#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lpk s SER 59 N 0.00 -0.03 -0.46 1.61 1.04 -1.26 -2.35 113.70 112.25 3lpk s SER 59 Ca 0.00 0.06 0.08 0.00 0.48 0.00 0.00 55.95 56.57 3lpk s SER 59 Cb 0.00 0.07 0.29 0.00 0.10 0.00 0.00 66.02 66.47 3lpk s SER 59 CO 0.00 -0.02 0.68 0.49 0.98 0.00 0.00 173.24 175.37 3lpk n PHE 60 N 3.04 1.24 -0.32 5.02 3.01 -1.26 -4.96 117.46 123.22 3lpk n PHE 60 Ca -0.12 -3.81 0.25 0.00 1.01 0.00 0.00 57.45 54.77 3lpk n PHE 60 Cb 0.60 -0.43 0.55 0.00 -0.01 0.00 0.00 39.48 40.18 3lpk n PHE 60 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3lpk h VAL 61 N 2.14 0.50 0.00 -4.37 2.07 -1.98 0.93 116.25 115.54 3lpk h VAL 61 Ca 0.11 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3lpk h VAL 61 Cb 0.80 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 3lpk h VAL 61 CO 0.60 0.06 -0.01 1.05 0.02 0.00 0.00 177.57 179.30 3lpk h GLU 62 N 0.33 0.00 0.00 1.57 9.09 -1.96 -3.08 114.58 120.53 3lpk h GLU 62 Ca 0.59 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.00 3lpk h GLU 62 Cb 1.62 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.72 3lpk h GLU 62 CO -0.26 0.01 -1.12 -1.33 0.05 0.00 0.00 179.01 176.36 3lpk n MET 63 N -3.11 1.56 -1.87 1.06 2.81 0.27 -4.41 117.12 113.43 3lpk n MET 63 Ca -0.01 -0.06 -0.41 0.00 -1.81 0.00 0.00 57.70 55.41 3lpk n MET 63 Cb 0.21 -1.21 -0.02 0.00 -0.71 0.00 0.00 33.22 31.50 3lpk n MET 63 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3lpk s VAL 64 N -2.56 2.28 -1.27 2.03 1.01 -0.90 -2.61 120.40 118.38 3lpk s VAL 64 Ca -0.00 0.25 -0.02 0.00 0.00 0.00 0.00 61.98 62.21 3lpk s VAL 64 Cb 0.09 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.31 3lpk s VAL 64 CO 0.53 0.04 0.22 0.47 0.00 0.00 0.00 175.10 176.37 3lpk n ASP 65 N 1.82 -4.87 -0.69 3.32 10.43 -1.19 -4.91 116.55 120.47 3lpk n ASP 65 Ca 0.06 -0.11 0.11 0.00 2.57 0.00 0.00 54.79 57.42 3lpk n ASP 65 Cb 0.39 -3.86 0.34 0.00 1.84 0.00 0.00 41.12 39.83 3lpk n ASP 65 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 3lpk n ASN 66 N -1.24 2.07 -4.70 -2.24 6.94 -1.00 -4.84 115.26 110.24 3lpk n ASN 66 Ca -0.14 -1.76 -0.27 0.00 -0.02 0.00 0.00 54.58 52.38 3lpk n ASN 66 Cb 0.62 -0.12 -0.07 0.00 -2.36 0.00 0.00 39.78 37.84 3lpk n ASN 66 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3lpk s LEU 67 N -1.60 3.48 0.12 -4.53 1.43 -0.70 -4.43 118.68 112.45 3lpk s LEU 67 Ca 0.34 -0.27 -0.03 0.00 -1.03 0.00 0.00 54.13 53.14 3lpk s LEU 67 Cb 0.19 -2.14 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 3lpk s LEU 67 CO 0.28 0.11 0.09 -0.13 0.23 0.00 0.00 176.35 176.93 3lpk s ARG 68 N -2.81 0.92 0.00 1.70 0.52 -1.03 0.33 118.95 118.58 3lpk s ARG 68 Ca 0.28 -1.33 0.00 0.00 -0.52 0.00 0.00 55.73 54.15 3lpk s ARG 68 Cb -0.10 0.27 0.00 0.00 0.52 0.00 0.00 34.95 35.64 3lpk s ARG 68 CO 0.20 -0.27 0.00 0.41 0.02 0.00 0.00 175.30 175.66 3lpk n GLY 69 N -0.08 0.34 3.43 -3.53 0.00 -1.26 -1.07 105.19 103.02 3lpk n GLY 69 Ca -0.08 -2.30 -0.12 0.00 0.00 0.00 0.00 46.02 43.52 3lpk n GLY 69 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lpk s LYS 70 N 0.00 1.25 0.30 1.61 -2.85 -1.03 -4.71 119.74 114.30 3lpk s LYS 70 Ca 0.00 -0.40 0.03 0.00 -1.00 0.00 0.00 55.97 54.60 3lpk s LYS 70 Cb 0.00 0.58 0.75 0.00 -2.06 0.00 0.00 37.83 37.09 3lpk s LYS 70 CO 0.00 -0.53 1.63 0.66 0.10 0.00 0.00 175.35 177.21 3lpk h SER 71 N 2.09 -0.06 1.31 0.03 4.64 -1.93 0.45 113.55 120.09 3lpk h SER 71 Ca -0.33 0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.20 3lpk h SER 71 Cb 1.29 0.30 -0.00 0.00 -0.31 0.00 0.00 62.40 63.68 3lpk h SER 71 CO 0.38 -0.20 -0.02 1.23 -0.87 0.00 0.00 176.83 177.34 3lpk h GLY 72 N 0.16 0.00 -0.06 -0.77 0.00 -1.96 -3.28 103.07 97.16 3lpk h GLY 72 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.90 3lpk h GLY 72 CO -0.70 0.00 -0.04 -1.06 0.00 0.00 0.00 176.54 174.74 3lpk n GLN 73 N -3.11 3.14 0.00 4.80 6.02 -0.48 -5.00 117.38 122.74 3lpk n GLN 73 Ca 0.02 -0.28 0.00 0.00 -0.01 0.00 0.00 57.00 56.73 3lpk n GLN 73 Cb 0.39 -0.78 0.00 0.00 1.02 0.00 0.00 30.24 30.86 3lpk n GLN 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3lpk n GLY 74 N 0.60 0.80 3.69 1.08 0.00 0.15 -4.87 105.19 106.63 3lpk n GLY 74 Ca 0.01 -1.74 -0.35 0.00 0.00 0.00 0.00 46.02 43.93 3lpk n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3lpk s TYR 75 N -2.93 3.26 0.12 1.61 1.51 -1.26 -2.47 117.35 117.20 3lpk s TYR 75 Ca 0.00 0.17 0.06 0.00 -1.01 0.00 0.00 57.07 56.29 3lpk s TYR 75 Cb 0.00 -1.94 -0.04 0.00 -0.11 0.00 0.00 41.96 39.87 3lpk s TYR 75 CO 0.00 0.36 -0.14 1.52 -1.11 0.00 0.00 175.55 176.18 3lpk s TYR 76 N -0.33 1.37 0.16 2.71 -0.85 -0.23 -0.44 117.35 119.75 3lpk s TYR 76 Ca 0.08 -0.57 0.11 0.00 -0.52 0.00 0.00 57.07 56.17 3lpk s TYR 76 Cb -0.12 -0.72 -0.04 0.00 0.38 0.00 0.00 41.96 41.46 3lpk s TYR 76 CO 0.02 0.13 -0.24 0.54 -1.52 0.00 0.00 175.55 174.48 3lpk s VAL 77 N -2.21 2.21 0.14 -3.49 0.11 0.77 -2.47 120.40 115.46 3lpk s VAL 77 Ca 0.09 -1.88 -0.25 0.00 -2.93 0.00 0.00 61.98 57.00 3lpk s VAL 77 Cb -0.04 -2.00 -0.07 0.00 -1.53 0.00 0.00 36.38 32.73 3lpk s VAL 77 CO 0.03 -0.06 0.78 -0.70 -3.33 0.00 0.00 175.10 171.82 3lpk s GLU 78 N -2.40 4.56 0.14 1.54 2.12 -1.26 0.26 118.70 123.67 3lpk s GLU 78 Ca 0.17 1.15 -0.02 0.00 0.36 0.00 0.00 54.97 56.63 3lpk s GLU 78 Cb -0.09 -3.29 -0.04 0.00 0.26 0.00 0.00 34.13 30.98 3lpk s GLU 78 CO 0.08 0.49 0.09 -1.64 -0.54 0.00 0.00 175.26 173.73 3lpk s MET 79 N -0.84 0.99 0.02 4.30 -1.94 0.07 -4.17 119.30 117.72 3lpk s MET 79 Ca 0.37 -1.44 0.04 0.00 -1.71 0.00 0.00 55.69 52.95 3lpk s MET 79 Cb -0.23 0.26 -0.02 0.00 2.01 0.00 0.00 34.83 36.86 3lpk s MET 79 CO 0.26 -0.30 -0.14 0.95 -0.01 0.00 0.00 175.02 175.78 3lpk s THR 80 N -4.06 1.08 -0.00 2.05 -4.23 -0.66 -0.73 115.64 109.10 3lpk s THR 80 Ca 0.26 -0.80 0.04 0.00 -1.18 0.00 0.00 61.69 60.00 3lpk s THR 80 Cb 0.07 -0.94 -0.01 0.00 1.34 0.00 0.00 72.50 72.96 3lpk s THR 80 CO 0.03 0.14 -0.11 0.68 -0.54 0.00 0.00 174.62 174.82 3lpk s VAL 81 N -0.60 0.89 0.00 2.29 -7.23 -0.46 -2.02 120.40 113.27 3lpk s VAL 81 Ca 0.03 -0.56 0.00 0.00 -1.81 0.00 0.00 61.98 59.64 3lpk s VAL 81 Cb -0.07 -0.76 0.00 0.00 0.56 0.00 0.00 36.38 36.11 3lpk s VAL 81 CO 0.00 0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.60 3lpk n GLY 82 N 2.65 -0.79 2.71 2.32 0.00 -0.56 -1.22 105.19 110.30 3lpk n GLY 82 Ca -0.15 -1.71 -0.24 0.00 0.00 0.00 0.00 46.02 43.93 3lpk n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3lpk s SER 83 N -1.76 1.89 0.86 1.61 0.01 -1.26 -3.00 113.70 112.05 3lpk s SER 83 Ca 0.00 -0.29 -0.11 0.00 1.31 0.00 0.00 55.95 56.86 3lpk s SER 83 Cb 0.00 -0.37 0.11 0.00 0.21 0.00 0.00 66.02 65.97 3lpk s SER 83 CO 0.00 -0.26 1.10 -2.16 0.41 0.00 0.00 173.24 172.33 3lpk s PRO 84 N 2.02 1.56 0.07 12.44 0.04 -1.26 -0.97 135.00 148.91 3lpk s PRO 84 Ca 0.03 1.06 -0.35 0.00 0.04 0.00 0.00 61.00 61.79 3lpk s PRO 84 Cb -0.14 -1.82 -0.14 0.00 0.04 0.00 0.00 34.50 32.44 3lpk s PRO 84 CO -0.06 -2.10 1.63 -2.30 0.04 0.00 0.00 177.00 174.21 3lpk n PRO 85 N -3.82 1.99 -3.77 0.56 -0.02 -1.16 -4.90 135.00 123.88 3lpk n PRO 85 Ca 0.08 0.72 -0.37 0.00 -2.02 0.00 0.00 63.50 61.91 3lpk n PRO 85 Cb 0.54 -2.49 -0.13 0.00 -0.02 0.00 0.00 33.50 31.40 3lpk n PRO 85 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3lpk s GLN 86 N 1.76 2.67 0.12 -0.52 -0.21 -0.36 -4.90 119.66 118.22 3lpk s GLN 86 Ca 0.84 -1.14 -0.30 0.00 0.02 0.00 0.00 55.36 54.78 3lpk s GLN 86 Cb -0.73 -3.41 -0.07 0.00 1.00 0.00 0.00 33.01 29.81 3lpk s GLN 86 CO 0.44 -0.62 1.13 0.99 -2.12 0.00 0.00 175.29 175.10 3lpk s THR 87 N 1.40 3.98 -0.02 -0.19 2.01 -1.26 -1.35 115.64 120.21 3lpk s THR 87 Ca -0.01 1.57 -0.07 0.00 0.31 0.00 0.00 61.69 63.49 3lpk s THR 87 Cb -0.19 -4.01 0.01 0.00 0.01 0.00 0.00 72.50 68.32 3lpk s THR 87 CO 0.02 0.21 0.14 -0.76 -0.69 0.00 0.00 174.62 173.54 3lpk s LEU 88 N 0.24 1.50 -0.18 4.42 1.43 0.09 -4.96 118.68 121.22 3lpk s LEU 88 Ca 0.53 -0.05 -0.17 0.00 -1.03 0.00 0.00 54.13 53.41 3lpk s LEU 88 Cb -0.29 0.64 -0.04 0.00 0.03 0.00 0.00 46.19 46.53 3lpk s LEU 88 CO 0.32 -0.28 0.43 0.20 0.23 0.00 0.00 176.35 177.26 3lpk s ASN 89 N -0.96 6.51 -0.12 2.29 0.02 -1.26 -0.75 114.94 120.67 3lpk s ASN 89 Ca -0.10 0.61 0.03 0.00 -1.02 0.00 0.00 52.86 52.37 3lpk s ASN 89 Cb -0.06 -2.25 0.00 0.00 0.02 0.00 0.00 41.25 38.97 3lpk s ASN 89 CO 0.01 -0.07 -0.22 -0.63 0.02 0.00 0.00 177.10 176.21 3lpk s ILE 90 N 1.17 2.14 0.13 0.60 -1.09 0.14 -0.19 121.20 124.11 3lpk s ILE 90 Ca 0.21 -0.97 -0.31 0.00 -2.23 0.00 0.00 60.65 57.35 3lpk s ILE 90 Cb -0.15 -1.84 -0.10 0.00 -1.58 0.00 0.00 42.46 38.79 3lpk s ILE 90 CO 0.08 0.55 1.69 -0.22 -1.23 0.00 0.00 174.94 175.82 3lpk s LEU 91 N 0.61 4.38 -0.42 2.97 2.96 -0.05 -0.16 118.68 128.97 3lpk s LEU 91 Ca -0.12 2.66 -0.25 0.00 -0.22 0.00 0.00 54.13 56.20 3lpk s LEU 91 Cb -0.16 -3.58 0.02 0.00 0.50 0.00 0.00 46.19 42.97 3lpk s LEU 91 CO 0.03 -0.92 0.91 -0.69 -1.32 0.00 0.00 176.35 174.36 3lpk s VAL 92 N 2.03 4.54 -0.31 1.68 1.01 0.42 -0.29 120.40 129.49 3lpk s VAL 92 Ca 0.75 0.91 0.02 0.00 0.00 0.00 0.00 61.98 63.66 3lpk s VAL 92 Cb -0.44 -4.37 0.09 0.00 0.00 0.00 0.00 36.38 31.66 3lpk s VAL 92 CO 0.33 -0.68 0.05 -0.62 0.00 0.00 0.00 175.10 174.17 3lpk s ASP 93 N 2.08 4.40 0.00 3.32 2.15 -0.72 -4.15 116.67 123.75 3lpk s ASP 93 Ca 0.37 -1.84 0.29 0.00 0.43 0.00 0.00 52.55 51.79 3lpk s ASP 93 Cb -0.11 -1.32 1.71 0.00 -0.30 0.00 0.00 42.92 42.90 3lpk s ASP 93 CO 0.23 -0.37 2.09 0.35 -0.17 0.00 0.00 175.17 177.30 3lpk n THR 94 N 4.50 0.00 -0.36 1.71 -2.24 -1.26 -0.70 114.28 115.92 3lpk n THR 94 Ca -0.01 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.88 3lpk n THR 94 Cb 0.42 -0.47 0.29 0.00 -2.10 0.00 0.00 70.33 68.48 3lpk n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3lpk n GLY 95 N 0.92 2.60 3.55 3.38 0.00 -1.26 -4.16 105.19 110.22 3lpk n GLY 95 Ca 0.22 -0.72 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 3lpk n GLY 95 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3lpk s SER 96 N -1.00 0.27 -0.04 1.61 1.04 -1.23 -4.99 113.70 109.35 3lpk s SER 96 Ca 0.44 -1.16 0.06 0.00 0.48 0.00 0.00 55.95 55.77 3lpk s SER 96 Cb 0.24 0.62 0.10 0.00 0.10 0.00 0.00 66.02 67.07 3lpk s SER 96 CO 0.29 -1.22 0.97 -1.20 0.98 0.00 0.00 173.24 173.06 3lpk n SER 97 N -0.80 1.13 -4.64 7.02 7.64 -1.26 -1.00 113.62 121.71 3lpk n SER 97 Ca -0.01 -2.20 -0.34 0.00 1.01 0.00 0.00 58.87 57.33 3lpk n SER 97 Cb 0.62 -0.21 -0.10 0.00 -1.01 0.00 0.00 64.21 63.51 3lpk n SER 97 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3lpk s ASN 98 N -1.47 4.96 -0.33 6.43 -0.87 -1.26 -4.55 114.94 117.85 3lpk s ASN 98 Ca 0.11 0.04 -0.12 0.00 -1.57 0.00 0.00 52.86 51.31 3lpk s ASN 98 Cb 0.09 -1.31 -0.02 0.00 -0.02 0.00 0.00 41.25 39.99 3lpk s ASN 98 CO 0.01 0.35 0.23 0.12 -2.57 0.00 0.00 177.10 175.24 3lpk s PHE 99 N -0.90 3.23 0.01 2.20 5.99 -1.26 -1.31 117.98 125.94 3lpk s PHE 99 Ca 0.14 -0.19 -0.01 0.00 0.00 0.00 0.00 56.93 56.87 3lpk s PHE 99 Cb -0.11 -2.46 -0.01 0.00 0.00 0.00 0.00 43.02 40.44 3lpk s PHE 99 CO 0.04 -0.34 0.00 0.00 -0.00 0.00 0.00 175.22 174.91 3lpk s ALA 100 N 1.72 0.02 0.03 11.12 0.00 -0.66 -1.54 121.76 132.45 3lpk s ALA 100 Ca 0.06 -0.26 0.02 0.00 0.00 0.00 0.00 51.96 51.78 3lpk s ALA 100 Cb -0.17 0.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 3lpk s ALA 100 CO 0.10 -0.09 -0.07 0.14 0.00 0.00 0.00 175.76 175.84 3lpk s VAL 101 N -0.74 0.53 0.28 0.00 -7.23 -0.36 -0.03 120.40 112.85 3lpk s VAL 101 Ca -0.08 -0.81 -0.30 0.00 -1.81 0.00 0.00 61.98 58.97 3lpk s VAL 101 Cb -0.05 -0.55 -0.12 0.00 0.56 0.00 0.00 36.38 36.22 3lpk s VAL 101 CO -0.00 -0.21 1.58 0.61 -0.31 0.00 0.00 175.10 176.76 3lpk n GLY 102 N 1.94 1.27 0.29 2.32 0.00 -0.06 -0.38 105.19 110.57 3lpk n GLY 102 Ca -0.20 0.47 0.05 0.00 0.00 0.00 0.00 46.02 46.34 3lpk n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lpk n ALA 103 N 2.16 2.11 -3.42 4.61 0.00 0.12 -0.54 120.51 125.55 3lpk n ALA 103 Ca 0.09 -1.75 -0.15 0.00 0.00 0.00 0.00 53.44 51.63 3lpk n ALA 103 Cb 0.36 -0.43 -0.04 0.00 0.00 0.00 0.00 19.45 19.33 3lpk n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3lpk s ALA 104 N -1.35 -1.59 0.33 0.00 0.00 -1.22 -4.78 121.76 113.16 3lpk s ALA 104 Ca 0.15 0.81 -0.27 0.00 0.00 0.00 0.00 51.96 52.65 3lpk s ALA 104 Cb 0.13 0.44 -0.13 0.00 0.00 0.00 0.00 23.12 23.56 3lpk s ALA 104 CO 0.01 -0.56 1.03 -2.30 0.00 0.00 0.00 175.76 173.94 3lpk n PRO 105 N 0.28 1.42 -3.72 0.00 -0.02 -1.26 -4.94 135.00 126.76 3lpk n PRO 105 Ca -0.18 0.50 -0.13 0.00 -2.02 0.00 0.00 63.50 61.67 3lpk n PRO 105 Cb 0.61 -1.94 -0.10 0.00 -0.02 0.00 0.00 33.50 32.05 3lpk n PRO 105 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3lpk s HIS 106 N -1.13 -0.49 0.47 6.00 2.46 -1.26 -5.05 115.29 116.29 3lpk s HIS 106 Ca 0.59 1.17 0.27 0.00 0.47 0.00 0.00 55.06 57.55 3lpk s HIS 106 Cb -0.64 0.17 1.31 0.00 -0.13 0.00 0.00 32.58 33.29 3lpk s HIS 106 CO 0.59 -0.24 1.81 -1.00 -2.47 0.00 0.00 174.74 173.43 3lpk h PRO 107 N 5.66 0.19 -0.02 2.88 0.13 -2.04 -0.13 132.00 138.68 3lpk h PRO 107 Ca -0.28 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3lpk h PRO 107 Cb 1.18 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3lpk h PRO 107 CO 0.24 0.13 -0.02 1.19 -0.23 0.00 0.00 178.00 179.31 3lpk n PHE 108 N -4.41 0.00 -4.62 1.56 0.99 -1.26 -4.87 117.46 104.85 3lpk n PHE 108 Ca 0.24 0.00 -0.34 0.00 -0.00 0.00 0.00 57.45 57.35 3lpk n PHE 108 Cb 1.00 -0.01 -0.12 0.00 -1.00 0.00 0.00 39.48 39.35 3lpk n PHE 108 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3lpk s LEU 109 N -2.04 3.09 0.00 4.37 1.43 -0.06 -4.68 118.68 120.79 3lpk s LEU 109 Ca 0.36 -0.10 0.12 0.00 -1.03 0.00 0.00 54.13 53.48 3lpk s LEU 109 Cb 0.21 -1.69 0.28 0.00 0.03 0.00 0.00 46.19 45.02 3lpk s LEU 109 CO 0.35 0.29 1.19 0.00 0.23 0.00 0.00 176.35 178.40 3lpk n HIS 110 N 2.72 0.39 -3.54 0.29 1.44 -1.26 -4.55 115.22 110.70 3lpk n HIS 110 Ca -0.18 -0.36 -0.11 0.00 -2.01 0.00 0.00 57.72 55.06 3lpk n HIS 110 Cb 0.53 -0.02 -0.04 0.00 0.12 0.00 0.00 29.99 30.58 3lpk n HIS 110 CO 0.00 0.00 0.00 -0.98 -2.81 0.00 0.00 176.34 172.55 3lpk s ARG 111 N -1.01 0.74 0.23 -1.40 1.70 -1.26 -5.17 118.95 112.78 3lpk s ARG 111 Ca 0.23 -0.01 -0.19 0.00 -0.47 0.00 0.00 55.73 55.30 3lpk s ARG 111 Cb 0.13 0.35 0.02 0.00 -0.57 0.00 0.00 34.95 34.88 3lpk s ARG 111 CO 0.17 -0.27 0.60 1.52 -1.08 0.00 0.00 175.30 176.25 3lpk s TYR 112 N -1.88 -0.12 -0.09 5.89 -0.85 -1.26 -4.93 117.35 114.11 3lpk s TYR 112 Ca -0.00 -0.26 -0.30 0.00 -0.52 0.00 0.00 57.07 55.99 3lpk s TYR 112 Cb -0.01 0.51 -0.04 0.00 0.38 0.00 0.00 41.96 42.80 3lpk s TYR 112 CO -0.01 -1.05 1.45 -0.47 -1.52 0.00 0.00 175.55 173.95 3lpk s TYR 113 N -3.90 2.47 -0.63 -3.49 5.04 0.30 -4.95 117.35 112.20 3lpk s TYR 113 Ca 0.11 0.63 -0.06 0.00 -2.44 0.00 0.00 57.07 55.31 3lpk s TYR 113 Cb -0.03 -3.71 0.16 0.00 0.35 0.00 0.00 41.96 38.74 3lpk s TYR 113 CO 0.02 -2.75 0.48 -0.65 -1.34 0.00 0.00 175.55 171.31 3lpk s GLN 114 N 3.54 2.73 0.29 4.97 -0.21 -1.26 -4.40 119.66 125.32 3lpk s GLN 114 Ca 0.64 -2.36 0.02 0.00 0.02 0.00 0.00 55.36 53.68 3lpk s GLN 114 Cb -0.28 -3.90 0.57 0.00 1.00 0.00 0.00 33.01 30.40 3lpk s GLN 114 CO 0.23 -1.19 1.85 0.00 -2.12 0.00 0.00 175.29 174.05 3lpk h ARG 115 N 7.46 0.96 0.00 2.91 3.08 -1.93 -1.63 114.38 125.23 3lpk h ARG 115 Ca -0.03 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3lpk h ARG 115 Cb 0.99 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.83 3lpk h ARG 115 CO 0.74 0.63 0.00 0.00 -1.07 0.00 0.00 179.97 180.28 3lpk n GLN 116 N -4.59 0.09 -0.07 0.04 0.00 -1.26 -1.62 117.38 109.97 3lpk n GLN 116 Ca 0.18 0.46 0.12 0.00 0.00 0.00 0.00 57.00 57.76 3lpk n GLN 116 Cb 0.34 -1.73 0.14 0.00 0.00 0.00 0.00 30.24 28.99 3lpk n GLN 116 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3lpk n LEU 117 N -1.91 3.12 -4.38 2.61 4.77 -0.61 -4.87 117.00 115.72 3lpk n LEU 117 Ca 0.01 -1.18 -0.36 0.00 -0.03 0.00 0.00 56.01 54.45 3lpk n LEU 117 Cb 0.11 -0.09 -0.13 0.00 -2.33 0.00 0.00 43.42 40.98 3lpk n LEU 117 CO 0.11 0.58 -0.32 -0.55 -1.33 0.00 0.00 177.39 175.89 3lpk s SER 118 N -1.76 4.84 0.47 -1.43 0.15 -0.64 -4.20 113.70 111.13 3lpk s SER 118 Ca 0.31 -0.35 0.26 0.00 0.70 0.00 0.00 55.95 56.88 3lpk s SER 118 Cb 0.20 -1.85 0.97 0.00 -1.71 0.00 0.00 66.02 63.63 3lpk s SER 118 CO 0.30 -0.05 1.84 0.77 1.20 0.00 0.00 173.24 177.30 3lpk h SER 119 N 8.19 0.00 -0.20 5.45 4.64 -1.34 -3.03 113.55 127.27 3lpk h SER 119 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3lpk h SER 119 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3lpk h SER 119 CO 0.59 0.15 0.00 0.35 -0.87 0.00 0.00 176.83 177.05 3lpk n THR 120 N -3.27 0.24 -2.04 2.95 -2.24 -1.26 -4.95 114.28 103.71 3lpk n THR 120 Ca 0.01 -0.51 -0.41 0.00 -2.27 0.00 0.00 64.05 60.87 3lpk n THR 120 Cb 0.41 0.85 -0.02 0.00 -2.10 0.00 0.00 70.33 69.47 3lpk n THR 120 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3lpk s TYR 121 N -1.76 3.04 -0.12 4.78 5.04 -1.15 -4.51 117.35 122.67 3lpk s TYR 121 Ca 0.34 1.07 0.00 0.00 -2.44 0.00 0.00 57.07 56.05 3lpk s TYR 121 Cb 0.20 -3.79 0.02 0.00 0.35 0.00 0.00 41.96 38.75 3lpk s TYR 121 CO 0.30 -2.53 -0.12 1.03 -1.34 0.00 0.00 175.55 172.89 3lpk s ARG 122 N -0.44 1.99 -0.17 4.97 0.52 0.07 -4.98 118.95 120.91 3lpk s ARG 122 Ca 0.58 -0.45 -0.24 0.00 -0.52 0.00 0.00 55.73 55.10 3lpk s ARG 122 Cb -0.41 -1.85 -0.02 0.00 0.52 0.00 0.00 34.95 33.19 3lpk s ARG 122 CO 0.43 -0.19 0.79 0.34 0.02 0.00 0.00 175.30 176.69 3lpk s ASP 123 N 1.41 6.91 0.00 0.23 2.15 -1.26 -0.36 116.67 125.74 3lpk s ASP 123 Ca 0.01 1.11 0.27 0.00 0.43 0.00 0.00 52.55 54.38 3lpk s ASP 123 Cb -0.13 -2.43 1.22 0.00 -0.30 0.00 0.00 42.92 41.27 3lpk s ASP 123 CO -0.07 -0.37 1.83 0.18 -0.17 0.00 0.00 175.17 176.57 3lpk n LEU 124 N 5.16 1.07 -3.87 -1.34 4.77 -0.85 -4.94 117.00 117.01 3lpk n LEU 124 Ca 0.03 -0.38 -0.26 0.00 -0.03 0.00 0.00 56.01 55.38 3lpk n LEU 124 Cb 0.49 -0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 41.56 3lpk n LEU 124 CO 0.47 0.19 -0.18 0.54 -1.33 0.00 0.00 177.39 177.08 3lpk n ARG 125 N -0.15 -3.17 -3.66 3.23 1.74 -1.26 -4.97 116.66 108.43 3lpk n ARG 125 Ca 0.20 0.44 -0.11 0.00 -0.77 0.00 0.00 57.85 57.61 3lpk n ARG 125 Cb 0.28 -4.54 -0.08 0.00 -1.02 0.00 0.00 32.46 27.09 3lpk n ARG 125 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 3lpk s LYS 126 N -6.37 0.68 0.25 5.56 2.20 -1.26 -5.05 119.74 115.75 3lpk s LYS 126 Ca 0.09 1.01 0.04 0.00 -0.36 0.00 0.00 55.97 56.74 3lpk s LYS 126 Cb -0.03 0.22 -0.03 0.00 -1.51 0.00 0.00 37.83 36.48 3lpk s LYS 126 CO 0.87 -0.12 0.38 0.20 -0.36 0.00 0.00 175.35 176.32 3lpk s GLY 127 N 0.99 1.26 -0.08 5.54 0.00 -1.26 -0.01 107.32 113.75 3lpk s GLY 127 Ca -0.05 -1.17 -0.07 0.00 0.00 0.00 0.00 44.72 43.43 3lpk s GLY 127 CO -0.09 -1.18 0.22 0.54 0.00 0.00 0.00 173.10 172.59 3lpk s VAL 128 N -2.01 -0.01 -0.24 1.40 0.11 0.71 -4.87 120.40 115.49 3lpk s VAL 128 Ca 0.35 0.04 -0.06 0.00 -2.93 0.00 0.00 61.98 59.38 3lpk s VAL 128 Cb -0.09 -0.32 -0.02 0.00 -1.53 0.00 0.00 36.38 34.42 3lpk s VAL 128 CO 0.30 0.02 0.04 -0.47 -3.33 0.00 0.00 175.10 171.66 3lpk s TYR 129 N 0.41 3.05 -0.29 1.54 5.04 -1.26 -0.82 117.35 125.02 3lpk s TYR 129 Ca -0.02 -0.55 0.02 0.00 -2.44 0.00 0.00 57.07 54.07 3lpk s TYR 129 Cb -0.04 -2.20 0.08 0.00 0.35 0.00 0.00 41.96 40.15 3lpk s TYR 129 CO -0.02 -0.40 0.01 0.08 -1.34 0.00 0.00 175.55 173.88 3lpk s VAL 130 N 1.57 1.65 -0.09 3.14 1.01 -0.62 -4.98 120.40 122.08 3lpk s VAL 130 Ca 0.06 -1.63 -0.07 0.00 0.00 0.00 0.00 61.98 60.33 3lpk s VAL 130 Cb -0.15 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 3lpk s VAL 130 CO 0.02 -0.38 0.18 -2.16 0.00 0.00 0.00 175.10 172.76 3lpk s PRO 131 N 1.27 3.50 0.49 2.72 0.04 -1.26 -1.95 135.00 139.81 3lpk s PRO 131 Ca 0.03 -0.09 0.03 0.00 0.04 0.00 0.00 61.00 61.01 3lpk s PRO 131 Cb -0.19 -3.18 -0.03 0.00 0.04 0.00 0.00 34.50 31.15 3lpk s PRO 131 CO -0.11 0.75 0.01 0.71 0.04 0.00 0.00 177.00 178.41 3lpk s TYR 132 N -1.08 2.02 0.12 0.56 2.02 0.15 -4.98 117.35 116.16 3lpk s TYR 132 Ca 0.18 -0.88 -0.19 0.00 -0.37 0.00 0.00 57.07 55.80 3lpk s TYR 132 Cb -0.13 -1.66 -0.05 0.00 -0.40 0.00 0.00 41.96 39.72 3lpk s TYR 132 CO 0.07 0.27 1.73 1.15 -1.57 0.00 0.00 175.55 177.20 3lpk h THR 133 N 1.44 1.11 0.15 -0.71 2.02 -2.02 -3.28 112.91 111.62 3lpk h THR 133 Ca -0.44 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.45 3lpk h THR 133 Cb 1.30 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 3lpk h THR 133 CO 0.76 0.11 -0.07 -0.61 0.37 0.00 0.00 175.52 176.07 3lpk h GLN 134 N 0.31 -0.19 0.00 6.66 5.75 -1.96 -3.49 115.11 122.19 3lpk h GLN 134 Ca 0.09 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.60 3lpk h GLN 134 Cb 0.05 0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.64 3lpk h GLN 134 CO -0.02 0.17 0.00 0.41 -2.65 0.00 0.00 178.83 176.75 3lpk n GLY 135 N -0.10 2.75 3.60 2.39 0.00 -1.24 -4.86 105.19 107.73 3lpk n GLY 135 Ca -0.09 -0.90 -0.09 0.00 0.00 0.00 0.00 46.02 44.94 3lpk n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lpk s LYS 136 N -0.19 1.49 0.10 1.61 -2.85 -0.62 0.33 119.74 119.62 3lpk s LYS 136 Ca 0.00 -0.96 -0.09 0.00 -1.00 0.00 0.00 55.97 53.92 3lpk s LYS 136 Cb 0.00 0.53 -0.00 0.00 -2.06 0.00 0.00 37.83 36.29 3lpk s LYS 136 CO 0.00 -0.64 0.20 1.67 0.10 0.00 0.00 175.35 176.68 3lpk s TRP 137 N -3.91 0.21 -0.10 1.78 1.48 -0.82 -0.95 118.94 116.63 3lpk s TRP 137 Ca 0.12 -0.63 0.03 0.00 -1.06 0.00 0.00 56.10 54.57 3lpk s TRP 137 Cb -0.02 -0.07 -0.01 0.00 -1.16 0.00 0.00 33.47 32.22 3lpk s TRP 137 CO 0.01 -0.57 -0.21 -2.00 -4.06 0.00 0.00 176.95 170.12 3lpk s GLU 138 N -3.88 3.05 0.15 3.25 2.56 0.13 -1.59 118.70 122.37 3lpk s GLU 138 Ca 0.07 -0.83 -0.02 0.00 0.00 0.00 0.00 54.97 54.19 3lpk s GLU 138 Cb 0.05 -2.36 -0.04 0.00 2.00 0.00 0.00 34.13 33.78 3lpk s GLU 138 CO -0.09 0.23 0.11 0.20 -0.56 0.00 0.00 175.26 175.15 3lpk s GLY 139 N 0.25 1.03 -0.18 -1.50 0.00 -0.00 -0.98 107.32 105.94 3lpk s GLY 139 Ca -0.14 -1.45 -0.03 0.00 0.00 0.00 0.00 44.72 43.10 3lpk s GLY 139 CO 0.07 -1.30 -0.06 -0.54 0.00 0.00 0.00 173.10 171.28 3lpk s GLU 140 N -4.07 3.50 0.41 2.90 2.02 -0.31 -0.20 118.70 122.95 3lpk s GLU 140 Ca 0.27 -0.59 -0.21 0.00 0.02 0.00 0.00 54.97 54.45 3lpk s GLU 140 Cb 0.07 -2.90 -0.11 0.00 0.10 0.00 0.00 34.13 31.29 3lpk s GLU 140 CO 0.04 0.06 0.93 -0.51 0.02 0.00 0.00 175.26 175.80 3lpk s LEU 141 N 0.82 3.99 0.00 1.80 1.43 0.98 -0.59 118.68 127.12 3lpk s LEU 141 Ca -0.02 1.67 -0.11 0.00 -1.03 0.00 0.00 54.13 54.64 3lpk s LEU 141 Cb -0.15 -4.45 0.04 0.00 0.03 0.00 0.00 46.19 41.67 3lpk s LEU 141 CO 0.01 -0.32 0.52 0.61 0.23 0.00 0.00 176.35 177.41 3lpk n GLY 142 N -0.49 0.61 3.15 -3.19 0.00 -0.83 -2.00 105.19 102.45 3lpk n GLY 142 Ca 0.06 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 3lpk n GLY 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3lpk s THR 143 N -2.17 0.56 0.18 2.61 -4.23 0.51 -0.50 115.64 112.61 3lpk s THR 143 Ca 0.12 -1.90 -0.24 0.00 -1.18 0.00 0.00 61.69 58.49 3lpk s THR 143 Cb -0.01 -1.64 0.06 0.00 1.34 0.00 0.00 72.50 72.26 3lpk s THR 143 CO 0.00 -0.91 0.96 -0.62 -0.54 0.00 0.00 174.62 173.52 3lpk s ASP 144 N -3.01 -0.12 0.03 3.99 -1.08 -1.02 -0.75 116.67 114.71 3lpk s ASP 144 Ca 0.10 -0.52 -0.26 0.00 -0.52 0.00 0.00 52.55 51.35 3lpk s ASP 144 Cb 0.06 0.52 -0.05 0.00 -1.46 0.00 0.00 42.92 41.99 3lpk s ASP 144 CO -0.06 -0.98 0.82 -0.76 0.52 0.00 0.00 175.17 174.70 3lpk s LEU 145 N -3.06 4.43 0.01 -1.34 1.43 -1.26 -1.62 118.68 117.27 3lpk s LEU 145 Ca 0.15 1.50 0.05 0.00 -1.03 0.00 0.00 54.13 54.79 3lpk s LEU 145 Cb -0.02 -3.32 -0.02 0.00 0.03 0.00 0.00 46.19 42.87 3lpk s LEU 145 CO 0.04 -0.06 -0.15 -0.69 0.23 0.00 0.00 176.35 175.72 3lpk s VAL 146 N 0.23 1.22 0.12 -1.59 1.01 0.30 -1.50 120.40 120.19 3lpk s VAL 146 Ca 0.42 -0.84 -0.00 0.00 0.00 0.00 0.00 61.98 61.55 3lpk s VAL 146 Cb -0.21 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 3lpk s VAL 146 CO 0.24 0.20 0.02 -0.44 0.00 0.00 0.00 175.10 175.12 3lpk s SER 147 N -0.75 0.60 -0.36 3.32 0.01 -0.86 -0.36 113.70 115.31 3lpk s SER 147 Ca 0.04 -1.14 0.02 0.00 1.31 0.00 0.00 55.95 56.18 3lpk s SER 147 Cb -0.07 0.22 0.11 0.00 0.21 0.00 0.00 66.02 66.49 3lpk s SER 147 CO 0.00 -0.65 0.12 -0.63 0.41 0.00 0.00 173.24 172.49 3lpk s ILE 148 N -3.91 1.53 0.27 1.44 1.01 -1.26 -1.65 121.20 118.63 3lpk s ILE 148 Ca 0.20 -2.03 -0.10 0.00 0.00 0.00 0.00 60.65 58.72 3lpk s ILE 148 Cb 0.07 -2.12 0.41 0.00 0.01 0.00 0.00 42.46 40.83 3lpk s ILE 148 CO -0.01 -0.70 1.57 -0.65 0.00 0.00 0.00 174.94 175.15 3lpk h PRO 149 N 7.60 -0.00 -2.19 2.79 0.11 -1.90 -0.18 132.00 138.22 3lpk h PRO 149 Ca -0.08 0.00 -0.75 0.00 0.11 0.00 0.00 66.00 65.28 3lpk h PRO 149 Cb 0.99 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 31.80 3lpk h PRO 149 CO 0.50 -0.00 0.62 0.72 -0.21 0.00 0.00 178.00 179.63 3lpk n HIS 150 N -5.59 3.10 -1.90 0.65 8.25 -1.26 -4.91 115.22 113.55 3lpk n HIS 150 Ca 0.14 -2.85 0.00 0.00 -0.26 0.00 0.00 57.72 54.76 3lpk n HIS 150 Cb 0.47 -1.00 0.00 0.00 1.12 0.00 0.00 29.99 30.58 3lpk n HIS 150 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3lpk n GLY 151 N -0.19 3.94 3.75 -1.41 0.00 -0.08 -4.49 105.19 106.71 3lpk n GLY 151 Ca 0.44 -0.87 -0.38 0.00 0.00 0.00 0.00 46.02 45.21 3lpk n GLY 151 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3lpk s PRO 152 N 1.45 3.14 -1.48 1.61 0.02 -1.26 -4.86 135.00 133.62 3lpk s PRO 152 Ca 0.00 2.23 -0.12 0.00 0.02 0.00 0.00 61.00 63.13 3lpk s PRO 152 Cb 0.00 -2.25 0.02 0.00 0.02 0.00 0.00 34.50 32.29 3lpk s PRO 152 CO 0.00 -1.19 2.42 -1.71 -0.33 0.00 0.00 177.00 176.20 3lpk n ASN 153 N -1.03 5.85 -4.03 2.53 5.15 -1.26 -4.62 115.26 117.84 3lpk n ASN 153 Ca 0.10 -2.82 -0.08 0.00 -0.60 0.00 0.00 54.58 51.18 3lpk n ASN 153 Cb 0.45 -1.58 -0.09 0.00 -0.53 0.00 0.00 39.78 38.03 3lpk n ASN 153 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3lpk s VAL 154 N 2.18 0.15 -0.05 3.44 -7.23 -1.26 -5.16 120.40 112.48 3lpk s VAL 154 Ca 0.54 -1.63 0.05 0.00 -1.81 0.00 0.00 61.98 59.12 3lpk s VAL 154 Cb 0.15 -1.64 -0.00 0.00 0.56 0.00 0.00 36.38 35.44 3lpk s VAL 154 CO -0.07 -0.70 -0.19 -0.89 -0.31 0.00 0.00 175.10 172.94 3lpk s THR 155 N -3.94 1.61 0.05 5.32 2.01 -1.26 -4.44 115.64 114.98 3lpk s THR 155 Ca 0.12 -0.81 0.07 0.00 0.31 0.00 0.00 61.69 61.38 3lpk s THR 155 Cb 0.07 -1.38 -0.03 0.00 0.01 0.00 0.00 72.50 71.17 3lpk s THR 155 CO -0.06 0.46 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.44 3lpk s VAL 156 N 0.03 1.60 -0.34 3.82 1.01 0.51 -4.91 120.40 122.11 3lpk s VAL 156 Ca -0.05 -1.21 -0.16 0.00 0.00 0.00 0.00 61.98 60.56 3lpk s VAL 156 Cb -0.13 -1.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 3lpk s VAL 156 CO 0.03 0.15 0.42 -0.60 0.00 0.00 0.00 175.10 175.10 3lpk s ARG 157 N -1.25 3.58 0.22 2.72 3.52 -1.26 0.11 118.95 126.60 3lpk s ARG 157 Ca 0.07 -0.32 0.05 0.00 -0.13 0.00 0.00 55.73 55.40 3lpk s ARG 157 Cb -0.09 -3.81 -0.05 0.00 -1.56 0.00 0.00 34.95 29.45 3lpk s ARG 157 CO 0.02 -0.57 -0.07 0.00 -0.81 0.00 0.00 175.30 173.87 3lpk s ALA 158 N 2.15 1.93 0.32 6.12 0.00 -0.64 -4.93 121.76 126.72 3lpk s ALA 158 Ca 0.14 -1.72 -0.28 0.00 0.00 0.00 0.00 51.96 50.10 3lpk s ALA 158 Cb -0.16 0.19 -0.09 0.00 0.00 0.00 0.00 23.12 23.06 3lpk s ALA 158 CO 0.12 -0.10 1.13 -0.80 0.00 0.00 0.00 175.76 176.11 3lpk s ASN 159 N -3.32 7.00 -0.03 0.00 0.01 -1.26 -2.43 114.94 114.92 3lpk s ASN 159 Ca 0.25 2.31 0.00 0.00 -0.71 0.00 0.00 52.86 54.71 3lpk s ASN 159 Cb 0.03 -2.62 0.03 0.00 0.41 0.00 0.00 41.25 39.10 3lpk s ASN 159 CO 0.07 -0.34 0.02 -0.63 -1.51 0.00 0.00 177.10 174.72 3lpk s ILE 160 N -1.27 0.04 -0.33 0.60 1.01 0.35 -4.65 121.20 116.95 3lpk s ILE 160 Ca 0.49 0.17 -0.15 0.00 0.00 0.00 0.00 60.65 61.16 3lpk s ILE 160 Cb -0.31 -0.17 -0.02 0.00 0.01 0.00 0.00 42.46 41.97 3lpk s ILE 160 CO 0.40 0.12 0.35 0.00 0.00 0.00 0.00 174.94 175.82 3lpk s ALA 161 N 1.11 3.50 -0.56 9.38 0.00 -0.59 -1.96 121.76 132.65 3lpk s ALA 161 Ca -0.09 -1.17 -0.24 0.00 0.00 0.00 0.00 51.96 50.47 3lpk s ALA 161 Cb -0.13 -2.79 0.04 0.00 0.00 0.00 0.00 23.12 20.24 3lpk s ALA 161 CO -0.02 -1.01 0.94 0.00 0.00 0.00 0.00 175.76 175.67 3lpk s ALA 162 N 2.01 3.16 -0.10 0.00 0.00 0.25 -1.22 121.76 125.85 3lpk s ALA 162 Ca 0.12 -1.28 -0.30 0.00 0.00 0.00 0.00 51.96 50.50 3lpk s ALA 162 Cb -0.16 -3.74 -0.04 0.00 0.00 0.00 0.00 23.12 19.17 3lpk s ALA 162 CO 0.11 -2.41 1.47 0.42 0.00 0.00 0.00 175.76 175.35 3lpk s ILE 163 N 3.96 3.89 -0.04 0.00 1.01 0.49 -1.16 121.20 129.35 3lpk s ILE 163 Ca 0.30 1.10 0.10 0.00 0.00 0.00 0.00 60.65 62.14 3lpk s ILE 163 Cb -0.13 -3.71 -0.15 0.00 0.01 0.00 0.00 42.46 38.49 3lpk s ILE 163 CO 0.19 -0.09 0.16 0.35 0.00 0.00 0.00 174.94 175.55 3lpk n THR 164 N 5.36 0.22 -3.89 2.92 -2.24 -0.15 -0.70 114.28 115.79 3lpk n THR 164 Ca 0.15 -0.29 -0.11 0.00 -2.27 0.00 0.00 64.05 61.53 3lpk n THR 164 Cb 0.44 -0.07 -0.11 0.00 -2.10 0.00 0.00 70.33 68.49 3lpk n THR 164 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3lpk s GLU 165 N -2.55 0.34 0.16 -0.78 2.02 -1.13 -4.89 118.70 111.86 3lpk s GLU 165 Ca -0.04 -0.32 -0.21 0.00 0.02 0.00 0.00 54.97 54.42 3lpk s GLU 165 Cb 0.05 0.14 0.06 0.00 0.10 0.00 0.00 34.13 34.48 3lpk s GLU 165 CO 0.42 -0.07 0.55 -1.54 0.02 0.00 0.00 175.26 174.63 3lpk s SER 166 N -1.03 -0.47 -0.17 -0.19 1.04 -1.26 0.17 113.70 111.79 3lpk s SER 166 Ca -0.11 -0.11 -0.04 0.00 0.48 0.00 0.00 55.95 56.16 3lpk s SER 166 Cb -0.06 0.57 0.07 0.00 0.10 0.00 0.00 66.02 66.70 3lpk s SER 166 CO 0.00 -0.95 0.14 -0.62 0.98 0.00 0.00 173.24 172.80 3lpk s ASP 167 N -2.77 1.78 -1.70 7.02 -1.08 -0.13 -4.87 116.67 114.93 3lpk s ASP 167 Ca 0.02 -0.35 -0.01 0.00 -0.52 0.00 0.00 52.55 51.69 3lpk s ASP 167 Cb -0.00 0.04 0.00 0.00 -1.46 0.00 0.00 42.92 41.50 3lpk s ASP 167 CO -0.12 -0.33 0.17 0.29 0.52 0.00 0.00 175.17 175.71 3lpk n LYS 168 N 5.30 -2.62 -0.08 4.34 5.02 -1.26 -1.59 118.16 127.27 3lpk n LYS 168 Ca -0.06 0.97 -0.07 0.00 -2.02 0.00 0.00 58.31 57.12 3lpk n LYS 168 Cb 0.49 -5.69 -0.02 0.00 -0.02 0.00 0.00 35.03 29.79 3lpk n LYS 168 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3lpk n PHE 169 N -4.13 0.15 -2.26 2.13 7.35 -1.26 -3.93 117.46 115.51 3lpk n PHE 169 Ca -0.21 0.06 -0.36 0.00 -0.76 0.00 0.00 57.45 56.18 3lpk n PHE 169 Cb 0.67 -0.49 -0.01 0.00 0.35 0.00 0.00 39.48 40.00 3lpk n PHE 169 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 3lpk s PHE 170 N -2.61 2.80 -0.17 -5.13 0.40 -1.26 -4.99 117.98 107.02 3lpk s PHE 170 Ca -0.24 1.54 -0.03 0.00 -0.60 0.00 0.00 56.93 57.60 3lpk s PHE 170 Cb 0.03 -3.34 -0.02 0.00 0.51 0.00 0.00 43.02 40.20 3lpk s PHE 170 CO 0.35 -1.52 -0.05 0.42 0.70 0.00 0.00 175.22 175.12 3lpk s ILE 171 N -1.63 3.59 -0.04 0.64 1.01 -1.26 -5.04 121.20 118.47 3lpk s ILE 171 Ca 0.67 -0.45 -0.30 0.00 0.00 0.00 0.00 60.65 60.57 3lpk s ILE 171 Cb -0.27 -2.58 -0.07 0.00 0.01 0.00 0.00 42.46 39.55 3lpk s ILE 171 CO 0.32 0.47 1.89 0.21 0.00 0.00 0.00 174.94 177.83 3lpk s ASN 172 N 0.75 6.37 0.00 3.58 3.04 -1.26 -2.28 114.94 125.13 3lpk s ASN 172 Ca -0.02 2.37 0.00 0.00 0.04 0.00 0.00 52.86 55.25 3lpk s ASN 172 Cb -0.15 -2.53 0.00 0.00 -1.54 0.00 0.00 41.25 37.04 3lpk s ASN 172 CO 0.02 -1.16 0.00 0.61 -3.04 0.00 0.00 177.10 173.53 3lpk n GLY 173 N 4.61 0.75 0.17 1.21 0.00 -1.26 -4.95 105.19 105.73 3lpk n GLY 173 Ca 0.20 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.27 3lpk n GLY 173 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3lpk h SER 174 N 0.00 0.00 0.00 1.61 4.64 -1.81 -3.48 113.55 114.51 3lpk h SER 174 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3lpk h SER 174 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3lpk h SER 174 CO 0.00 0.43 0.00 -3.20 -0.87 0.00 0.00 176.83 173.19 3lpk n ASN 175 N -3.43 -3.15 -4.60 4.97 5.15 -1.26 -4.95 115.26 107.99 3lpk n ASN 175 Ca 0.00 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 53.69 3lpk n ASN 175 Cb 0.59 -1.12 -0.09 0.00 -0.53 0.00 0.00 39.78 38.63 3lpk n ASN 175 CO 0.00 0.00 0.00 -1.66 1.40 0.00 0.00 177.26 177.00 3lpk s TRP 176 N -1.99 2.78 0.00 1.20 1.48 -1.26 -4.62 118.94 116.53 3lpk s TRP 176 Ca 0.00 -0.14 0.00 0.00 -1.06 0.00 0.00 56.10 54.90 3lpk s TRP 176 Cb 0.00 -1.43 0.00 0.00 -1.16 0.00 0.00 33.47 30.88 3lpk s TRP 176 CO 0.00 0.45 0.85 0.39 -4.06 0.00 0.00 176.95 174.58 3lpk n GLU 177 N 0.57 2.00 -3.85 3.25 4.71 0.74 -4.86 120.64 123.19 3lpk n GLU 177 Ca -0.13 -1.21 -0.06 0.00 -0.01 0.00 0.00 57.16 55.75 3lpk n GLU 177 Cb 0.53 -0.95 0.02 0.00 -1.01 0.00 0.00 31.44 30.03 3lpk n GLU 177 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 3lpk s GLY 178 N -0.72 0.24 0.01 0.62 0.00 -1.17 -0.88 107.32 105.41 3lpk s GLY 178 Ca 0.00 -0.54 0.03 0.00 0.00 0.00 0.00 44.72 44.22 3lpk s GLY 178 CO 0.00 1.11 -0.11 -1.50 0.00 0.00 0.00 173.10 172.61 3lpk s ILE 179 N -2.24 0.83 -0.46 0.90 2.07 0.96 -0.87 121.20 122.38 3lpk s ILE 179 Ca 0.19 -0.62 0.00 0.00 -1.41 0.00 0.00 60.65 58.81 3lpk s ILE 179 Cb -0.04 -0.73 0.12 0.00 0.13 0.00 0.00 42.46 41.95 3lpk s ILE 179 CO 0.08 0.11 0.23 -0.22 -1.91 0.00 0.00 174.94 173.23 3lpk s LEU 180 N -0.58 4.97 -0.38 8.50 2.96 0.61 -1.65 118.68 133.11 3lpk s LEU 180 Ca 0.02 -2.42 -0.29 0.00 -0.22 0.00 0.00 54.13 51.22 3lpk s LEU 180 Cb -0.05 -1.75 0.01 0.00 0.50 0.00 0.00 46.19 44.89 3lpk s LEU 180 CO 0.00 -0.41 1.40 -0.83 -1.32 0.00 0.00 176.35 175.19 3lpk s GLY 181 N 0.97 1.16 0.00 7.98 0.00 -0.43 -1.76 107.32 115.25 3lpk s GLY 181 Ca 0.12 -0.06 0.25 0.00 0.00 0.00 0.00 44.72 45.03 3lpk s GLY 181 CO -0.04 2.75 1.45 1.04 0.00 0.00 0.00 173.10 178.30 3lpk n LEU 182 N 8.56 2.50 0.00 0.66 4.77 0.12 -4.27 117.00 129.34 3lpk n LEU 182 Ca 0.16 -0.90 -0.15 0.00 -0.03 0.00 0.00 56.01 55.08 3lpk n LEU 182 Cb 0.47 -0.05 0.11 0.00 -2.33 0.00 0.00 43.42 41.62 3lpk n LEU 182 CO 0.68 0.45 0.44 0.00 -1.33 0.00 0.00 177.39 177.64 3lpk n ALA 183 N 0.93 -0.96 -1.97 -1.18 0.00 -0.17 -4.94 120.51 112.22 3lpk n ALA 183 Ca 0.17 -0.90 -0.30 0.00 0.00 0.00 0.00 53.44 52.41 3lpk n ALA 183 Cb 0.50 -0.05 0.02 0.00 0.00 0.00 0.00 19.45 19.92 3lpk n ALA 183 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3lpk s TYR 184 N -2.45 3.53 0.54 0.00 1.51 -0.45 -4.67 117.35 115.37 3lpk s TYR 184 Ca 0.39 1.10 0.26 0.00 -1.01 0.00 0.00 57.07 57.81 3lpk s TYR 184 Cb -0.01 -2.70 1.42 0.00 -0.11 0.00 0.00 41.96 40.56 3lpk s TYR 184 CO 0.28 -0.71 2.00 0.00 -1.11 0.00 0.00 175.55 176.02 3lpk h ALA 185 N -0.26 2.41 -0.93 3.71 0.00 -1.87 -2.69 119.26 119.63 3lpk h ALA 185 Ca -0.45 -0.02 0.22 0.00 0.00 0.00 0.00 54.91 54.67 3lpk h ALA 185 Cb 1.21 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 3lpk h ALA 185 CO 0.62 -0.61 0.62 1.49 0.00 0.00 0.00 179.25 181.37 3lpk h GLU 186 N 0.00 0.35 -0.46 0.00 4.81 -1.88 -0.17 114.58 117.23 3lpk h GLU 186 Ca 0.23 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 3lpk h GLU 186 Cb 0.96 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.26 3lpk h GLU 186 CO -0.00 0.23 0.00 0.44 -0.73 0.00 0.00 179.01 178.95 3lpk n ILE 187 N -4.50 1.87 -2.54 2.32 -5.35 -1.01 -4.64 119.36 105.50 3lpk n ILE 187 Ca 0.20 -1.38 -0.35 0.00 -0.27 0.00 0.00 62.75 60.95 3lpk n ILE 187 Cb 0.76 0.06 -0.04 0.00 -1.74 0.00 0.00 39.64 38.68 3lpk n ILE 187 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3lpk s ALA 188 N -2.03 2.95 -0.03 -1.28 0.00 -0.08 -4.51 121.76 116.78 3lpk s ALA 188 Ca 0.43 0.65 -0.01 0.00 0.00 0.00 0.00 51.96 53.03 3lpk s ALA 188 Cb 0.29 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 3lpk s ALA 188 CO 0.17 -0.28 0.04 1.03 0.00 0.00 0.00 175.76 176.72 3lpk s ARG 189 N -2.94 2.97 0.43 0.00 3.00 -1.26 -2.76 118.95 118.39 3lpk s ARG 189 Ca 0.64 -0.49 0.24 0.00 0.00 0.00 0.00 55.73 56.12 3lpk s ARG 189 Cb -0.19 -2.80 0.74 0.00 0.00 0.00 0.00 34.95 32.71 3lpk s ARG 189 CO 0.23 0.66 1.75 -1.00 0.00 0.00 0.00 175.30 176.94 3lpk h PRO 190 N 4.51 0.00 -3.06 3.54 0.13 -1.95 -3.47 132.00 131.71 3lpk h PRO 190 Ca -0.50 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 3lpk h PRO 190 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 3lpk h PRO 190 CO 0.58 0.20 0.24 0.16 -0.23 0.00 0.00 178.00 178.95 3lpk s ASP 191 N -6.16 0.02 0.00 1.44 -4.77 -1.11 -5.03 116.67 101.05 3lpk s ASP 191 Ca 0.02 -1.10 0.11 0.00 -3.30 0.00 0.00 52.55 48.29 3lpk s ASP 191 Cb 0.09 0.83 0.65 0.00 -1.09 0.00 0.00 42.92 43.39 3lpk s ASP 191 CO 0.65 -1.63 1.08 -0.90 0.70 0.00 0.00 175.17 175.06 3lpk n ASP 192 N -1.29 0.00 0.16 2.11 5.68 -1.25 -2.26 116.55 119.70 3lpk n ASP 192 Ca -0.07 -0.59 0.12 0.00 -0.50 0.00 0.00 54.79 53.74 3lpk n ASP 192 Cb 0.60 0.00 0.20 0.00 -1.14 0.00 0.00 41.12 40.78 3lpk n ASP 192 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 3lpk h SER 193 N 0.00 0.00 -1.99 -1.12 4.64 -1.92 -3.41 113.55 109.75 3lpk h SER 193 Ca 0.00 -0.02 -0.63 0.00 -0.47 0.00 0.00 61.79 60.67 3lpk h SER 193 Cb 0.00 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 61.96 3lpk h SER 193 CO 0.00 0.01 1.04 -0.22 -0.87 0.00 0.00 176.83 176.79 3lpk s LEU 194 N -5.50 4.14 -0.02 5.97 2.96 -0.96 -4.97 118.68 120.29 3lpk s LEU 194 Ca 0.07 -1.43 -0.36 0.00 -0.22 0.00 0.00 54.13 52.19 3lpk s LEU 194 Cb 0.08 -2.48 -0.14 0.00 0.50 0.00 0.00 46.19 44.15 3lpk s LEU 194 CO 0.67 -1.39 1.68 1.21 -1.32 0.00 0.00 176.35 177.20 3lpk n GLU 195 N 7.96 1.82 -1.67 1.98 2.13 -1.26 -4.89 120.64 126.70 3lpk n GLU 195 Ca 0.19 0.66 -0.33 0.00 0.66 0.00 0.00 57.16 58.34 3lpk n GLU 195 Cb 0.49 -2.42 0.06 0.00 0.27 0.00 0.00 31.44 29.83 3lpk n GLU 195 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 3lpk s PRO 196 N 2.50 2.64 0.16 5.31 0.02 -1.26 -4.51 135.00 139.86 3lpk s PRO 196 Ca 0.88 1.46 -0.17 0.00 0.02 0.00 0.00 61.00 63.19 3lpk s PRO 196 Cb -0.80 -1.92 0.09 0.00 0.02 0.00 0.00 34.50 31.88 3lpk s PRO 196 CO 0.49 -1.39 1.67 0.35 -0.33 0.00 0.00 177.00 177.80 3lpk h PHE 197 N -0.07 -0.23 -0.07 6.54 3.57 -1.83 -1.97 116.94 122.89 3lpk h PHE 197 Ca -0.47 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.04 3lpk h PHE 197 Cb 1.26 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 40.15 3lpk h PHE 197 CO 0.53 -0.18 -0.08 0.35 -2.23 0.00 0.00 178.31 176.71 3lpk h PHE 198 N -0.01 0.10 -0.42 0.41 3.57 -1.92 0.07 116.94 118.74 3lpk h PHE 198 Ca 0.19 -0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.56 3lpk h PHE 198 Cb 0.29 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 3lpk h PHE 198 CO -0.35 0.18 -0.20 -0.44 -2.23 0.00 0.00 178.31 175.27 3lpk h ASP 199 N 0.10 0.91 -0.51 0.41 3.32 -1.75 -1.80 116.42 117.11 3lpk h ASP 199 Ca 0.02 -0.40 -0.08 0.00 0.02 0.00 0.00 57.03 56.59 3lpk h ASP 199 Cb 0.20 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3lpk h ASP 199 CO 0.01 1.11 0.02 0.28 -1.72 0.00 0.00 179.24 178.94 3lpk h SER 200 N 0.70 0.87 0.04 6.45 0.02 -0.75 -1.26 113.55 119.62 3lpk h SER 200 Ca 0.09 -0.30 0.02 0.00 -0.84 0.00 0.00 61.79 60.77 3lpk h SER 200 Cb 0.77 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.05 3lpk h SER 200 CO 0.06 0.95 -0.18 0.25 -1.14 0.00 0.00 176.83 176.77 3lpk h LEU 201 N 0.76 -0.52 -0.80 5.07 5.85 -0.85 0.13 115.31 124.94 3lpk h LEU 201 Ca 0.15 0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.85 3lpk h LEU 201 Cb 0.49 0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 3lpk h LEU 201 CO 0.02 -0.25 -0.02 0.58 -0.34 0.00 0.00 178.44 178.43 3lpk h VAL 202 N -0.32 1.25 -0.41 1.05 2.07 -1.28 -1.57 116.25 117.05 3lpk h VAL 202 Ca 0.04 -1.09 -0.13 0.00 0.82 0.00 0.00 66.70 66.34 3lpk h VAL 202 Cb 0.37 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 3lpk h VAL 202 CO -0.14 0.39 -0.26 0.50 0.02 0.00 0.00 177.57 178.08 3lpk h LYS 203 N 0.81 0.89 -0.00 1.57 3.64 -0.89 -3.24 116.57 119.35 3lpk h LYS 203 Ca 0.15 -0.42 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 3lpk h LYS 203 Cb 0.52 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 3lpk h LYS 203 CO 0.03 1.07 -0.28 1.04 -2.27 0.00 0.00 179.45 179.03 3lpk n GLN 204 N -4.16 0.14 -3.07 1.90 6.02 0.42 -4.94 117.38 113.68 3lpk n GLN 204 Ca -0.02 -0.06 -0.10 0.00 -0.01 0.00 0.00 57.00 56.81 3lpk n GLN 204 Cb 0.47 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.20 3lpk n GLN 204 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3lpk n THR 205 N -1.38 0.00 0.20 5.09 -2.24 -0.60 -5.04 114.28 110.31 3lpk n THR 205 Ca 0.08 -1.10 0.12 0.00 -2.27 0.00 0.00 64.05 60.87 3lpk n THR 205 Cb 0.33 0.46 0.23 0.00 -2.10 0.00 0.00 70.33 69.25 3lpk n THR 205 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3lpk n HIS 206 N -0.37 0.56 -1.69 4.78 8.25 -1.26 -4.77 115.22 120.72 3lpk n HIS 206 Ca -0.00 -0.29 -0.43 0.00 -0.26 0.00 0.00 57.72 56.74 3lpk n HIS 206 Cb 0.28 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.36 3lpk n HIS 206 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3lpk n VAL 207 N 1.50 0.24 -1.62 1.59 0.31 -1.26 -4.91 118.33 114.18 3lpk n VAL 207 Ca 0.20 -0.04 -0.39 0.00 -0.01 0.00 0.00 64.34 64.10 3lpk n VAL 207 Cb 0.60 -1.99 0.04 0.00 -0.91 0.00 0.00 33.84 31.59 3lpk n VAL 207 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3lpk n PRO 208 N 4.97 1.11 -1.88 5.55 -0.02 -1.26 -4.69 135.00 138.77 3lpk n PRO 208 Ca 0.18 0.41 -0.41 0.00 -2.02 0.00 0.00 63.50 61.65 3lpk n PRO 208 Cb 0.35 -2.14 -0.01 0.00 -0.02 0.00 0.00 33.50 31.67 3lpk n PRO 208 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3lpk n ASN 209 N -0.30 3.88 -3.61 2.55 5.15 -1.26 -4.28 115.26 117.39 3lpk n ASN 209 Ca 0.12 -2.83 -0.08 0.00 -0.60 0.00 0.00 54.58 51.20 3lpk n ASN 209 Cb 0.44 -1.60 -0.05 0.00 -0.53 0.00 0.00 39.78 38.04 3lpk n ASN 209 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3lpk s LEU 210 N 3.19 -0.28 0.04 1.20 0.20 -1.26 -1.30 118.68 120.47 3lpk s LEU 210 Ca 0.52 0.37 -0.10 0.00 0.69 0.00 0.00 54.13 55.61 3lpk s LEU 210 Cb 0.10 1.62 0.01 0.00 -0.43 0.00 0.00 46.19 47.49 3lpk s LEU 210 CO 0.00 -0.21 0.21 0.72 -0.29 0.00 0.00 176.35 176.79 3lpk s PHE 211 N -0.74 0.03 0.04 5.38 -0.71 -1.08 0.45 117.98 121.34 3lpk s PHE 211 Ca 0.02 -0.22 0.04 0.00 -1.04 0.00 0.00 56.93 55.73 3lpk s PHE 211 Cb -0.02 -0.01 -0.02 0.00 -1.21 0.00 0.00 43.02 41.76 3lpk s PHE 211 CO -0.04 -0.43 -0.11 -1.54 -1.34 0.00 0.00 175.22 171.76 3lpk s SER 212 N -2.04 1.25 -0.08 1.98 1.04 -0.35 -0.12 113.70 115.39 3lpk s SER 212 Ca -0.06 -0.44 0.04 0.00 0.48 0.00 0.00 55.95 55.98 3lpk s SER 212 Cb -0.01 -0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.05 3lpk s SER 212 CO -0.03 -0.04 -0.20 -0.76 0.98 0.00 0.00 173.24 173.18 3lpk s LEU 213 N -1.15 1.96 -0.33 2.42 1.43 0.89 -1.05 118.68 122.85 3lpk s LEU 213 Ca -0.02 -0.46 0.04 0.00 -1.03 0.00 0.00 54.13 52.65 3lpk s LEU 213 Cb -0.08 -1.20 0.09 0.00 0.03 0.00 0.00 46.19 45.03 3lpk s LEU 213 CO 0.01 0.14 0.03 -1.58 0.23 0.00 0.00 176.35 175.18 3lpk s GLN 214 N 0.28 1.54 -0.23 1.70 0.74 0.54 -1.34 119.66 122.88 3lpk s GLN 214 Ca -0.13 -1.75 -0.12 0.00 0.05 0.00 0.00 55.36 53.41 3lpk s GLN 214 Cb -0.16 -3.09 -0.05 0.00 1.10 0.00 0.00 33.01 30.82 3lpk s GLN 214 CO 0.06 -0.89 0.23 -0.51 -0.55 0.00 0.00 175.29 173.63 3lpk s LEU 215 N 0.98 4.11 -0.38 3.68 1.43 -1.26 -0.48 118.68 126.76 3lpk s LEU 215 Ca 0.08 0.21 -0.08 0.00 -1.03 0.00 0.00 54.13 53.31 3lpk s LEU 215 Cb -0.19 -2.22 0.06 0.00 0.03 0.00 0.00 46.19 43.86 3lpk s LEU 215 CO -0.09 0.01 0.19 0.00 0.23 0.00 0.00 176.35 176.69 3lpk s GLY 217 N 1.73 3.09 0.27 0.00 0.00 -1.26 -4.76 107.32 106.38 3lpk s GLY 217 Ca 0.01 0.59 0.05 0.00 0.00 0.00 0.00 44.72 45.37 3lpk s GLY 217 CO 0.03 1.20 1.65 0.00 0.00 0.00 0.00 173.10 175.98 3lpk h ALA 218 N 4.36 1.00 0.00 3.20 0.00 -1.94 -3.44 119.26 122.44 3lpk h ALA 218 Ca -0.45 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.01 3lpk h ALA 218 Cb 1.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3lpk h ALA 218 CO 0.68 0.63 0.00 0.41 0.00 0.00 0.00 179.25 180.98 3lpk n GLY 219 N -0.04 0.33 3.56 0.00 0.00 -1.26 -5.01 105.19 102.77 3lpk n GLY 219 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 3lpk n GLY 219 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3lpk s PHE 220 N -2.10 0.21 0.41 1.61 -0.71 -1.26 -4.87 117.98 111.27 3lpk s PHE 220 Ca 0.00 -0.58 -0.26 0.00 -1.04 0.00 0.00 56.93 55.05 3lpk s PHE 220 Cb 0.00 0.24 -0.08 0.00 -1.21 0.00 0.00 43.02 41.96 3lpk s PHE 220 CO 0.00 -0.95 1.26 -2.14 -1.34 0.00 0.00 175.22 172.04 3lpk s PRO 221 N -3.97 3.98 -0.17 1.99 0.02 -1.26 -4.92 135.00 130.66 3lpk s PRO 221 Ca 0.18 2.05 -0.00 0.00 0.02 0.00 0.00 61.00 63.24 3lpk s PRO 221 Cb -0.01 -2.72 0.00 0.00 0.02 0.00 0.00 34.50 31.80 3lpk s PRO 221 CO 0.05 -0.45 -0.14 -0.51 -0.33 0.00 0.00 177.00 175.62 3lpk s LEU 222 N -2.47 2.47 1.07 -5.54 1.43 -1.26 -5.05 118.68 109.33 3lpk s LEU 222 Ca 0.57 -0.50 -0.17 0.00 -1.03 0.00 0.00 54.13 53.00 3lpk s LEU 222 Cb -0.36 -1.58 0.24 0.00 0.03 0.00 0.00 46.19 44.52 3lpk s LEU 222 CO 0.45 0.05 1.20 0.54 0.23 0.00 0.00 176.35 178.82 3lpk s ASN 223 N 1.05 2.09 0.17 2.29 2.20 -1.26 -4.63 114.94 116.84 3lpk s ASN 223 Ca -0.01 0.50 -0.21 0.00 -0.94 0.00 0.00 52.86 52.21 3lpk s ASN 223 Cb -0.15 -0.69 0.09 0.00 -2.00 0.00 0.00 41.25 38.50 3lpk s ASN 223 CO -0.04 -3.39 1.61 -0.61 -2.94 0.00 0.00 177.10 171.74 3lpk h GLN 224 N -2.09 -0.18 -0.13 3.55 4.15 -1.99 -0.61 115.11 117.81 3lpk h GLN 224 Ca -0.45 0.01 -0.17 0.00 0.77 0.00 0.00 58.65 58.81 3lpk h GLN 224 Cb 1.27 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 29.00 3lpk h GLN 224 CO 0.38 -0.12 -0.63 0.66 -1.93 0.00 0.00 178.83 177.20 3lpk h SER 225 N -0.19 0.54 -0.19 -0.69 4.64 -2.00 -3.17 113.55 112.49 3lpk h SER 225 Ca 0.19 -0.31 -0.01 0.00 -0.47 0.00 0.00 61.79 61.19 3lpk h SER 225 Cb 0.49 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 3lpk h SER 225 CO -0.52 1.03 0.08 -0.33 -0.87 0.00 0.00 176.83 176.22 3lpk h GLU 226 N 0.35 0.29 0.00 4.77 5.08 -1.79 -2.23 114.58 121.04 3lpk h GLU 226 Ca -0.01 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3lpk h GLU 226 Cb 1.18 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 3lpk h GLU 226 CO 0.11 0.35 -0.08 -0.24 -1.00 0.00 0.00 179.01 178.15 3lpk h VAL 227 N 0.16 0.45 0.00 3.13 3.04 -1.18 0.18 116.25 122.04 3lpk h VAL 227 Ca 0.07 -0.41 -0.16 0.00 -1.01 0.00 0.00 66.70 65.19 3lpk h VAL 227 Cb 0.17 1.28 -0.02 0.00 -2.01 0.00 0.00 31.29 30.70 3lpk h VAL 227 CO -0.01 0.08 -0.77 -0.07 -1.01 0.00 0.00 177.57 175.80 3lpk h LEU 228 N 0.00 0.00 0.00 3.16 3.38 -1.46 -3.33 115.31 117.07 3lpk h LEU 228 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3lpk h LEU 228 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3lpk h LEU 228 CO 0.01 0.72 -1.41 0.00 0.09 0.00 0.00 178.44 177.85 3lpk n ALA 229 N -2.29 3.32 -2.06 1.53 0.00 -0.58 -4.98 120.51 115.46 3lpk n ALA 229 Ca 0.00 -0.47 -0.33 0.00 0.00 0.00 0.00 53.44 52.65 3lpk n ALA 229 Cb 0.83 -0.86 -0.06 0.00 0.00 0.00 0.00 19.45 19.36 3lpk n ALA 229 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3lpk s SER 230 N -4.14 6.81 -0.21 0.00 0.15 0.53 -5.04 113.70 111.80 3lpk s SER 230 Ca -0.01 1.38 -0.25 0.00 0.70 0.00 0.00 55.95 57.77 3lpk s SER 230 Cb 0.14 -2.42 -0.01 0.00 -1.71 0.00 0.00 66.02 62.03 3lpk s SER 230 CO 0.86 -0.25 0.85 -0.69 1.20 0.00 0.00 173.24 175.21 3lpk s VAL 231 N -2.04 4.84 -1.12 4.45 1.01 -1.26 -4.69 120.40 121.59 3lpk s VAL 231 Ca 0.56 1.64 0.24 0.00 0.00 0.00 0.00 61.98 64.43 3lpk s VAL 231 Cb -0.10 -4.15 -0.00 0.00 0.00 0.00 0.00 36.38 32.13 3lpk s VAL 231 CO 0.16 -0.05 1.34 0.61 0.00 0.00 0.00 175.10 177.17 3lpk n GLY 232 N 3.60 -1.10 0.00 4.51 0.00 0.15 -4.93 105.19 107.42 3lpk n GLY 232 Ca 0.06 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3lpk n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lpk n GLY 233 N 1.48 0.44 2.93 -0.02 0.00 -1.13 -0.47 105.19 108.42 3lpk n GLY 233 Ca 0.06 -1.60 -0.12 0.00 0.00 0.00 0.00 46.02 44.36 3lpk n GLY 233 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3lpk s SER 234 N -4.00 -0.04 -0.28 1.61 0.01 0.36 -1.72 113.70 109.65 3lpk s SER 234 Ca 0.00 0.07 0.02 0.00 1.31 0.00 0.00 55.95 57.35 3lpk s SER 234 Cb 0.00 0.11 0.08 0.00 0.21 0.00 0.00 66.02 66.41 3lpk s SER 234 CO 0.00 -0.04 -0.03 -0.32 0.41 0.00 0.00 173.24 173.26 3lpk s MET 235 N -0.08 1.67 -0.40 12.44 0.00 -1.26 -0.34 119.30 131.33 3lpk s MET 235 Ca -0.01 -1.36 -0.19 0.00 0.00 0.00 0.00 55.69 54.13 3lpk s MET 235 Cb -0.01 -2.80 0.01 0.00 0.00 0.00 0.00 34.83 32.03 3lpk s MET 235 CO 0.00 -0.73 0.55 0.42 0.00 0.00 0.00 175.02 175.27 3lpk s ILE 236 N 1.19 4.95 -0.31 10.11 -1.09 -0.21 -4.85 121.20 130.99 3lpk s ILE 236 Ca -0.00 0.11 -0.18 0.00 -2.23 0.00 0.00 60.65 58.35 3lpk s ILE 236 Cb -0.19 -4.08 -0.02 0.00 -1.58 0.00 0.00 42.46 36.59 3lpk s ILE 236 CO -0.08 -0.41 0.50 -0.63 -1.23 0.00 0.00 174.94 173.09 3lpk s ILE 237 N 2.51 5.05 0.00 2.92 1.01 -1.26 -1.21 121.20 130.23 3lpk s ILE 237 Ca 0.19 0.59 0.00 0.00 0.00 0.00 0.00 60.65 61.43 3lpk s ILE 237 Cb -0.15 -3.88 0.00 0.00 0.01 0.00 0.00 42.46 38.43 3lpk s ILE 237 CO 0.16 -0.06 0.00 0.61 0.00 0.00 0.00 174.94 175.65 3lpk n GLY 238 N 4.62 0.75 0.71 6.18 0.00 0.17 -4.78 105.19 112.84 3lpk n GLY 238 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.97 3lpk n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lpk n GLY 239 N -2.42 1.23 2.92 -0.02 0.00 -1.24 -4.39 105.19 101.27 3lpk n GLY 239 Ca 0.00 -0.97 -0.25 0.00 0.00 0.00 0.00 46.02 44.80 3lpk n GLY 239 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lpk s ILE 240 N -2.51 0.92 -0.34 -0.61 1.01 -1.26 -4.08 121.20 114.33 3lpk s ILE 240 Ca 0.04 -0.27 -0.11 0.00 0.00 0.00 0.00 60.65 60.31 3lpk s ILE 240 Cb -0.01 -0.92 -0.00 0.00 0.01 0.00 0.00 42.46 41.54 3lpk s ILE 240 CO 0.01 0.33 0.20 -0.62 0.00 0.00 0.00 174.94 174.87 3lpk s ASP 241 N 1.35 5.80 0.39 3.58 3.68 -1.26 -4.21 116.67 126.01 3lpk s ASP 241 Ca -0.02 -0.57 0.27 0.00 2.13 0.00 0.00 52.55 54.36 3lpk s ASP 241 Cb -0.14 -2.07 1.39 0.00 -1.45 0.00 0.00 42.92 40.66 3lpk s ASP 241 CO -0.04 -0.25 1.83 0.45 0.13 0.00 0.00 175.17 177.30 3lpk h HIS 242 N 8.43 0.00 0.00 -5.34 3.86 -1.85 -2.46 115.15 117.79 3lpk h HIS 242 Ca -0.31 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.90 3lpk h HIS 242 Cb 1.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.61 3lpk h HIS 242 CO 0.63 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 178.29 3lpk n SER 243 N -2.47 0.62 -0.06 2.45 3.41 -1.26 -3.52 113.62 112.78 3lpk n SER 243 Ca -0.01 0.57 0.14 0.00 -0.26 0.00 0.00 58.87 59.32 3lpk n SER 243 Cb 0.10 -0.73 0.64 0.00 -0.26 0.00 0.00 64.21 63.95 3lpk n SER 243 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3lpk n LEU 244 N -2.10 0.29 -4.06 1.04 4.77 -0.93 -4.81 117.00 111.20 3lpk n LEU 244 Ca 0.05 0.13 -0.10 0.00 -0.03 0.00 0.00 56.01 56.06 3lpk n LEU 244 Cb 0.37 -0.24 -0.07 0.00 -2.33 0.00 0.00 43.42 41.15 3lpk n LEU 244 CO 0.27 0.06 0.01 -0.72 -1.33 0.00 0.00 177.39 175.68 3lpk s TYR 245 N -2.58 0.65 0.18 -1.77 1.13 -1.23 -1.39 117.35 112.34 3lpk s TYR 245 Ca 0.26 -0.96 0.07 0.00 -1.41 0.00 0.00 57.07 55.04 3lpk s TYR 245 Cb 0.20 -0.11 -0.04 0.00 -1.10 0.00 0.00 41.96 40.91 3lpk s TYR 245 CO 0.49 -0.83 -0.14 0.95 -2.51 0.00 0.00 175.55 173.51 3lpk s THR 246 N -4.06 1.60 0.00 -3.49 -4.23 -0.74 -4.79 115.64 99.93 3lpk s THR 246 Ca 0.27 -2.11 0.00 0.00 -1.18 0.00 0.00 61.69 58.67 3lpk s THR 246 Cb 0.03 -1.94 0.00 0.00 1.34 0.00 0.00 72.50 71.93 3lpk s THR 246 CO 0.09 -0.58 0.00 0.61 -0.54 0.00 0.00 174.62 174.19 3lpk n GLY 247 N -0.20 -1.03 3.93 3.99 0.00 -1.26 -3.64 105.19 106.98 3lpk n GLY 247 Ca -0.10 -1.20 -0.27 0.00 0.00 0.00 0.00 46.02 44.46 3lpk n GLY 247 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3lpk s SER 248 N -4.00 6.37 -0.06 1.61 0.01 -1.26 -4.96 113.70 111.42 3lpk s SER 248 Ca 0.00 0.36 -0.18 0.00 1.31 0.00 0.00 55.95 57.44 3lpk s SER 248 Cb 0.00 -1.99 -0.05 0.00 0.21 0.00 0.00 66.02 64.19 3lpk s SER 248 CO 0.00 -0.04 0.48 -0.76 0.41 0.00 0.00 173.24 173.33 3lpk s LEU 249 N -3.38 4.37 -0.05 2.44 1.43 -1.26 -4.52 118.68 117.71 3lpk s LEU 249 Ca 0.38 0.93 0.06 0.00 -1.03 0.00 0.00 54.13 54.47 3lpk s LEU 249 Cb -0.11 -2.71 -0.02 0.00 0.03 0.00 0.00 46.19 43.39 3lpk s LEU 249 CO 0.29 0.13 -0.23 0.26 0.23 0.00 0.00 176.35 177.02 3lpk s TRP 250 N -0.09 2.45 -0.07 0.29 0.52 -0.29 -4.91 118.94 116.85 3lpk s TRP 250 Ca 0.26 -0.55 0.01 0.00 0.02 0.00 0.00 56.10 55.84 3lpk s TRP 250 Cb -0.16 -1.58 -0.03 0.00 -1.15 0.00 0.00 33.47 30.55 3lpk s TRP 250 CO 0.13 -0.10 -0.08 0.71 0.02 0.00 0.00 176.95 177.62 3lpk s TYR 251 N -0.37 2.90 0.04 -1.98 1.51 -1.26 -0.52 117.35 117.67 3lpk s TYR 251 Ca 0.03 -0.01 0.07 0.00 -1.01 0.00 0.00 57.07 56.15 3lpk s TYR 251 Cb -0.12 -1.70 -0.03 0.00 -0.11 0.00 0.00 41.96 40.00 3lpk s TYR 251 CO 0.02 0.31 -0.19 -0.08 -1.11 0.00 0.00 175.55 174.49 3lpk s THR 252 N -0.79 2.73 0.44 -0.71 -1.32 -0.10 -3.49 115.64 112.39 3lpk s THR 252 Ca 0.12 -1.19 -0.23 0.00 -1.21 0.00 0.00 61.69 59.18 3lpk s THR 252 Cb -0.11 -2.14 -0.08 0.00 -1.51 0.00 0.00 72.50 68.67 3lpk s THR 252 CO 0.01 0.35 1.14 -2.84 -2.21 0.00 0.00 174.62 171.07 3lpk s PRO 253 N -1.39 3.90 -0.48 7.08 0.02 -1.26 -0.69 135.00 142.18 3lpk s PRO 253 Ca 0.14 1.71 -0.27 0.00 0.02 0.00 0.00 61.00 62.61 3lpk s PRO 253 Cb -0.10 -2.47 0.03 0.00 0.02 0.00 0.00 34.50 31.98 3lpk s PRO 253 CO 0.05 -0.42 1.02 0.42 -0.33 0.00 0.00 177.00 177.73 3lpk s ILE 254 N -1.56 4.35 0.14 2.83 1.01 -0.63 -4.54 121.20 122.78 3lpk s ILE 254 Ca 0.61 0.89 -0.22 0.00 0.00 0.00 0.00 60.65 61.94 3lpk s ILE 254 Cb -0.27 -4.52 -0.00 0.00 0.01 0.00 0.00 42.46 37.68 3lpk s ILE 254 CO 0.33 -0.94 1.66 -0.09 0.00 0.00 0.00 174.94 175.90 3lpk h ARG 255 N 9.17 -0.18 -3.41 2.79 2.43 -1.07 -3.44 114.38 120.67 3lpk h ARG 255 Ca -0.24 0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 58.78 3lpk h ARG 255 Cb 1.07 0.04 -0.23 0.00 -0.42 0.00 0.00 29.97 30.43 3lpk h ARG 255 CO 1.08 -0.12 -0.49 0.50 -1.51 0.00 0.00 179.97 179.42 3lpk s ARG 256 N -6.14 0.36 -1.14 0.20 3.52 -1.26 -5.08 118.95 109.41 3lpk s ARG 256 Ca -0.14 -0.10 -0.16 0.00 -0.13 0.00 0.00 55.73 55.20 3lpk s ARG 256 Cb 0.11 0.16 0.15 0.00 -1.56 0.00 0.00 34.95 33.81 3lpk s ARG 256 CO 0.68 -0.08 1.38 -1.21 -0.81 0.00 0.00 175.30 175.26 3lpk s GLU 257 N -0.71 3.95 0.00 5.12 2.02 -1.26 -3.99 118.70 123.82 3lpk s GLU 257 Ca -0.08 -2.30 0.00 0.00 0.02 0.00 0.00 54.97 52.61 3lpk s GLU 257 Cb -0.05 -5.07 0.00 0.00 0.10 0.00 0.00 34.13 29.12 3lpk s GLU 257 CO 0.01 -1.81 0.00 -2.67 0.02 0.00 0.00 175.26 170.81 3lpk n TRP 258 N 6.14 -0.06 -2.68 1.61 4.27 -1.26 -4.62 117.44 120.85 3lpk n TRP 258 Ca 0.34 0.00 -0.23 0.00 -3.89 0.00 0.00 57.50 53.72 3lpk n TRP 258 Cb 0.45 0.26 0.10 0.00 -1.36 0.00 0.00 31.31 30.75 3lpk n TRP 258 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 3lpk s TYR 259 N -0.52 1.54 -1.08 -2.67 2.02 -1.26 -1.33 117.35 114.05 3lpk s TYR 259 Ca 0.00 -0.37 -0.16 0.00 -0.37 0.00 0.00 57.07 56.17 3lpk s TYR 259 Cb 0.00 -2.84 0.15 0.00 -0.40 0.00 0.00 41.96 38.88 3lpk s TYR 259 CO 0.00 -1.60 1.30 0.71 -1.57 0.00 0.00 175.55 174.39 3lpk s TYR 260 N -3.05 3.31 0.03 2.71 1.51 -1.26 -4.82 117.35 115.78 3lpk s TYR 260 Ca 0.65 -1.78 -0.25 0.00 -1.01 0.00 0.00 57.07 54.68 3lpk s TYR 260 Cb -0.05 -4.31 -0.05 0.00 -0.11 0.00 0.00 41.96 37.44 3lpk s TYR 260 CO 0.43 -1.45 0.75 -2.00 -1.11 0.00 0.00 175.55 172.18 3lpk s GLU 261 N 2.14 4.48 0.34 -0.62 2.12 -1.26 -2.31 118.70 123.60 3lpk s GLU 261 Ca 0.38 1.03 0.03 0.00 0.36 0.00 0.00 54.97 56.78 3lpk s GLU 261 Cb -0.04 -3.37 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 3lpk s GLU 261 CO -0.04 0.25 0.12 0.14 -0.54 0.00 0.00 175.26 175.19 3lpk s VAL 262 N 0.07 0.67 -0.13 3.70 -7.23 -0.54 -0.43 120.40 116.51 3lpk s VAL 262 Ca 0.38 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.56 3lpk s VAL 262 Cb -0.20 -2.54 0.02 0.00 0.56 0.00 0.00 36.38 34.22 3lpk s VAL 262 CO 0.22 0.00 -0.15 -0.63 -0.31 0.00 0.00 175.10 174.23 3lpk s ILE 263 N -3.40 1.55 -0.15 -0.62 1.01 -1.26 -4.10 121.20 114.22 3lpk s ILE 263 Ca 0.32 -0.64 -0.17 0.00 0.00 0.00 0.00 60.65 60.15 3lpk s ILE 263 Cb 0.05 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 3lpk s ILE 263 CO 0.15 0.45 0.45 -0.63 0.00 0.00 0.00 174.94 175.37 3lpk s ILE 264 N 1.23 5.19 -0.42 2.92 1.01 -1.26 -2.12 121.20 127.74 3lpk s ILE 264 Ca -0.01 0.86 0.12 0.00 0.00 0.00 0.00 60.65 61.62 3lpk s ILE 264 Cb -0.14 -3.78 -0.14 0.00 0.01 0.00 0.00 42.46 38.41 3lpk s ILE 264 CO -0.06 0.29 0.44 1.33 0.00 0.00 0.00 174.94 176.94 3lpk n VAL 265 N 3.94 0.00 -3.56 2.92 0.24 -0.19 -4.73 118.33 116.95 3lpk n VAL 265 Ca -0.07 -0.24 -0.15 0.00 -2.04 0.00 0.00 64.34 61.84 3lpk n VAL 265 Cb 0.51 0.82 -0.06 0.00 -1.47 0.00 0.00 33.84 33.64 3lpk n VAL 265 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3lpk s ARG 266 N -2.27 0.86 -0.02 7.34 3.52 -1.24 -4.78 118.95 122.36 3lpk s ARG 266 Ca 0.02 0.39 0.02 0.00 -0.13 0.00 0.00 55.73 56.03 3lpk s ARG 266 Cb 0.09 0.41 0.01 0.00 -1.56 0.00 0.00 34.95 33.89 3lpk s ARG 266 CO 0.48 -0.23 -0.05 0.08 -0.81 0.00 0.00 175.30 174.77 3lpk s VAL 267 N -0.77 0.51 0.06 7.11 1.01 -1.26 -0.63 120.40 126.43 3lpk s VAL 267 Ca -0.06 -0.19 0.06 0.00 0.00 0.00 0.00 61.98 61.79 3lpk s VAL 267 Cb -0.01 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 3lpk s VAL 267 CO 0.05 0.18 -0.16 -1.61 0.00 0.00 0.00 175.10 173.57 3lpk s GLU 268 N 0.40 0.98 -0.27 2.72 2.02 -0.53 -1.06 118.70 122.96 3lpk s GLU 268 Ca -0.05 -0.89 0.02 0.00 0.02 0.00 0.00 54.97 54.07 3lpk s GLU 268 Cb -0.09 -1.03 0.07 0.00 0.10 0.00 0.00 34.13 33.18 3lpk s GLU 268 CO -0.00 0.25 -0.05 0.42 0.02 0.00 0.00 175.26 175.89 3lpk s ILE 269 N -1.01 1.94 -1.35 -1.63 -1.09 -0.28 -1.25 121.20 116.53 3lpk s ILE 269 Ca 0.02 -1.63 -0.04 0.00 -2.23 0.00 0.00 60.65 56.76 3lpk s ILE 269 Cb -0.09 -2.18 0.02 0.00 -1.58 0.00 0.00 42.46 38.63 3lpk s ILE 269 CO 0.02 -0.19 0.85 0.59 -1.23 0.00 0.00 174.94 174.99 3lpk n ASN 270 N 4.49 -2.67 0.00 3.58 4.13 -0.10 -1.46 115.26 123.23 3lpk n ASN 270 Ca -0.10 -0.76 0.00 0.00 1.68 0.00 0.00 54.58 55.41 3lpk n ASN 270 Cb 0.43 -4.24 0.00 0.00 -1.54 0.00 0.00 39.78 34.42 3lpk n ASN 270 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3lpk n GLY 271 N -1.59 2.82 3.65 7.41 0.00 -1.26 -4.98 105.19 111.24 3lpk n GLY 271 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 3lpk n GLY 271 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3lpk s GLN 272 N 0.00 4.19 0.12 1.61 0.74 -0.54 -4.97 119.66 120.81 3lpk s GLN 272 Ca 0.00 0.72 -0.31 0.00 0.05 0.00 0.00 55.36 55.82 3lpk s GLN 272 Cb 0.00 -3.61 -0.10 0.00 1.10 0.00 0.00 33.01 30.40 3lpk s GLN 272 CO 0.00 -0.36 1.83 0.34 -0.55 0.00 0.00 175.29 176.55 3lpk s ASP 273 N 1.30 6.42 0.60 6.67 2.15 -1.26 -1.12 116.67 131.43 3lpk s ASP 273 Ca 0.30 2.76 0.38 0.00 0.43 0.00 0.00 52.55 56.42 3lpk s ASP 273 Cb -0.16 -2.57 1.90 0.00 -0.30 0.00 0.00 42.92 41.79 3lpk s ASP 273 CO 0.09 -1.00 2.19 0.25 -0.17 0.00 0.00 175.17 176.53 3lpk h LEU 274 N 8.64 0.00 -1.36 -1.34 5.85 -1.47 -3.47 115.31 122.17 3lpk h LEU 274 Ca -0.46 0.00 -0.43 0.00 0.84 0.00 0.00 57.88 57.83 3lpk h LEU 274 Cb 1.22 0.00 0.04 0.00 0.37 0.00 0.00 40.66 42.28 3lpk h LEU 274 CO 0.95 0.01 -0.78 1.17 -0.34 0.00 0.00 178.44 179.45 3lpk n LYS 275 N -3.16 -5.61 -4.00 1.25 4.81 -1.26 -5.02 118.16 105.16 3lpk n LYS 275 Ca -0.01 0.65 -0.22 0.00 -0.87 0.00 0.00 58.31 57.86 3lpk n LYS 275 Cb 0.18 -5.43 -0.04 0.00 0.02 0.00 0.00 35.03 29.77 3lpk n LYS 275 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 3lpk s MET 276 N -6.22 2.78 0.11 1.64 -1.94 -1.26 -5.04 119.30 109.36 3lpk s MET 276 Ca 0.32 -1.20 -0.31 0.00 -1.71 0.00 0.00 55.69 52.80 3lpk s MET 276 Cb -0.16 -2.48 -0.10 0.00 2.01 0.00 0.00 34.83 34.10 3lpk s MET 276 CO 0.80 0.26 1.84 0.34 -0.01 0.00 0.00 175.02 178.26 3lpk s ASP 277 N -3.89 6.43 0.49 3.03 -1.08 -1.26 -4.81 116.67 115.59 3lpk s ASP 277 Ca 0.36 2.73 0.27 0.00 -0.52 0.00 0.00 52.55 55.39 3lpk s ASP 277 Cb -0.07 -2.56 1.45 0.00 -1.46 0.00 0.00 42.92 40.29 3lpk s ASP 277 CO 0.25 -1.01 1.79 0.00 0.52 0.00 0.00 175.17 176.73 3lpk h LYS 279 N 0.00 0.00 -0.31 0.00 3.64 -1.80 -2.66 116.57 115.44 3lpk h LYS 279 Ca 0.00 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 3lpk h LYS 279 Cb 0.34 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 3lpk h LYS 279 CO 0.00 0.38 0.08 0.93 -2.27 0.00 0.00 179.45 178.57 3lpk h GLU 280 N 0.00 0.44 0.00 1.90 4.39 -1.08 -2.18 114.58 118.05 3lpk h GLU 280 Ca -0.00 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.61 3lpk h GLU 280 Cb 0.67 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.24 3lpk h GLU 280 CO 0.05 0.41 -0.12 1.88 -1.16 0.00 0.00 179.01 180.07 3lpk h TYR 281 N 0.44 0.00 -0.03 4.33 0.99 -1.61 -3.07 116.97 118.02 3lpk h TYR 281 Ca 0.11 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.82 3lpk h TYR 281 Cb 0.16 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 37.88 3lpk h TYR 281 CO 0.01 0.12 -0.51 0.09 -0.00 0.00 0.00 178.16 177.86 3lpk n ASN 282 N -3.44 1.82 -4.48 3.88 3.02 -0.84 -4.44 115.26 110.78 3lpk n ASN 282 Ca -0.01 -3.90 -0.41 0.00 -0.03 0.00 0.00 54.58 50.23 3lpk n ASN 282 Cb 0.28 -0.52 -0.11 0.00 -0.61 0.00 0.00 39.78 38.82 3lpk n ASN 282 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3lpk s TYR 283 N -3.25 3.23 -2.33 3.10 5.04 -1.08 -0.28 117.35 121.78 3lpk s TYR 283 Ca 0.38 -0.46 0.23 0.00 -2.44 0.00 0.00 57.07 54.79 3lpk s TYR 283 Cb 0.37 -2.49 0.51 0.00 0.35 0.00 0.00 41.96 40.70 3lpk s TYR 283 CO -0.07 -0.47 1.45 -0.40 -1.34 0.00 0.00 175.55 174.72 3lpk n ASP 284 N 5.09 3.46 -3.61 4.32 3.85 -1.26 -3.38 116.55 125.03 3lpk n ASP 284 Ca -0.12 -1.98 -0.01 0.00 -0.71 0.00 0.00 54.79 51.97 3lpk n ASP 284 Cb 0.48 -0.31 -0.01 0.00 -1.35 0.00 0.00 41.12 39.93 3lpk n ASP 284 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.20 174.60 3lpk s LYS 285 N -1.38 0.29 -0.06 0.11 -2.85 0.61 -4.72 119.74 111.74 3lpk s LYS 285 Ca 0.41 -0.14 0.02 0.00 -1.00 0.00 0.00 55.97 55.26 3lpk s LYS 285 Cb 0.23 0.11 0.02 0.00 -2.06 0.00 0.00 37.83 36.13 3lpk s LYS 285 CO 0.32 -0.13 -0.09 -1.12 0.10 0.00 0.00 175.35 174.42 3lpk s SER 286 N -2.61 1.49 0.12 0.03 0.01 -1.26 0.19 113.70 111.67 3lpk s SER 286 Ca 0.12 -0.24 0.03 0.00 1.31 0.00 0.00 55.95 57.17 3lpk s SER 286 Cb 0.03 -0.70 -0.04 0.00 0.21 0.00 0.00 66.02 65.52 3lpk s SER 286 CO -0.04 0.00 -0.08 0.27 0.41 0.00 0.00 173.24 173.80 3lpk s ILE 287 N 0.77 0.90 -0.31 1.44 -4.36 -0.48 -1.47 121.20 117.69 3lpk s ILE 287 Ca -0.13 -1.98 -0.10 0.00 -0.26 0.00 0.00 60.65 58.17 3lpk s ILE 287 Cb -0.15 -1.75 -0.01 0.00 1.25 0.00 0.00 42.46 41.80 3lpk s ILE 287 CO 0.02 -0.82 0.16 -0.69 0.24 0.00 0.00 174.94 173.86 3lpk s VAL 288 N -3.48 4.74 -0.24 8.37 1.01 -0.98 -0.73 120.40 129.09 3lpk s VAL 288 Ca 0.14 -0.31 -0.03 0.00 0.00 0.00 0.00 61.98 61.78 3lpk s VAL 288 Cb 0.04 -3.39 0.08 0.00 0.00 0.00 0.00 36.38 33.11 3lpk s VAL 288 CO -0.02 0.10 0.08 -0.62 0.00 0.00 0.00 175.10 174.63 3lpk s ASP 289 N 1.64 3.28 0.12 3.32 2.15 -0.26 -4.48 116.67 122.44 3lpk s ASP 289 Ca 0.05 -1.11 0.22 0.00 0.43 0.00 0.00 52.55 52.14 3lpk s ASP 289 Cb -0.17 -0.59 0.87 0.00 -0.30 0.00 0.00 42.92 42.74 3lpk s ASP 289 CO 0.07 -0.37 1.67 -1.54 -0.17 0.00 0.00 175.17 174.83 3lpk n SER 290 N 5.06 0.36 -0.38 -0.34 3.41 -1.26 -2.77 113.62 117.70 3lpk n SER 290 Ca -0.06 0.57 0.09 0.00 -0.26 0.00 0.00 58.87 59.21 3lpk n SER 290 Cb 0.45 -0.66 0.38 0.00 -0.26 0.00 0.00 64.21 64.12 3lpk n SER 290 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3lpk n GLY 291 N 0.41 -0.10 3.09 5.00 0.00 -1.26 -4.59 105.19 107.73 3lpk n GLY 291 Ca 0.04 -0.31 -0.23 0.00 0.00 0.00 0.00 46.02 45.52 3lpk n GLY 291 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lpk s THR 292 N -1.83 1.13 -0.04 2.61 2.01 -1.11 -5.03 115.64 113.38 3lpk s THR 292 Ca 0.28 -0.57 -0.19 0.00 0.31 0.00 0.00 61.69 61.52 3lpk s THR 292 Cb 0.15 -0.97 -0.13 0.00 0.01 0.00 0.00 72.50 71.56 3lpk s THR 292 CO 0.22 0.33 0.82 0.74 -0.69 0.00 0.00 174.62 176.05 3lpk h THR 293 N 5.14 0.48 -4.57 -0.82 2.02 -1.86 0.29 112.91 113.59 3lpk h THR 293 Ca -0.33 -0.84 -0.48 0.00 0.77 0.00 0.00 66.41 65.53 3lpk h THR 293 Cb 1.17 0.79 0.09 0.00 -1.74 0.00 0.00 68.15 68.46 3lpk h THR 293 CO 0.48 0.12 0.41 0.20 0.37 0.00 0.00 175.52 177.10 3lpk s ASN 294 N -5.19 4.76 -0.35 4.18 0.01 -1.26 -1.26 114.94 115.82 3lpk s ASN 294 Ca -0.11 0.89 -0.21 0.00 -0.71 0.00 0.00 52.86 52.72 3lpk s ASN 294 Cb 0.01 -1.47 0.00 0.00 0.41 0.00 0.00 41.25 40.20 3lpk s ASN 294 CO 0.39 -1.75 0.69 -0.22 -1.51 0.00 0.00 177.10 174.70 3lpk s LEU 295 N -5.53 4.20 -0.15 0.60 2.96 -0.49 -2.41 118.68 117.86 3lpk s LEU 295 Ca 0.61 0.26 -0.05 0.00 -0.22 0.00 0.00 54.13 54.73 3lpk s LEU 295 Cb -0.11 -2.88 -0.03 0.00 0.50 0.00 0.00 46.19 43.66 3lpk s LEU 295 CO 0.50 -0.63 0.01 -0.13 -1.32 0.00 0.00 176.35 174.78 3lpk s ARG 296 N 2.84 3.69 0.08 1.98 0.52 0.09 -1.62 118.95 126.52 3lpk s ARG 296 Ca 0.27 -0.42 0.10 0.00 -0.52 0.00 0.00 55.73 55.16 3lpk s ARG 296 Cb -0.14 -3.02 -0.03 0.00 0.52 0.00 0.00 34.95 32.27 3lpk s ARG 296 CO 0.15 0.34 -0.26 -0.51 0.02 0.00 0.00 175.30 175.05 3lpk s LEU 297 N 0.13 2.24 0.34 2.53 1.43 0.18 -0.50 118.68 125.02 3lpk s LEU 297 Ca 0.02 -0.66 -0.27 0.00 -1.03 0.00 0.00 54.13 52.19 3lpk s LEU 297 Cb -0.13 -1.20 -0.12 0.00 0.03 0.00 0.00 46.19 44.76 3lpk s LEU 297 CO 0.02 0.20 1.17 -2.65 0.23 0.00 0.00 176.35 175.32 3lpk n PRO 298 N 1.38 1.78 -0.27 1.29 -0.02 -1.26 -0.07 135.00 137.83 3lpk n PRO 298 Ca -0.18 0.63 -0.06 0.00 -2.02 0.00 0.00 63.50 61.88 3lpk n PRO 298 Cb 0.53 -2.15 -0.04 0.00 -0.02 0.00 0.00 33.50 31.81 3lpk n PRO 298 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3lpk n LYS 299 N 0.52 -0.25 -0.36 -0.52 4.81 -0.91 -0.14 118.16 121.30 3lpk n LYS 299 Ca 0.07 0.98 -0.03 0.00 -0.87 0.00 0.00 58.31 58.46 3lpk n LYS 299 Cb 0.35 -1.45 0.10 0.00 0.02 0.00 0.00 35.03 34.06 3lpk n LYS 299 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 3lpk h LYS 300 N 0.00 1.30 -0.22 1.64 3.64 -1.91 -1.48 116.57 119.54 3lpk h LYS 300 Ca 0.13 -0.10 -0.17 0.00 -1.27 0.00 0.00 60.65 59.24 3lpk h LYS 300 Cb 0.29 -0.28 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3lpk h LYS 300 CO -0.62 0.89 -0.52 0.28 -2.27 0.00 0.00 179.45 177.21 3lpk h VAL 301 N 1.33 1.30 -0.31 2.00 2.07 -1.09 -2.80 116.25 118.74 3lpk h VAL 301 Ca 0.35 -1.73 0.04 0.00 0.82 0.00 0.00 66.70 66.18 3lpk h VAL 301 Cb -0.09 1.81 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 3lpk h VAL 301 CO -0.07 0.55 0.09 0.15 0.02 0.00 0.00 177.57 178.31 3lpk h PHE 302 N 0.47 0.16 -0.78 1.57 3.57 -0.19 0.22 116.94 121.96 3lpk h PHE 302 Ca -0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 3lpk h PHE 302 Cb 1.13 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.81 3lpk h PHE 302 CO 0.09 0.06 0.46 0.93 -2.23 0.00 0.00 178.31 177.62 3lpk h GLU 303 N 0.22 1.07 -0.38 1.11 5.08 -1.29 -0.22 114.58 120.17 3lpk h GLU 303 Ca 0.14 -0.10 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 3lpk h GLU 303 Cb 0.12 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 3lpk h GLU 303 CO -0.16 0.76 -0.15 0.00 -1.00 0.00 0.00 179.01 178.46 3lpk h ALA 304 N 1.25 0.53 -0.39 3.43 0.00 -1.16 -2.34 119.26 120.57 3lpk h ALA 304 Ca 0.28 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3lpk h ALA 304 Cb -0.03 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3lpk h ALA 304 CO -0.05 0.44 0.13 0.00 0.00 0.00 0.00 179.25 179.77 3lpk h ALA 305 N 0.81 0.51 -0.67 0.00 0.00 -0.27 -1.99 119.26 117.65 3lpk h ALA 305 Ca 0.09 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3lpk h ALA 305 Cb 0.69 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3lpk h ALA 305 CO 0.05 0.15 0.27 0.28 0.00 0.00 0.00 179.25 180.00 3lpk h VAL 306 N 0.48 1.24 -0.74 0.00 2.07 -1.03 0.15 116.25 118.42 3lpk h VAL 306 Ca 0.13 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.91 3lpk h VAL 306 Cb 0.24 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 3lpk h VAL 306 CO -0.01 0.30 0.49 0.11 0.02 0.00 0.00 177.57 178.48 3lpk h LYS 307 N 0.95 0.97 -0.29 1.57 1.57 -1.30 0.79 116.57 120.83 3lpk h LYS 307 Ca 0.22 -0.06 -0.12 0.00 -1.87 0.00 0.00 60.65 58.82 3lpk h LYS 307 Cb 0.20 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 3lpk h LYS 307 CO -0.02 0.64 -0.30 1.03 -0.57 0.00 0.00 179.45 180.24 3lpk h SER 308 N 1.00 0.77 -0.21 0.86 0.87 -0.83 -1.34 113.55 114.66 3lpk h SER 308 Ca 0.27 -0.47 -0.07 0.00 -1.23 0.00 0.00 61.79 60.29 3lpk h SER 308 Cb -0.10 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.62 3lpk h SER 308 CO -0.06 1.08 -0.07 0.40 -0.53 0.00 0.00 176.83 177.64 3lpk h ILE 309 N 0.47 1.23 -0.33 2.23 2.04 -0.48 -1.25 117.51 121.42 3lpk h ILE 309 Ca 0.05 -0.97 -0.06 0.00 1.00 0.00 0.00 64.86 64.87 3lpk h ILE 309 Cb 0.87 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 3lpk h ILE 309 CO 0.07 0.32 -0.04 0.11 0.00 0.00 0.00 178.15 178.62 3lpk h LYS 310 N 0.53 0.61 -0.61 2.37 1.57 -0.74 -2.14 116.57 118.15 3lpk h LYS 310 Ca 0.10 -0.21 0.02 0.00 -1.87 0.00 0.00 60.65 58.69 3lpk h LYS 310 Cb 0.45 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.68 3lpk h LYS 310 CO 0.02 0.76 0.39 0.00 -0.57 0.00 0.00 179.45 180.05 3lpk h ALA 311 N 0.83 0.79 -0.03 3.86 0.00 -0.78 -0.55 119.26 123.37 3lpk h ALA 311 Ca 0.09 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3lpk h ALA 311 Cb 0.51 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3lpk h ALA 311 CO 0.02 0.15 -0.40 0.00 0.00 0.00 0.00 179.25 179.03 3lpk h ALA 312 N 1.25 1.27 -0.55 0.00 0.00 -1.16 -3.01 119.26 117.06 3lpk h ALA 312 Ca 0.24 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3lpk h ALA 312 Cb -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3lpk h ALA 312 CO -0.08 0.53 0.00 -1.13 0.00 0.00 0.00 179.25 178.57 3lpk n SER 313 N -4.05 4.58 0.23 0.00 3.41 -0.81 -4.71 113.62 112.27 3lpk n SER 313 Ca -0.02 -2.56 0.11 0.00 -0.26 0.00 0.00 58.87 56.14 3lpk n SER 313 Cb 0.44 -0.55 0.58 0.00 -0.26 0.00 0.00 64.21 64.42 3lpk n SER 313 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3lpk h SER 314 N 3.50 0.00 0.26 4.04 4.64 -0.97 -2.16 113.55 122.86 3lpk h SER 314 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3lpk h SER 314 Cb 1.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.54 3lpk h SER 314 CO 0.24 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.55 3lpk n THR 315 N -2.40 1.33 -3.97 2.95 -2.24 -1.26 -4.45 114.28 104.23 3lpk n THR 315 Ca -0.01 0.43 -0.16 0.00 -2.27 0.00 0.00 64.05 62.04 3lpk n THR 315 Cb 0.29 -1.35 -0.16 0.00 -2.10 0.00 0.00 70.33 67.02 3lpk n THR 315 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3lpk s GLU 316 N -3.16 0.30 -0.13 -0.78 2.02 -0.81 -5.15 118.70 110.99 3lpk s GLU 316 Ca 0.02 0.01 -0.06 0.00 0.02 0.00 0.00 54.97 54.96 3lpk s GLU 316 Cb 0.05 -0.42 -0.04 0.00 0.10 0.00 0.00 34.13 33.83 3lpk s GLU 316 CO 0.18 -0.07 0.09 0.15 0.02 0.00 0.00 175.26 175.63 3lpk s LYS 317 N 0.66 3.47 0.12 1.61 -0.14 -1.26 -4.95 119.74 119.25 3lpk s LYS 317 Ca -0.07 -0.24 0.10 0.00 -1.36 0.00 0.00 55.97 54.40 3lpk s LYS 317 Cb -0.10 -3.11 -0.04 0.00 -1.68 0.00 0.00 37.83 32.90 3lpk s LYS 317 CO -0.01 0.64 -0.25 -0.06 -0.76 0.00 0.00 175.35 174.90 3lpk s PHE 318 N -0.64 2.17 0.78 3.18 0.40 -1.26 -5.13 117.98 117.47 3lpk s PHE 318 Ca 0.12 -0.39 -0.14 0.00 -0.60 0.00 0.00 56.93 55.92 3lpk s PHE 318 Cb -0.12 -1.17 0.07 0.00 0.51 0.00 0.00 43.02 42.31 3lpk s PHE 318 CO 0.02 0.31 1.21 -1.25 0.70 0.00 0.00 175.22 176.22 3lpk s PRO 319 N -2.04 1.81 0.32 0.24 0.04 -1.26 -4.90 135.00 129.22 3lpk s PRO 319 Ca 0.12 1.79 0.03 0.00 0.04 0.00 0.00 61.00 62.97 3lpk s PRO 319 Cb -0.10 -1.79 0.61 0.00 0.04 0.00 0.00 34.50 33.25 3lpk s PRO 319 CO 0.06 -2.09 1.93 -0.44 0.04 0.00 0.00 177.00 176.49 3lpk h ASP 320 N -0.66 0.82 -0.41 6.66 3.32 -2.00 -1.09 116.42 123.06 3lpk h ASP 320 Ca -0.47 0.00 0.12 0.00 0.02 0.00 0.00 57.03 56.70 3lpk h ASP 320 Cb 1.30 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.66 3lpk h ASP 320 CO 0.47 0.53 0.32 1.23 -1.72 0.00 0.00 179.24 180.07 3lpk h GLY 321 N 0.93 0.00 0.60 2.75 0.00 -1.94 -1.27 103.07 104.14 3lpk h GLY 321 Ca 0.36 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.68 3lpk h GLY 321 CO -0.13 0.00 -0.09 -2.75 0.00 0.00 0.00 176.54 173.57 3lpk h PHE 322 N 0.00 -0.23 0.00 5.60 3.57 -1.37 -1.62 116.94 122.89 3lpk h PHE 322 Ca 0.19 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.69 3lpk h PHE 322 Cb 0.83 0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.64 3lpk h PHE 322 CO 0.00 0.14 0.00 -1.49 -2.23 0.00 0.00 178.31 174.73 3lpk h TRP 323 N -0.66 0.00 -0.03 0.41 4.06 -1.33 0.91 115.95 119.32 3lpk h TRP 323 Ca -0.03 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.92 3lpk h TRP 323 Cb 0.47 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.63 3lpk h TRP 323 CO 0.05 0.00 0.00 1.28 -3.56 0.00 0.00 178.44 176.21 3lpk n LEU 324 N -2.64 1.03 -0.31 -4.49 4.77 -0.57 -4.90 117.00 109.89 3lpk n LEU 324 Ca -0.01 -0.36 -0.04 0.00 -0.03 0.00 0.00 56.01 55.57 3lpk n LEU 324 Cb 0.14 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.20 3lpk n LEU 324 CO 0.18 0.18 -0.04 0.61 -1.33 0.00 0.00 177.39 176.99 3lpk n GLY 325 N 1.10 0.59 0.13 -0.72 0.00 0.31 -4.88 105.19 101.72 3lpk n GLY 325 Ca 0.20 -0.17 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 3lpk n GLY 325 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3lpk n GLU 326 N -1.44 0.66 -4.16 1.61 1.02 -0.81 -4.75 120.64 112.77 3lpk n GLU 326 Ca -0.04 0.27 -0.29 0.00 -0.02 0.00 0.00 57.16 57.08 3lpk n GLU 326 Cb 0.31 -1.61 -0.08 0.00 -0.02 0.00 0.00 31.44 30.04 3lpk n GLU 326 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 3lpk s GLN 327 N -2.51 2.45 0.51 3.49 -2.07 -0.67 -5.00 119.66 115.86 3lpk s GLN 327 Ca -0.31 -0.95 -0.05 0.00 -1.82 0.00 0.00 55.36 52.24 3lpk s GLN 327 Cb 0.09 -2.45 -0.02 0.00 -1.09 0.00 0.00 33.01 29.54 3lpk s GLN 327 CO 0.63 0.51 0.81 -0.48 -1.32 0.00 0.00 175.29 175.44 3lpk s LEU 328 N -2.51 3.49 -0.01 2.60 0.05 -1.26 -4.24 118.68 116.81 3lpk s LEU 328 Ca 0.26 0.77 0.05 0.00 0.05 0.00 0.00 54.13 55.26 3lpk s LEU 328 Cb -0.11 -3.67 -0.01 0.00 -2.05 0.00 0.00 46.19 40.35 3lpk s LEU 328 CO 0.18 -0.76 -0.18 -0.69 -0.55 0.00 0.00 176.35 174.35 3lpk s VAL 329 N -2.80 1.39 0.14 1.48 1.01 -0.49 -4.95 120.40 116.18 3lpk s VAL 329 Ca 0.50 -0.77 0.07 0.00 0.00 0.00 0.00 61.98 61.77 3lpk s VAL 329 Cb -0.10 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 3lpk s VAL 329 CO 0.44 0.38 -0.16 0.00 0.00 0.00 0.00 175.10 175.76 3lpk s TRP 331 N -2.06 0.73 0.48 0.00 0.51 -0.49 -4.97 118.94 113.13 3lpk s TRP 331 Ca 0.11 -0.68 -0.23 0.00 -2.12 0.00 0.00 56.10 53.18 3lpk s TRP 331 Cb -0.05 -0.44 -0.08 0.00 -0.81 0.00 0.00 33.47 32.09 3lpk s TRP 331 CO 0.04 -0.13 1.11 0.94 -0.51 0.00 0.00 176.95 178.41 3lpk n GLN 332 N 0.86 1.45 -1.67 4.98 7.27 -1.26 -1.06 117.38 127.94 3lpk n GLN 332 Ca -0.19 0.53 -0.63 0.00 0.07 0.00 0.00 57.00 56.78 3lpk n GLN 332 Cb 0.57 -2.23 -0.09 0.00 2.41 0.00 0.00 30.24 30.91 3lpk n GLN 332 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3lpk n ALA 333 N -0.75 -1.76 -0.44 1.69 0.00 -1.24 -0.97 120.51 117.04 3lpk n ALA 333 Ca 0.10 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.05 3lpk n ALA 333 Cb 0.42 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.93 3lpk n ALA 333 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3lpk n GLY 334 N 3.28 2.09 1.18 0.00 0.00 -1.26 -4.90 105.19 105.57 3lpk n GLY 334 Ca 0.27 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.39 3lpk n GLY 334 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3lpk n THR 335 N -2.00 0.80 -1.67 2.61 -2.24 -0.14 -4.97 114.28 106.66 3lpk n THR 335 Ca 0.00 -0.84 -0.54 0.00 -2.27 0.00 0.00 64.05 60.41 3lpk n THR 335 Cb 0.00 0.51 -0.06 0.00 -2.10 0.00 0.00 70.33 68.68 3lpk n THR 335 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3lpk n THR 336 N 1.39 0.26 -1.25 4.28 -1.04 -1.26 -4.80 114.28 111.86 3lpk n THR 336 Ca 0.21 -0.05 -0.35 0.00 -2.04 0.00 0.00 64.05 61.83 3lpk n THR 336 Cb 0.55 -1.28 -0.05 0.00 -1.82 0.00 0.00 70.33 67.74 3lpk n THR 336 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3lpk n PRO 337 N 4.78 3.43 -0.31 -2.82 -0.04 -1.26 -4.75 135.00 134.03 3lpk n PRO 337 Ca 0.23 -2.02 0.15 0.00 -0.04 0.00 0.00 63.50 61.82 3lpk n PRO 337 Cb 0.19 -2.69 0.32 0.00 -0.04 0.00 0.00 33.50 31.28 3lpk n PRO 337 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3lpk h TRP 338 N 4.83 0.39 -0.01 0.54 4.06 -1.95 -1.20 115.95 122.60 3lpk h TRP 338 Ca 0.78 0.05 0.00 0.00 2.06 0.00 0.00 58.89 61.78 3lpk h TRP 338 Cb 0.42 -0.02 -0.00 0.00 -1.00 0.00 0.00 29.16 28.55 3lpk h TRP 338 CO 1.88 -0.24 0.03 -2.95 -3.56 0.00 0.00 178.44 173.59 3lpk h ASN 339 N 0.19 0.00 1.40 -3.49 7.08 -2.00 -1.89 115.58 116.86 3lpk h ASN 339 Ca 0.59 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.81 3lpk h ASN 339 Cb 1.23 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.47 3lpk h ASN 339 CO -0.68 0.00 -0.24 0.16 -2.08 0.00 0.00 177.43 174.58 3lpk h ILE 340 N 0.00 0.00 -3.19 6.14 3.07 -1.58 -3.44 117.51 118.51 3lpk h ILE 340 Ca 0.00 -0.64 -0.58 0.00 1.55 0.00 0.00 64.86 65.19 3lpk h ILE 340 Cb 0.05 1.49 -0.05 0.00 -0.27 0.00 0.00 36.82 38.05 3lpk h ILE 340 CO -0.00 0.00 -0.07 -0.36 -1.05 0.00 0.00 178.15 176.67 3lpk s PHE 341 N -3.16 3.79 0.56 0.16 0.08 -0.71 -3.47 117.98 115.23 3lpk s PHE 341 Ca 0.08 1.21 -0.10 0.00 0.12 0.00 0.00 56.93 58.23 3lpk s PHE 341 Cb 0.11 -2.45 -0.05 0.00 -0.57 0.00 0.00 43.02 40.06 3lpk s PHE 341 CO 0.66 0.60 0.96 -1.25 -0.10 0.00 0.00 175.22 176.09 3lpk s PRO 342 N -1.11 3.64 0.40 0.24 0.04 -1.26 -4.83 135.00 132.12 3lpk s PRO 342 Ca 0.28 0.64 -0.09 0.00 0.04 0.00 0.00 61.00 61.87 3lpk s PRO 342 Cb -0.19 -2.17 -0.06 0.00 0.04 0.00 0.00 34.50 32.12 3lpk s PRO 342 CO 0.18 -0.42 0.74 0.14 0.04 0.00 0.00 177.00 177.68 3lpk s VAL 343 N -2.97 4.84 -0.12 -0.36 -7.23 -1.26 -4.35 120.40 108.95 3lpk s VAL 343 Ca 0.54 0.47 0.03 0.00 -1.81 0.00 0.00 61.98 61.21 3lpk s VAL 343 Cb -0.11 -3.75 0.01 0.00 0.56 0.00 0.00 36.38 33.09 3lpk s VAL 343 CO 0.48 -0.54 -0.22 -0.63 -0.31 0.00 0.00 175.10 173.87 3lpk s ILE 344 N -2.38 2.02 -0.14 -0.62 1.01 0.09 -0.92 121.20 120.26 3lpk s ILE 344 Ca 0.50 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 60.16 3lpk s ILE 344 Cb -0.10 -1.77 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 3lpk s ILE 344 CO 0.33 0.55 -0.12 -0.44 0.00 0.00 0.00 174.94 175.26 3lpk s SER 345 N 0.59 4.09 -0.24 3.58 0.01 -0.38 0.06 113.70 121.42 3lpk s SER 345 Ca -0.13 -0.31 -0.02 0.00 1.31 0.00 0.00 55.95 56.80 3lpk s SER 345 Cb -0.17 -1.63 0.02 0.00 0.21 0.00 0.00 66.02 64.45 3lpk s SER 345 CO 0.03 0.16 -0.07 -0.76 0.41 0.00 0.00 173.24 173.02 3lpk s LEU 346 N 0.40 3.02 -0.06 2.44 1.43 -0.32 -1.45 118.68 124.15 3lpk s LEU 346 Ca -0.09 -0.71 -0.20 0.00 -1.03 0.00 0.00 54.13 52.09 3lpk s LEU 346 Cb -0.16 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 3lpk s LEU 346 CO 0.05 -0.09 0.58 -0.31 0.23 0.00 0.00 176.35 176.82 3lpk s TYR 347 N 1.37 3.60 0.11 0.29 1.51 0.20 -1.48 117.35 122.94 3lpk s TYR 347 Ca 0.02 1.11 0.09 0.00 -1.01 0.00 0.00 57.07 57.28 3lpk s TYR 347 Cb -0.16 -2.64 -0.04 0.00 -0.11 0.00 0.00 41.96 39.01 3lpk s TYR 347 CO -0.05 0.22 -0.17 -0.51 -1.11 0.00 0.00 175.55 173.93 3lpk s LEU 348 N 0.33 2.71 0.31 -1.29 1.43 0.58 -1.02 118.68 121.74 3lpk s LEU 348 Ca 0.31 -0.53 -0.30 0.00 -1.03 0.00 0.00 54.13 52.59 3lpk s LEU 348 Cb -0.17 -1.56 -0.11 0.00 0.03 0.00 0.00 46.19 44.38 3lpk s LEU 348 CO 0.15 0.19 1.57 -0.32 0.23 0.00 0.00 176.35 178.17 3lpk s MET 349 N -2.05 4.12 0.57 1.70 -2.45 -0.90 -2.03 119.30 118.26 3lpk s MET 349 Ca 0.18 2.58 -0.01 0.00 -1.25 0.00 0.00 55.69 57.19 3lpk s MET 349 Cb -0.11 -3.01 0.12 0.00 1.25 0.00 0.00 34.83 33.08 3lpk s MET 349 CO 0.10 -0.62 0.79 0.41 1.05 0.00 0.00 175.02 176.75 3lpk n GLY 350 N 1.77 0.57 0.12 2.11 0.00 0.69 -4.01 105.19 106.44 3lpk n GLY 350 Ca 0.07 -2.00 0.12 0.00 0.00 0.00 0.00 46.02 44.21 3lpk n GLY 350 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3lpk h GLU 351 N 0.00 0.00 -6.13 1.61 5.08 -1.79 -3.41 114.58 109.93 3lpk h GLU 351 Ca -0.26 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.51 3lpk h GLU 351 Cb 0.95 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.15 3lpk h GLU 351 CO 0.27 0.00 -0.25 0.08 -1.00 0.00 0.00 179.01 178.11 3lpk s VAL 352 N -3.25 5.10 0.27 3.13 1.01 -1.26 -5.04 120.40 120.35 3lpk s VAL 352 Ca 0.04 0.39 -0.31 0.00 0.00 0.00 0.00 61.98 62.10 3lpk s VAL 352 Cb 0.10 -3.64 -0.12 0.00 0.00 0.00 0.00 36.38 32.71 3lpk s VAL 352 CO 0.73 0.23 1.51 0.41 0.00 0.00 0.00 175.10 177.99 3lpk n THR 353 N 0.73 0.99 -2.00 3.92 -1.04 -1.26 -2.09 114.28 113.53 3lpk n THR 353 Ca -0.07 -0.25 -0.18 0.00 -2.04 0.00 0.00 64.05 61.52 3lpk n THR 353 Cb 0.52 -1.75 -0.04 0.00 -1.82 0.00 0.00 70.33 67.24 3lpk n THR 353 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3lpk n ASN 354 N 2.17 -4.95 -4.23 8.00 3.02 -1.26 -4.97 115.26 113.04 3lpk n ASN 354 Ca 0.10 0.23 -0.29 0.00 -0.03 0.00 0.00 54.58 54.60 3lpk n ASN 354 Cb 0.34 -4.28 -0.16 0.00 -0.61 0.00 0.00 39.78 35.08 3lpk n ASN 354 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3lpk s GLN 355 N -4.34 2.00 0.22 3.52 0.74 -0.89 -1.06 119.66 119.86 3lpk s GLN 355 Ca 0.00 -0.79 0.01 0.00 0.05 0.00 0.00 55.36 54.63 3lpk s GLN 355 Cb 0.00 -1.82 -0.05 0.00 1.10 0.00 0.00 33.01 32.25 3lpk s GLN 355 CO 0.00 0.40 0.08 -1.54 -0.55 0.00 0.00 175.29 173.68 3lpk s SER 356 N -0.30 0.98 0.21 6.67 1.04 -0.37 -0.23 113.70 121.71 3lpk s SER 356 Ca 0.03 -1.33 -0.00 0.00 0.48 0.00 0.00 55.95 55.12 3lpk s SER 356 Cb -0.11 0.20 -0.04 0.00 0.10 0.00 0.00 66.02 66.17 3lpk s SER 356 CO 0.01 -0.71 0.13 0.72 0.98 0.00 0.00 173.24 174.36 3lpk s PHE 357 N -3.81 1.25 0.07 5.02 -0.12 -0.86 -0.46 117.98 119.06 3lpk s PHE 357 Ca 0.34 -1.34 0.04 0.00 -0.05 0.00 0.00 56.93 55.92 3lpk s PHE 357 Cb 0.07 -0.63 -0.03 0.00 -0.63 0.00 0.00 43.02 41.80 3lpk s PHE 357 CO 0.11 -0.58 -0.12 -0.98 -0.05 0.00 0.00 175.22 173.60 3lpk s ARG 358 N -4.12 0.75 -0.07 1.99 1.70 0.82 -0.30 118.95 119.71 3lpk s ARG 358 Ca 0.39 -0.94 0.04 0.00 -0.47 0.00 0.00 55.73 54.75 3lpk s ARG 358 Cb 0.07 -0.64 -0.01 0.00 -0.57 0.00 0.00 34.95 33.80 3lpk s ARG 358 CO 0.13 0.13 -0.20 0.96 -1.08 0.00 0.00 175.30 175.23 3lpk s ILE 359 N -1.52 2.48 -0.11 4.99 -4.36 -0.55 -1.04 121.20 121.09 3lpk s ILE 359 Ca -0.03 -0.91 0.01 0.00 -0.26 0.00 0.00 60.65 59.47 3lpk s ILE 359 Cb -0.09 -1.95 -0.01 0.00 1.25 0.00 0.00 42.46 41.66 3lpk s ILE 359 CO 0.01 0.57 -0.15 -0.89 0.24 0.00 0.00 174.94 174.72 3lpk s THR 360 N -0.19 2.88 -0.06 8.37 2.01 0.10 -1.18 115.64 127.58 3lpk s THR 360 Ca -0.02 -0.73 0.01 0.00 0.31 0.00 0.00 61.69 61.26 3lpk s THR 360 Cb -0.13 -2.18 -0.03 0.00 0.01 0.00 0.00 72.50 70.16 3lpk s THR 360 CO 0.03 0.54 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.80 3lpk s ILE 361 N 0.22 3.70 0.33 1.82 1.01 0.11 -2.58 121.20 125.81 3lpk s ILE 361 Ca -0.10 -0.53 0.07 0.00 0.00 0.00 0.00 60.65 60.10 3lpk s ILE 361 Cb -0.16 -2.53 -0.01 0.00 0.01 0.00 0.00 42.46 39.77 3lpk s ILE 361 CO 0.06 0.56 0.44 -0.76 0.00 0.00 0.00 174.94 175.24 3lpk s LEU 362 N -0.91 3.93 0.61 2.97 1.43 -1.26 -0.73 118.68 124.72 3lpk s LEU 362 Ca 0.13 -0.23 0.39 0.00 -1.03 0.00 0.00 54.13 53.39 3lpk s LEU 362 Cb -0.11 -2.67 2.00 0.00 0.03 0.00 0.00 46.19 45.44 3lpk s LEU 362 CO 0.02 -0.41 2.23 1.55 0.23 0.00 0.00 176.35 179.98 3lpk h PRO 363 N 0.96 0.00 0.00 1.29 0.13 -1.88 0.19 132.00 132.69 3lpk h PRO 363 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3lpk h PRO 363 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3lpk h PRO 363 CO 0.54 0.02 0.00 1.96 -0.23 0.00 0.00 178.00 180.29 3lpk h GLN 364 N 0.00 0.00 0.01 0.86 7.50 -1.87 0.13 115.11 121.74 3lpk h GLN 364 Ca -0.00 0.00 -0.37 0.00 0.50 0.00 0.00 58.65 58.77 3lpk h GLN 364 Cb 0.17 0.00 -0.05 0.00 0.05 0.00 0.00 27.48 27.65 3lpk h GLN 364 CO 0.00 0.00 -2.07 1.04 -1.50 0.00 0.00 178.83 176.30 3lpk n GLN 365 N -2.62 0.59 0.00 1.46 3.00 0.64 -4.54 117.38 115.91 3lpk n GLN 365 Ca -0.01 0.36 0.15 0.00 -0.01 0.00 0.00 57.00 57.49 3lpk n GLN 365 Cb 0.11 -1.59 0.71 0.00 0.00 0.00 0.00 30.24 29.47 3lpk n GLN 365 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.06 179.54 3lpk n TYR 366 N -4.20 0.00 -3.72 1.08 0.18 -0.98 -4.48 117.16 105.04 3lpk n TYR 366 Ca -0.45 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 58.95 3lpk n TYR 366 Cb 0.83 -0.13 -0.12 0.00 -0.38 0.00 0.00 39.34 39.54 3lpk n TYR 366 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3lpk s LEU 367 N -2.31 4.52 -0.22 -3.48 1.43 0.45 -0.00 118.68 119.06 3lpk s LEU 367 Ca 0.35 -1.23 -0.24 0.00 -1.03 0.00 0.00 54.13 51.97 3lpk s LEU 367 Cb 0.21 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.52 3lpk s LEU 367 CO 0.43 -0.37 0.81 -0.60 0.23 0.00 0.00 176.35 176.85 3lpk s ARG 368 N 1.40 4.22 0.29 1.70 3.52 0.59 -4.77 118.95 125.89 3lpk s ARG 368 Ca -0.00 0.93 -0.30 0.00 -0.13 0.00 0.00 55.73 56.23 3lpk s ARG 368 Cb -0.20 -3.62 -0.11 0.00 -1.56 0.00 0.00 34.95 29.46 3lpk s ARG 368 CO 0.03 -0.44 1.51 -2.14 -0.81 0.00 0.00 175.30 173.45 3lpk s PRO 369 N 2.57 4.19 0.01 5.12 0.02 -1.26 -0.92 135.00 144.72 3lpk s PRO 369 Ca 0.35 2.46 -0.05 0.00 0.02 0.00 0.00 61.00 63.79 3lpk s PRO 369 Cb -0.16 -3.05 -0.01 0.00 0.02 0.00 0.00 34.50 31.31 3lpk s PRO 369 CO 0.09 -0.52 0.07 0.14 -0.33 0.00 0.00 177.00 176.45 3lpk s VAL 370 N -0.17 0.09 0.09 3.83 -7.23 -0.78 -4.70 120.40 111.54 3lpk s VAL 370 Ca 0.60 -0.76 -0.30 0.00 -1.81 0.00 0.00 61.98 59.71 3lpk s VAL 370 Cb -0.45 -0.36 -0.05 0.00 0.56 0.00 0.00 36.38 36.07 3lpk s VAL 370 CO 0.48 -0.42 1.03 -0.70 -0.31 0.00 0.00 175.10 175.18 3lpk s GLU 371 N -1.39 4.61 0.65 4.82 2.56 -1.26 -4.06 118.70 124.62 3lpk s GLU 371 Ca -0.15 1.55 -0.18 0.00 0.00 0.00 0.00 54.97 56.19 3lpk s GLU 371 Cb -0.08 -3.37 -0.01 0.00 2.00 0.00 0.00 34.13 32.66 3lpk s GLU 371 CO 0.01 0.06 1.26 -3.47 -0.56 0.00 0.00 175.26 172.55 3lpk n ASP 372 N 3.11 1.92 0.32 -1.70 2.03 -1.26 -4.86 116.55 116.11 3lpk n ASP 372 Ca 0.04 0.82 0.20 0.00 0.52 0.00 0.00 54.79 56.37 3lpk n ASP 372 Cb 0.49 -1.54 1.08 0.00 -0.72 0.00 0.00 41.12 40.43 3lpk n ASP 372 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 3lpk h VAL 373 N 0.50 0.21 -0.54 5.18 2.07 -1.99 0.05 116.25 121.73 3lpk h VAL 373 Ca -0.51 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 66.97 3lpk h VAL 373 Cb 1.34 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 3lpk h VAL 373 CO 0.53 0.01 0.00 0.00 0.02 0.00 0.00 177.57 178.12 3lpk n ALA 374 N -2.17 2.39 -1.12 1.67 0.00 -1.26 -4.93 120.51 115.09 3lpk n ALA 374 Ca -0.03 -1.14 -0.09 0.00 0.00 0.00 0.00 53.44 52.19 3lpk n ALA 374 Cb 0.09 -0.86 -0.04 0.00 0.00 0.00 0.00 19.45 18.64 3lpk n ALA 374 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3lpk n THR 375 N 1.50 0.00 -0.14 0.00 -1.04 0.00 -4.90 114.28 109.71 3lpk n THR 375 Ca 0.21 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 62.12 3lpk n THR 375 Cb 0.60 -1.05 0.09 0.00 -1.82 0.00 0.00 70.33 68.15 3lpk n THR 375 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 3lpk n SER 376 N -0.18 -2.44 -1.18 8.00 3.41 -1.26 -4.90 113.62 115.07 3lpk n SER 376 Ca -0.09 -0.28 0.11 0.00 -0.26 0.00 0.00 58.87 58.35 3lpk n SER 376 Cb 0.40 -0.36 0.28 0.00 -0.26 0.00 0.00 64.21 64.27 3lpk n SER 376 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3lpk n GLN 377 N -2.52 2.48 -2.20 4.33 6.02 -1.26 -4.85 117.38 119.39 3lpk n GLN 377 Ca 0.04 -2.29 -0.34 0.00 -0.01 0.00 0.00 57.00 54.40 3lpk n GLN 377 Cb 0.19 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.95 3lpk n GLN 377 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3lpk s ASP 378 N -1.07 5.83 -0.32 1.08 1.01 -1.26 -3.69 116.67 118.26 3lpk s ASP 378 Ca 0.43 1.97 -0.14 0.00 0.71 0.00 0.00 52.55 55.51 3lpk s ASP 378 Cb 0.22 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.58 3lpk s ASP 378 CO 0.30 -1.13 0.32 -1.81 0.21 0.00 0.00 175.17 173.05 3lpk s ASP 379 N -2.27 6.15 0.22 0.27 -0.00 -0.23 -4.77 116.67 116.06 3lpk s ASP 379 Ca 0.67 -0.14 0.11 0.00 -0.00 0.00 0.00 52.55 53.20 3lpk s ASP 379 Cb -0.19 -2.18 -0.05 0.00 -0.00 0.00 0.00 42.92 40.51 3lpk s ASP 379 CO 0.30 -0.25 -0.17 0.00 -0.00 0.00 0.00 175.17 175.05 3lpk s TYR 381 N -2.01 0.17 0.06 0.00 1.51 -0.09 -1.86 117.35 115.13 3lpk s TYR 381 Ca 0.26 -0.53 0.08 0.00 -1.01 0.00 0.00 57.07 55.87 3lpk s TYR 381 Cb -0.07 0.10 -0.03 0.00 -0.11 0.00 0.00 41.96 41.85 3lpk s TYR 381 CO 0.14 -0.76 -0.24 0.15 -1.11 0.00 0.00 175.55 173.74 3lpk s LYS 382 N -3.91 1.54 -0.28 -0.62 1.02 -0.10 -1.40 119.74 115.99 3lpk s LYS 382 Ca 0.12 -1.06 -0.29 0.00 0.02 0.00 0.00 55.97 54.76 3lpk s LYS 382 Cb 0.02 -1.72 -0.01 0.00 -0.52 0.00 0.00 37.83 35.60 3lpk s LYS 382 CO -0.03 0.44 1.46 0.12 -0.92 0.00 0.00 175.35 176.41 3lpk s PHE 383 N -0.85 2.39 -0.41 3.18 5.36 -1.26 -0.30 117.98 126.09 3lpk s PHE 383 Ca 0.10 0.71 0.01 0.00 -0.96 0.00 0.00 56.93 56.78 3lpk s PHE 383 Cb -0.09 -3.99 0.41 0.00 -0.34 0.00 0.00 43.02 39.00 3lpk s PHE 383 CO 0.02 -2.27 1.86 0.00 -1.46 0.00 0.00 175.22 173.37 3lpk n ALA 384 N 8.17 5.26 -3.62 11.12 0.00 1.00 -4.38 120.51 138.06 3lpk n ALA 384 Ca 0.17 -2.34 -0.28 0.00 0.00 0.00 0.00 53.44 50.99 3lpk n ALA 384 Cb 0.46 -1.45 -0.17 0.00 0.00 0.00 0.00 19.45 18.29 3lpk n ALA 384 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3lpk s ILE 385 N -2.99 1.49 0.19 0.00 1.01 -1.26 -1.40 121.20 118.25 3lpk s ILE 385 Ca 0.45 -0.65 -0.01 0.00 0.00 0.00 0.00 60.65 60.44 3lpk s ILE 385 Cb 0.36 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 3lpk s ILE 385 CO 0.04 0.44 0.11 -0.94 0.00 0.00 0.00 174.94 174.59 3lpk s SER 386 N 0.93 0.28 0.34 3.58 1.04 -0.64 -4.71 113.70 114.52 3lpk s SER 386 Ca -0.08 -1.36 -0.26 0.00 0.48 0.00 0.00 55.95 54.74 3lpk s SER 386 Cb -0.15 0.34 -0.10 0.00 0.10 0.00 0.00 66.02 66.22 3lpk s SER 386 CO -0.01 -0.81 0.98 -1.58 0.98 0.00 0.00 173.24 172.81 3lpk s GLN 387 N -4.13 4.48 0.06 4.02 0.74 -1.26 -0.65 119.66 122.91 3lpk s GLN 387 Ca 0.36 1.40 0.04 0.00 0.05 0.00 0.00 55.36 57.22 3lpk s GLN 387 Cb 0.07 -2.75 -0.03 0.00 1.10 0.00 0.00 33.01 31.41 3lpk s GLN 387 CO 0.10 0.16 -0.12 0.45 -0.55 0.00 0.00 175.29 175.34 3lpk s SER 388 N -1.56 1.36 0.00 6.67 0.15 0.90 -4.73 113.70 116.48 3lpk s SER 388 Ca 0.52 -0.57 0.06 0.00 0.70 0.00 0.00 55.95 56.66 3lpk s SER 388 Cb -0.20 -0.02 0.13 0.00 -1.71 0.00 0.00 66.02 64.22 3lpk s SER 388 CO 0.26 -0.11 1.03 -1.54 1.20 0.00 0.00 173.24 174.07 3lpk n SER 389 N 1.44 2.25 -1.62 5.45 3.41 -1.26 -2.14 113.62 121.14 3lpk n SER 389 Ca -0.21 -1.82 -0.03 0.00 -0.26 0.00 0.00 58.87 56.55 3lpk n SER 389 Cb 0.54 -0.09 0.08 0.00 -0.26 0.00 0.00 64.21 64.49 3lpk n SER 389 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3lpk n THR 390 N 0.11 1.58 -0.10 6.66 -2.24 -1.26 -4.87 114.28 114.16 3lpk n THR 390 Ca 0.05 -2.90 0.00 0.00 -2.27 0.00 0.00 64.05 58.94 3lpk n THR 390 Cb 0.30 0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 3lpk n THR 390 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3lpk n GLY 391 N -0.53 -3.39 3.74 3.38 0.00 -1.22 -4.55 105.19 102.62 3lpk n GLY 391 Ca 0.20 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 3lpk n GLY 391 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lpk s THR 392 N -0.94 4.19 -0.25 2.61 2.01 0.13 -4.30 115.64 119.09 3lpk s THR 392 Ca 0.00 1.90 0.02 0.00 0.31 0.00 0.00 61.69 63.92 3lpk s THR 392 Cb 0.00 -4.21 0.06 0.00 0.01 0.00 0.00 72.50 68.36 3lpk s THR 392 CO 0.00 0.33 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.51 3lpk s VAL 393 N -0.30 1.74 -0.95 3.82 1.01 0.34 -1.38 120.40 124.68 3lpk s VAL 393 Ca 0.47 -1.41 -0.20 0.00 0.00 0.00 0.00 61.98 60.84 3lpk s VAL 393 Cb -0.26 -1.98 0.10 0.00 0.00 0.00 0.00 36.38 34.24 3lpk s VAL 393 CO 0.32 -0.12 1.23 -0.04 0.00 0.00 0.00 175.10 176.49 3lpk s MET 394 N 1.29 3.59 0.14 2.72 -1.94 0.09 -0.73 119.30 124.45 3lpk s MET 394 Ca -0.06 -1.54 -0.02 0.00 -1.71 0.00 0.00 55.69 52.37 3lpk s MET 394 Cb -0.19 -5.05 0.03 0.00 2.01 0.00 0.00 34.83 31.63 3lpk s MET 394 CO -0.06 -1.92 0.19 0.41 -0.01 0.00 0.00 175.02 173.63 3lpk n GLY 395 N 5.94 -0.89 0.31 -0.03 0.00 -1.01 -1.10 105.19 108.41 3lpk n GLY 395 Ca 0.26 -1.72 0.10 0.00 0.00 0.00 0.00 46.02 44.67 3lpk n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lpk h ALA 396 N -1.74 1.38 0.00 4.61 0.00 -0.11 -1.01 119.26 122.38 3lpk h ALA 396 Ca -0.06 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3lpk h ALA 396 Cb 0.18 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3lpk h ALA 396 CO 0.05 -0.19 -0.13 -0.39 0.00 0.00 0.00 179.25 178.59 3lpk h VAL 397 N 0.55 0.92 0.18 0.00 -1.51 -1.44 0.36 116.25 115.30 3lpk h VAL 397 Ca 0.51 -0.47 -0.24 0.00 -1.23 0.00 0.00 66.70 65.27 3lpk h VAL 397 Cb 0.84 1.27 0.03 0.00 -2.13 0.00 0.00 31.29 31.30 3lpk h VAL 397 CO -0.43 0.13 -1.05 0.40 -1.23 0.00 0.00 177.57 175.39 3lpk h ILE 398 N 0.00 1.42 0.00 7.19 1.08 -1.48 -3.30 117.51 122.43 3lpk h ILE 398 Ca -0.00 -2.58 -0.02 0.00 -0.39 0.00 0.00 64.86 61.87 3lpk h ILE 398 Cb 0.26 3.14 -0.00 0.00 -3.07 0.00 0.00 36.82 37.14 3lpk h ILE 398 CO 0.02 0.75 -0.09 0.24 -0.69 0.00 0.00 178.15 178.37 3lpk h MET 399 N -0.21 0.00 0.00 2.37 2.86 -0.77 -2.37 114.93 116.81 3lpk h MET 399 Ca -0.19 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 3lpk h MET 399 Cb 1.81 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.47 3lpk h MET 399 CO 0.19 0.09 0.00 0.93 1.06 0.00 0.00 176.91 179.18 3lpk h GLU 400 N 0.00 0.00 0.00 1.72 5.08 -1.02 -1.66 114.58 118.70 3lpk h GLU 400 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3lpk h GLU 400 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3lpk h GLU 400 CO 0.01 0.00 -0.50 0.41 -1.00 0.00 0.00 179.01 177.93 3lpk n GLY 401 N -0.73 -1.37 3.20 -3.84 0.00 -0.89 -4.28 105.19 97.27 3lpk n GLY 401 Ca -0.01 -0.27 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 3lpk n GLY 401 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3lpk s PHE 402 N -3.09 1.04 -0.25 1.61 0.40 -0.63 -1.91 117.98 115.17 3lpk s PHE 402 Ca 0.09 -1.08 -0.14 0.00 -0.60 0.00 0.00 56.93 55.20 3lpk s PHE 402 Cb 0.15 -0.60 -0.04 0.00 0.51 0.00 0.00 43.02 43.05 3lpk s PHE 402 CO 0.69 -0.31 0.34 -0.47 0.70 0.00 0.00 175.22 176.18 3lpk s TYR 403 N -3.78 3.29 -0.19 0.36 5.04 0.52 -4.48 117.35 118.10 3lpk s TYR 403 Ca 0.22 0.43 -0.02 0.00 -2.44 0.00 0.00 57.07 55.26 3lpk s TYR 403 Cb 0.07 -2.51 -0.00 0.00 0.35 0.00 0.00 41.96 39.86 3lpk s TYR 403 CO 0.02 -0.13 -0.11 0.08 -1.34 0.00 0.00 175.55 174.07 3lpk s VAL 404 N 1.72 2.87 -0.37 3.14 1.01 -0.45 -2.06 120.40 126.27 3lpk s VAL 404 Ca 0.15 -0.67 -0.13 0.00 0.00 0.00 0.00 61.98 61.33 3lpk s VAL 404 Cb -0.15 -2.26 0.01 0.00 0.00 0.00 0.00 36.38 33.97 3lpk s VAL 404 CO 0.09 0.48 0.24 -0.69 0.00 0.00 0.00 175.10 175.22 3lpk s VAL 405 N 1.22 5.03 -1.07 2.92 1.01 0.01 -0.08 120.40 129.44 3lpk s VAL 405 Ca 0.02 -0.56 -0.16 0.00 0.00 0.00 0.00 61.98 61.29 3lpk s VAL 405 Cb -0.14 -3.71 0.16 0.00 0.00 0.00 0.00 36.38 32.68 3lpk s VAL 405 CO -0.05 -0.17 1.26 -0.36 0.00 0.00 0.00 175.10 175.79 3lpk s PHE 406 N 1.65 3.39 -1.29 5.22 0.08 0.83 -0.64 117.98 127.22 3lpk s PHE 406 Ca 0.05 -1.84 -0.17 0.00 0.12 0.00 0.00 56.93 55.09 3lpk s PHE 406 Cb -0.18 -4.26 0.09 0.00 -0.57 0.00 0.00 43.02 38.10 3lpk s PHE 406 CO 0.09 -1.40 1.71 -3.47 -0.10 0.00 0.00 175.22 172.05 3lpk n ASP 407 N 5.83 4.94 -0.27 1.36 -0.08 -0.38 -2.65 116.55 125.31 3lpk n ASP 407 Ca 0.30 -2.93 -0.03 0.00 -1.51 0.00 0.00 54.79 50.62 3lpk n ASP 407 Cb 0.45 -1.71 0.13 0.00 2.34 0.00 0.00 41.12 42.34 3lpk n ASP 407 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 3lpk h ARG 408 N 7.39 1.13 -0.88 -0.67 3.08 -1.76 -1.02 114.38 121.64 3lpk h ARG 408 Ca 0.43 -0.15 0.08 0.00 0.07 0.00 0.00 59.98 60.41 3lpk h ARG 408 Cb 0.86 -0.21 -0.06 0.00 0.08 0.00 0.00 29.97 30.63 3lpk h ARG 408 CO 1.44 0.85 0.57 0.00 -1.07 0.00 0.00 179.97 181.77 3lpk h ALA 409 N 1.31 1.57 -0.36 0.04 0.00 -1.51 -1.94 119.26 118.38 3lpk h ALA 409 Ca 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3lpk h ALA 409 Cb 0.08 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.63 3lpk h ALA 409 CO -0.04 0.28 0.00 0.54 0.00 0.00 0.00 179.25 180.03 3lpk n ARG 410 N -4.50 3.26 -3.97 0.00 1.74 -1.08 -4.99 116.66 107.12 3lpk n ARG 410 Ca 0.14 -2.73 -0.32 0.00 -0.77 0.00 0.00 57.85 54.18 3lpk n ARG 410 Cb 0.24 -1.79 -0.01 0.00 -1.02 0.00 0.00 32.46 29.88 3lpk n ARG 410 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 3lpk n LYS 411 N 0.04 -1.88 -3.66 5.56 4.81 -0.48 -4.93 118.16 117.62 3lpk n LYS 411 Ca 0.21 0.31 -0.10 0.00 -0.87 0.00 0.00 58.31 57.85 3lpk n LYS 411 Cb 0.84 -3.93 -0.05 0.00 0.02 0.00 0.00 35.03 31.91 3lpk n LYS 411 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 3lpk s ARG 412 N -6.71 1.07 -0.12 1.64 1.70 -0.63 -1.61 118.95 114.29 3lpk s ARG 412 Ca 0.20 -0.74 0.03 0.00 -0.47 0.00 0.00 55.73 54.76 3lpk s ARG 412 Cb -0.09 0.46 0.00 0.00 -0.57 0.00 0.00 34.95 34.76 3lpk s ARG 412 CO 0.92 -0.41 -0.23 0.42 -1.08 0.00 0.00 175.30 174.91 3lpk s ILE 413 N -3.81 2.06 -0.01 4.99 1.01 0.14 -1.25 121.20 124.32 3lpk s ILE 413 Ca 0.04 -1.00 -0.01 0.00 0.00 0.00 0.00 60.65 59.67 3lpk s ILE 413 Cb 0.02 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 3lpk s ILE 413 CO -0.11 0.56 0.10 -0.83 0.00 0.00 0.00 174.94 174.65 3lpk s GLY 414 N 0.52 2.05 -0.03 6.18 0.00 0.19 -0.92 107.32 115.31 3lpk s GLY 414 Ca -0.14 -0.84 0.04 0.00 0.00 0.00 0.00 44.72 43.78 3lpk s GLY 414 CO 0.05 -0.71 -0.15 -1.36 0.00 0.00 0.00 173.10 170.93 3lpk s PHE 415 N -1.20 1.40 0.01 1.90 0.40 0.33 -0.81 117.98 120.02 3lpk s PHE 415 Ca 0.23 -0.34 -0.11 0.00 -0.60 0.00 0.00 56.93 56.10 3lpk s PHE 415 Cb -0.12 -0.94 0.01 0.00 0.51 0.00 0.00 43.02 42.48 3lpk s PHE 415 CO 0.14 -0.10 0.24 0.00 0.70 0.00 0.00 175.22 176.20 3lpk s ALA 416 N -0.07 -0.55 0.18 5.36 0.00 -0.87 -1.13 121.76 124.69 3lpk s ALA 416 Ca -0.00 0.01 -0.32 0.00 0.00 0.00 0.00 51.96 51.65 3lpk s ALA 416 Cb -0.09 0.17 -0.12 0.00 0.00 0.00 0.00 23.12 23.09 3lpk s ALA 416 CO 0.01 -0.29 1.74 0.28 0.00 0.00 0.00 175.76 177.49 3lpk n VAL 417 N 1.06 0.08 -2.53 0.00 0.31 -1.24 -0.36 118.33 115.66 3lpk n VAL 417 Ca -0.21 -0.01 -0.39 0.00 -0.01 0.00 0.00 64.34 63.72 3lpk n VAL 417 Cb 0.57 -1.97 -0.04 0.00 -0.91 0.00 0.00 33.84 31.49 3lpk n VAL 417 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3lpk s SER 418 N 1.48 7.18 0.14 4.52 0.15 -0.80 -1.78 113.70 124.58 3lpk s SER 418 Ca 0.77 2.17 0.20 0.00 0.70 0.00 0.00 55.95 59.79 3lpk s SER 418 Cb -0.52 -2.61 0.83 0.00 -1.71 0.00 0.00 66.02 62.01 3lpk s SER 418 CO 0.34 -0.20 1.62 0.00 1.20 0.00 0.00 173.24 176.20 3lpk n ALA 419 N 0.89 1.72 -1.07 5.45 0.00 -0.49 -2.83 120.51 124.17 3lpk n ALA 419 Ca 0.00 0.02 0.09 0.00 0.00 0.00 0.00 53.44 53.55 3lpk n ALA 419 Cb 0.46 -1.33 0.17 0.00 0.00 0.00 0.00 19.45 18.76 3lpk n ALA 419 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3lpk s HIS 421 N -2.88 3.20 0.07 0.00 -0.00 -1.13 -4.54 115.29 109.99 3lpk s HIS 421 Ca 0.35 1.60 -0.24 0.00 -0.00 0.00 0.00 55.06 56.77 3lpk s HIS 421 Cb 0.30 -2.93 -0.06 0.00 -0.00 0.00 0.00 32.58 29.89 3lpk s HIS 421 CO 0.04 -0.38 0.72 0.08 -0.00 0.00 0.00 174.74 175.20 3lpk s VAL 422 N -2.11 4.68 0.12 -5.38 1.01 -1.26 -5.05 120.40 112.41 3lpk s VAL 422 Ca 0.64 1.54 -0.04 0.00 0.00 0.00 0.00 61.98 64.12 3lpk s VAL 422 Cb -0.12 -4.07 0.02 0.00 0.00 0.00 0.00 36.38 32.21 3lpk s VAL 422 CO 0.16 0.43 0.22 0.00 0.00 0.00 0.00 175.10 175.91 3lpk n HIS 423 N 2.40 -1.30 -4.33 5.22 -0.00 -1.26 -4.75 115.22 111.22 3lpk n HIS 423 Ca -0.05 -0.60 -0.15 0.00 -0.00 0.00 0.00 57.72 56.92 3lpk n HIS 423 Cb 0.50 0.26 -0.04 0.00 -0.00 0.00 0.00 29.99 30.72 3lpk n HIS 423 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 3lpk n ASP 424 N -1.31 1.87 0.29 4.39 5.68 -1.20 -5.03 116.55 121.23 3lpk n ASP 424 Ca -0.02 -2.15 0.18 0.00 -0.50 0.00 0.00 54.79 52.30 3lpk n ASP 424 Cb 0.18 0.37 0.78 0.00 -1.14 0.00 0.00 41.12 41.31 3lpk n ASP 424 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3lpk h GLU 425 N 0.00 0.00 0.00 0.11 9.09 -2.06 -3.31 114.58 118.41 3lpk h GLU 425 Ca -0.19 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 58.97 3lpk h GLU 425 Cb 0.65 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.71 3lpk h GLU 425 CO 0.31 0.00 -2.19 1.19 0.05 0.00 0.00 179.01 178.38 3lpk n PHE 426 N -3.10 0.11 -4.13 2.06 3.01 -1.26 -5.01 117.46 109.13 3lpk n PHE 426 Ca -0.00 0.04 -0.12 0.00 1.01 0.00 0.00 57.45 58.38 3lpk n PHE 426 Cb 0.27 -0.88 -0.11 0.00 -0.01 0.00 0.00 39.48 38.75 3lpk n PHE 426 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3lpk s ARG 427 N -2.81 0.72 0.04 -1.08 0.52 -1.25 -5.17 118.95 109.92 3lpk s ARG 427 Ca -0.09 -1.10 -0.00 0.00 -0.52 0.00 0.00 55.73 54.02 3lpk s ARG 427 Cb 0.08 -0.26 -0.03 0.00 0.52 0.00 0.00 34.95 35.26 3lpk s ARG 427 CO 0.85 0.02 -0.03 -0.08 0.02 0.00 0.00 175.30 176.07 3lpk s THR 428 N -2.68 0.21 0.81 0.02 -1.32 -1.26 -3.25 115.64 108.16 3lpk s THR 428 Ca 0.03 -1.33 -0.10 0.00 -1.21 0.00 0.00 61.69 59.08 3lpk s THR 428 Cb -0.01 -0.85 0.08 0.00 -1.51 0.00 0.00 72.50 70.20 3lpk s THR 428 CO -0.02 -0.71 1.10 0.00 -2.21 0.00 0.00 174.62 172.78 3lpk s ALA 429 N -2.54 2.05 0.09 11.08 0.00 -1.26 -4.93 121.76 126.24 3lpk s ALA 429 Ca -0.05 0.31 -0.14 0.00 0.00 0.00 0.00 51.96 52.08 3lpk s ALA 429 Cb -0.02 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 19.82 3lpk s ALA 429 CO -0.05 -2.01 0.33 0.00 0.00 0.00 0.00 175.76 174.03 3lpk s ALA 430 N -2.85 -0.70 -0.19 0.00 0.00 -1.07 -4.95 121.76 111.99 3lpk s ALA 430 Ca 0.62 -0.14 -0.03 0.00 0.00 0.00 0.00 51.96 52.41 3lpk s ALA 430 Cb -0.18 0.52 0.06 0.00 0.00 0.00 0.00 23.12 23.52 3lpk s ALA 430 CO 0.57 -0.54 0.05 0.08 0.00 0.00 0.00 175.76 175.92 3lpk s VAL 431 N -3.39 0.38 0.06 0.00 1.01 -1.26 0.02 120.40 117.22 3lpk s VAL 431 Ca 0.01 -0.49 0.02 0.00 0.00 0.00 0.00 61.98 61.52 3lpk s VAL 431 Cb 0.02 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.43 3lpk s VAL 431 CO -0.09 -0.25 -0.07 -1.61 0.00 0.00 0.00 175.10 173.09 3lpk s GLU 432 N 1.92 0.61 -0.01 2.72 2.02 -0.20 -4.87 118.70 120.89 3lpk s GLU 432 Ca 0.00 -0.95 -0.28 0.00 0.02 0.00 0.00 54.97 53.76 3lpk s GLU 432 Cb -0.17 -0.21 0.09 0.00 0.10 0.00 0.00 34.13 33.95 3lpk s GLU 432 CO -0.09 0.01 1.28 0.20 0.02 0.00 0.00 175.26 176.68 3lpk s GLY 433 N -2.10 -0.11 0.46 -1.39 0.00 -1.26 -0.13 107.32 102.79 3lpk s GLY 433 Ca -0.03 -0.00 0.05 0.00 0.00 0.00 0.00 44.72 44.74 3lpk s GLY 433 CO -0.02 5.82 0.64 2.56 0.00 0.00 0.00 173.10 182.10 3lpk s PRO 434 N -2.02 2.77 0.00 2.90 0.04 -1.26 -5.08 135.00 132.35 3lpk s PRO 434 Ca 0.30 -1.02 0.03 0.00 0.04 0.00 0.00 61.00 60.35 3lpk s PRO 434 Cb -0.01 -2.66 -0.01 0.00 0.04 0.00 0.00 34.50 31.86 3lpk s PRO 434 CO -0.00 -0.39 -0.10 -0.06 0.04 0.00 0.00 177.00 176.48 3lpk s PHE 435 N -2.49 0.93 -0.09 0.56 0.40 0.39 -4.95 117.98 112.74 3lpk s PHE 435 Ca 0.55 -0.22 -0.30 0.00 -0.60 0.00 0.00 56.93 56.36 3lpk s PHE 435 Cb -0.10 -0.59 -0.02 0.00 0.51 0.00 0.00 43.02 42.82 3lpk s PHE 435 CO 0.35 -0.01 1.17 0.08 0.70 0.00 0.00 175.22 177.51 3lpk s VAL 436 N -0.39 4.37 -0.06 -0.44 1.01 -1.26 -1.24 120.40 122.39 3lpk s VAL 436 Ca 0.03 1.68 -0.02 0.00 0.00 0.00 0.00 61.98 63.66 3lpk s VAL 436 Cb -0.05 -4.08 0.04 0.00 0.00 0.00 0.00 36.38 32.29 3lpk s VAL 436 CO -0.00 -0.03 0.13 -0.89 0.00 0.00 0.00 175.10 174.30 3lpk s THR 437 N 2.43 -0.06 0.27 3.92 2.01 -0.23 -4.93 115.64 119.04 3lpk s THR 437 Ca 0.54 0.20 0.07 0.00 0.31 0.00 0.00 61.69 62.80 3lpk s THR 437 Cb -0.23 -0.22 -0.03 0.00 0.01 0.00 0.00 72.50 72.04 3lpk s THR 437 CO 0.19 0.08 0.26 -0.76 -0.69 0.00 0.00 174.62 173.71 3lpk s LEU 438 N 1.24 3.92 -1.68 4.42 1.43 -1.26 -4.05 118.68 122.69 3lpk s LEU 438 Ca -0.08 -0.20 -0.18 0.00 -1.03 0.00 0.00 54.13 52.63 3lpk s LEU 438 Cb -0.12 -2.48 0.16 0.00 0.03 0.00 0.00 46.19 43.78 3lpk s LEU 438 CO -0.05 -0.11 0.78 0.47 0.23 0.00 0.00 176.35 177.67 3lpk n ASP 439 N -1.29 -3.37 0.12 2.29 10.43 -1.26 -4.85 116.55 118.62 3lpk n ASP 439 Ca -0.07 -0.98 0.04 0.00 2.57 0.00 0.00 54.79 56.35 3lpk n ASP 439 Cb 0.58 -2.76 0.44 0.00 1.84 0.00 0.00 41.12 41.22 3lpk n ASP 439 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 3lpk h MET 440 N -1.46 0.26 0.00 -1.24 2.86 -2.00 -1.50 114.93 111.85 3lpk h MET 440 Ca -0.58 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.01 3lpk h MET 440 Cb 1.38 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.99 3lpk h MET 440 CO 0.77 0.31 -0.03 0.93 1.06 0.00 0.00 176.91 179.95 3lpk h GLU 441 N 0.26 0.00 0.00 1.72 5.08 -1.98 0.13 114.58 119.79 3lpk h GLU 441 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3lpk h GLU 441 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 3lpk h GLU 441 CO 0.01 0.03 0.00 -0.25 -1.00 0.00 0.00 179.01 177.79 3lpk n ASP 442 N -3.45 0.61 0.19 1.42 8.00 -0.56 -2.60 116.55 120.16 3lpk n ASP 442 Ca -0.02 0.60 0.08 0.00 0.71 0.00 0.00 54.79 56.16 3lpk n ASP 442 Cb 0.13 -0.75 0.24 0.00 -0.02 0.00 0.00 41.12 40.72 3lpk n ASP 442 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3lpk s GLY 444 N -4.33 2.77 0.13 0.00 0.00 -1.07 -4.00 107.32 100.81 3lpk s GLY 444 Ca 0.03 0.77 -0.07 0.00 0.00 0.00 0.00 44.72 45.45 3lpk s GLY 444 CO 0.68 1.22 0.40 -0.47 0.00 0.00 0.00 173.10 174.93 3lpk s TYR 445 N -1.60 3.51 0.00 1.90 5.04 -1.26 -4.97 117.35 119.96 3lpk s TYR 445 Ca 0.58 0.67 0.00 0.00 -2.44 0.00 0.00 57.07 55.88 3lpk s TYR 445 Cb -0.24 -2.09 0.00 0.00 0.35 0.00 0.00 41.96 39.98 3lpk s TYR 445 CO 0.30 0.45 0.37 0.09 -1.34 0.00 0.00 175.55 175.41