 0.08 0.72 -0.48 117.98 127.74 3kmy s PHE 406 Ca 0.06 -2.28 -0.17 0.00 0.12 0.00 0.00 56.93 54.66 3kmy s PHE 406 Cb -0.17 -4.01 0.07 0.00 -0.57 0.00 0.00 43.02 38.34 3kmy s PHE 406 CO 0.09 -1.14 1.84 -3.47 -0.10 0.00 0.00 175.22 172.44 3kmy n ASP 407 N 4.14 4.72 -0.26 1.36 -0.08 -0.46 -2.61 116.55 123.36 3kmy n ASP 407 Ca 0.26 -2.91 -0.00 0.00 -1.51 0.00 0.00 54.79 50.63 3kmy n ASP 407 Cb 0.43 -1.72 0.12 0.00 2.34 0.00 0.00 41.12 42.29 3kmy n ASP 407 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 3kmy h ARG 408 N 7.18 0.75 -0.96 -0.67 3.08 -1.75 -1.06 114.38 120.95 3kmy h ARG 408 Ca 0.47 -0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.55 3kmy h ARG 408 Cb 0.82 -0.17 -0.07 0.00 0.08 0.00 0.00 29.97 30.63 3kmy h ARG 408 CO 1.55 0.50 0.61 0.00 -1.07 0.00 0.00 179.97 181.55 3kmy h ALA 409 N 1.38 1.35 -0.41 0.04 0.00 -1.50 -2.46 119.26 117.67 3kmy h ALA 409 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3kmy h ALA 409 Cb 0.22 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3kmy h ALA 409 CO -0.19 0.35 0.00 0.54 0.00 0.00 0.00 179.25 179.94 3kmy n ARG 410 N -4.57 3.44 -3.97 0.00 1.74 -1.03 -4.99 116.66 107.29 3kmy n ARG 410 Ca 0.15 -2.78 -0.31 0.00 -0.77 0.00 0.00 57.85 54.15 3kmy n ARG 410 Cb 0.22 -1.83 -0.01 0.00 -1.02 0.00 0.00 32.46 29.81 3kmy n ARG 410 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 3kmy n LYS 411 N 0.21 -1.97 -3.68 5.56 4.81 -0.48 -4.93 118.16 117.68 3kmy n LYS 411 Ca 0.22 0.31 -0.10 0.00 -0.87 0.00 0.00 58.31 57.87 3kmy n LYS 411 Cb 0.87 -3.97 -0.05 0.00 0.02 0.00 0.00 35.03 31.89 3kmy n LYS 411 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 3kmy s ARG 412 N -6.69 1.00 -0.12 1.64 1.70 -0.77 -1.60 118.95 114.11 3kmy s ARG 412 Ca 0.19 -0.72 0.02 0.00 -0.47 0.00 0.00 55.73 54.75 3kmy s ARG 412 Cb -0.08 0.43 0.01 0.00 -0.57 0.00 0.00 34.95 34.74 3kmy s ARG 412 CO 0.91 -0.37 -0.19 0.42 -1.08 0.00 0.00 175.30 174.99 3kmy s ILE 413 N -3.65 1.80 0.03 4.99 1.01 0.36 -1.36 121.20 124.37 3kmy s ILE 413 Ca 0.02 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 59.84 3kmy s ILE 413 Cb 0.02 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.85 3kmy s ILE 413 CO -0.11 0.50 0.17 -0.83 0.00 0.00 0.00 174.94 174.68 3kmy s GLY 414 N 0.83 2.15 -0.03 6.18 0.00 0.37 -0.90 107.32 115.93 3kmy s GLY 414 Ca -0.08 -0.83 0.03 0.00 0.00 0.00 0.00 44.72 43.84 3kmy s GLY 414 CO -0.01 -0.77 -0.11 -1.36 0.00 0.00 0.00 173.10 170.86 3kmy s PHE 415 N -1.40 1.09 0.01 1.90 0.40 0.46 -0.84 117.98 119.61 3kmy s PHE 415 Ca 0.30 -0.27 -0.09 0.00 -0.60 0.00 0.00 56.93 56.27 3kmy s PHE 415 Cb -0.13 -0.76 0.01 0.00 0.51 0.00 0.00 43.02 42.65 3kmy s PHE 415 CO 0.23 -0.10 0.18 0.00 0.70 0.00 0.00 175.22 176.24 3kmy s ALA 416 N 0.08 -0.43 0.23 5.36 0.00 -0.96 -1.13 121.76 124.90 3kmy s ALA 416 Ca -0.02 -0.06 -0.32 0.00 0.00 0.00 0.00 51.96 51.57 3kmy s ALA 416 Cb -0.08 0.13 -0.12 0.00 0.00 0.00 0.00 23.12 23.05 3kmy s ALA 416 CO 0.01 -0.24 1.68 0.28 0.00 0.00 0.00 175.76 177.48 3kmy n VAL 417 N 1.28 0.24 -2.55 0.00 0.31 -1.24 -0.68 118.33 115.70 3kmy n VAL 417 Ca -0.22 -0.06 -0.40 0.00 -0.01 0.00 0.00 64.34 63.65 3kmy n VAL 417 Cb 0.56 -1.95 -0.05 0.00 -0.91 0.00 0.00 33.84 31.50 3kmy n VAL 417 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3kmy s SER 418 N 0.99 7.36 0.17 4.52 0.15 -0.70 -1.85 113.70 124.34 3kmy s SER 418 Ca 0.73 2.15 0.19 0.00 0.70 0.00 0.00 55.95 59.73 3kmy s SER 418 Cb -0.52 -2.62 0.83 0.00 -1.71 0.00 0.00 66.02 62.01 3kmy s SER 418 CO 0.36 -0.08 1.59 0.00 1.20 0.00 0.00 173.24 176.32 3kmy n ALA 419 N 1.49 1.58 -1.04 5.45 0.00 -0.56 -2.71 120.51 124.72 3kmy n ALA 419 Ca -0.01 0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.58 3kmy n ALA 419 Cb 0.46 -1.31 0.15 0.00 0.00 0.00 0.00 19.45 18.74 3kmy n ALA 419 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kmy s HIS 421 N -2.84 3.42 0.09 0.00 -0.00 -1.10 -4.52 115.29 110.34 3kmy s HIS 421 Ca 0.33 1.69 -0.28 0.00 -0.00 0.00 0.00 55.06 56.80 3kmy s HIS 421 Cb 0.28 -3.03 -0.06 0.00 -0.00 0.00 0.00 32.58 29.77 3kmy s HIS 421 CO 0.04 -0.29 0.87 0.08 -0.00 0.00 0.00 174.74 175.43 3kmy s VAL 422 N -1.69 4.58 0.12 -5.38 1.01 -1.26 -5.03 120.40 112.74 3kmy s VAL 422 Ca 0.55 1.86 -0.03 0.00 0.00 0.00 0.00 61.98 64.37 3kmy s VAL 422 Cb -0.20 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 31.97 3kmy s VAL 422 CO 0.25 0.35 0.22 0.00 0.00 0.00 0.00 175.10 175.92 3kmy n HIS 423 N 2.69 -1.18 -4.38 5.22 -0.00 -1.26 -4.71 115.22 111.61 3kmy n HIS 423 Ca -0.00 -0.68 -0.18 0.00 -0.00 0.00 0.00 57.72 56.86 3kmy n HIS 423 Cb 0.49 0.26 -0.04 0.00 -0.00 0.00 0.00 29.99 30.70 3kmy n HIS 423 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 3kmy n ASP 424 N -1.49 1.86 0.03 4.39 5.68 -1.20 -5.03 116.55 120.79 3kmy n ASP 424 Ca -0.02 -2.37 0.10 0.00 -0.50 0.00 0.00 54.79 52.00 3kmy n ASP 424 Cb 0.19 0.47 0.40 0.00 -1.14 0.00 0.00 41.12 41.04 3kmy n ASP 424 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3kmy n GLU 425 N -0.66 0.06 -0.09 0.11 0.00 -1.26 -3.73 120.64 115.07 3kmy n GLU 425 Ca -0.08 0.24 -0.08 0.00 0.00 0.00 0.00 57.16 57.25 3kmy n GLU 425 Cb 0.39 -1.59 -0.14 0.00 0.00 0.00 0.00 31.44 30.09 3kmy n GLU 425 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 3kmy n PHE 426 N -1.70 0.00 -4.12 -1.84 3.01 -1.26 -5.03 117.46 106.53 3kmy n PHE 426 Ca 0.04 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.39 3kmy n PHE 426 Cb 0.23 -0.88 -0.10 0.00 -0.01 0.00 0.00 39.48 38.71 3kmy n PHE 426 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3kmy s ARG 427 N -2.49 0.69 0.05 -1.08 0.52 -1.24 -5.17 118.95 110.23 3kmy s ARG 427 Ca -0.09 -1.12 -0.02 0.00 -0.52 0.00 0.00 55.73 53.99 3kmy s ARG 427 Cb 0.06 -0.15 -0.03 0.00 0.52 0.00 0.00 34.95 35.35 3kmy s ARG 427 CO 0.75 -0.01 0.00 -0.08 0.02 0.00 0.00 175.30 175.98 3kmy s THR 428 N -2.92 0.18 0.88 0.02 -1.32 -1.26 -3.25 115.64 107.97 3kmy s THR 428 Ca 0.03 -1.52 -0.11 0.00 -1.21 0.00 0.00 61.69 58.89 3kmy s THR 428 Cb 0.01 -1.21 0.12 0.00 -1.51 0.00 0.00 72.50 69.90 3kmy s THR 428 CO -0.04 -0.84 1.09 0.00 -2.21 0.00 0.00 174.62 172.63 3kmy s ALA 429 N -3.33 1.62 0.08 11.08 0.00 -1.26 -4.91 121.76 125.03 3kmy s ALA 429 Ca 0.01 0.09 -0.16 0.00 0.00 0.00 0.00 51.96 51.90 3kmy s ALA 429 Cb 0.04 -3.24 0.03 0.00 0.00 0.00 0.00 23.12 19.94 3kmy s ALA 429 CO -0.08 -2.32 0.39 0.00 0.00 0.00 0.00 175.76 173.75 3kmy s ALA 430 N -2.87 -0.91 -0.20 0.00 0.00 -0.88 -4.96 121.76 111.94 3kmy s ALA 430 Ca 0.63 0.10 -0.03 0.00 0.00 0.00 0.00 51.96 52.66 3kmy s ALA 430 Cb -0.19 0.49 0.06 0.00 0.00 0.00 0.00 23.12 23.49 3kmy s ALA 430 CO 0.57 -0.53 0.06 0.08 0.00 0.00 0.00 175.76 175.94 3kmy s VAL 431 N -3.08 0.36 0.06 0.00 1.01 -1.26 -0.21 120.40 117.28 3kmy s VAL 431 Ca -0.01 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.47 3kmy s VAL 431 Cb 0.01 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 3kmy s VAL 431 CO -0.07 -0.29 -0.10 -1.61 0.00 0.00 0.00 175.10 173.03 3kmy s GLU 432 N 1.93 0.66 0.03 2.72 2.02 -0.22 -4.84 118.70 120.99 3kmy s GLU 432 Ca 0.01 -0.87 -0.27 0.00 0.02 0.00 0.00 54.97 53.86 3kmy s GLU 432 Cb -0.17 -0.50 0.10 0.00 0.10 0.00 0.00 34.13 33.66 3kmy s GLU 432 CO -0.11 0.10 1.23 0.20 0.02 0.00 0.00 175.26 176.69 3kmy s GLY 433 N -1.72 -0.13 0.40 -1.39 0.00 -1.26 -0.56 107.32 102.66 3kmy s GLY 433 Ca -0.06 0.07 0.08 0.00 0.00 0.00 0.00 44.72 44.81 3kmy s GLY 433 CO 0.01 3.82 0.54 2.56 0.00 0.00 0.00 173.10 180.03 3kmy s PRO 434 N -2.15 2.91 0.05 2.90 0.04 -1.26 -5.08 135.00 132.40 3kmy s PRO 434 Ca 0.25 -1.17 0.05 0.00 0.04 0.00 0.00 61.00 60.17 3kmy s PRO 434 Cb -0.00 -2.78 -0.02 0.00 0.04 0.00 0.00 34.50 31.74 3kmy s PRO 434 CO 0.00 -0.17 -0.16 -0.06 0.04 0.00 0.00 177.00 176.65 3kmy s PHE 435 N -2.30 1.35 -0.31 0.56 0.40 0.49 -4.94 117.98 113.23 3kmy s PHE 435 Ca 0.52 -0.37 -0.24 0.00 -0.60 0.00 0.00 56.93 56.24 3kmy s PHE 435 Cb -0.10 -0.79 0.00 0.00 0.51 0.00 0.00 43.02 42.64 3kmy s PHE 435 CO 0.32 0.06 0.81 0.08 0.70 0.00 0.00 175.22 177.19 3kmy s VAL 436 N -0.92 4.77 -0.05 -0.44 1.01 -1.26 -0.72 120.40 122.80 3kmy s VAL 436 Ca 0.02 1.23 0.02 0.00 0.00 0.00 0.00 61.98 63.25 3kmy s VAL 436 Cb -0.08 -4.16 0.02 0.00 0.00 0.00 0.00 36.38 32.15 3kmy s VAL 436 CO 0.02 -0.26 -0.08 -0.89 0.00 0.00 0.00 175.10 173.89 3kmy s THR 437 N 3.00 0.77 0.30 3.92 2.01 -0.47 -4.95 115.64 120.22 3kmy s THR 437 Ca 0.33 -0.28 0.06 0.00 0.31 0.00 0.00 61.69 62.11 3kmy s THR 437 Cb -0.14 -0.74 -0.02 0.00 0.01 0.00 0.00 72.50 71.61 3kmy s THR 437 CO 0.13 0.27 0.43 -0.76 -0.69 0.00 0.00 174.62 173.99 3kmy s LEU 438 N 0.70 4.12 -1.67 4.42 1.43 -1.26 -4.10 118.68 122.31 3kmy s LEU 438 Ca -0.11 -0.06 -0.13 0.00 -1.03 0.00 0.00 54.13 52.79 3kmy s LEU 438 Cb -0.14 -2.81 0.13 0.00 0.03 0.00 0.00 46.19 43.40 3kmy s LEU 438 CO 0.02 -0.28 0.33 0.47 0.23 0.00 0.00 176.35 177.11 3kmy n ASP 439 N -1.55 -0.60 0.26 2.29 9.92 -1.26 -4.81 116.55 120.79 3kmy n ASP 439 Ca -0.04 -1.21 0.13 0.00 -0.53 0.00 0.00 54.79 53.14 3kmy n ASP 439 Cb 0.58 -1.53 0.67 0.00 -0.64 0.00 0.00 41.12 40.20 3kmy n ASP 439 CO 0.00 0.00 0.00 0.24 0.13 0.00 0.00 177.20 177.57 3kmy h MET 440 N -1.19 0.00 0.00 -1.24 2.86 -2.01 -1.97 114.93 111.38 3kmy h MET 440 Ca -0.60 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.02 3kmy h MET 440 Cb 1.34 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.99 3kmy h MET 440 CO 0.78 0.14 -0.11 0.93 1.06 0.00 0.00 176.91 179.71 3kmy h GLU 441 N 0.00 0.00 0.00 1.72 5.08 -1.98 -1.34 114.58 118.06 3kmy h GLU 441 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3kmy h GLU 441 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3kmy h GLU 441 CO 0.02 0.11 0.00 -0.25 -1.00 0.00 0.00 179.01 177.89 3kmy n ASP 442 N -3.76 0.64 0.22 1.42 8.00 -0.74 -2.66 116.55 119.67 3kmy n ASP 442 Ca -0.02 0.62 0.11 0.00 0.71 0.00 0.00 54.79 56.21 3kmy n ASP 442 Cb 0.22 -0.77 0.35 0.00 -0.02 0.00 0.00 41.12 40.90 3kmy n ASP 442 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kmy s GLY 444 N -4.26 2.63 0.11 0.00 0.00 -1.09 -4.03 107.32 100.67 3kmy s GLY 444 Ca 0.03 0.69 -0.10 0.00 0.00 0.00 0.00 44.72 45.34 3kmy s GLY 444 CO 0.64 1.07 0.44 -0.47 0.00 0.00 0.00 173.10 174.78 3kmy s TYR 445 N -1.80 3.57 0.00 1.90 5.04 -1.26 -4.99 117.35 119.81 3kmy s TYR 445 Ca 0.63 0.83 0.00 0.00 -2.44 0.00 0.00 57.07 56.09 3kmy s TYR 445 Cb -0.20 -2.20 0.00 0.00 0.35 0.00 0.00 41.96 39.91 3kmy s TYR 445 CO 0.25 0.48 0.33 0.09 -1.34 0.00 0.00 175.55 175.35