#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lpk n SER 59 N 0.00 2.79 -2.75 1.61 7.64 -1.26 -4.56 113.62 117.09 3lpk n SER 59 Ca 0.00 -1.82 -0.16 0.00 1.01 0.00 0.00 58.87 57.90 3lpk n SER 59 Cb 0.00 -0.14 0.01 0.00 -1.01 0.00 0.00 64.21 63.06 3lpk n SER 59 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3lpk n PHE 60 N 0.96 1.63 -0.17 1.43 3.01 -1.26 -4.94 117.46 118.12 3lpk n PHE 60 Ca 0.13 -3.15 0.28 0.00 1.01 0.00 0.00 57.45 55.71 3lpk n PHE 60 Cb 0.45 -0.34 0.72 0.00 -0.01 0.00 0.00 39.48 40.30 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 2.52 0.57 0.00 -4.37 2.07 -1.96 -0.61 116.25 114.46 3lpk h VAL 61 Ca 0.04 -0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.51 3lpk h VAL 61 Cb 1.04 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3lpk h VAL 61 CO 0.59 0.00 -0.20 -0.08 0.02 0.00 0.00 177.57 177.91 3lpk h GLU 62 N 0.01 0.00 0.00 1.57 4.81 -1.96 -3.11 114.58 115.91 3lpk h GLU 62 Ca 0.41 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.64 3lpk h GLU 62 Cb 1.65 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.03 3lpk h GLU 62 CO -0.01 0.20 -1.09 -1.33 -0.73 0.00 0.00 179.01 176.05 3lpk n MET 63 N -3.71 1.06 -1.88 1.92 2.81 -0.26 -4.49 117.12 112.57 3lpk n MET 63 Ca -0.01 -0.04 -0.41 0.00 -1.81 0.00 0.00 57.70 55.42 3lpk n MET 63 Cb 0.31 -1.35 -0.01 0.00 -0.71 0.00 0.00 33.22 31.46 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 -2.81 2.28 -1.43 2.03 1.01 -1.05 -2.61 120.40 117.81 3lpk s VAL 64 Ca 0.03 0.25 -0.01 0.00 0.00 0.00 0.00 61.98 62.25 3lpk s VAL 64 Cb 0.13 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.35 3lpk s VAL 64 CO 0.72 0.05 0.15 0.47 0.00 0.00 0.00 175.10 176.50 3lpk n ASP 65 N 1.58 -5.18 -0.80 3.32 10.43 -1.20 -4.91 116.55 119.79 3lpk n ASP 65 Ca 0.05 -0.08 0.09 0.00 2.57 0.00 0.00 54.79 57.41 3lpk n ASP 65 Cb 0.39 -4.20 0.25 0.00 1.84 0.00 0.00 41.12 39.41 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 -1.47 2.34 -4.62 -2.24 6.94 -0.93 -4.82 115.26 110.46 3lpk n ASN 66 Ca -0.17 -1.91 -0.27 0.00 -0.02 0.00 0.00 54.58 52.20 3lpk n ASN 66 Cb 0.64 -0.24 -0.09 0.00 -2.36 0.00 0.00 39.78 37.73 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 -1.22 3.17 0.10 -4.53 1.43 -0.46 -4.41 118.68 112.75 3lpk s LEU 67 Ca 0.32 -0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 52.98 3lpk s LEU 67 Cb 0.17 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.48 3lpk s LEU 67 CO 0.24 0.12 0.03 -0.13 0.23 0.00 0.00 176.35 176.83 3lpk s ARG 68 N -2.72 0.80 0.00 1.70 0.52 -0.95 0.41 118.95 118.71 3lpk s ARG 68 Ca 0.25 -1.33 0.00 0.00 -0.52 0.00 0.00 55.73 54.13 3lpk s ARG 68 Cb -0.10 0.24 0.00 0.00 0.52 0.00 0.00 34.95 35.61 3lpk s ARG 68 CO 0.17 -0.21 0.00 0.41 0.02 0.00 0.00 175.30 175.69 3lpk n GLY 69 N -0.02 0.55 3.54 -3.53 0.00 -1.26 -0.73 105.19 103.74 3lpk n GLY 69 Ca -0.09 -2.26 -0.09 0.00 0.00 0.00 0.00 46.02 43.57 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 -0.14 1.16 0.26 1.61 -2.85 -1.03 -4.75 119.74 114.00 3lpk s LYS 70 Ca 0.00 -0.49 -0.01 0.00 -1.00 0.00 0.00 55.97 54.47 3lpk s LYS 70 Cb 0.00 0.49 0.58 0.00 -2.06 0.00 0.00 37.83 36.84 3lpk s LYS 70 CO 0.00 -0.52 1.69 0.66 0.10 0.00 0.00 175.35 177.28 3lpk h SER 71 N 2.00 0.13 0.84 0.03 4.64 -1.93 0.56 113.55 119.82 3lpk h SER 71 Ca -0.27 0.15 -0.03 0.00 -0.47 0.00 0.00 61.79 61.18 3lpk h SER 71 Cb 1.27 0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 63.53 3lpk h SER 71 CO 0.32 -0.03 -0.14 1.23 -0.87 0.00 0.00 176.83 177.35 3lpk h GLY 72 N 0.32 0.00 0.00 -0.77 0.00 -1.96 -3.28 103.07 97.38 3lpk h GLY 72 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.81 3lpk h GLY 72 CO -0.53 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 174.95 3lpk n GLN 73 N -3.34 3.57 0.00 4.80 6.02 -0.78 -5.00 117.38 122.66 3lpk n GLN 73 Ca -0.00 -0.20 0.00 0.00 -0.01 0.00 0.00 57.00 56.79 3lpk n GLN 73 Cb 0.35 -0.69 0.00 0.00 1.02 0.00 0.00 30.24 30.92 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 0.57 1.51 3.71 1.08 0.00 0.19 -4.88 105.19 107.37 3lpk n GLY 74 Ca 0.00 -1.78 -0.35 0.00 0.00 0.00 0.00 46.02 43.89 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 -2.76 3.26 0.12 1.61 1.51 -1.26 -2.47 117.35 117.35 3lpk s TYR 75 Ca 0.00 0.23 0.04 0.00 -1.01 0.00 0.00 57.07 56.33 3lpk s TYR 75 Cb 0.00 -1.86 -0.04 0.00 -0.11 0.00 0.00 41.96 39.95 3lpk s TYR 75 CO 0.00 0.47 -0.10 1.52 -1.11 0.00 0.00 175.55 176.33 3lpk s TYR 76 N -0.73 1.16 0.13 2.71 -0.85 0.09 -0.50 117.35 119.35 3lpk s TYR 76 Ca 0.12 -0.70 0.10 0.00 -0.52 0.00 0.00 57.07 56.07 3lpk s TYR 76 Cb -0.12 -0.61 -0.04 0.00 0.38 0.00 0.00 41.96 41.57 3lpk s TYR 76 CO 0.02 0.03 -0.23 0.54 -1.52 0.00 0.00 175.55 174.39 3lpk s VAL 77 N -2.79 2.02 0.17 -3.49 0.11 0.05 -2.25 120.40 114.21 3lpk s VAL 77 Ca 0.10 -1.73 -0.25 0.00 -2.93 0.00 0.00 61.98 57.17 3lpk s VAL 77 Cb -0.01 -1.83 -0.08 0.00 -1.53 0.00 0.00 36.38 32.93 3lpk s VAL 77 CO 0.00 -0.04 0.77 -0.70 -3.33 0.00 0.00 175.10 171.80 3lpk s GLU 78 N -2.16 4.55 0.16 1.54 2.12 -1.26 -0.34 118.70 123.30 3lpk s GLU 78 Ca 0.12 1.14 -0.02 0.00 0.36 0.00 0.00 54.97 56.57 3lpk s GLU 78 Cb -0.09 -3.25 -0.04 0.00 0.26 0.00 0.00 34.13 31.01 3lpk s GLU 78 CO 0.06 0.57 0.11 -1.64 -0.54 0.00 0.00 175.26 173.82 3lpk s MET 79 N -1.17 1.04 0.04 4.30 -1.94 -0.16 -4.08 119.30 117.32 3lpk s MET 79 Ca 0.36 -1.45 0.05 0.00 -1.71 0.00 0.00 55.69 52.93 3lpk s MET 79 Cb -0.23 0.27 -0.02 0.00 2.01 0.00 0.00 34.83 36.86 3lpk s MET 79 CO 0.26 -0.32 -0.15 0.95 -0.01 0.00 0.00 175.02 175.75 3lpk s THR 80 N -4.07 1.18 0.01 2.05 -4.23 -0.32 -0.99 115.64 109.26 3lpk s THR 80 Ca 0.27 -1.03 0.03 0.00 -1.18 0.00 0.00 61.69 59.77 3lpk s THR 80 Cb 0.07 -1.06 -0.01 0.00 1.34 0.00 0.00 72.50 72.83 3lpk s THR 80 CO 0.04 0.02 -0.08 0.68 -0.54 0.00 0.00 174.62 174.74 3lpk s VAL 81 N -0.86 0.65 0.00 2.29 -7.23 -0.17 -1.95 120.40 113.12 3lpk s VAL 81 Ca 0.02 -0.53 0.00 0.00 -1.81 0.00 0.00 61.98 59.66 3lpk s VAL 81 Cb -0.08 -0.58 0.00 0.00 0.56 0.00 0.00 36.38 36.28 3lpk s VAL 81 CO 0.01 0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.47 3lpk n GLY 82 N 2.53 -0.84 2.74 2.32 0.00 -0.49 -0.58 105.19 110.87 3lpk n GLY 82 Ca -0.15 -1.69 -0.25 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 -2.18 2.07 0.81 1.61 0.01 -1.26 -2.63 113.70 112.12 3lpk s SER 83 Ca 0.00 -0.36 -0.11 0.00 1.31 0.00 0.00 55.95 56.79 3lpk s SER 83 Cb 0.00 -0.47 0.08 0.00 0.21 0.00 0.00 66.02 65.84 3lpk s SER 83 CO 0.00 -0.24 1.11 -2.16 0.41 0.00 0.00 173.24 172.36 3lpk s PRO 84 N 1.95 1.93 0.22 12.44 0.04 -1.26 -0.90 135.00 149.42 3lpk s PRO 84 Ca 0.03 1.31 -0.32 0.00 0.04 0.00 0.00 61.00 62.06 3lpk s PRO 84 Cb -0.14 -1.85 -0.12 0.00 0.04 0.00 0.00 34.50 32.43 3lpk s PRO 84 CO -0.06 -1.91 1.65 -0.35 0.04 0.00 0.00 177.00 176.36 3lpk n PRO 85 N -3.64 2.59 -3.76 0.56 -0.04 -1.08 -4.90 135.00 124.73 3lpk n PRO 85 Ca 0.10 0.93 -0.37 0.00 -0.04 0.00 0.00 63.50 64.12 3lpk n PRO 85 Cb 0.53 -2.74 -0.13 0.00 -0.04 0.00 0.00 33.50 31.12 3lpk n PRO 85 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 3lpk s GLN 86 N 0.67 3.27 0.13 0.54 -0.21 0.26 -4.88 119.66 119.44 3lpk s GLN 86 Ca 0.73 -0.74 -0.30 0.00 0.02 0.00 0.00 55.36 55.08 3lpk s GLN 86 Cb -0.55 -3.36 -0.06 0.00 1.00 0.00 0.00 33.01 30.04 3lpk s GLN 86 CO 0.38 -0.36 1.00 0.99 -2.12 0.00 0.00 175.29 175.17 3lpk s THR 87 N 1.54 4.31 0.01 -0.19 2.01 -1.26 -1.00 115.64 121.05 3lpk s THR 87 Ca 0.04 1.95 -0.11 0.00 0.31 0.00 0.00 61.69 63.88 3lpk s THR 87 Cb -0.16 -4.24 0.01 0.00 0.01 0.00 0.00 72.50 68.11 3lpk s THR 87 CO 0.03 0.31 0.21 -0.76 -0.69 0.00 0.00 174.62 173.72 3lpk s LEU 88 N -0.13 1.25 -0.17 4.42 1.43 -0.16 -4.95 118.68 120.36 3lpk s LEU 88 Ca 0.47 -0.16 -0.13 0.00 -1.03 0.00 0.00 54.13 53.28 3lpk s LEU 88 Cb -0.25 0.97 -0.05 0.00 0.03 0.00 0.00 46.19 46.89 3lpk s LEU 88 CO 0.31 -0.46 0.27 0.20 0.23 0.00 0.00 176.35 176.90 3lpk s ASN 89 N -1.59 6.38 -0.12 2.29 0.01 -1.26 -0.99 114.94 119.66 3lpk s ASN 89 Ca -0.11 0.44 0.03 0.00 -0.71 0.00 0.00 52.86 52.51 3lpk s ASN 89 Cb -0.05 -2.17 0.01 0.00 0.41 0.00 0.00 41.25 39.45 3lpk s ASN 89 CO 0.01 0.10 -0.21 -0.63 -1.51 0.00 0.00 177.10 174.86 3lpk s ILE 90 N 0.53 1.92 0.17 0.60 -1.09 0.53 -0.09 121.20 123.77 3lpk s ILE 90 Ca 0.15 -0.91 -0.32 0.00 -2.23 0.00 0.00 60.65 57.35 3lpk s ILE 90 Cb -0.13 -1.70 -0.11 0.00 -1.58 0.00 0.00 42.46 38.95 3lpk s ILE 90 CO 0.03 0.52 1.66 -0.22 -1.23 0.00 0.00 174.94 175.71 3lpk s LEU 91 N 0.76 4.37 -0.43 2.97 2.96 0.32 -0.77 118.68 128.86 3lpk s LEU 91 Ca -0.09 2.71 -0.24 0.00 -0.22 0.00 0.00 54.13 56.28 3lpk s LEU 91 Cb -0.16 -3.59 0.02 0.00 0.50 0.00 0.00 46.19 42.96 3lpk s LEU 91 CO 0.00 -0.90 0.85 -0.69 -1.32 0.00 0.00 176.35 174.29 3lpk s VAL 92 N 1.46 4.59 -0.33 1.68 1.01 0.34 -0.07 120.40 129.09 3lpk s VAL 92 Ca 0.73 0.71 0.02 0.00 0.00 0.00 0.00 61.98 63.45 3lpk s VAL 92 Cb -0.46 -4.34 0.10 0.00 0.00 0.00 0.00 36.38 31.68 3lpk s VAL 92 CO 0.32 -0.69 0.06 -0.62 0.00 0.00 0.00 175.10 174.17 3lpk s ASP 93 N 2.10 4.51 0.00 3.32 2.15 -0.73 -4.14 116.67 123.89 3lpk s ASP 93 Ca 0.34 -1.97 0.24 0.00 0.43 0.00 0.00 52.55 51.59 3lpk s ASP 93 Cb -0.11 -1.38 1.39 0.00 -0.30 0.00 0.00 42.92 42.52 3lpk s ASP 93 CO 0.23 -0.39 1.90 0.35 -0.17 0.00 0.00 175.17 177.09 3lpk n THR 94 N 4.45 0.01 0.39 1.71 -2.24 -1.26 -0.83 114.28 116.51 3lpk n THR 94 Ca 0.02 -0.01 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 3lpk n THR 94 Cb 0.42 -0.33 0.22 0.00 -2.10 0.00 0.00 70.33 68.53 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 0.88 1.63 3.50 3.38 0.00 -1.26 -4.20 105.19 109.12 3lpk n GLY 95 Ca 0.18 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.53 0.61 -0.04 1.61 1.04 -1.23 -4.98 113.70 109.18 3lpk s SER 96 Ca 0.38 -1.34 0.05 0.00 0.48 0.00 0.00 55.95 55.52 3lpk s SER 96 Cb 0.23 0.63 0.08 0.00 0.10 0.00 0.00 66.02 67.06 3lpk s SER 96 CO 0.32 -1.24 0.93 -1.20 0.98 0.00 0.00 173.24 173.03 3lpk n SER 97 N -1.09 1.07 -4.66 7.02 7.64 -1.26 -0.84 113.62 121.50 3lpk n SER 97 Ca 0.00 -2.09 -0.35 0.00 1.01 0.00 0.00 58.87 57.45 3lpk n SER 97 Cb 0.62 -0.18 -0.10 0.00 -1.01 0.00 0.00 64.21 63.54 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 -1.31 5.15 -0.29 6.43 -0.87 -1.26 -4.53 114.94 118.26 3lpk s ASN 98 Ca 0.09 0.11 -0.12 0.00 -1.57 0.00 0.00 52.86 51.38 3lpk s ASN 98 Cb 0.08 -1.45 -0.04 0.00 -0.02 0.00 0.00 41.25 39.82 3lpk s ASN 98 CO 0.01 0.37 0.21 0.12 -2.57 0.00 0.00 177.10 175.24 3lpk s PHE 99 N -0.82 3.22 -0.04 2.20 5.99 -1.26 -1.37 117.98 125.90 3lpk s PHE 99 Ca 0.12 0.07 -0.08 0.00 0.00 0.00 0.00 56.93 57.04 3lpk s PHE 99 Cb -0.11 -2.42 0.01 0.00 0.00 0.00 0.00 43.02 40.50 3lpk s PHE 99 CO 0.02 -0.21 0.19 0.00 -0.00 0.00 0.00 175.22 175.22 3lpk s ALA 100 N 1.78 -0.45 0.05 11.12 0.00 -0.61 -1.83 121.76 131.80 3lpk s ALA 100 Ca 0.07 0.28 0.03 0.00 0.00 0.00 0.00 51.96 52.34 3lpk s ALA 100 Cb -0.16 -0.13 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 3lpk s ALA 100 CO 0.11 -0.15 -0.09 0.14 0.00 0.00 0.00 175.76 175.77 3lpk s VAL 101 N -0.57 0.62 0.28 0.00 -7.23 -0.39 -0.28 120.40 112.83 3lpk s VAL 101 Ca -0.07 -1.14 -0.30 0.00 -1.81 0.00 0.00 61.98 58.66 3lpk s VAL 101 Cb -0.04 -0.71 -0.12 0.00 0.56 0.00 0.00 36.38 36.07 3lpk s VAL 101 CO 0.01 -0.38 1.59 0.61 -0.31 0.00 0.00 175.10 176.62 3lpk n GLY 102 N 1.38 1.30 0.49 2.32 0.00 0.09 -0.31 105.19 110.47 3lpk n GLY 102 Ca -0.22 0.48 0.04 0.00 0.00 0.00 0.00 46.02 46.32 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 2.27 2.25 -3.49 4.61 0.00 0.23 -0.99 120.51 125.40 3lpk n ALA 103 Ca 0.09 -1.85 -0.14 0.00 0.00 0.00 0.00 53.44 51.54 3lpk n ALA 103 Cb 0.36 -0.48 -0.04 0.00 0.00 0.00 0.00 19.45 19.29 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 -1.15 -1.72 0.31 0.00 0.00 -1.21 -4.80 121.76 113.18 3lpk s ALA 104 Ca 0.17 1.00 -0.28 0.00 0.00 0.00 0.00 51.96 52.85 3lpk s ALA 104 Cb 0.16 0.32 -0.13 0.00 0.00 0.00 0.00 23.12 23.47 3lpk s ALA 104 CO -0.02 -0.55 1.14 -2.30 0.00 0.00 0.00 175.76 174.03 3lpk n PRO 105 N 0.29 1.71 -3.72 0.00 -0.02 -1.26 -4.95 135.00 127.05 3lpk n PRO 105 Ca -0.16 0.60 -0.13 0.00 -2.02 0.00 0.00 63.50 61.78 3lpk n PRO 105 Cb 0.61 -2.07 -0.09 0.00 -0.02 0.00 0.00 33.50 31.92 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 -1.07 -0.51 0.42 6.00 2.46 -1.26 -5.06 115.29 116.27 3lpk s HIS 106 Ca 0.57 1.24 0.23 0.00 0.47 0.00 0.00 55.06 57.57 3lpk s HIS 106 Cb -0.64 0.17 1.24 0.00 -0.13 0.00 0.00 32.58 33.22 3lpk s HIS 106 CO 0.61 -0.25 1.72 -1.35 -2.47 0.00 0.00 174.74 173.00 3lpk h PRO 107 N 5.40 0.26 -0.23 2.88 0.11 -2.03 -0.44 132.00 137.94 3lpk h PRO 107 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3lpk h PRO 107 Cb 1.18 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3lpk h PRO 107 CO 0.22 0.17 0.00 1.19 -0.21 0.00 0.00 178.00 179.37 3lpk n PHE 108 N -4.63 0.29 -4.76 0.65 0.99 -1.26 -4.88 117.46 103.86 3lpk n PHE 108 Ca 0.29 -0.15 -0.33 0.00 -0.00 0.00 0.00 57.45 57.27 3lpk n PHE 108 Cb 1.09 0.00 -0.13 0.00 -1.00 0.00 0.00 39.48 39.43 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 -1.61 2.84 0.00 4.37 1.43 -0.18 -4.69 118.68 120.85 3lpk s LEU 109 Ca 0.35 -0.21 0.13 0.00 -1.03 0.00 0.00 54.13 53.36 3lpk s LEU 109 Cb 0.20 -1.62 0.30 0.00 0.03 0.00 0.00 46.19 45.10 3lpk s LEU 109 CO 0.29 0.26 1.21 0.00 0.23 0.00 0.00 176.35 178.34 3lpk n HIS 110 N 2.86 0.41 -3.52 0.29 1.44 -1.26 -4.57 115.22 110.87 3lpk n HIS 110 Ca -0.18 -0.38 -0.10 0.00 -2.01 0.00 0.00 57.72 55.05 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 -1.02 0.80 0.23 -1.40 1.70 -1.26 -5.17 118.95 112.83 3lpk s ARG 111 Ca 0.24 -0.09 -0.22 0.00 -0.47 0.00 0.00 55.73 55.19 3lpk s ARG 111 Cb 0.13 0.37 0.04 0.00 -0.57 0.00 0.00 34.95 34.92 3lpk s ARG 111 CO 0.18 -0.31 0.67 1.52 -1.08 0.00 0.00 175.30 176.28 3lpk s TYR 112 N -2.26 -0.32 -0.04 5.89 -0.85 -1.26 -4.94 117.35 113.58 3lpk s TYR 112 Ca 0.01 -0.05 -0.30 0.00 -0.52 0.00 0.00 57.07 56.21 3lpk s TYR 112 Cb -0.01 0.64 -0.05 0.00 0.38 0.00 0.00 41.96 42.93 3lpk s TYR 112 CO -0.03 -1.08 1.46 -0.47 -1.52 0.00 0.00 175.55 173.91 3lpk s TYR 113 N -3.86 2.57 -0.56 -3.49 5.04 -0.16 -4.95 117.35 111.94 3lpk s TYR 113 Ca 0.07 0.64 -0.04 0.00 -2.44 0.00 0.00 57.07 55.31 3lpk s TYR 113 Cb -0.04 -3.72 0.15 0.00 0.35 0.00 0.00 41.96 38.69 3lpk s TYR 113 CO -0.01 -2.80 0.38 -0.65 -1.34 0.00 0.00 175.55 171.13 3lpk s GLN 114 N 3.10 2.43 0.37 4.97 -0.21 -1.26 -4.41 119.66 124.65 3lpk s GLN 114 Ca 0.65 -2.27 0.09 0.00 0.02 0.00 0.00 55.36 53.85 3lpk s GLN 114 Cb -0.31 -3.72 0.84 0.00 1.00 0.00 0.00 33.01 30.82 3lpk s GLN 114 CO 0.25 -1.15 1.91 0.00 -2.12 0.00 0.00 175.29 174.19 3lpk h ARG 115 N 7.44 0.64 0.00 2.91 3.08 -1.94 -1.71 114.38 124.80 3lpk h ARG 115 Ca -0.06 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.95 3lpk h ARG 115 Cb 0.99 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.90 3lpk h ARG 115 CO 0.72 0.42 0.00 0.00 -1.07 0.00 0.00 179.97 180.04 3lpk n GLN 116 N -4.51 0.04 -0.05 0.04 0.00 -1.26 -1.90 117.38 109.74 3lpk n GLN 116 Ca 0.14 0.33 0.11 0.00 0.00 0.00 0.00 57.00 57.58 3lpk n GLN 116 Cb 0.39 -1.58 0.12 0.00 0.00 0.00 0.00 30.24 29.17 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 -1.65 2.96 -4.42 2.61 4.77 -0.64 -4.88 117.00 115.75 3lpk n LEU 117 Ca 0.03 -1.14 -0.36 0.00 -0.03 0.00 0.00 56.01 54.51 3lpk n LEU 117 Cb 0.15 -0.06 -0.13 0.00 -2.33 0.00 0.00 43.42 41.05 3lpk n LEU 117 CO 0.13 0.54 -0.30 -0.55 -1.33 0.00 0.00 177.39 175.88 3lpk s SER 118 N -1.71 4.96 0.48 -1.43 0.15 -0.80 -4.18 113.70 111.17 3lpk s SER 118 Ca 0.28 -0.24 0.30 0.00 0.70 0.00 0.00 55.95 56.99 3lpk s SER 118 Cb 0.19 -1.88 1.05 0.00 -1.71 0.00 0.00 66.02 63.67 3lpk s SER 118 CO 0.28 -0.02 1.86 0.77 1.20 0.00 0.00 173.24 177.33 3lpk h SER 119 N 8.13 0.00 -0.22 5.45 4.64 -1.32 -3.07 113.55 127.16 3lpk h SER 119 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3lpk h SER 119 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3lpk h SER 119 CO 0.59 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.90 3lpk n THR 120 N -2.97 0.27 -2.01 2.95 -2.24 -1.26 -4.96 114.28 104.05 3lpk n THR 120 Ca 0.02 -0.61 -0.41 0.00 -2.27 0.00 0.00 64.05 60.77 3lpk n THR 120 Cb 0.36 1.14 -0.02 0.00 -2.10 0.00 0.00 70.33 69.71 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 -1.73 3.04 -0.11 4.78 5.04 -1.16 -4.52 117.35 122.69 3lpk s TYR 121 Ca 0.34 0.97 0.01 0.00 -2.44 0.00 0.00 57.07 55.95 3lpk s TYR 121 Cb 0.21 -3.82 0.02 0.00 0.35 0.00 0.00 41.96 38.72 3lpk s TYR 121 CO 0.31 -2.74 -0.14 1.03 -1.34 0.00 0.00 175.55 172.66 3lpk s ARG 122 N -0.05 2.12 -0.14 4.97 0.52 -0.21 -4.99 118.95 121.17 3lpk s ARG 122 Ca 0.61 -0.52 -0.23 0.00 -0.52 0.00 0.00 55.73 55.07 3lpk s ARG 122 Cb -0.42 -1.84 -0.03 0.00 0.52 0.00 0.00 34.95 33.18 3lpk s ARG 122 CO 0.41 -0.09 0.72 0.34 0.02 0.00 0.00 175.30 176.69 3lpk s ASP 123 N 1.08 6.88 0.00 0.23 2.15 -1.26 -0.72 116.67 125.03 3lpk s ASP 123 Ca -0.05 1.07 0.22 0.00 0.43 0.00 0.00 52.55 54.22 3lpk s ASP 123 Cb -0.15 -2.40 0.77 0.00 -0.30 0.00 0.00 42.92 40.84 3lpk s ASP 123 CO -0.03 -0.25 1.57 0.18 -0.17 0.00 0.00 175.17 176.47 3lpk n LEU 124 N 4.63 1.79 -3.93 -1.34 4.77 -0.82 -4.96 117.00 117.14 3lpk n LEU 124 Ca 0.00 -0.72 -0.33 0.00 -0.03 0.00 0.00 56.01 54.94 3lpk n LEU 124 Cb 0.50 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 3lpk n LEU 124 CO 0.46 0.36 -0.20 0.54 -1.33 0.00 0.00 177.39 177.23 3lpk n ARG 125 N 0.40 -1.67 -3.64 3.23 1.74 -1.26 -4.97 116.66 110.49 3lpk n ARG 125 Ca 0.17 0.31 -0.09 0.00 -0.77 0.00 0.00 57.85 57.47 3lpk n ARG 125 Cb 0.36 -3.84 -0.07 0.00 -1.02 0.00 0.00 32.46 27.88 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 -6.66 0.72 0.35 5.56 2.20 -1.26 -5.06 119.74 115.59 3lpk s LYS 126 Ca 0.27 1.13 0.03 0.00 -0.36 0.00 0.00 55.97 57.04 3lpk s LYS 126 Cb -0.12 0.20 -0.02 0.00 -1.51 0.00 0.00 37.83 36.39 3lpk s LYS 126 CO 0.91 -0.14 0.52 0.20 -0.36 0.00 0.00 175.35 176.49 3lpk s GLY 127 N 1.29 1.45 -0.13 5.54 0.00 -1.26 -0.79 107.32 113.42 3lpk s GLY 127 Ca -0.07 -1.17 -0.13 0.00 0.00 0.00 0.00 44.72 43.34 3lpk s GLY 127 CO -0.14 -1.09 0.37 0.54 0.00 0.00 0.00 173.10 172.78 3lpk s VAL 128 N -2.28 0.00 -0.22 1.40 0.11 -0.30 -4.88 120.40 114.24 3lpk s VAL 128 Ca 0.43 -0.02 -0.04 0.00 -2.93 0.00 0.00 61.98 59.41 3lpk s VAL 128 Cb -0.10 -0.53 -0.01 0.00 -1.53 0.00 0.00 36.38 34.22 3lpk s VAL 128 CO 0.34 -0.01 -0.03 -0.47 -3.33 0.00 0.00 175.10 171.59 3lpk s TYR 129 N 0.11 2.97 -0.28 1.54 5.04 -1.26 -1.60 117.35 123.87 3lpk s TYR 129 Ca -0.01 -0.85 0.01 0.00 -2.44 0.00 0.00 57.07 53.78 3lpk s TYR 129 Cb -0.03 -2.11 0.08 0.00 0.35 0.00 0.00 41.96 40.26 3lpk s TYR 129 CO 0.01 -0.50 0.01 0.08 -1.34 0.00 0.00 175.55 173.81 3lpk s VAL 130 N 1.42 1.61 -0.02 3.14 1.01 -0.54 -4.98 120.40 122.03 3lpk s VAL 130 Ca 0.05 -1.60 -0.03 0.00 0.00 0.00 0.00 61.98 60.40 3lpk s VAL 130 Cb -0.14 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 3lpk s VAL 130 CO -0.02 -0.38 0.17 -2.16 0.00 0.00 0.00 175.10 172.71 3lpk s PRO 131 N 1.30 3.43 0.48 2.72 0.04 -1.26 -1.99 135.00 139.71 3lpk s PRO 131 Ca 0.03 -0.30 0.02 0.00 0.04 0.00 0.00 61.00 60.78 3lpk s PRO 131 Cb -0.19 -3.10 -0.02 0.00 0.04 0.00 0.00 34.50 31.24 3lpk s PRO 131 CO -0.11 0.69 0.03 0.71 0.04 0.00 0.00 177.00 178.36 3lpk s TYR 132 N -1.29 1.88 0.13 0.56 2.02 0.16 -4.98 117.35 115.83 3lpk s TYR 132 Ca 0.26 -1.02 -0.16 0.00 -0.37 0.00 0.00 57.07 55.77 3lpk s TYR 132 Cb -0.13 -1.51 -0.02 0.00 -0.40 0.00 0.00 41.96 39.91 3lpk s TYR 132 CO 0.17 0.11 1.64 1.15 -1.57 0.00 0.00 175.55 177.05 3lpk h THR 133 N 1.48 1.21 0.21 -0.71 2.02 -2.02 -3.29 112.91 111.80 3lpk h THR 133 Ca -0.42 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.05 3lpk h THR 133 Cb 1.30 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 3lpk h THR 133 CO 0.70 0.24 -0.10 -0.61 0.37 0.00 0.00 175.52 176.13 3lpk h GLN 134 N 0.47 -0.27 0.00 6.66 5.75 -1.96 -3.49 115.11 122.27 3lpk h GLN 134 Ca 0.12 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 3lpk h GLN 134 Cb 0.26 0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.87 3lpk h GLN 134 CO -0.00 0.07 0.00 0.41 -2.65 0.00 0.00 178.83 176.65 3lpk n GLY 135 N -0.22 2.87 3.59 2.39 0.00 -1.24 -4.86 105.19 107.71 3lpk n GLY 135 Ca -0.09 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 44.98 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 0.24 1.47 0.12 1.61 -2.85 -0.52 0.39 119.74 120.20 3lpk s LYS 136 Ca 0.00 -0.93 -0.11 0.00 -1.00 0.00 0.00 55.97 53.93 3lpk s LYS 136 Cb 0.00 0.53 0.01 0.00 -2.06 0.00 0.00 37.83 36.31 3lpk s LYS 136 CO 0.00 -0.63 0.28 1.67 0.10 0.00 0.00 175.35 176.77 3lpk s TRP 137 N -3.90 0.12 -0.00 1.78 1.48 -0.84 -0.47 118.94 117.11 3lpk s TRP 137 Ca 0.11 -0.50 0.05 0.00 -1.06 0.00 0.00 56.10 54.70 3lpk s TRP 137 Cb -0.02 0.04 -0.01 0.00 -1.16 0.00 0.00 33.47 32.32 3lpk s TRP 137 CO 0.00 -0.65 -0.17 -1.21 -4.06 0.00 0.00 176.95 170.86 3lpk s GLU 138 N -3.88 1.36 0.34 3.25 2.02 0.12 -1.47 118.70 120.44 3lpk s GLU 138 Ca 0.08 -0.65 -0.09 0.00 0.02 0.00 0.00 54.97 54.32 3lpk s GLU 138 Cb 0.03 -1.33 0.02 0.00 0.10 0.00 0.00 34.13 32.95 3lpk s GLU 138 CO -0.08 0.36 0.59 0.20 0.02 0.00 0.00 175.26 176.35 3lpk s GLY 139 N -0.53 0.90 -0.16 -1.39 0.00 -0.63 -1.34 107.32 104.17 3lpk s GLY 139 Ca 0.06 -1.11 -0.02 0.00 0.00 0.00 0.00 44.72 43.65 3lpk s GLY 139 CO -0.00 -0.67 -0.08 -0.54 0.00 0.00 0.00 173.10 171.81 3lpk s GLU 140 N -3.00 3.50 0.33 2.90 2.02 -0.07 -1.14 118.70 123.25 3lpk s GLU 140 Ca 0.23 -0.61 -0.25 0.00 0.02 0.00 0.00 54.97 54.37 3lpk s GLU 140 Cb -0.02 -2.81 -0.10 0.00 0.10 0.00 0.00 34.13 31.29 3lpk s GLU 140 CO 0.15 0.16 0.93 -0.51 0.02 0.00 0.00 175.26 176.01 3lpk s LEU 141 N 0.54 4.28 0.00 1.80 1.43 0.03 -0.27 118.68 126.50 3lpk s LEU 141 Ca -0.05 1.79 -0.09 0.00 -1.03 0.00 0.00 54.13 54.75 3lpk s LEU 141 Cb -0.15 -4.06 0.03 0.00 0.03 0.00 0.00 46.19 42.04 3lpk s LEU 141 CO 0.03 -0.10 0.40 0.61 0.23 0.00 0.00 176.35 177.52 3lpk n GLY 142 N 0.40 0.92 3.15 -3.19 0.00 -0.72 -1.95 105.19 103.80 3lpk n GLY 142 Ca 0.02 -0.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.32 0.60 0.15 2.61 -4.23 0.10 -0.44 115.64 112.11 3lpk s THR 143 Ca 0.09 -1.90 -0.25 0.00 -1.18 0.00 0.00 61.69 58.45 3lpk s THR 143 Cb -0.01 -1.64 0.07 0.00 1.34 0.00 0.00 72.50 72.26 3lpk s THR 143 CO 0.02 -0.89 0.98 -0.62 -0.54 0.00 0.00 174.62 173.56 3lpk s ASP 144 N -3.01 -0.16 0.05 3.99 -1.08 -0.97 -1.04 116.67 114.45 3lpk s ASP 144 Ca 0.11 -0.41 -0.28 0.00 -0.52 0.00 0.00 52.55 51.45 3lpk s ASP 144 Cb 0.06 0.47 -0.05 0.00 -1.46 0.00 0.00 42.92 41.94 3lpk s ASP 144 CO -0.06 -0.88 0.89 -0.76 0.52 0.00 0.00 175.17 174.88 3lpk s LEU 145 N -2.97 4.44 0.01 -1.34 1.43 -1.26 -1.74 118.68 117.25 3lpk s LEU 145 Ca 0.13 1.62 0.05 0.00 -1.03 0.00 0.00 54.13 54.90 3lpk s LEU 145 Cb -0.01 -3.45 -0.02 0.00 0.03 0.00 0.00 46.19 42.74 3lpk s LEU 145 CO 0.02 -0.10 -0.17 -0.69 0.23 0.00 0.00 176.35 175.65 3lpk s VAL 146 N 0.30 1.32 0.08 -1.59 1.01 0.15 -1.39 120.40 120.28 3lpk s VAL 146 Ca 0.45 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 3lpk s VAL 146 Cb -0.22 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 3lpk s VAL 146 CO 0.27 0.23 -0.00 -0.44 0.00 0.00 0.00 175.10 175.15 3lpk s SER 147 N -0.76 0.49 -0.32 3.32 0.01 -0.83 -1.23 113.70 114.39 3lpk s SER 147 Ca 0.05 -1.07 0.02 0.00 1.31 0.00 0.00 55.95 56.26 3lpk s SER 147 Cb -0.07 0.22 0.10 0.00 0.21 0.00 0.00 66.02 66.48 3lpk s SER 147 CO 0.00 -0.63 0.07 -0.63 0.41 0.00 0.00 173.24 172.46 3lpk s ILE 148 N -3.94 1.68 0.24 1.44 1.01 -1.26 -1.18 121.20 119.19 3lpk s ILE 148 Ca 0.13 -1.93 -0.12 0.00 0.00 0.00 0.00 60.65 58.74 3lpk s ILE 148 Cb 0.08 -2.24 0.33 0.00 0.01 0.00 0.00 42.46 40.63 3lpk s ILE 148 CO -0.05 -0.62 1.59 -0.65 0.00 0.00 0.00 174.94 175.20 3lpk h PRO 149 N 7.82 -0.01 -2.19 2.79 0.11 -1.90 -0.84 132.00 137.77 3lpk h PRO 149 Ca -0.08 0.00 -0.77 0.00 0.11 0.00 0.00 66.00 65.26 3lpk h PRO 149 Cb 1.02 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 31.84 3lpk h PRO 149 CO 0.50 -0.01 0.78 0.72 -0.21 0.00 0.00 178.00 179.78 3lpk n HIS 150 N -5.53 2.99 -1.79 0.65 8.25 -1.26 -4.91 115.22 113.63 3lpk n HIS 150 Ca 0.11 -2.72 0.00 0.00 -0.26 0.00 0.00 57.72 54.85 3lpk n HIS 150 Cb 0.41 -1.07 0.00 0.00 1.12 0.00 0.00 29.99 30.45 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 -0.18 4.48 3.75 -1.41 0.00 -0.32 -4.43 105.19 107.08 3lpk n GLY 151 Ca 0.46 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 45.22 3lpk n GLY 151 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3lpk s PRO 152 N 1.78 2.77 -1.28 1.61 0.04 -1.26 -4.85 135.00 133.81 3lpk s PRO 152 Ca 0.00 1.68 -0.09 0.00 0.04 0.00 0.00 61.00 62.63 3lpk s PRO 152 Cb 0.00 -1.92 0.17 0.00 0.04 0.00 0.00 34.50 32.79 3lpk s PRO 152 CO 0.00 -1.33 1.92 0.09 0.04 0.00 0.00 177.00 177.73 3lpk n ASN 153 N -2.03 5.50 -4.10 6.66 3.02 -1.26 -4.62 115.26 118.43 3lpk n ASN 153 Ca 0.13 -3.13 -0.09 0.00 -0.03 0.00 0.00 54.58 51.46 3lpk n ASN 153 Cb 0.50 -1.45 -0.10 0.00 -0.61 0.00 0.00 39.78 38.13 3lpk n ASN 153 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3lpk s VAL 154 N 0.03 0.14 -0.05 2.41 -7.23 -1.26 -5.16 120.40 109.29 3lpk s VAL 154 Ca 0.41 -1.79 0.03 0.00 -1.81 0.00 0.00 61.98 58.81 3lpk s VAL 154 Cb 0.11 -1.82 0.01 0.00 0.56 0.00 0.00 36.38 35.24 3lpk s VAL 154 CO -0.00 -0.64 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.15 3lpk s THR 155 N -3.99 1.03 0.10 5.32 2.01 -1.26 -4.49 115.64 114.35 3lpk s THR 155 Ca 0.17 -0.46 0.05 0.00 0.31 0.00 0.00 61.69 61.77 3lpk s THR 155 Cb 0.07 -0.93 -0.03 0.00 0.01 0.00 0.00 72.50 71.62 3lpk s THR 155 CO -0.03 0.32 -0.14 0.68 -0.69 0.00 0.00 174.62 174.77 3lpk s VAL 156 N 0.42 1.18 -0.26 3.82 -7.23 -0.36 -4.92 120.40 113.05 3lpk s VAL 156 Ca -0.09 -1.53 -0.16 0.00 -1.81 0.00 0.00 61.98 58.39 3lpk s VAL 156 Cb -0.13 -1.31 -0.03 0.00 0.56 0.00 0.00 36.38 35.47 3lpk s VAL 156 CO 0.02 -0.35 0.43 -0.60 -0.31 0.00 0.00 175.10 174.29 3lpk s ARG 157 N -2.28 4.05 0.17 4.82 3.52 -1.26 0.34 118.95 128.31 3lpk s ARG 157 Ca 0.04 0.16 0.03 0.00 -0.13 0.00 0.00 55.73 55.83 3lpk s ARG 157 Cb -0.07 -3.65 -0.05 0.00 -1.56 0.00 0.00 34.95 29.63 3lpk s ARG 157 CO 0.02 -0.29 -0.04 0.00 -0.81 0.00 0.00 175.30 174.18 3lpk s ALA 158 N 2.12 1.47 0.38 6.12 0.00 -0.71 -4.93 121.76 126.21 3lpk s ALA 158 Ca 0.18 -1.58 -0.26 0.00 0.00 0.00 0.00 51.96 50.29 3lpk s ALA 158 Cb -0.16 0.34 -0.09 0.00 0.00 0.00 0.00 23.12 23.22 3lpk s ALA 158 CO 0.09 -0.22 1.14 -0.80 0.00 0.00 0.00 175.76 175.97 3lpk s ASN 159 N -3.19 6.68 -0.03 0.00 0.01 -1.26 -2.30 114.94 114.84 3lpk s ASN 159 Ca 0.22 2.29 -0.01 0.00 -0.71 0.00 0.00 52.86 54.65 3lpk s ASN 159 Cb 0.05 -2.61 0.03 0.00 0.41 0.00 0.00 41.25 39.13 3lpk s ASN 159 CO 0.03 -0.56 0.06 -0.63 -1.51 0.00 0.00 177.10 174.50 3lpk s ILE 160 N -1.42 -0.07 -0.32 0.60 1.01 0.42 -4.69 121.20 116.73 3lpk s ILE 160 Ca 0.55 0.24 -0.15 0.00 0.00 0.00 0.00 60.65 61.29 3lpk s ILE 160 Cb -0.29 -0.13 -0.02 0.00 0.01 0.00 0.00 42.46 42.02 3lpk s ILE 160 CO 0.37 0.10 0.38 0.00 0.00 0.00 0.00 174.94 175.79 3lpk s ALA 161 N 1.26 3.52 -0.54 9.38 0.00 -0.76 -1.75 121.76 132.87 3lpk s ALA 161 Ca -0.07 -1.05 -0.23 0.00 0.00 0.00 0.00 51.96 50.61 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 -0.04 -0.93 0.87 0.00 0.00 0.00 0.00 175.76 175.66 3lpk s ALA 162 N 2.07 3.21 -0.14 0.00 0.00 0.63 -1.26 121.76 126.26 3lpk s ALA 162 Ca 0.13 -1.31 -0.29 0.00 0.00 0.00 0.00 51.96 50.49 3lpk s ALA 162 Cb -0.16 -3.65 -0.03 0.00 0.00 0.00 0.00 23.12 19.28 3lpk s ALA 162 CO 0.11 -2.28 1.52 0.42 0.00 0.00 0.00 175.76 175.53 3lpk s ILE 163 N 3.66 3.83 -0.04 0.00 1.01 0.58 -0.89 121.20 129.35 3lpk s ILE 163 Ca 0.28 0.99 0.14 0.00 0.00 0.00 0.00 60.65 62.05 3lpk s ILE 163 Cb -0.14 -3.71 -0.21 0.00 0.01 0.00 0.00 42.46 38.41 3lpk s ILE 163 CO 0.18 -0.17 0.25 0.35 0.00 0.00 0.00 174.94 175.56 3lpk n THR 164 N 5.75 0.19 -3.78 2.92 -2.24 -0.45 -0.60 114.28 116.06 3lpk n THR 164 Ca 0.17 -0.37 -0.13 0.00 -2.27 0.00 0.00 64.05 61.45 3lpk n THR 164 Cb 0.44 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.57 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 -2.84 0.41 0.09 -0.78 2.02 -1.09 -4.89 118.70 111.62 3lpk s GLU 165 Ca -0.05 0.22 -0.17 0.00 0.02 0.00 0.00 54.97 54.98 3lpk s GLU 165 Cb 0.08 0.19 0.04 0.00 0.10 0.00 0.00 34.13 34.54 3lpk s GLU 165 CO 0.58 -0.07 0.42 -1.54 0.02 0.00 0.00 175.26 174.66 3lpk s SER 166 N -0.27 -0.27 -0.09 -0.19 1.04 -1.26 0.12 113.70 112.78 3lpk s SER 166 Ca -0.04 -0.17 -0.03 0.00 0.48 0.00 0.00 55.95 56.19 3lpk s SER 166 Cb -0.03 0.46 0.04 0.00 0.10 0.00 0.00 66.02 66.59 3lpk s SER 166 CO 0.01 -0.78 0.07 -0.62 0.98 0.00 0.00 173.24 172.90 3lpk s ASP 167 N -2.46 1.59 -1.52 7.02 3.68 0.38 -4.85 116.67 120.52 3lpk s ASP 167 Ca -0.01 -0.17 0.00 0.00 2.13 0.00 0.00 52.55 54.50 3lpk s ASP 167 Cb 0.01 -0.19 0.00 0.00 -1.45 0.00 0.00 42.92 41.28 3lpk s ASP 167 CO -0.08 -0.28 0.00 0.29 0.13 0.00 0.00 175.17 175.23 3lpk n LYS 168 N 5.28 -1.87 -0.06 4.34 5.02 -1.26 -1.44 118.16 128.18 3lpk n LYS 168 Ca -0.05 0.86 -0.05 0.00 -2.02 0.00 0.00 58.31 57.05 3lpk n LYS 168 Cb 0.50 -5.48 -0.02 0.00 -0.02 0.00 0.00 35.03 30.01 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 -3.67 0.16 -2.17 2.13 7.35 -1.26 -3.98 117.46 116.02 3lpk n PHE 169 Ca -0.21 0.07 -0.39 0.00 -0.76 0.00 0.00 57.45 56.17 3lpk n PHE 169 Cb 0.65 -0.40 -0.01 0.00 0.35 0.00 0.00 39.48 40.08 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 -2.15 2.92 -0.14 -5.13 0.40 -1.26 -4.99 117.98 107.63 3lpk s PHE 170 Ca -0.17 1.49 -0.02 0.00 -0.60 0.00 0.00 56.93 57.63 3lpk s PHE 170 Cb 0.02 -3.52 -0.02 0.00 0.51 0.00 0.00 43.02 40.01 3lpk s PHE 170 CO 0.25 -1.71 -0.08 0.42 0.70 0.00 0.00 175.22 174.79 3lpk s ILE 171 N -1.35 3.51 0.04 0.64 1.01 -1.26 -5.02 121.20 118.77 3lpk s ILE 171 Ca 0.58 -0.50 -0.30 0.00 0.00 0.00 0.00 60.65 60.43 3lpk s ILE 171 Cb -0.34 -2.51 -0.08 0.00 0.01 0.00 0.00 42.46 39.54 3lpk s ILE 171 CO 0.43 0.51 1.76 0.21 0.00 0.00 0.00 174.94 177.86 3lpk s ASN 172 N 0.28 6.55 0.00 3.58 3.04 -1.26 -2.42 114.94 124.71 3lpk s ASN 172 Ca -0.06 2.52 0.00 0.00 0.04 0.00 0.00 52.86 55.36 3lpk s ASN 172 Cb -0.15 -2.55 0.00 0.00 -1.54 0.00 0.00 41.25 37.01 3lpk s ASN 172 CO 0.04 -0.96 0.00 0.61 -3.04 0.00 0.00 177.10 173.75 3lpk n GLY 173 N 4.21 0.90 0.21 1.21 0.00 -1.26 -4.91 105.19 105.54 3lpk n GLY 173 Ca 0.18 0.00 0.08 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 -1.83 -3.47 113.55 114.49 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 0.29 0.00 -3.20 -0.87 0.00 0.00 176.83 173.05 3lpk n ASN 175 N -3.57 -2.96 -4.64 4.97 5.15 -1.26 -4.94 115.26 108.01 3lpk n ASN 175 Ca -0.01 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 53.67 3lpk n ASN 175 Cb 0.43 -1.16 -0.09 0.00 -0.53 0.00 0.00 39.78 38.44 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 -2.06 2.88 -0.00 1.20 1.48 -1.26 -4.62 118.94 116.56 3lpk s TRP 176 Ca 0.00 -0.08 0.00 0.00 -1.06 0.00 0.00 56.10 54.96 3lpk s TRP 176 Cb 0.00 -1.50 0.01 0.00 -1.16 0.00 0.00 33.47 30.82 3lpk s TRP 176 CO 0.00 0.45 0.99 0.39 -4.06 0.00 0.00 176.95 174.73 3lpk n GLU 177 N 0.67 2.90 -3.88 3.25 4.71 0.86 -4.85 120.64 124.30 3lpk n GLU 177 Ca -0.12 -1.50 -0.03 0.00 -0.01 0.00 0.00 57.16 55.50 3lpk n GLU 177 Cb 0.52 -1.00 0.02 0.00 -1.01 0.00 0.00 31.44 29.97 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 -1.02 0.06 -0.01 0.62 0.00 -1.15 -0.73 107.32 105.10 3lpk s GLY 178 Ca 0.01 -0.26 0.03 0.00 0.00 0.00 0.00 44.72 44.50 3lpk s GLY 178 CO 0.00 2.46 -0.11 -1.50 0.00 0.00 0.00 173.10 173.95 3lpk s ILE 179 N -2.24 0.86 -0.51 0.90 2.07 0.61 -0.52 121.20 122.38 3lpk s ILE 179 Ca 0.22 -0.45 -0.04 0.00 -1.41 0.00 0.00 60.65 58.96 3lpk s ILE 179 Cb -0.02 -0.72 0.13 0.00 0.13 0.00 0.00 42.46 41.98 3lpk s ILE 179 CO 0.04 0.25 0.32 -0.22 -1.91 0.00 0.00 174.94 173.43 3lpk s LEU 180 N -0.17 5.35 -0.38 8.50 2.96 0.91 -1.57 118.68 134.27 3lpk s LEU 180 Ca 0.03 -2.33 -0.29 0.00 -0.22 0.00 0.00 54.13 51.32 3lpk s LEU 180 Cb -0.05 -1.87 0.01 0.00 0.50 0.00 0.00 46.19 44.77 3lpk s LEU 180 CO -0.00 -0.50 1.35 -0.83 -1.32 0.00 0.00 176.35 175.05 3lpk s GLY 181 N 1.54 1.21 0.00 7.98 0.00 -0.47 -1.77 107.32 115.81 3lpk s GLY 181 Ca 0.11 -0.09 0.25 0.00 0.00 0.00 0.00 44.72 44.99 3lpk s GLY 181 CO -0.04 2.68 1.45 1.04 0.00 0.00 0.00 173.10 178.24 3lpk n LEU 182 N 8.33 2.48 0.00 0.66 4.77 -0.01 -4.20 117.00 129.02 3lpk n LEU 182 Ca 0.16 -0.89 -0.16 0.00 -0.03 0.00 0.00 56.01 55.09 3lpk n LEU 182 Cb 0.48 -0.04 0.11 0.00 -2.33 0.00 0.00 43.42 41.63 3lpk n LEU 182 CO 0.68 0.44 0.46 0.00 -1.33 0.00 0.00 177.39 177.65 3lpk n ALA 183 N 0.92 -0.92 -1.88 -1.18 0.00 -0.02 -4.94 120.51 112.50 3lpk n ALA 183 Ca 0.16 -0.93 -0.30 0.00 0.00 0.00 0.00 53.44 52.37 3lpk n ALA 183 Cb 0.50 -0.05 0.04 0.00 0.00 0.00 0.00 19.45 19.94 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 -2.53 3.41 0.55 0.00 1.51 -0.51 -4.63 117.35 115.16 3lpk s TYR 184 Ca 0.40 1.12 0.24 0.00 -1.01 0.00 0.00 57.07 57.83 3lpk s TYR 184 Cb -0.01 -2.97 1.49 0.00 -0.11 0.00 0.00 41.96 40.36 3lpk s TYR 184 CO 0.29 -1.04 2.09 0.00 -1.11 0.00 0.00 175.55 175.78 3lpk h ALA 185 N -0.56 2.04 -0.91 3.71 0.00 -1.88 -2.81 119.26 118.87 3lpk h ALA 185 Ca -0.45 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 54.63 3lpk h ALA 185 Cb 1.23 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 3lpk h ALA 185 CO 0.63 -0.31 0.59 1.49 0.00 0.00 0.00 179.25 181.65 3lpk h GLU 186 N 0.00 0.59 -0.58 0.00 4.81 -1.88 -0.92 114.58 116.60 3lpk h GLU 186 Ca 0.11 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3lpk h GLU 186 Cb 0.49 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.74 3lpk h GLU 186 CO -0.00 0.39 0.00 0.44 -0.73 0.00 0.00 179.01 179.11 3lpk n ILE 187 N -4.57 1.76 -2.54 2.32 -5.35 -1.06 -4.62 119.36 105.29 3lpk n ILE 187 Ca 0.19 -1.24 -0.36 0.00 -0.27 0.00 0.00 62.75 61.07 3lpk n ILE 187 Cb 0.56 0.15 -0.04 0.00 -1.74 0.00 0.00 39.64 38.58 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 -1.81 3.00 -0.03 -1.28 0.00 -0.35 -4.53 121.76 116.76 3lpk s ALA 188 Ca 0.47 0.67 -0.01 0.00 0.00 0.00 0.00 51.96 53.09 3lpk s ALA 188 Cb 0.30 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 3lpk s ALA 188 CO 0.22 -0.26 0.07 1.03 0.00 0.00 0.00 175.76 176.82 3lpk s ARG 189 N -2.79 3.08 0.45 0.00 3.00 -1.26 -2.74 118.95 118.68 3lpk s ARG 189 Ca 0.62 -0.43 0.25 0.00 0.00 0.00 0.00 55.73 56.16 3lpk s ARG 189 Cb -0.20 -2.87 0.71 0.00 0.00 0.00 0.00 34.95 32.59 3lpk s ARG 189 CO 0.25 0.67 1.74 -1.00 0.00 0.00 0.00 175.30 176.96 3lpk h PRO 190 N 4.44 0.00 -3.19 3.54 0.13 -1.95 -3.47 132.00 131.50 3lpk h PRO 190 Ca -0.50 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.58 3lpk h PRO 190 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 3lpk h PRO 190 CO 0.60 0.13 0.19 0.16 -0.23 0.00 0.00 178.00 178.85 3lpk s ASP 191 N -6.11 0.11 0.00 1.44 -4.77 -1.11 -5.04 116.67 101.20 3lpk s ASP 191 Ca 0.03 -1.14 0.11 0.00 -3.30 0.00 0.00 52.55 48.25 3lpk s ASP 191 Cb 0.08 0.81 0.63 0.00 -1.09 0.00 0.00 42.92 43.34 3lpk s ASP 191 CO 0.64 -1.58 1.09 -0.90 0.70 0.00 0.00 175.17 175.12 3lpk n ASP 192 N -1.29 0.00 0.08 2.11 5.68 -1.25 -2.51 116.55 119.38 3lpk n ASP 192 Ca -0.06 -0.77 0.12 0.00 -0.50 0.00 0.00 54.79 53.58 3lpk n ASP 192 Cb 0.60 0.00 0.22 0.00 -1.14 0.00 0.00 41.12 40.80 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 -2.09 -1.12 4.64 -1.92 -3.41 113.55 109.65 3lpk h SER 193 Ca 0.00 -0.13 -0.62 0.00 -0.47 0.00 0.00 61.79 60.57 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 0.07 1.00 -0.22 -0.87 0.00 0.00 176.83 176.81 3lpk s LEU 194 N -4.48 4.03 0.02 5.97 2.96 -1.04 -4.98 118.68 121.16 3lpk s LEU 194 Ca 0.07 -1.26 -0.34 0.00 -0.22 0.00 0.00 54.13 52.37 3lpk s LEU 194 Cb 0.12 -2.49 -0.13 0.00 0.50 0.00 0.00 46.19 44.20 3lpk s LEU 194 CO 0.69 -1.46 1.72 1.21 -1.32 0.00 0.00 176.35 177.19 3lpk n GLU 195 N 8.13 2.05 -1.19 1.98 2.13 -1.26 -4.90 120.64 127.58 3lpk n GLU 195 Ca 0.15 0.75 -0.31 0.00 0.66 0.00 0.00 57.16 58.41 3lpk n GLU 195 Cb 0.49 -2.54 0.10 0.00 0.27 0.00 0.00 31.44 29.76 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 2.52 2.07 0.18 5.31 0.02 -1.26 -4.54 135.00 139.29 3lpk s PRO 196 Ca 0.87 1.25 -0.13 0.00 0.02 0.00 0.00 61.00 63.01 3lpk s PRO 196 Cb -0.72 -1.87 0.17 0.00 0.02 0.00 0.00 34.50 32.10 3lpk s PRO 196 CO 0.46 -1.80 1.74 0.35 -0.33 0.00 0.00 177.00 177.42 3lpk h PHE 197 N -1.19 0.25 -0.29 6.54 3.57 -1.81 -2.40 116.94 121.61 3lpk h PHE 197 Ca -0.44 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.03 3lpk h PHE 197 Cb 1.24 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.92 3lpk h PHE 197 CO 0.56 0.06 -0.07 0.35 -2.23 0.00 0.00 178.31 176.99 3lpk h PHE 198 N 0.31 0.49 -0.69 0.41 3.57 -1.92 -0.57 116.94 118.54 3lpk h PHE 198 Ca 0.24 -0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 3lpk h PHE 198 Cb 0.28 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.85 3lpk h PHE 198 CO -0.18 0.53 0.19 -0.44 -2.23 0.00 0.00 178.31 176.19 3lpk h ASP 199 N 0.44 1.03 -0.35 0.41 3.32 -1.84 -1.57 116.42 117.86 3lpk h ASP 199 Ca 0.09 -0.22 -0.04 0.00 0.02 0.00 0.00 57.03 56.88 3lpk h ASP 199 Cb 0.40 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 3lpk h ASP 199 CO 0.02 0.98 0.07 0.28 -1.72 0.00 0.00 179.24 178.87 3lpk h SER 200 N 1.02 0.55 -0.16 6.45 0.02 -0.89 -1.95 113.55 118.60 3lpk h SER 200 Ca 0.22 -0.25 0.04 0.00 -0.84 0.00 0.00 61.79 60.96 3lpk h SER 200 Cb 0.33 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.69 3lpk h SER 200 CO -0.00 0.66 -0.09 0.25 -1.14 0.00 0.00 176.83 176.51 3lpk h LEU 201 N 0.42 -0.29 -0.50 5.07 5.85 -0.86 -0.97 115.31 124.04 3lpk h LEU 201 Ca 0.11 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.83 3lpk h LEU 201 Cb 0.33 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 3lpk h LEU 201 CO 0.00 -0.12 0.03 0.58 -0.34 0.00 0.00 178.44 178.60 3lpk h VAL 202 N -0.08 1.26 -0.43 1.05 2.07 -1.26 -2.09 116.25 116.77 3lpk h VAL 202 Ca 0.09 -1.02 -0.08 0.00 0.82 0.00 0.00 66.70 66.51 3lpk h VAL 202 Cb 0.21 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 3lpk h VAL 202 CO -0.21 0.36 -0.07 0.50 0.02 0.00 0.00 177.57 178.17 3lpk h LYS 203 N 0.72 0.75 0.00 1.57 3.64 -1.13 -3.17 116.57 118.95 3lpk h LYS 203 Ca 0.14 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 3lpk h LYS 203 Cb 0.47 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3lpk h LYS 203 CO 0.02 0.80 -0.62 1.04 -2.27 0.00 0.00 179.45 178.42 3lpk n GLN 204 N -4.19 0.15 -2.40 1.90 6.02 -0.39 -4.97 117.38 113.51 3lpk n GLN 204 Ca 0.02 0.03 -0.04 0.00 -0.01 0.00 0.00 57.00 57.00 3lpk n GLN 204 Cb 0.33 -1.58 -0.01 0.00 1.02 0.00 0.00 30.24 30.00 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 -1.80 0.00 -0.55 5.09 -2.24 -0.79 -5.04 114.28 108.95 3lpk n THR 205 Ca 0.04 -0.39 0.08 0.00 -2.27 0.00 0.00 64.05 61.51 3lpk n THR 205 Cb 0.39 0.13 0.28 0.00 -2.10 0.00 0.00 70.33 69.03 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 -0.16 1.05 -1.96 4.78 8.25 -1.26 -4.81 115.22 121.11 3lpk n HIS 206 Ca -0.01 -0.62 -0.42 0.00 -0.26 0.00 0.00 57.72 56.40 3lpk n HIS 206 Cb 0.10 -0.18 -0.03 0.00 1.12 0.00 0.00 29.99 31.01 3lpk n HIS 206 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3lpk s VAL 207 N -1.72 2.97 0.58 1.59 1.01 -1.26 -4.94 120.40 118.62 3lpk s VAL 207 Ca 0.41 0.53 -0.20 0.00 0.00 0.00 0.00 61.98 62.73 3lpk s VAL 207 Cb 0.27 -3.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 3lpk s VAL 207 CO 0.20 0.01 1.11 -2.65 0.00 0.00 0.00 175.10 173.78 3lpk n PRO 208 N 5.03 1.17 -1.99 2.72 -0.02 -1.26 -4.70 135.00 135.95 3lpk n PRO 208 Ca 0.15 0.44 -0.42 0.00 -2.02 0.00 0.00 63.50 61.66 3lpk n PRO 208 Cb 0.40 -2.31 -0.01 0.00 -0.02 0.00 0.00 33.50 31.56 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 -0.87 4.04 -3.62 2.55 5.15 -1.26 -4.26 115.26 117.00 3lpk n ASN 209 Ca 0.13 -2.84 -0.07 0.00 -0.60 0.00 0.00 54.58 51.20 3lpk n ASN 209 Cb 0.46 -1.64 -0.06 0.00 -0.53 0.00 0.00 39.78 38.01 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 3.42 -0.23 0.05 1.20 0.20 -1.26 -1.33 118.68 120.73 3lpk s LEU 210 Ca 0.52 0.34 -0.06 0.00 0.69 0.00 0.00 54.13 55.61 3lpk s LEU 210 Cb 0.10 1.51 -0.01 0.00 -0.43 0.00 0.00 46.19 47.36 3lpk s LEU 210 CO 0.01 -0.16 0.12 0.72 -0.29 0.00 0.00 176.35 176.74 3lpk s PHE 211 N -0.62 0.21 0.05 5.38 -0.71 -1.00 0.57 117.98 121.86 3lpk s PHE 211 Ca 0.04 -0.57 0.03 0.00 -1.04 0.00 0.00 56.93 55.39 3lpk s PHE 211 Cb -0.02 -0.14 -0.02 0.00 -1.21 0.00 0.00 43.02 41.62 3lpk s PHE 211 CO -0.06 -0.42 -0.10 -1.54 -1.34 0.00 0.00 175.22 171.77 3lpk s SER 212 N -2.41 1.09 -0.07 1.98 1.04 -0.26 -0.26 113.70 114.81 3lpk s SER 212 Ca -0.01 -0.54 0.03 0.00 0.48 0.00 0.00 55.95 55.91 3lpk s SER 212 Cb 0.02 0.00 0.01 0.00 0.10 0.00 0.00 66.02 66.15 3lpk s SER 212 CO -0.07 -0.15 -0.14 -0.76 0.98 0.00 0.00 173.24 173.10 3lpk s LEU 213 N -1.52 1.73 -0.35 2.42 1.43 0.11 -0.96 118.68 121.55 3lpk s LEU 213 Ca -0.07 -0.34 0.04 0.00 -1.03 0.00 0.00 54.13 52.73 3lpk s LEU 213 Cb -0.09 -0.91 0.10 0.00 0.03 0.00 0.00 46.19 45.31 3lpk s LEU 213 CO 0.01 0.06 0.06 -1.58 0.23 0.00 0.00 176.35 175.13 3lpk s GLN 214 N 0.55 1.50 -0.20 1.70 0.74 0.07 -1.30 119.66 122.72 3lpk s GLN 214 Ca -0.14 -1.90 -0.16 0.00 0.05 0.00 0.00 55.36 53.21 3lpk s GLN 214 Cb -0.16 -3.22 -0.04 0.00 1.10 0.00 0.00 33.01 30.70 3lpk s GLN 214 CO 0.04 -0.95 0.41 -0.51 -0.55 0.00 0.00 175.29 173.74 3lpk s LEU 215 N 0.87 4.15 -0.39 3.68 1.43 -1.26 -0.90 118.68 126.26 3lpk s LEU 215 Ca 0.11 0.53 -0.07 0.00 -1.03 0.00 0.00 54.13 53.68 3lpk s LEU 215 Cb -0.19 -2.54 0.08 0.00 0.03 0.00 0.00 46.19 43.57 3lpk s LEU 215 CO -0.08 -0.09 0.20 0.00 0.23 0.00 0.00 176.35 176.61 3lpk s GLY 217 N 1.88 3.01 0.27 0.00 0.00 -1.26 -4.75 107.32 106.46 3lpk s GLY 217 Ca 0.03 0.63 0.07 0.00 0.00 0.00 0.00 44.72 45.45 3lpk s GLY 217 CO 0.00 1.16 1.62 0.00 0.00 0.00 0.00 173.10 175.89 3lpk h ALA 218 N 3.76 0.97 0.00 3.20 0.00 -1.94 -3.44 119.26 121.81 3lpk h ALA 218 Ca -0.46 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 53.94 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 0.67 0.70 0.00 0.41 0.00 0.00 0.00 179.25 181.02 3lpk n GLY 219 N 0.13 0.53 3.69 0.00 0.00 -1.26 -5.00 105.19 103.28 3lpk n GLY 219 Ca -0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.25 0.15 0.47 1.61 -0.71 -1.26 -4.89 117.98 111.10 3lpk s PHE 220 Ca 0.00 -0.55 -0.22 0.00 -1.04 0.00 0.00 56.93 55.11 3lpk s PHE 220 Cb 0.00 0.38 -0.07 0.00 -1.21 0.00 0.00 43.02 42.12 3lpk s PHE 220 CO 0.00 -1.09 1.17 -2.14 -1.34 0.00 0.00 175.22 171.82 3lpk s PRO 221 N -3.98 3.69 -0.15 1.99 0.02 -1.26 -4.90 135.00 130.40 3lpk s PRO 221 Ca 0.18 1.77 0.01 0.00 0.02 0.00 0.00 61.00 62.98 3lpk s PRO 221 Cb -0.03 -2.36 0.02 0.00 0.02 0.00 0.00 34.50 32.15 3lpk s PRO 221 CO 0.08 -0.60 -0.18 -0.51 -0.33 0.00 0.00 177.00 175.46 3lpk s LEU 222 N -3.12 1.92 1.11 -5.54 1.43 -1.26 -5.06 118.68 108.15 3lpk s LEU 222 Ca 0.65 -0.56 -0.18 0.00 -1.03 0.00 0.00 54.13 53.01 3lpk s LEU 222 Cb -0.28 -1.32 0.26 0.00 0.03 0.00 0.00 46.19 44.87 3lpk s LEU 222 CO 0.34 -0.00 1.22 0.54 0.23 0.00 0.00 176.35 178.68 3lpk s ASN 223 N 1.24 1.79 0.19 2.29 2.20 -1.26 -4.61 114.94 116.78 3lpk s ASN 223 Ca 0.02 0.38 -0.13 0.00 -0.94 0.00 0.00 52.86 52.19 3lpk s ASN 223 Cb -0.14 -0.47 0.19 0.00 -2.00 0.00 0.00 41.25 38.83 3lpk s ASN 223 CO -0.09 -3.56 1.72 -0.61 -2.94 0.00 0.00 177.10 171.62 3lpk h GLN 224 N -2.21 0.23 -0.26 3.55 4.15 -1.99 -0.00 115.11 118.59 3lpk h GLN 224 Ca -0.44 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 58.92 3lpk h GLN 224 Cb 1.26 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.88 3lpk h GLN 224 CO 0.33 0.15 -0.01 0.77 -1.93 0.00 0.00 178.83 178.14 3lpk h SER 225 N 0.24 0.45 -0.48 -0.69 0.02 -2.00 -2.98 113.55 108.11 3lpk h SER 225 Ca 0.25 -0.32 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 3lpk h SER 225 Cb 0.33 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 3lpk h SER 225 CO -0.32 0.66 0.27 -0.33 -1.14 0.00 0.00 176.83 175.97 3lpk h GLU 226 N 0.23 0.66 0.00 3.45 5.08 -1.83 -2.51 114.58 119.66 3lpk h GLU 226 Ca 0.07 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3lpk h GLU 226 Cb 0.44 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 3lpk h GLU 226 CO 0.02 0.52 -0.06 -0.24 -1.00 0.00 0.00 179.01 178.24 3lpk h VAL 227 N 0.63 0.24 0.00 3.13 3.04 -1.01 -0.22 116.25 122.06 3lpk h VAL 227 Ca 0.17 -0.45 -0.21 0.00 -1.01 0.00 0.00 66.70 65.20 3lpk h VAL 227 Cb 0.04 1.35 -0.03 0.00 -2.01 0.00 0.00 31.29 30.64 3lpk h VAL 227 CO -0.03 0.06 -1.14 -0.07 -1.01 0.00 0.00 177.57 175.38 3lpk h LEU 228 N 0.00 0.00 0.00 3.16 3.38 -1.30 -3.35 115.31 117.20 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 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3lpk h LEU 228 CO 0.01 0.91 -1.10 0.00 0.09 0.00 0.00 178.44 178.35 3lpk n ALA 229 N -2.39 4.17 -2.19 1.53 0.00 -0.92 -4.98 120.51 115.73 3lpk n ALA 229 Ca -0.05 -0.54 -0.33 0.00 0.00 0.00 0.00 53.44 52.53 3lpk n ALA 229 Cb 0.94 -0.83 -0.06 0.00 0.00 0.00 0.00 19.45 19.50 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 -3.35 6.78 -0.15 0.00 0.15 -0.14 -5.05 113.70 111.94 3lpk s SER 230 Ca 0.05 1.22 -0.27 0.00 0.70 0.00 0.00 55.95 57.65 3lpk s SER 230 Cb 0.16 -2.35 -0.01 0.00 -1.71 0.00 0.00 66.02 62.11 3lpk s SER 230 CO 0.85 -0.14 0.92 -0.69 1.20 0.00 0.00 173.24 175.38 3lpk s VAL 231 N -1.88 4.82 -1.93 4.45 1.01 -1.26 -4.71 120.40 120.90 3lpk s VAL 231 Ca 0.51 1.84 0.23 0.00 0.00 0.00 0.00 61.98 64.56 3lpk s VAL 231 Cb -0.11 -4.23 0.04 0.00 0.00 0.00 0.00 36.38 32.08 3lpk s VAL 231 CO 0.19 -0.00 1.19 0.61 0.00 0.00 0.00 175.10 177.08 3lpk n GLY 232 N 3.29 -0.15 0.00 4.51 0.00 0.17 -4.92 105.19 108.09 3lpk n GLY 232 Ca 0.07 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 1.41 0.71 2.90 -0.02 0.00 -1.13 -0.53 105.19 108.52 3lpk n GLY 233 Ca 0.10 -1.77 -0.12 0.00 0.00 0.00 0.00 46.02 44.23 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 0.09 -0.26 1.61 0.01 -0.08 -1.36 113.70 109.71 3lpk s SER 234 Ca 0.00 -0.11 0.02 0.00 1.31 0.00 0.00 55.95 57.17 3lpk s SER 234 Cb 0.00 0.02 0.07 0.00 0.21 0.00 0.00 66.02 66.31 3lpk s SER 234 CO 0.00 -0.06 -0.07 -0.32 0.41 0.00 0.00 173.24 173.21 3lpk s MET 235 N -0.31 1.91 -0.37 12.44 0.00 -1.26 -0.75 119.30 130.95 3lpk s MET 235 Ca -0.03 -1.30 -0.17 0.00 0.00 0.00 0.00 55.69 54.19 3lpk s MET 235 Cb -0.02 -2.81 0.00 0.00 0.00 0.00 0.00 34.83 32.00 3lpk s MET 235 CO -0.00 -0.64 0.46 0.42 0.00 0.00 0.00 175.02 175.27 3lpk s ILE 236 N 1.18 5.06 -0.30 10.11 -1.09 -0.14 -4.84 121.20 131.18 3lpk s ILE 236 Ca -0.05 0.06 -0.19 0.00 -2.23 0.00 0.00 60.65 58.23 3lpk s ILE 236 Cb -0.19 -3.97 -0.01 0.00 -1.58 0.00 0.00 42.46 36.71 3lpk s ILE 236 CO -0.06 -0.27 0.59 -0.63 -1.23 0.00 0.00 174.94 173.33 3lpk s ILE 237 N 2.26 4.97 0.00 2.92 -1.09 -1.26 -1.10 121.20 127.91 3lpk s ILE 237 Ca 0.15 0.78 0.00 0.00 -2.23 0.00 0.00 60.65 59.35 3lpk s ILE 237 Cb -0.16 -3.96 0.00 0.00 -1.58 0.00 0.00 42.46 36.76 3lpk s ILE 237 CO 0.13 -0.11 0.00 0.61 -1.23 0.00 0.00 174.94 174.34 3lpk n GLY 238 N 4.48 0.74 1.79 6.18 0.00 0.19 -4.77 105.19 113.81 3lpk n GLY 238 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.41 1.04 2.97 -0.02 0.00 -1.24 -4.38 105.19 101.14 3lpk n GLY 239 Ca 0.00 -1.04 -0.29 0.00 0.00 0.00 0.00 46.02 44.69 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 -2.36 1.34 -0.36 -0.61 1.01 -1.26 -4.02 121.20 114.93 3lpk s ILE 240 Ca 0.10 -0.51 -0.13 0.00 0.00 0.00 0.00 60.65 60.12 3lpk s ILE 240 Cb -0.01 -1.30 -0.00 0.00 0.01 0.00 0.00 42.46 41.15 3lpk s ILE 240 CO 0.03 0.40 0.25 -0.62 0.00 0.00 0.00 174.94 175.00 3lpk s ASP 241 N 1.58 6.03 0.30 3.58 2.15 -1.26 -4.74 116.67 124.30 3lpk s ASP 241 Ca 0.05 -0.59 0.22 0.00 0.43 0.00 0.00 52.55 52.65 3lpk s ASP 241 Cb -0.13 -2.13 1.10 0.00 -0.30 0.00 0.00 42.92 41.46 3lpk s ASP 241 CO -0.10 -0.30 1.66 1.41 -0.17 0.00 0.00 175.17 177.67 3lpk n HIS 242 N 5.11 0.74 0.79 -5.34 8.25 -1.26 -2.26 115.22 121.25 3lpk n HIS 242 Ca -0.12 0.36 0.13 0.00 -0.26 0.00 0.00 57.72 57.83 3lpk n HIS 242 Cb 0.49 -1.07 0.50 0.00 1.12 0.00 0.00 29.99 31.03 3lpk n HIS 242 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3lpk n SER 243 N -2.23 0.43 -0.29 0.41 3.41 -1.26 -3.56 113.62 110.53 3lpk n SER 243 Ca -0.00 0.54 0.14 0.00 -0.26 0.00 0.00 58.87 59.29 3lpk n SER 243 Cb 0.08 -0.66 0.61 0.00 -0.26 0.00 0.00 64.21 63.99 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 -1.90 0.95 -3.96 1.04 4.77 -0.96 -4.82 117.00 112.12 3lpk n LEU 244 Ca 0.06 -0.28 -0.10 0.00 -0.03 0.00 0.00 56.01 55.67 3lpk n LEU 244 Cb 0.38 -0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.36 3lpk n LEU 244 CO 0.28 0.16 0.06 -0.72 -1.33 0.00 0.00 177.39 175.84 3lpk s TYR 245 N -2.14 0.38 0.19 -1.77 1.13 -1.23 -1.41 117.35 112.49 3lpk s TYR 245 Ca 0.37 -0.73 0.08 0.00 -1.41 0.00 0.00 57.07 55.38 3lpk s TYR 245 Cb 0.21 0.03 -0.05 0.00 -1.10 0.00 0.00 41.96 41.06 3lpk s TYR 245 CO 0.39 -0.81 -0.15 0.95 -2.51 0.00 0.00 175.55 173.41 3lpk s THR 246 N -3.98 1.73 0.00 -3.49 -4.23 -0.69 -4.79 115.64 100.19 3lpk s THR 246 Ca 0.19 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 3lpk s THR 246 Cb 0.02 -1.97 0.00 0.00 1.34 0.00 0.00 72.50 71.89 3lpk s THR 246 CO 0.03 -0.53 0.00 0.61 -0.54 0.00 0.00 174.62 174.19 3lpk n GLY 247 N -0.19 -1.13 3.95 3.99 0.00 -1.26 -3.59 105.19 106.96 3lpk n GLY 247 Ca -0.09 -1.23 -0.24 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 6.34 -0.12 1.61 0.01 -1.26 -4.96 113.70 111.31 3lpk s SER 248 Ca 0.00 0.22 -0.16 0.00 1.31 0.00 0.00 55.95 57.32 3lpk s SER 248 Cb 0.00 -1.93 -0.05 0.00 0.21 0.00 0.00 66.02 64.26 3lpk s SER 248 CO 0.00 -0.05 0.38 -0.76 0.41 0.00 0.00 173.24 173.21 3lpk s LEU 249 N -3.65 4.29 -0.06 2.44 1.43 -1.26 -4.49 118.68 117.37 3lpk s LEU 249 Ca 0.36 0.68 0.05 0.00 -1.03 0.00 0.00 54.13 54.19 3lpk s LEU 249 Cb -0.10 -2.52 -0.02 0.00 0.03 0.00 0.00 46.19 43.58 3lpk s LEU 249 CO 0.30 0.09 -0.21 0.26 0.23 0.00 0.00 176.35 177.02 3lpk s TRP 250 N 0.31 2.55 -0.09 0.29 0.52 -0.08 -4.90 118.94 117.55 3lpk s TRP 250 Ca 0.21 -0.55 -0.01 0.00 0.02 0.00 0.00 56.10 55.77 3lpk s TRP 250 Cb -0.14 -1.64 -0.03 0.00 -1.15 0.00 0.00 33.47 30.51 3lpk s TRP 250 CO 0.08 -0.10 -0.04 0.71 0.02 0.00 0.00 176.95 177.61 3lpk s TYR 251 N -0.26 3.04 0.03 -1.98 1.51 -1.26 -0.53 117.35 117.90 3lpk s TYR 251 Ca -0.00 0.05 0.07 0.00 -1.01 0.00 0.00 57.07 56.18 3lpk s TYR 251 Cb -0.13 -1.77 -0.03 0.00 -0.11 0.00 0.00 41.96 39.92 3lpk s TYR 251 CO 0.03 0.34 -0.18 -0.08 -1.11 0.00 0.00 175.55 174.55 3lpk s THR 252 N -0.69 2.77 0.47 -0.71 -1.32 0.19 -3.50 115.64 112.85 3lpk s THR 252 Ca 0.11 -1.13 -0.23 0.00 -1.21 0.00 0.00 61.69 59.22 3lpk s THR 252 Cb -0.12 -2.15 -0.07 0.00 -1.51 0.00 0.00 72.50 68.66 3lpk s THR 252 CO 0.02 0.38 1.21 -2.84 -2.21 0.00 0.00 174.62 171.18 3lpk s PRO 253 N -1.31 3.65 -0.49 7.08 0.02 -1.26 -0.55 135.00 142.13 3lpk s PRO 253 Ca 0.14 1.88 -0.25 0.00 0.02 0.00 0.00 61.00 62.80 3lpk s PRO 253 Cb -0.10 -2.39 0.03 0.00 0.02 0.00 0.00 34.50 32.05 3lpk s PRO 253 CO 0.04 -0.67 0.91 0.42 -0.33 0.00 0.00 177.00 177.36 3lpk s ILE 254 N -1.48 4.48 0.17 2.83 1.01 -0.36 -4.60 121.20 123.24 3lpk s ILE 254 Ca 0.65 0.54 -0.15 0.00 0.00 0.00 0.00 60.65 61.69 3lpk s ILE 254 Cb -0.31 -4.45 0.08 0.00 0.01 0.00 0.00 42.46 37.79 3lpk s ILE 254 CO 0.38 -0.90 1.70 -0.09 0.00 0.00 0.00 174.94 176.03 3lpk h ARG 255 N 9.14 0.14 -2.95 2.79 2.43 -1.43 -3.44 114.38 121.05 3lpk h ARG 255 Ca -0.25 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 58.79 3lpk h ARG 255 Cb 1.08 -0.03 -0.22 0.00 -0.42 0.00 0.00 29.97 30.38 3lpk h ARG 255 CO 1.03 0.09 -0.28 0.50 -1.51 0.00 0.00 179.97 179.81 3lpk s ARG 256 N -6.17 0.57 -0.95 0.20 3.52 -1.26 -5.09 118.95 109.77 3lpk s ARG 256 Ca -0.13 0.09 -0.18 0.00 -0.13 0.00 0.00 55.73 55.37 3lpk s ARG 256 Cb 0.14 0.26 0.13 0.00 -1.56 0.00 0.00 34.95 33.93 3lpk s ARG 256 CO 0.71 -0.13 1.15 -1.21 -0.81 0.00 0.00 175.30 175.02 3lpk s GLU 257 N -0.72 3.64 0.00 5.12 2.02 -1.26 -4.07 118.70 123.43 3lpk s GLU 257 Ca -0.08 -1.83 0.00 0.00 0.02 0.00 0.00 54.97 53.08 3lpk s GLU 257 Cb -0.04 -4.93 0.00 0.00 0.10 0.00 0.00 34.13 29.26 3lpk s GLU 257 CO 0.03 -1.77 0.00 -2.67 0.02 0.00 0.00 175.26 170.86 3lpk n TRP 258 N 6.48 -0.05 -2.47 1.61 4.27 -1.26 -4.63 117.44 121.39 3lpk n TRP 258 Ca 0.25 0.00 -0.25 0.00 -3.89 0.00 0.00 57.50 53.61 3lpk n TRP 258 Cb 0.49 0.03 0.13 0.00 -1.36 0.00 0.00 31.31 30.60 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 -0.07 1.52 -1.11 -2.67 2.02 -1.26 -1.42 117.35 114.36 3lpk s TYR 259 Ca 0.00 -0.19 -0.16 0.00 -0.37 0.00 0.00 57.07 56.36 3lpk s TYR 259 Cb 0.00 -3.21 0.15 0.00 -0.40 0.00 0.00 41.96 38.50 3lpk s TYR 259 CO 0.00 -1.93 1.33 0.71 -1.57 0.00 0.00 175.55 174.09 3lpk s TYR 260 N -3.30 3.34 0.09 2.71 1.51 -1.26 -4.82 117.35 115.62 3lpk s TYR 260 Ca 0.68 -1.85 -0.26 0.00 -1.01 0.00 0.00 57.07 54.64 3lpk s TYR 260 Cb -0.05 -4.31 -0.06 0.00 -0.11 0.00 0.00 41.96 37.43 3lpk s TYR 260 CO 0.46 -1.44 0.80 -2.00 -1.11 0.00 0.00 175.55 172.26 3lpk s GLU 261 N 2.06 4.55 0.36 -0.62 2.12 -1.26 -2.31 118.70 123.60 3lpk s GLU 261 Ca 0.39 1.15 0.04 0.00 0.36 0.00 0.00 54.97 56.91 3lpk s GLU 261 Cb -0.03 -3.34 -0.04 0.00 0.26 0.00 0.00 34.13 30.98 3lpk s GLU 261 CO -0.03 0.35 0.13 0.14 -0.54 0.00 0.00 175.26 175.31 3lpk s VAL 262 N -0.35 0.61 -0.15 3.70 -7.23 -0.18 -1.11 120.40 115.69 3lpk s VAL 262 Ca 0.39 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 3lpk s VAL 262 Cb -0.22 -2.48 0.03 0.00 0.56 0.00 0.00 36.38 34.27 3lpk s VAL 262 CO 0.25 0.00 -0.13 -0.63 -0.31 0.00 0.00 175.10 174.28 3lpk s ILE 263 N -3.35 1.49 -0.13 -0.62 1.01 -1.26 -4.05 121.20 114.29 3lpk s ILE 263 Ca 0.30 -0.63 -0.19 0.00 0.00 0.00 0.00 60.65 60.14 3lpk s ILE 263 Cb 0.04 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 41.04 3lpk s ILE 263 CO 0.16 0.40 0.50 -0.63 0.00 0.00 0.00 174.94 175.37 3lpk s ILE 264 N 1.51 5.16 -0.54 2.92 1.01 -1.26 -2.11 121.20 127.89 3lpk s ILE 264 Ca 0.04 0.99 0.11 0.00 0.00 0.00 0.00 60.65 61.79 3lpk s ILE 264 Cb -0.13 -3.84 -0.11 0.00 0.01 0.00 0.00 42.46 38.38 3lpk s ILE 264 CO -0.10 0.30 0.47 1.33 0.00 0.00 0.00 174.94 176.94 3lpk n VAL 265 N 3.82 0.00 -3.58 2.92 0.24 0.67 -4.74 118.33 117.66 3lpk n VAL 265 Ca -0.06 -0.25 -0.13 0.00 -2.04 0.00 0.00 64.34 61.86 3lpk n VAL 265 Cb 0.51 1.01 -0.06 0.00 -1.47 0.00 0.00 33.84 33.83 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 -2.01 0.73 -0.02 7.34 3.52 -1.23 -4.79 118.95 122.49 3lpk s ARG 266 Ca 0.04 0.38 0.02 0.00 -0.13 0.00 0.00 55.73 56.04 3lpk s ARG 266 Cb 0.08 0.35 0.00 0.00 -1.56 0.00 0.00 34.95 33.83 3lpk s ARG 266 CO 0.44 -0.19 -0.07 0.08 -0.81 0.00 0.00 175.30 174.75 3lpk s VAL 267 N -0.67 0.60 0.07 7.11 1.01 -1.26 -0.56 120.40 126.70 3lpk s VAL 267 Ca -0.03 -0.27 0.06 0.00 0.00 0.00 0.00 61.98 61.74 3lpk s VAL 267 Cb -0.02 -0.54 -0.03 0.00 0.00 0.00 0.00 36.38 35.79 3lpk s VAL 267 CO 0.02 0.19 -0.16 -1.61 0.00 0.00 0.00 175.10 173.55 3lpk s GLU 268 N 0.19 0.91 -0.24 2.72 2.02 -0.51 -0.75 118.70 123.04 3lpk s GLU 268 Ca -0.02 -0.97 0.02 0.00 0.02 0.00 0.00 54.97 54.01 3lpk s GLU 268 Cb -0.07 -0.97 0.06 0.00 0.10 0.00 0.00 34.13 33.25 3lpk s GLU 268 CO 0.00 0.22 -0.07 0.42 0.02 0.00 0.00 175.26 175.85 3lpk s ILE 269 N -1.18 1.75 -1.40 -1.63 -1.09 -0.26 -1.48 121.20 115.91 3lpk s ILE 269 Ca 0.00 -1.36 -0.06 0.00 -2.23 0.00 0.00 60.65 57.01 3lpk s ILE 269 Cb -0.10 -1.96 0.03 0.00 -1.58 0.00 0.00 42.46 38.86 3lpk s ILE 269 CO 0.02 -0.07 0.81 0.59 -1.23 0.00 0.00 174.94 175.07 3lpk n ASN 270 N 4.59 -2.65 0.00 3.58 4.13 -0.09 -1.28 115.26 123.53 3lpk n ASN 270 Ca -0.13 -0.80 0.00 0.00 1.68 0.00 0.00 54.58 55.33 3lpk n ASN 270 Cb 0.43 -3.98 0.00 0.00 -1.54 0.00 0.00 39.78 34.69 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 -1.64 2.78 3.66 7.41 0.00 -1.26 -4.98 105.19 111.16 3lpk n GLY 271 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 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 4.25 0.15 1.61 0.74 -0.40 -4.96 119.66 121.05 3lpk s GLN 272 Ca 0.00 0.96 -0.31 0.00 0.05 0.00 0.00 55.36 56.06 3lpk s GLN 272 Cb 0.00 -3.60 -0.11 0.00 1.10 0.00 0.00 33.01 30.40 3lpk s GLN 272 CO 0.00 -0.38 1.81 0.34 -0.55 0.00 0.00 175.29 176.50 3lpk s ASP 273 N 1.22 6.40 0.56 6.67 2.15 -1.26 -1.10 116.67 131.31 3lpk s ASP 273 Ca 0.36 2.80 0.32 0.00 0.43 0.00 0.00 52.55 56.47 3lpk s ASP 273 Cb -0.16 -2.58 1.63 0.00 -0.30 0.00 0.00 42.92 41.52 3lpk s ASP 273 CO 0.11 -1.00 2.11 0.25 -0.17 0.00 0.00 175.17 176.47 3lpk h LEU 274 N 8.10 0.00 -0.96 -1.34 5.85 -1.31 -3.47 115.31 122.18 3lpk h LEU 274 Ca -0.45 0.00 -0.42 0.00 0.84 0.00 0.00 57.88 57.85 3lpk h LEU 274 Cb 1.21 0.00 0.08 0.00 0.37 0.00 0.00 40.66 42.33 3lpk h LEU 274 CO 0.95 0.07 -0.71 1.17 -0.34 0.00 0.00 178.44 179.58 3lpk n LYS 275 N -3.39 -7.05 -4.11 1.25 4.81 -1.26 -5.02 118.16 103.39 3lpk n LYS 275 Ca -0.01 0.75 -0.23 0.00 -0.87 0.00 0.00 58.31 57.95 3lpk n LYS 275 Cb 0.22 -5.74 -0.05 0.00 0.02 0.00 0.00 35.03 29.49 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 -6.35 2.92 0.10 1.64 -1.94 -1.26 -5.03 119.30 109.37 3lpk s MET 276 Ca 0.56 -1.01 -0.32 0.00 -1.71 0.00 0.00 55.69 53.21 3lpk s MET 276 Cb -0.26 -2.58 -0.11 0.00 2.01 0.00 0.00 34.83 33.88 3lpk s MET 276 CO 0.76 0.42 1.81 -3.47 -0.01 0.00 0.00 175.02 174.53 3lpk n ASP 277 N -0.99 3.81 0.33 3.03 -0.08 -1.26 -4.80 116.55 116.60 3lpk n ASP 277 Ca -0.08 1.00 0.18 0.00 -1.51 0.00 0.00 54.79 54.38 3lpk n ASP 277 Cb 0.57 -1.50 0.98 0.00 2.34 0.00 0.00 41.12 43.52 3lpk n ASP 277 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3lpk h LYS 279 N 0.00 0.29 -0.64 0.00 3.64 -1.80 -2.34 116.57 115.73 3lpk h LYS 279 Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3lpk h LYS 279 Cb 0.34 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 3lpk h LYS 279 CO 0.00 0.36 0.41 0.93 -2.27 0.00 0.00 179.45 178.88 3lpk h GLU 280 N 0.28 0.85 0.00 1.90 4.39 -1.24 -2.26 114.58 118.49 3lpk h GLU 280 Ca 0.06 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 3lpk h GLU 280 Cb 0.28 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 28.74 3lpk h GLU 280 CO 0.01 0.57 -0.08 1.88 -1.16 0.00 0.00 179.01 180.23 3lpk h TYR 281 N 0.87 0.00 -0.03 4.33 0.99 -1.56 -2.96 116.97 118.61 3lpk h TYR 281 Ca 0.23 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.95 3lpk h TYR 281 Cb -0.08 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 37.64 3lpk h TYR 281 CO 0.00 0.08 -0.41 0.09 -0.00 0.00 0.00 178.16 177.92 3lpk n ASN 282 N -3.53 1.84 -4.46 3.88 3.02 -0.87 -4.42 115.26 110.72 3lpk n ASN 282 Ca -0.02 -3.81 -0.43 0.00 -0.03 0.00 0.00 54.58 50.29 3lpk n ASN 282 Cb 0.21 -0.53 -0.09 0.00 -0.61 0.00 0.00 39.78 38.76 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 -3.20 3.21 -2.14 3.10 5.04 -1.07 -0.04 117.35 122.25 3lpk s TYR 283 Ca 0.38 -0.56 0.20 0.00 -2.44 0.00 0.00 57.07 54.65 3lpk s TYR 283 Cb 0.36 -2.77 0.37 0.00 0.35 0.00 0.00 41.96 40.28 3lpk s TYR 283 CO -0.05 -0.66 1.32 -0.40 -1.34 0.00 0.00 175.55 174.42 3lpk n ASP 284 N 5.33 3.23 -3.59 4.32 5.68 -1.26 -3.42 116.55 126.83 3lpk n ASP 284 Ca -0.10 -1.93 -0.04 0.00 -0.50 0.00 0.00 54.79 52.22 3lpk n ASP 284 Cb 0.47 -0.22 -0.02 0.00 -1.14 0.00 0.00 41.12 40.21 3lpk n ASP 284 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 3lpk s LYS 285 N -1.35 0.40 -0.07 0.11 -2.85 0.94 -4.71 119.74 112.22 3lpk s LYS 285 Ca 0.34 -0.16 0.03 0.00 -1.00 0.00 0.00 55.97 55.17 3lpk s LYS 285 Cb 0.20 0.17 0.01 0.00 -2.06 0.00 0.00 37.83 36.15 3lpk s LYS 285 CO 0.28 -0.18 -0.15 -1.12 0.10 0.00 0.00 175.35 174.28 3lpk s SER 286 N -2.36 2.06 0.12 0.03 0.01 -1.26 -0.25 113.70 112.06 3lpk s SER 286 Ca 0.10 -0.35 0.03 0.00 1.31 0.00 0.00 55.95 57.04 3lpk s SER 286 Cb -0.00 -0.95 -0.04 0.00 0.21 0.00 0.00 66.02 65.24 3lpk s SER 286 CO -0.05 0.06 -0.09 0.27 0.41 0.00 0.00 173.24 173.84 3lpk s ILE 287 N 0.61 0.95 -0.32 1.44 -4.36 -0.46 -1.02 121.20 118.05 3lpk s ILE 287 Ca -0.15 -1.97 -0.10 0.00 -0.26 0.00 0.00 60.65 58.16 3lpk s ILE 287 Cb -0.16 -1.74 -0.01 0.00 1.25 0.00 0.00 42.46 41.80 3lpk s ILE 287 CO 0.05 -0.78 0.17 -0.69 0.24 0.00 0.00 174.94 173.92 3lpk s VAL 288 N -3.37 4.74 -0.29 8.37 1.01 -0.98 -0.13 120.40 129.75 3lpk s VAL 288 Ca 0.14 -0.39 -0.02 0.00 0.00 0.00 0.00 61.98 61.71 3lpk s VAL 288 Cb 0.03 -3.43 0.09 0.00 0.00 0.00 0.00 36.38 33.08 3lpk s VAL 288 CO -0.02 0.04 0.09 -0.62 0.00 0.00 0.00 175.10 174.60 3lpk s ASP 289 N 1.63 3.79 0.18 3.32 2.15 -0.20 -4.49 116.67 123.06 3lpk s ASP 289 Ca 0.05 -1.46 0.22 0.00 0.43 0.00 0.00 52.55 51.79 3lpk s ASP 289 Cb -0.17 -0.74 0.88 0.00 -0.30 0.00 0.00 42.92 42.60 3lpk s ASP 289 CO 0.07 -0.40 1.66 -1.54 -0.17 0.00 0.00 175.17 174.79 3lpk n SER 290 N 4.95 0.49 -0.35 -0.34 3.41 -1.26 -2.59 113.62 117.92 3lpk n SER 290 Ca -0.04 0.61 0.06 0.00 -0.26 0.00 0.00 58.87 59.24 3lpk n SER 290 Cb 0.43 -0.72 0.24 0.00 -0.26 0.00 0.00 64.21 63.90 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 0.17 -0.13 3.02 5.00 0.00 -1.26 -4.60 105.19 107.39 3lpk n GLY 291 Ca 0.03 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.79 0.87 -0.03 2.61 2.01 -1.07 -5.03 115.64 113.22 3lpk s THR 292 Ca 0.21 -0.41 -0.21 0.00 0.31 0.00 0.00 61.69 61.59 3lpk s THR 292 Cb 0.11 -0.77 -0.13 0.00 0.01 0.00 0.00 72.50 71.71 3lpk s THR 292 CO 0.16 0.27 0.91 0.74 -0.69 0.00 0.00 174.62 176.00 3lpk h THR 293 N 5.34 0.44 -4.43 -0.82 2.02 -1.86 0.36 112.91 113.96 3lpk h THR 293 Ca -0.33 -0.74 -0.49 0.00 0.77 0.00 0.00 66.41 65.63 3lpk h THR 293 Cb 1.17 0.70 0.09 0.00 -1.74 0.00 0.00 68.15 68.38 3lpk h THR 293 CO 0.49 0.10 0.38 0.20 0.37 0.00 0.00 175.52 177.06 3lpk s ASN 294 N -5.09 4.91 -0.33 4.18 0.01 -1.26 -1.19 114.94 116.17 3lpk s ASN 294 Ca -0.12 1.12 -0.21 0.00 -0.71 0.00 0.00 52.86 52.94 3lpk s ASN 294 Cb 0.01 -1.83 -0.00 0.00 0.41 0.00 0.00 41.25 39.84 3lpk s ASN 294 CO 0.41 -1.68 0.68 -0.22 -1.51 0.00 0.00 177.10 174.78 3lpk s LEU 295 N -5.55 4.16 -0.12 0.60 2.96 -0.67 -2.40 118.68 117.66 3lpk s LEU 295 Ca 0.60 0.39 -0.03 0.00 -0.22 0.00 0.00 54.13 54.86 3lpk s LEU 295 Cb -0.12 -2.89 -0.03 0.00 0.50 0.00 0.00 46.19 43.65 3lpk s LEU 295 CO 0.52 -0.57 -0.00 -0.13 -1.32 0.00 0.00 176.35 174.85 3lpk s ARG 296 N 2.77 3.34 0.06 1.98 0.52 -0.20 -1.75 118.95 125.67 3lpk s ARG 296 Ca 0.27 -0.43 0.08 0.00 -0.52 0.00 0.00 55.73 55.12 3lpk s ARG 296 Cb -0.14 -2.89 -0.03 0.00 0.52 0.00 0.00 34.95 32.41 3lpk s ARG 296 CO 0.13 0.50 -0.21 -0.51 0.02 0.00 0.00 175.30 175.23 3lpk s LEU 297 N -0.31 2.21 0.35 2.53 1.43 0.09 -0.54 118.68 124.44 3lpk s LEU 297 Ca 0.06 -0.58 -0.27 0.00 -1.03 0.00 0.00 54.13 52.32 3lpk s LEU 297 Cb -0.12 -0.98 -0.12 0.00 0.03 0.00 0.00 46.19 45.00 3lpk s LEU 297 CO 0.02 0.14 1.19 -2.65 0.23 0.00 0.00 176.35 175.28 3lpk n PRO 298 N 1.62 1.83 -0.25 1.29 -0.02 -1.26 0.20 135.00 138.41 3lpk n PRO 298 Ca -0.18 0.64 -0.05 0.00 -2.02 0.00 0.00 63.50 61.90 3lpk n PRO 298 Cb 0.53 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.78 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 0.45 -0.23 0.02 -0.52 4.81 -0.97 -0.33 118.16 121.39 3lpk n LYS 299 Ca 0.07 0.92 -0.02 0.00 -0.87 0.00 0.00 58.31 58.41 3lpk n LYS 299 Cb 0.36 -1.36 0.23 0.00 0.02 0.00 0.00 35.03 34.28 3lpk n LYS 299 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 3lpk h LYS 300 N 0.00 0.47 -0.25 1.64 1.57 -1.92 -1.09 116.57 116.99 3lpk h LYS 300 Ca 0.13 -0.16 -0.20 0.00 -1.87 0.00 0.00 60.65 58.56 3lpk h LYS 300 Cb 0.29 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.56 3lpk h LYS 300 CO -0.58 0.65 -0.61 0.28 -0.57 0.00 0.00 179.45 178.61 3lpk h VAL 301 N 0.42 1.27 -0.22 0.50 2.07 -1.10 -2.28 116.25 116.91 3lpk h VAL 301 Ca 0.07 -1.80 0.00 0.00 0.82 0.00 0.00 66.70 65.79 3lpk h VAL 301 Cb 0.59 1.73 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 3lpk h VAL 301 CO 0.04 0.58 0.14 0.15 0.02 0.00 0.00 177.57 178.51 3lpk h PHE 302 N 0.63 0.29 -0.57 1.57 3.57 -0.37 0.25 116.94 122.31 3lpk h PHE 302 Ca -0.00 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.51 3lpk h PHE 302 Cb 1.23 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.84 3lpk h PHE 302 CO 0.08 0.20 0.37 0.93 -2.23 0.00 0.00 178.31 177.65 3lpk h GLU 303 N 0.29 0.72 -0.30 1.11 5.08 -1.19 0.06 114.58 120.35 3lpk h GLU 303 Ca 0.08 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 3lpk h GLU 303 Cb -0.01 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 3lpk h GLU 303 CO -0.02 0.48 0.02 0.00 -1.00 0.00 0.00 179.01 178.49 3lpk h ALA 304 N 1.22 0.40 -0.10 3.43 0.00 -1.10 -2.15 119.26 120.97 3lpk h ALA 304 Ca 0.22 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3lpk h ALA 304 Cb -0.05 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3lpk h ALA 304 CO -0.06 0.12 0.06 0.00 0.00 0.00 0.00 179.25 179.37 3lpk h ALA 305 N 0.86 0.12 -0.89 0.00 0.00 -0.22 -1.76 119.26 117.37 3lpk h ALA 305 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3lpk h ALA 305 Cb 0.39 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 3lpk h ALA 305 CO 0.01 -0.37 0.56 0.28 0.00 0.00 0.00 179.25 179.73 3lpk h VAL 306 N 0.11 1.24 -0.42 0.00 2.07 -0.98 0.23 116.25 118.50 3lpk h VAL 306 Ca 0.03 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.09 3lpk h VAL 306 Cb 0.01 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.72 3lpk h VAL 306 CO -0.01 0.24 0.26 0.50 0.02 0.00 0.00 177.57 178.59 3lpk h LYS 307 N 1.21 0.52 -0.48 1.57 3.64 -1.17 0.12 116.57 121.98 3lpk h LYS 307 Ca 0.32 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.54 3lpk h LYS 307 Cb -0.10 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.59 3lpk h LYS 307 CO -0.07 0.34 -0.21 1.03 -2.27 0.00 0.00 179.45 178.28 3lpk h SER 308 N 0.54 1.01 -0.38 4.20 0.87 -0.74 -1.14 113.55 117.91 3lpk h SER 308 Ca 0.16 -0.40 -0.09 0.00 -1.23 0.00 0.00 61.79 60.23 3lpk h SER 308 Cb -0.03 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.63 3lpk h SER 308 CO -0.05 1.18 -0.10 0.40 -0.53 0.00 0.00 176.83 177.73 3lpk h ILE 309 N 0.84 1.26 -0.27 2.23 2.04 -0.29 -1.14 117.51 122.19 3lpk h ILE 309 Ca 0.11 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.78 3lpk h ILE 309 Cb 0.79 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 3lpk h ILE 309 CO 0.07 0.40 0.09 0.11 0.00 0.00 0.00 178.15 178.82 3lpk h LYS 310 N 0.75 0.41 -0.62 2.37 1.57 -0.63 -1.86 116.57 118.55 3lpk h LYS 310 Ca 0.13 -0.08 0.06 0.00 -1.87 0.00 0.00 60.65 58.88 3lpk h LYS 310 Cb 0.59 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.78 3lpk h LYS 310 CO 0.04 0.47 0.33 0.00 -0.57 0.00 0.00 179.45 179.72 3lpk h ALA 311 N 0.92 0.83 -0.29 3.86 0.00 -0.90 -0.01 119.26 123.66 3lpk h ALA 311 Ca 0.09 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 3lpk h ALA 311 Cb 0.22 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3lpk h ALA 311 CO -0.00 -0.01 -0.23 0.00 0.00 0.00 0.00 179.25 179.01 3lpk h ALA 312 N 1.34 1.07 -0.57 0.00 0.00 -1.07 -2.92 119.26 117.11 3lpk h ALA 312 Ca 0.28 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3lpk h ALA 312 Cb 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3lpk h ALA 312 CO -0.19 0.57 0.00 -1.13 0.00 0.00 0.00 179.25 178.50 3lpk n SER 313 N -4.13 5.00 0.12 0.00 3.41 -0.71 -4.69 113.62 112.62 3lpk n SER 313 Ca -0.00 -2.66 0.06 0.00 -0.26 0.00 0.00 58.87 56.01 3lpk n SER 313 Cb 0.40 -0.62 0.33 0.00 -0.26 0.00 0.00 64.21 64.05 3lpk n SER 313 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3lpk n SER 314 N 0.80 0.31 0.00 4.04 3.41 -0.06 -1.90 113.62 120.21 3lpk n SER 314 Ca 0.25 0.57 0.07 0.00 -0.26 0.00 0.00 58.87 59.51 3lpk n SER 314 Cb 1.00 -0.57 0.34 0.00 -0.26 0.00 0.00 64.21 64.72 3lpk n SER 314 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3lpk n THR 315 N -1.93 0.89 -4.19 6.66 -2.24 -1.26 -4.53 114.28 107.69 3lpk n THR 315 Ca -0.01 0.22 -0.18 0.00 -2.27 0.00 0.00 64.05 61.81 3lpk n THR 315 Cb 0.18 -0.96 -0.16 0.00 -2.10 0.00 0.00 70.33 67.29 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 -2.95 0.67 -0.19 -0.78 2.02 -0.80 -5.14 118.70 111.53 3lpk s GLU 316 Ca 0.08 -0.15 -0.10 0.00 0.02 0.00 0.00 54.97 54.82 3lpk s GLU 316 Cb 0.10 -0.68 -0.05 0.00 0.10 0.00 0.00 34.13 33.61 3lpk s GLU 316 CO 0.28 0.02 0.13 0.21 0.02 0.00 0.00 175.26 175.92 3lpk s LYS 317 N 0.45 4.15 0.05 1.61 2.47 -1.26 -4.95 119.74 122.25 3lpk s LYS 317 Ca -0.06 -0.21 0.09 0.00 -1.56 0.00 0.00 55.97 54.24 3lpk s LYS 317 Cb -0.09 -3.41 -0.03 0.00 -1.46 0.00 0.00 37.83 32.84 3lpk s LYS 317 CO -0.00 0.33 -0.25 -0.06 0.16 0.00 0.00 175.35 175.52 3lpk s PHE 318 N 0.28 2.36 0.67 4.03 0.40 -1.26 -5.12 117.98 119.34 3lpk s PHE 318 Ca 0.09 -0.38 -0.16 0.00 -0.60 0.00 0.00 56.93 55.87 3lpk s PHE 318 Cb -0.11 -1.39 0.01 0.00 0.51 0.00 0.00 43.02 42.04 3lpk s PHE 318 CO -0.02 0.17 1.20 -1.25 0.70 0.00 0.00 175.22 176.03 3lpk s PRO 319 N -1.37 2.53 0.42 0.24 0.04 -1.26 -4.91 135.00 130.69 3lpk s PRO 319 Ca 0.12 1.75 0.16 0.00 0.04 0.00 0.00 61.00 63.08 3lpk s PRO 319 Cb -0.10 -1.88 1.05 0.00 0.04 0.00 0.00 34.50 33.61 3lpk s PRO 319 CO 0.03 -1.54 1.88 -0.44 0.04 0.00 0.00 177.00 176.97 3lpk h ASP 320 N 0.19 0.42 -0.14 6.66 3.32 -2.00 0.00 116.42 124.88 3lpk h ASP 320 Ca -0.49 0.03 0.04 0.00 0.02 0.00 0.00 57.03 56.64 3lpk h ASP 320 Cb 1.29 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 3lpk h ASP 320 CO 0.52 0.19 0.10 1.23 -1.72 0.00 0.00 179.24 179.56 3lpk h GLY 321 N 0.43 0.01 0.60 2.75 0.00 -1.94 -1.36 103.07 103.56 3lpk h GLY 321 Ca 0.43 -0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.74 3lpk h GLY 321 CO -0.16 0.00 -0.05 -2.75 0.00 0.00 0.00 176.54 173.59 3lpk h PHE 322 N 0.01 0.15 0.00 5.60 3.57 -1.15 -1.29 116.94 123.82 3lpk h PHE 322 Ca 0.06 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3lpk h PHE 322 Cb 0.25 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 38.96 3lpk h PHE 322 CO -0.00 0.56 0.00 -1.49 -2.23 0.00 0.00 178.31 175.15 3lpk h TRP 323 N -0.31 0.00 -0.04 0.41 4.06 -1.42 -0.77 115.95 117.89 3lpk h TRP 323 Ca 0.01 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.96 3lpk h TRP 323 Cb 0.54 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.70 3lpk h TRP 323 CO 0.09 0.00 0.00 1.28 -3.56 0.00 0.00 178.44 176.25 3lpk n LEU 324 N -2.96 0.73 -0.62 -4.49 4.77 -0.57 -4.89 117.00 108.98 3lpk n LEU 324 Ca 0.00 -0.27 -0.08 0.00 -0.03 0.00 0.00 56.01 55.63 3lpk n LEU 324 Cb 0.25 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 3lpk n LEU 324 CO 0.24 0.14 -0.08 0.61 -1.33 0.00 0.00 177.39 176.97 3lpk n GLY 325 N 1.02 0.95 0.13 -0.72 0.00 -0.29 -4.90 105.19 101.39 3lpk n GLY 325 Ca 0.19 -0.33 -0.21 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.05 0.65 -4.23 1.61 1.02 -0.69 -4.78 120.64 112.17 3lpk n GLU 326 Ca -0.08 0.21 -0.30 0.00 -0.02 0.00 0.00 57.16 56.96 3lpk n GLU 326 Cb 0.35 -1.54 -0.09 0.00 -0.02 0.00 0.00 31.44 30.14 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 -2.52 2.42 0.53 3.49 -2.07 -0.57 -4.99 119.66 115.95 3lpk s GLN 327 Ca -0.34 -0.87 -0.06 0.00 -1.82 0.00 0.00 55.36 52.28 3lpk s GLN 327 Cb 0.10 -2.46 -0.02 0.00 -1.09 0.00 0.00 33.01 29.54 3lpk s GLN 327 CO 0.59 0.55 0.84 -0.48 -1.32 0.00 0.00 175.29 175.47 3lpk s LEU 328 N -2.08 3.46 0.00 2.60 0.05 -1.26 -4.19 118.68 117.26 3lpk s LEU 328 Ca 0.22 0.86 0.06 0.00 0.05 0.00 0.00 54.13 55.33 3lpk s LEU 328 Cb -0.11 -3.77 -0.02 0.00 -2.05 0.00 0.00 46.19 40.23 3lpk s LEU 328 CO 0.14 -0.78 -0.19 0.68 -0.55 0.00 0.00 176.35 175.66 3lpk s VAL 329 N -2.86 1.49 0.10 1.48 -7.23 -0.35 -4.94 120.40 108.09 3lpk s VAL 329 Ca 0.50 -0.89 0.06 0.00 -1.81 0.00 0.00 61.98 59.84 3lpk s VAL 329 Cb -0.10 -1.26 -0.03 0.00 0.56 0.00 0.00 36.38 35.55 3lpk s VAL 329 CO 0.45 0.34 -0.16 0.00 -0.31 0.00 0.00 175.10 175.43 3lpk s TRP 331 N -1.58 0.93 0.41 0.00 0.51 -0.54 -4.97 118.94 113.71 3lpk s TRP 331 Ca 0.05 -0.63 -0.25 0.00 -2.12 0.00 0.00 56.10 53.14 3lpk s TRP 331 Cb -0.08 -0.53 -0.10 0.00 -0.81 0.00 0.00 33.47 31.95 3lpk s TRP 331 CO 0.03 -0.04 1.14 0.94 -0.51 0.00 0.00 176.95 178.51 3lpk n GLN 332 N 0.81 1.64 -1.63 4.98 7.27 -1.26 -1.04 117.38 128.15 3lpk n GLN 332 Ca -0.18 0.58 -0.63 0.00 0.07 0.00 0.00 57.00 56.84 3lpk n GLN 332 Cb 0.57 -2.20 -0.09 0.00 2.41 0.00 0.00 30.24 30.93 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 -0.30 -2.39 -0.83 1.69 0.00 -1.23 -0.88 120.51 116.57 3lpk n ALA 333 Ca 0.08 0.54 0.00 0.00 0.00 0.00 0.00 53.44 54.06 3lpk n ALA 333 Cb 0.39 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 17.98 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 2.80 1.15 1.28 0.00 0.00 -1.26 -4.90 105.19 104.27 3lpk n GLY 334 Ca 0.25 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.37 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 1.46 -1.67 2.61 -2.24 -0.06 -4.98 114.28 107.40 3lpk n THR 335 Ca 0.00 -1.16 -0.50 0.00 -2.27 0.00 0.00 64.05 60.12 3lpk n THR 335 Cb 0.00 0.28 -0.05 0.00 -2.10 0.00 0.00 70.33 68.46 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 1.03 0.31 -1.27 4.28 -1.04 -1.26 -4.81 114.28 111.52 3lpk n THR 336 Ca 0.22 -0.06 -0.36 0.00 -2.04 0.00 0.00 64.05 61.82 3lpk n THR 336 Cb 0.72 -1.53 -0.05 0.00 -1.82 0.00 0.00 70.33 67.65 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 5.06 3.49 -0.30 -2.82 -0.04 -1.26 -4.75 135.00 134.38 3lpk n PRO 337 Ca 0.21 -2.05 0.13 0.00 -0.04 0.00 0.00 63.50 61.76 3lpk n PRO 337 Cb 0.25 -2.70 0.30 0.00 -0.04 0.00 0.00 33.50 31.31 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 4.74 0.38 -0.00 0.54 4.06 -1.95 -1.30 115.95 122.42 3lpk h TRP 338 Ca 0.79 0.05 0.00 0.00 2.06 0.00 0.00 58.89 61.79 3lpk h TRP 338 Cb 0.44 -0.03 -0.00 0.00 -1.00 0.00 0.00 29.16 28.57 3lpk h TRP 338 CO 1.88 -0.21 0.03 -2.95 -3.56 0.00 0.00 178.44 173.63 3lpk h ASN 339 N 0.22 0.00 1.31 -3.49 7.08 -2.00 -1.67 115.58 117.03 3lpk h ASN 339 Ca 0.56 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.78 3lpk h ASN 339 Cb 1.14 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.38 3lpk h ASN 339 CO -0.65 0.00 -0.33 0.16 -2.08 0.00 0.00 177.43 174.53 3lpk h ILE 340 N 0.00 0.00 -3.21 6.14 3.07 -1.60 -3.44 117.51 118.46 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 0.07 1.44 -0.04 0.00 -0.27 0.00 0.00 36.82 38.01 3lpk h ILE 340 CO -0.00 0.00 -0.08 -0.36 -1.05 0.00 0.00 178.15 176.66 3lpk s PHE 341 N -3.17 3.74 0.56 0.16 0.08 -0.63 -3.48 117.98 115.25 3lpk s PHE 341 Ca 0.07 1.17 -0.12 0.00 0.12 0.00 0.00 56.93 58.17 3lpk s PHE 341 Cb 0.11 -2.42 -0.05 0.00 -0.57 0.00 0.00 43.02 40.08 3lpk s PHE 341 CO 0.68 0.56 0.98 -1.25 -0.10 0.00 0.00 175.22 176.09 3lpk s PRO 342 N -1.31 3.72 0.36 0.24 0.04 -1.26 -4.84 135.00 131.95 3lpk s PRO 342 Ca 0.30 0.75 -0.08 0.00 0.04 0.00 0.00 61.00 62.00 3lpk s PRO 342 Cb -0.18 -2.14 -0.06 0.00 0.04 0.00 0.00 34.50 32.16 3lpk s PRO 342 CO 0.18 -0.41 0.68 0.14 0.04 0.00 0.00 177.00 177.63 3lpk s VAL 343 N -2.91 4.88 -0.13 -0.36 -7.23 -1.26 -4.34 120.40 109.05 3lpk s VAL 343 Ca 0.55 0.39 0.03 0.00 -1.81 0.00 0.00 61.98 61.14 3lpk s VAL 343 Cb -0.11 -3.73 0.01 0.00 0.56 0.00 0.00 36.38 33.11 3lpk s VAL 343 CO 0.45 -0.44 -0.22 -0.63 -0.31 0.00 0.00 175.10 173.95 3lpk s ILE 344 N -2.25 1.99 -0.12 -0.62 1.01 -0.34 -0.91 121.20 119.95 3lpk s ILE 344 Ca 0.48 -0.95 -0.01 0.00 0.00 0.00 0.00 60.65 60.18 3lpk s ILE 344 Cb -0.10 -1.75 -0.02 0.00 0.01 0.00 0.00 42.46 40.59 3lpk s ILE 344 CO 0.31 0.54 -0.10 -0.44 0.00 0.00 0.00 174.94 175.24 3lpk s SER 345 N 0.73 4.28 -0.22 3.58 0.01 -0.55 -0.70 113.70 120.83 3lpk s SER 345 Ca -0.10 -0.23 -0.02 0.00 1.31 0.00 0.00 55.95 56.91 3lpk s SER 345 Cb -0.16 -1.55 0.01 0.00 0.21 0.00 0.00 66.02 64.53 3lpk s SER 345 CO 0.01 0.20 -0.10 -0.76 0.41 0.00 0.00 173.24 172.99 3lpk s LEU 346 N 0.15 2.74 -0.09 2.44 1.43 -0.16 -1.42 118.68 123.77 3lpk s LEU 346 Ca -0.05 -0.63 -0.19 0.00 -1.03 0.00 0.00 54.13 52.23 3lpk s LEU 346 Cb -0.15 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 3lpk s LEU 346 CO 0.04 -0.05 0.53 -0.31 0.23 0.00 0.00 176.35 176.79 3lpk s TYR 347 N 1.37 3.55 0.08 0.29 1.51 0.28 -1.47 117.35 122.96 3lpk s TYR 347 Ca 0.04 1.00 0.08 0.00 -1.01 0.00 0.00 57.07 57.17 3lpk s TYR 347 Cb -0.15 -2.60 -0.04 0.00 -0.11 0.00 0.00 41.96 39.07 3lpk s TYR 347 CO -0.07 0.19 -0.16 -0.51 -1.11 0.00 0.00 175.55 173.89 3lpk s LEU 348 N 0.49 2.73 0.26 -1.29 1.43 0.25 -0.24 118.68 122.31 3lpk s LEU 348 Ca 0.29 -0.46 -0.31 0.00 -1.03 0.00 0.00 54.13 52.62 3lpk s LEU 348 Cb -0.16 -1.58 -0.13 0.00 0.03 0.00 0.00 46.19 44.35 3lpk s LEU 348 CO 0.13 0.22 1.50 0.80 0.23 0.00 0.00 176.35 179.22 3lpk n MET 349 N 1.14 2.34 -2.30 1.70 0.00 -0.90 -2.14 117.12 116.96 3lpk n MET 349 Ca -0.16 0.83 -0.24 0.00 -0.00 0.00 0.00 57.70 58.14 3lpk n MET 349 Cb 0.52 -2.55 0.14 0.00 0.00 0.00 0.00 33.22 31.33 3lpk n MET 349 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3lpk n GLY 350 N 2.25 0.09 0.16 -5.12 0.00 0.85 -4.01 105.19 99.42 3lpk n GLY 350 Ca 0.11 -1.94 0.12 0.00 0.00 0.00 0.00 46.02 44.30 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 -6.01 1.61 5.08 -1.79 -3.41 114.58 110.06 3lpk h GLU 351 Ca -0.34 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.41 3lpk h GLU 351 Cb 1.16 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.36 3lpk h GLU 351 CO 0.33 0.00 -0.35 0.08 -1.00 0.00 0.00 179.01 178.07 3lpk s VAL 352 N -3.27 5.23 0.29 3.13 1.01 -1.26 -5.05 120.40 120.48 3lpk s VAL 352 Ca 0.04 0.15 -0.30 0.00 0.00 0.00 0.00 61.98 61.87 3lpk s VAL 352 Cb 0.08 -3.60 -0.13 0.00 0.00 0.00 0.00 36.38 32.73 3lpk s VAL 352 CO 0.72 0.25 1.41 0.41 0.00 0.00 0.00 175.10 177.89 3lpk n THR 353 N 0.76 1.38 -2.16 3.92 -1.04 -1.26 -2.16 114.28 113.72 3lpk n THR 353 Ca -0.08 -0.35 -0.16 0.00 -2.04 0.00 0.00 64.05 61.43 3lpk n THR 353 Cb 0.52 -1.63 -0.02 0.00 -1.82 0.00 0.00 70.33 67.38 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 1.59 -4.62 -4.08 8.00 3.02 -1.26 -4.96 115.26 112.94 3lpk n ASN 354 Ca 0.08 0.18 -0.24 0.00 -0.03 0.00 0.00 54.58 54.58 3lpk n ASN 354 Cb 0.34 -3.97 -0.16 0.00 -0.61 0.00 0.00 39.78 35.39 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 -4.57 1.44 0.33 3.52 0.74 -0.92 -0.85 119.66 119.36 3lpk s GLN 355 Ca 0.00 -0.49 0.03 0.00 0.05 0.00 0.00 55.36 54.95 3lpk s GLN 355 Cb 0.00 -1.29 -0.04 0.00 1.10 0.00 0.00 33.01 32.78 3lpk s GLN 355 CO 0.00 0.20 0.12 -1.54 -0.55 0.00 0.00 175.29 173.52 3lpk s SER 356 N 0.08 2.06 0.19 6.67 1.04 -0.19 -0.10 113.70 123.43 3lpk s SER 356 Ca -0.03 -1.53 -0.04 0.00 0.48 0.00 0.00 55.95 54.83 3lpk s SER 356 Cb -0.10 0.29 -0.03 0.00 0.10 0.00 0.00 66.02 66.28 3lpk s SER 356 CO 0.01 -0.82 0.19 0.72 0.98 0.00 0.00 173.24 174.33 3lpk s PHE 357 N -3.44 0.88 0.09 5.02 -0.12 -0.91 -0.70 117.98 118.80 3lpk s PHE 357 Ca 0.33 -1.17 0.05 0.00 -0.05 0.00 0.00 56.93 56.08 3lpk s PHE 357 Cb 0.05 -0.36 -0.03 0.00 -0.63 0.00 0.00 43.02 42.05 3lpk s PHE 357 CO 0.16 -0.68 -0.14 -0.98 -0.05 0.00 0.00 175.22 173.53 3lpk s ARG 358 N -4.09 0.87 -0.07 1.99 1.70 0.89 -0.59 118.95 119.66 3lpk s ARG 358 Ca 0.31 -1.05 0.05 0.00 -0.47 0.00 0.00 55.73 54.57 3lpk s ARG 358 Cb 0.05 -0.80 -0.01 0.00 -0.57 0.00 0.00 34.95 33.62 3lpk s ARG 358 CO 0.08 0.17 -0.22 0.96 -1.08 0.00 0.00 175.30 175.20 3lpk s ILE 359 N -1.64 2.28 -0.11 4.99 -4.36 -0.54 -0.87 121.20 120.94 3lpk s ILE 359 Ca 0.02 -0.98 0.03 0.00 -0.26 0.00 0.00 60.65 59.46 3lpk s ILE 359 Cb -0.08 -1.85 0.00 0.00 1.25 0.00 0.00 42.46 41.78 3lpk s ILE 359 CO 0.02 0.57 -0.22 -0.89 0.24 0.00 0.00 174.94 174.66 3lpk s THR 360 N -0.13 1.96 0.20 8.37 2.01 0.61 -0.99 115.64 127.68 3lpk s THR 360 Ca -0.04 -0.95 0.09 0.00 0.31 0.00 0.00 61.69 61.10 3lpk s THR 360 Cb -0.14 -1.72 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 3lpk s THR 360 CO 0.04 0.54 -0.08 0.27 -0.69 0.00 0.00 174.62 174.70 3lpk s ILE 361 N 0.54 3.23 0.38 1.82 -4.36 0.12 -2.08 121.20 120.85 3lpk s ILE 361 Ca -0.15 -1.72 0.07 0.00 -0.26 0.00 0.00 60.65 58.60 3lpk s ILE 361 Cb -0.17 -2.63 -0.01 0.00 1.25 0.00 0.00 42.46 40.90 3lpk s ILE 361 CO 0.05 -0.17 0.43 -0.76 0.24 0.00 0.00 174.94 174.73 3lpk s LEU 362 N -3.02 3.63 0.57 0.37 1.43 -1.26 -1.20 118.68 119.21 3lpk s LEU 362 Ca 0.26 -0.48 0.33 0.00 -1.03 0.00 0.00 54.13 53.21 3lpk s LEU 362 Cb -0.08 -2.41 1.74 0.00 0.03 0.00 0.00 46.19 45.47 3lpk s LEU 362 CO 0.16 -0.57 2.16 1.55 0.23 0.00 0.00 176.35 179.88 3lpk h PRO 363 N 0.94 0.00 0.00 1.29 0.13 -1.89 0.12 132.00 132.59 3lpk h PRO 363 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3lpk h PRO 363 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 3lpk h PRO 363 CO 0.53 0.06 0.00 1.96 -0.23 0.00 0.00 178.00 180.32 3lpk h GLN 364 N 0.00 0.00 0.01 0.86 7.50 -1.86 0.14 115.11 121.77 3lpk h GLN 364 Ca -0.00 0.00 -0.32 0.00 0.50 0.00 0.00 58.65 58.83 3lpk h GLN 364 Cb 0.23 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.72 3lpk h GLN 364 CO 0.01 0.00 -1.78 1.04 -1.50 0.00 0.00 178.83 176.60 3lpk n GLN 365 N -3.06 0.60 0.00 1.46 3.00 0.39 -4.51 117.38 115.26 3lpk n GLN 365 Ca -0.02 0.43 0.15 0.00 -0.01 0.00 0.00 57.00 57.55 3lpk n GLN 365 Cb 0.11 -1.66 0.76 0.00 0.00 0.00 0.00 30.24 29.46 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 -4.23 0.00 -3.79 1.08 0.18 -0.97 -4.52 117.16 104.92 3lpk n TYR 366 Ca -0.40 0.00 -0.37 0.00 1.88 0.00 0.00 57.90 59.01 3lpk n TYR 366 Cb 0.79 -0.06 -0.13 0.00 -0.38 0.00 0.00 39.34 39.57 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 -2.14 4.09 -0.21 -3.48 1.43 0.48 -0.23 118.68 118.61 3lpk s LEU 367 Ca 0.40 -1.05 -0.22 0.00 -1.03 0.00 0.00 54.13 52.24 3lpk s LEU 367 Cb 0.21 -1.84 -0.02 0.00 0.03 0.00 0.00 46.19 44.57 3lpk s LEU 367 CO 0.39 -0.28 0.68 -0.60 0.23 0.00 0.00 176.35 176.78 3lpk s ARG 368 N 1.40 4.19 0.30 1.70 3.52 0.05 -4.77 118.95 125.35 3lpk s ARG 368 Ca -0.01 0.69 -0.29 0.00 -0.13 0.00 0.00 55.73 55.99 3lpk s ARG 368 Cb -0.19 -3.60 -0.11 0.00 -1.56 0.00 0.00 34.95 29.49 3lpk s ARG 368 CO 0.02 -0.33 1.50 -2.14 -0.81 0.00 0.00 175.30 173.54 3lpk s PRO 369 N 2.21 4.18 0.02 5.12 0.02 -1.26 -1.11 135.00 144.17 3lpk s PRO 369 Ca 0.30 2.47 -0.05 0.00 0.02 0.00 0.00 61.00 63.74 3lpk s PRO 369 Cb -0.16 -3.04 -0.01 0.00 0.02 0.00 0.00 34.50 31.32 3lpk s PRO 369 CO 0.10 -0.51 0.09 0.14 -0.33 0.00 0.00 177.00 176.48 3lpk s VAL 370 N -0.37 0.10 0.15 3.83 -7.23 -0.58 -4.71 120.40 111.59 3lpk s VAL 370 Ca 0.58 -0.86 -0.30 0.00 -1.81 0.00 0.00 61.98 59.59 3lpk s VAL 370 Cb -0.45 -0.53 -0.07 0.00 0.56 0.00 0.00 36.38 35.89 3lpk s VAL 370 CO 0.51 -0.48 1.08 -0.70 -0.31 0.00 0.00 175.10 175.20 3lpk s GLU 371 N -1.77 4.60 0.47 4.82 2.56 -1.26 -4.05 118.70 124.07 3lpk s GLU 371 Ca -0.12 1.66 -0.25 0.00 0.00 0.00 0.00 54.97 56.26 3lpk s GLU 371 Cb -0.06 -3.31 -0.08 0.00 2.00 0.00 0.00 34.13 32.68 3lpk s GLU 371 CO -0.01 0.07 1.39 0.34 -0.56 0.00 0.00 175.26 176.50 3lpk s ASP 372 N 0.04 5.80 0.66 -1.70 2.15 -1.26 -4.85 116.67 117.51 3lpk s ASP 372 Ca 0.50 2.85 0.37 0.00 0.43 0.00 0.00 52.55 56.70 3lpk s ASP 372 Cb -0.28 -2.65 2.05 0.00 -0.30 0.00 0.00 42.92 41.74 3lpk s ASP 372 CO 0.33 -1.22 2.18 0.58 -0.17 0.00 0.00 175.17 176.88 3lpk h VAL 373 N 2.14 0.08 -0.42 1.11 2.07 -1.99 0.66 116.25 119.91 3lpk h VAL 373 Ca -0.51 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.01 3lpk h VAL 373 Cb 1.27 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 3lpk h VAL 373 CO 0.60 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.19 3lpk n ALA 374 N -2.06 2.90 -2.00 1.67 0.00 -1.26 -4.95 120.51 114.81 3lpk n ALA 374 Ca -0.02 -1.79 0.00 0.00 0.00 0.00 0.00 53.44 51.63 3lpk n ALA 374 Cb 0.21 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 18.90 3lpk n ALA 374 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3lpk n THR 375 N 0.31 0.00 -0.18 0.00 -2.24 0.23 -4.88 114.28 107.52 3lpk n THR 375 Ca 0.21 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.93 3lpk n THR 375 Cb 0.80 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 69.08 3lpk n THR 375 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3lpk n SER 376 N -0.68 -2.09 -1.21 3.42 3.41 -1.26 -4.91 113.62 110.31 3lpk n SER 376 Ca 0.00 -0.27 0.08 0.00 -0.26 0.00 0.00 58.87 58.42 3lpk n SER 376 Cb 0.34 -0.17 0.26 0.00 -0.26 0.00 0.00 64.21 64.38 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 -2.53 2.86 -2.09 4.33 6.02 -1.26 -4.82 117.38 119.90 3lpk n GLN 377 Ca 0.02 -2.12 -0.32 0.00 -0.01 0.00 0.00 57.00 54.58 3lpk n GLN 377 Cb 0.10 -1.66 0.00 0.00 1.02 0.00 0.00 30.24 29.71 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 -0.85 6.07 -0.33 1.08 1.01 -1.26 -3.56 116.67 118.83 3lpk s ASP 378 Ca 0.38 1.66 -0.12 0.00 0.71 0.00 0.00 52.55 55.19 3lpk s ASP 378 Cb 0.23 -2.51 -0.02 0.00 1.01 0.00 0.00 42.92 41.63 3lpk s ASP 378 CO 0.20 -0.97 0.21 -1.81 0.21 0.00 0.00 175.17 173.02 3lpk s ASP 379 N -3.16 5.92 0.20 0.27 -0.00 -0.21 -4.77 116.67 114.93 3lpk s ASP 379 Ca 0.60 -0.42 0.11 0.00 -0.00 0.00 0.00 52.55 52.84 3lpk s ASP 379 Cb -0.13 -2.10 -0.04 0.00 -0.00 0.00 0.00 42.92 40.64 3lpk s ASP 379 CO 0.39 -0.21 -0.20 0.00 -0.00 0.00 0.00 175.17 175.15 3lpk s TYR 381 N -1.77 0.26 0.07 0.00 1.51 -0.26 -1.53 117.35 115.62 3lpk s TYR 381 Ca 0.23 -0.62 0.09 0.00 -1.01 0.00 0.00 57.07 55.76 3lpk s TYR 381 Cb -0.08 0.05 -0.03 0.00 -0.11 0.00 0.00 41.96 41.79 3lpk s TYR 381 CO 0.12 -0.75 -0.24 0.15 -1.11 0.00 0.00 175.55 173.72 3lpk s LYS 382 N -3.94 1.47 -0.24 -0.62 1.02 -0.27 -1.21 119.74 115.96 3lpk s LYS 382 Ca 0.14 -1.10 -0.29 0.00 0.02 0.00 0.00 55.97 54.74 3lpk s LYS 382 Cb 0.02 -1.70 -0.02 0.00 -0.52 0.00 0.00 37.83 35.62 3lpk s LYS 382 CO -0.02 0.42 1.48 0.12 -0.92 0.00 0.00 175.35 176.43 3lpk s PHE 383 N -0.91 2.36 -0.44 3.18 5.36 -1.26 -0.77 117.98 125.50 3lpk s PHE 383 Ca 0.10 0.68 0.00 0.00 -0.96 0.00 0.00 56.93 56.75 3lpk s PHE 383 Cb -0.10 -3.93 0.42 0.00 -0.34 0.00 0.00 43.02 39.08 3lpk s PHE 383 CO 0.03 -2.43 1.89 0.00 -1.46 0.00 0.00 175.22 173.26 3lpk n ALA 384 N 7.98 5.42 -3.45 11.12 0.00 0.68 -4.38 120.51 137.89 3lpk n ALA 384 Ca 0.17 -2.49 -0.27 0.00 0.00 0.00 0.00 53.44 50.84 3lpk n ALA 384 Cb 0.46 -1.49 -0.17 0.00 0.00 0.00 0.00 19.45 18.25 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 -3.22 1.43 0.19 0.00 1.01 -1.26 -1.66 121.20 117.68 3lpk s ILE 385 Ca 0.47 -0.64 -0.05 0.00 0.00 0.00 0.00 60.65 60.44 3lpk s ILE 385 Cb 0.38 -1.28 -0.03 0.00 0.01 0.00 0.00 42.46 41.54 3lpk s ILE 385 CO 0.03 0.42 0.20 -0.94 0.00 0.00 0.00 174.94 174.66 3lpk s SER 386 N 0.67 0.12 0.38 3.58 1.04 -0.72 -4.71 113.70 114.06 3lpk s SER 386 Ca -0.14 -1.17 -0.11 0.00 0.48 0.00 0.00 55.95 55.01 3lpk s SER 386 Cb -0.16 0.41 -0.07 0.00 0.10 0.00 0.00 66.02 66.30 3lpk s SER 386 CO 0.04 -0.88 0.75 0.00 0.98 0.00 0.00 173.24 174.13 3lpk s GLN 387 N -4.07 3.82 0.11 4.02 -2.07 -1.26 -0.73 119.66 119.47 3lpk s GLN 387 Ca 0.29 0.48 0.05 0.00 -1.82 0.00 0.00 55.36 54.36 3lpk s GLN 387 Cb 0.05 -2.42 -0.04 0.00 -1.09 0.00 0.00 33.01 29.52 3lpk s GLN 387 CO 0.07 0.02 -0.13 0.45 -1.32 0.00 0.00 175.29 174.38 3lpk s SER 388 N -2.95 1.82 0.00 12.60 0.15 0.13 -4.72 113.70 120.72 3lpk s SER 388 Ca 0.51 -0.77 0.04 0.00 0.70 0.00 0.00 55.95 56.44 3lpk s SER 388 Cb -0.10 -0.05 0.12 0.00 -1.71 0.00 0.00 66.02 64.28 3lpk s SER 388 CO 0.28 -0.15 1.07 -1.54 1.20 0.00 0.00 173.24 174.10 3lpk n SER 389 N 0.71 2.31 -1.16 5.45 3.41 -1.26 -2.30 113.62 120.77 3lpk n SER 389 Ca -0.17 -1.94 0.03 0.00 -0.26 0.00 0.00 58.87 56.53 3lpk n SER 389 Cb 0.56 -0.09 0.12 0.00 -0.26 0.00 0.00 64.21 64.54 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 -0.06 1.39 0.00 6.66 -2.24 -1.26 -4.88 114.28 113.89 3lpk n THR 390 Ca 0.05 -2.50 0.00 0.00 -2.27 0.00 0.00 64.05 59.33 3lpk n THR 390 Cb 0.31 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 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 -0.47 -0.20 3.75 3.38 0.00 -1.22 -4.54 105.19 105.87 3lpk n GLY 391 Ca 0.16 -1.90 -0.40 0.00 0.00 0.00 0.00 46.02 43.88 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 -1.05 3.90 -0.22 2.61 2.01 0.66 -4.29 115.64 119.25 3lpk s THR 392 Ca 0.00 1.81 0.00 0.00 0.31 0.00 0.00 61.69 63.81 3lpk s THR 392 Cb 0.00 -4.15 0.06 0.00 0.01 0.00 0.00 72.50 68.42 3lpk s THR 392 CO 0.00 0.39 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.59 3lpk s VAL 393 N -0.84 1.39 -0.94 3.82 1.01 0.30 -1.36 120.40 123.78 3lpk s VAL 393 Ca 0.44 -1.10 -0.21 0.00 0.00 0.00 0.00 61.98 61.12 3lpk s VAL 393 Cb -0.28 -1.67 0.09 0.00 0.00 0.00 0.00 36.38 34.52 3lpk s VAL 393 CO 0.35 -0.09 1.23 -0.04 0.00 0.00 0.00 175.10 176.55 3lpk s MET 394 N 1.46 3.55 0.05 2.72 -1.94 0.81 -1.04 119.30 124.92 3lpk s MET 394 Ca -0.05 -1.42 -0.01 0.00 -1.71 0.00 0.00 55.69 52.50 3lpk s MET 394 Cb -0.18 -5.00 0.01 0.00 2.01 0.00 0.00 34.83 31.66 3lpk s MET 394 CO -0.07 -1.94 0.07 0.41 -0.01 0.00 0.00 175.02 173.48 3lpk n GLY 395 N 5.98 -1.31 0.36 -0.03 0.00 -1.01 -1.03 105.19 108.15 3lpk n GLY 395 Ca 0.25 -1.65 0.04 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.00 1.42 0.00 4.61 0.00 0.12 -1.36 119.26 122.06 3lpk h ALA 396 Ca -0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3lpk h ALA 396 Cb 0.06 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 3lpk h ALA 396 CO 0.02 0.32 -0.13 -0.39 0.00 0.00 0.00 179.25 179.07 3lpk h VAL 397 N 1.07 0.81 0.13 0.00 -1.51 -1.41 0.45 116.25 115.78 3lpk h VAL 397 Ca 0.45 -0.50 -0.19 0.00 -1.23 0.00 0.00 66.70 65.24 3lpk h VAL 397 Cb 0.31 1.29 0.02 0.00 -2.13 0.00 0.00 31.29 30.78 3lpk h VAL 397 CO -0.22 0.13 -0.86 0.40 -1.23 0.00 0.00 177.57 175.79 3lpk h ILE 398 N 0.00 1.45 0.00 7.19 1.08 -1.60 -3.30 117.51 122.32 3lpk h ILE 398 Ca -0.00 -2.51 -0.01 0.00 -0.39 0.00 0.00 64.86 61.95 3lpk h ILE 398 Cb 0.28 3.13 -0.00 0.00 -3.07 0.00 0.00 36.82 37.16 3lpk h ILE 398 CO 0.02 0.70 -0.05 0.24 -0.69 0.00 0.00 178.15 178.37 3lpk h MET 399 N -0.40 0.00 0.00 2.37 2.86 -0.77 -2.18 114.93 116.81 3lpk h MET 399 Ca -0.16 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.48 3lpk h MET 399 Cb 1.62 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.28 3lpk h MET 399 CO 0.13 0.05 -0.01 0.93 1.06 0.00 0.00 176.91 179.07 3lpk h GLU 400 N 0.00 0.00 0.00 1.72 5.08 -1.00 -1.67 114.58 118.70 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 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3lpk h GLU 400 CO 0.01 0.01 -0.40 0.41 -1.00 0.00 0.00 179.01 178.04 3lpk n GLY 401 N -0.68 -1.38 3.17 -3.84 0.00 -0.82 -4.23 105.19 97.42 3lpk n GLY 401 Ca -0.02 -0.25 -0.11 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.05 0.91 -0.26 1.61 0.40 -0.63 -1.84 117.98 115.13 3lpk s PHE 402 Ca 0.10 -1.09 -0.15 0.00 -0.60 0.00 0.00 56.93 55.19 3lpk s PHE 402 Cb 0.16 -0.54 -0.04 0.00 0.51 0.00 0.00 43.02 43.12 3lpk s PHE 402 CO 0.66 -0.34 0.38 -0.47 0.70 0.00 0.00 175.22 176.15 3lpk s TYR 403 N -3.84 3.27 -0.19 0.36 5.04 0.81 -4.47 117.35 118.34 3lpk s TYR 403 Ca 0.19 0.46 -0.03 0.00 -2.44 0.00 0.00 57.07 55.24 3lpk s TYR 403 Cb 0.07 -2.57 -0.01 0.00 0.35 0.00 0.00 41.96 39.80 3lpk s TYR 403 CO -0.01 -0.19 -0.06 0.08 -1.34 0.00 0.00 175.55 174.04 3lpk s VAL 404 N 1.93 3.43 -0.31 3.14 1.01 -0.42 -2.04 120.40 127.15 3lpk s VAL 404 Ca 0.16 -0.49 -0.09 0.00 0.00 0.00 0.00 61.98 61.55 3lpk s VAL 404 Cb -0.16 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.69 3lpk s VAL 404 CO 0.09 0.46 0.14 -0.69 0.00 0.00 0.00 175.10 175.10 3lpk s VAL 405 N 1.03 4.51 -0.95 2.92 1.01 0.46 0.09 120.40 129.46 3lpk s VAL 405 Ca 0.00 -0.44 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 3lpk s VAL 405 Cb -0.15 -3.29 0.19 0.00 0.00 0.00 0.00 36.38 33.13 3lpk s VAL 405 CO -0.00 0.08 1.04 -0.36 0.00 0.00 0.00 175.10 175.87 3lpk s PHE 406 N 1.60 3.54 -1.26 5.22 0.08 0.64 -0.18 117.98 127.63 3lpk s PHE 406 Ca 0.04 -1.87 -0.14 0.00 0.12 0.00 0.00 56.93 55.08 3lpk s PHE 406 Cb -0.17 -4.07 0.14 0.00 -0.57 0.00 0.00 43.02 38.35 3lpk s PHE 406 CO 0.06 -1.23 1.60 -3.47 -0.10 0.00 0.00 175.22 172.08 3lpk n ASP 407 N 5.04 5.07 -0.26 1.36 -0.08 -0.18 -2.36 116.55 125.13 3lpk n ASP 407 Ca 0.22 -2.97 -0.01 0.00 -1.51 0.00 0.00 54.79 50.53 3lpk n ASP 407 Cb 0.46 -1.62 0.19 0.00 2.34 0.00 0.00 41.12 42.50 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 7.06 1.09 -0.84 -0.67 3.08 -1.75 -1.03 114.38 121.32 3lpk h ARG 408 Ca 0.38 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 60.37 3lpk h ARG 408 Cb 0.84 -0.24 -0.05 0.00 0.08 0.00 0.00 29.97 30.60 3lpk h ARG 408 CO 1.37 0.74 0.56 0.00 -1.07 0.00 0.00 179.97 181.57 3lpk h ALA 409 N 1.46 1.45 -0.34 0.04 0.00 -1.52 -2.55 119.26 117.80 3lpk h ALA 409 Ca 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3lpk h ALA 409 Cb -0.09 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.38 3lpk h ALA 409 CO -0.06 0.48 0.00 0.54 0.00 0.00 0.00 179.25 180.21 3lpk n ARG 410 N -4.43 3.22 -3.99 0.00 1.74 -1.04 -4.98 116.66 107.17 3lpk n ARG 410 Ca 0.10 -2.78 -0.29 0.00 -0.77 0.00 0.00 57.85 54.12 3lpk n ARG 410 Cb 0.08 -1.82 -0.02 0.00 -1.02 0.00 0.00 32.46 29.67 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 -0.13 -2.30 -3.79 5.56 4.81 -0.49 -4.92 118.16 116.90 3lpk n LYS 411 Ca 0.21 0.33 -0.09 0.00 -0.87 0.00 0.00 58.31 57.88 3lpk n LYS 411 Cb 0.87 -4.12 -0.07 0.00 0.02 0.00 0.00 35.03 31.73 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 -6.70 0.89 -0.11 1.64 1.70 -0.59 -1.22 118.95 114.56 3lpk s ARG 412 Ca 0.11 -0.84 0.03 0.00 -0.47 0.00 0.00 55.73 54.56 3lpk s ARG 412 Cb -0.05 0.37 0.00 0.00 -0.57 0.00 0.00 34.95 34.71 3lpk s ARG 412 CO 0.91 -0.30 -0.22 0.42 -1.08 0.00 0.00 175.30 175.03 3lpk s ILE 413 N -3.68 1.95 -0.03 4.99 1.01 0.28 -1.01 121.20 124.72 3lpk s ILE 413 Ca 0.03 -0.94 -0.01 0.00 0.00 0.00 0.00 60.65 59.73 3lpk s ILE 413 Cb 0.03 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.76 3lpk s ILE 413 CO -0.10 0.53 0.07 -0.83 0.00 0.00 0.00 174.94 174.62 3lpk s GLY 414 N 0.52 2.00 -0.03 6.18 0.00 0.75 -0.64 107.32 116.11 3lpk s GLY 414 Ca -0.15 -0.84 0.04 0.00 0.00 0.00 0.00 44.72 43.77 3lpk s GLY 414 CO 0.05 -0.69 -0.14 -1.36 0.00 0.00 0.00 173.10 170.96 3lpk s PHE 415 N -1.14 1.36 0.00 1.90 0.40 0.31 -0.41 117.98 120.41 3lpk s PHE 415 Ca 0.21 -0.33 -0.13 0.00 -0.60 0.00 0.00 56.93 56.07 3lpk s PHE 415 Cb -0.12 -0.91 0.02 0.00 0.51 0.00 0.00 43.02 42.52 3lpk s PHE 415 CO 0.11 -0.09 0.28 0.00 0.70 0.00 0.00 175.22 176.22 3lpk s ALA 416 N -0.06 -0.69 0.16 5.36 0.00 -0.87 -0.90 121.76 124.76 3lpk s ALA 416 Ca -0.00 0.17 -0.32 0.00 0.00 0.00 0.00 51.96 51.81 3lpk s ALA 416 Cb -0.09 0.14 -0.12 0.00 0.00 0.00 0.00 23.12 23.06 3lpk s ALA 416 CO 0.01 -0.29 1.76 0.28 0.00 0.00 0.00 175.76 177.52 3lpk n VAL 417 N 1.12 0.17 -2.44 0.00 0.31 -1.24 -0.13 118.33 116.12 3lpk n VAL 417 Ca -0.21 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 63.68 3lpk n VAL 417 Cb 0.57 -1.99 -0.04 0.00 -0.91 0.00 0.00 33.84 31.47 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 1.89 7.21 0.18 4.52 0.15 -0.76 -1.70 113.70 125.19 3lpk s SER 418 Ca 0.79 2.26 0.19 0.00 0.70 0.00 0.00 55.95 59.89 3lpk s SER 418 Cb -0.52 -2.62 0.84 0.00 -1.71 0.00 0.00 66.02 62.00 3lpk s SER 418 CO 0.36 -0.21 1.58 0.00 1.20 0.00 0.00 173.24 176.17 3lpk n ALA 419 N 1.55 1.53 -1.07 5.45 0.00 -0.50 -2.68 120.51 124.78 3lpk n ALA 419 Ca 0.00 0.06 0.10 0.00 0.00 0.00 0.00 53.44 53.60 3lpk n ALA 419 Cb 0.45 -1.31 0.16 0.00 0.00 0.00 0.00 19.45 18.75 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 3.12 0.03 0.00 -0.00 -1.09 -4.55 115.29 109.93 3lpk s HIS 421 Ca 0.34 1.60 -0.24 0.00 -0.00 0.00 0.00 55.06 56.76 3lpk s HIS 421 Cb 0.29 -3.01 -0.05 0.00 -0.00 0.00 0.00 32.58 29.80 3lpk s HIS 421 CO 0.04 -0.60 0.73 0.08 -0.00 0.00 0.00 174.74 174.99 3lpk s VAL 422 N -1.99 4.77 0.05 -5.38 1.01 -1.26 -5.05 120.40 112.56 3lpk s VAL 422 Ca 0.64 1.55 -0.01 0.00 0.00 0.00 0.00 61.98 64.16 3lpk s VAL 422 Cb -0.15 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.16 3lpk s VAL 422 CO 0.19 0.37 0.09 0.00 0.00 0.00 0.00 175.10 175.75 3lpk n HIS 423 N 2.80 -0.86 -4.44 5.22 -0.00 -1.26 -4.71 115.22 111.97 3lpk n HIS 423 Ca -0.03 -0.30 -0.21 0.00 -0.00 0.00 0.00 57.72 57.18 3lpk n HIS 423 Cb 0.50 0.10 -0.05 0.00 -0.00 0.00 0.00 29.99 30.54 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 -1.61 1.81 0.10 4.39 5.68 -1.19 -5.03 116.55 120.69 3lpk n ASP 424 Ca -0.01 -2.63 0.11 0.00 -0.50 0.00 0.00 54.79 51.77 3lpk n ASP 424 Cb 0.08 0.59 0.45 0.00 -1.14 0.00 0.00 41.12 41.11 3lpk n ASP 424 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3lpk n GLU 425 N -0.77 0.16 -0.07 0.11 0.28 -1.26 -3.73 120.64 115.36 3lpk n GLU 425 Ca -0.08 0.34 -0.03 0.00 -0.16 0.00 0.00 57.16 57.23 3lpk n GLU 425 Cb 0.46 -1.78 -0.16 0.00 1.43 0.00 0.00 31.44 31.40 3lpk n GLU 425 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 3lpk n PHE 426 N -2.09 0.00 -4.06 -1.84 3.01 -1.26 -5.01 117.46 106.21 3lpk n PHE 426 Ca 0.03 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.38 3lpk n PHE 426 Cb 0.26 -0.78 -0.11 0.00 -0.01 0.00 0.00 39.48 38.83 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 0.54 0.09 -1.08 0.52 -1.24 -5.16 118.95 109.80 3lpk s ARG 427 Ca -0.09 -0.85 0.02 0.00 -0.52 0.00 0.00 55.73 54.29 3lpk s ARG 427 Cb 0.08 -0.17 -0.04 0.00 0.52 0.00 0.00 34.95 35.34 3lpk s ARG 427 CO 0.81 0.01 -0.06 -0.08 0.02 0.00 0.00 175.30 176.00 3lpk s THR 428 N -1.90 0.63 0.84 0.02 -1.32 -1.26 -3.18 115.64 109.48 3lpk s THR 428 Ca -0.07 -1.82 -0.11 0.00 -1.21 0.00 0.00 61.69 58.48 3lpk s THR 428 Cb -0.07 -1.54 0.10 0.00 -1.51 0.00 0.00 72.50 69.48 3lpk s THR 428 CO -0.01 -0.83 1.09 0.00 -2.21 0.00 0.00 174.62 172.66 3lpk s ALA 429 N -3.38 1.90 0.10 11.08 0.00 -1.26 -4.91 121.76 125.29 3lpk s ALA 429 Ca 0.09 -0.05 -0.16 0.00 0.00 0.00 0.00 51.96 51.84 3lpk s ALA 429 Cb 0.04 -3.18 0.03 0.00 0.00 0.00 0.00 23.12 20.01 3lpk s ALA 429 CO -0.05 -2.04 0.39 0.00 0.00 0.00 0.00 175.76 174.06 3lpk s ALA 430 N -3.00 -0.91 -0.20 0.00 0.00 -0.88 -4.97 121.76 111.80 3lpk s ALA 430 Ca 0.62 0.02 -0.04 0.00 0.00 0.00 0.00 51.96 52.57 3lpk s ALA 430 Cb -0.17 0.57 0.07 0.00 0.00 0.00 0.00 23.12 23.59 3lpk s ALA 430 CO 0.56 -0.58 0.08 0.08 0.00 0.00 0.00 175.76 175.90 3lpk s VAL 431 N -3.40 0.20 0.09 0.00 1.01 -1.26 -0.28 120.40 116.77 3lpk s VAL 431 Ca 0.00 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.56 3lpk s VAL 431 Cb 0.01 -0.87 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 3lpk s VAL 431 CO -0.09 -0.34 -0.14 -1.61 0.00 0.00 0.00 175.10 172.92 3lpk s GLU 432 N 2.00 0.88 0.01 2.72 2.02 -0.05 -4.84 118.70 121.43 3lpk s GLU 432 Ca 0.02 -1.06 -0.28 0.00 0.02 0.00 0.00 54.97 53.67 3lpk s GLU 432 Cb -0.16 -0.80 0.10 0.00 0.10 0.00 0.00 34.13 33.36 3lpk s GLU 432 CO -0.14 0.17 1.25 0.20 0.02 0.00 0.00 175.26 176.76 3lpk s GLY 433 N -2.04 -0.19 0.45 -1.39 0.00 -1.26 -0.07 107.32 102.82 3lpk s GLY 433 Ca 0.02 0.19 0.06 0.00 0.00 0.00 0.00 44.72 44.99 3lpk s GLY 433 CO 0.02 3.47 0.62 2.56 0.00 0.00 0.00 173.10 179.77 3lpk s PRO 434 N -2.18 2.77 0.01 2.90 0.04 -1.26 -5.08 135.00 132.20 3lpk s PRO 434 Ca 0.24 -1.11 0.03 0.00 0.04 0.00 0.00 61.00 60.20 3lpk s PRO 434 Cb 0.01 -2.69 -0.01 0.00 0.04 0.00 0.00 34.50 31.84 3lpk s PRO 434 CO -0.01 -0.37 -0.10 -0.06 0.04 0.00 0.00 177.00 176.50 3lpk s PHE 435 N -2.45 0.90 -0.10 0.56 0.40 0.12 -4.95 117.98 112.47 3lpk s PHE 435 Ca 0.55 -0.25 -0.30 0.00 -0.60 0.00 0.00 56.93 56.33 3lpk s PHE 435 Cb -0.10 -0.56 -0.02 0.00 0.51 0.00 0.00 43.02 42.85 3lpk s PHE 435 CO 0.34 -0.01 1.10 0.08 0.70 0.00 0.00 175.22 177.44 3lpk s VAL 436 N -0.54 4.53 -0.04 -0.44 1.01 -1.26 -1.03 120.40 122.64 3lpk s VAL 436 Ca 0.01 1.83 -0.01 0.00 0.00 0.00 0.00 61.98 63.81 3lpk s VAL 436 Cb -0.06 -4.18 0.03 0.00 0.00 0.00 0.00 36.38 32.18 3lpk s VAL 436 CO 0.00 -0.02 0.07 -0.89 0.00 0.00 0.00 175.10 174.25 3lpk s THR 437 N 2.29 -0.07 0.19 3.92 2.01 -0.03 -4.92 115.64 119.04 3lpk s THR 437 Ca 0.51 0.24 0.05 0.00 0.31 0.00 0.00 61.69 62.80 3lpk s THR 437 Cb -0.21 -0.13 -0.04 0.00 0.01 0.00 0.00 72.50 72.13 3lpk s THR 437 CO 0.18 0.10 0.20 -0.76 -0.69 0.00 0.00 174.62 173.65 3lpk s LEU 438 N 1.26 3.97 -1.63 4.42 1.43 -1.26 -3.94 118.68 122.93 3lpk s LEU 438 Ca -0.07 -0.07 -0.15 0.00 -1.03 0.00 0.00 54.13 52.81 3lpk s LEU 438 Cb -0.13 -2.55 0.12 0.00 0.03 0.00 0.00 46.19 43.67 3lpk s LEU 438 CO -0.04 0.03 0.77 0.47 0.23 0.00 0.00 176.35 177.81 3lpk n ASP 439 N -0.68 -3.13 0.19 2.29 8.00 -1.26 -4.86 116.55 117.11 3lpk n ASP 439 Ca -0.08 -0.97 0.03 0.00 0.71 0.00 0.00 54.79 54.49 3lpk n ASP 439 Cb 0.55 -3.00 0.42 0.00 -0.02 0.00 0.00 41.12 39.07 3lpk n ASP 439 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 3lpk h MET 440 N -1.66 0.02 -0.20 -1.24 2.86 -2.00 -2.04 114.93 110.67 3lpk h MET 440 Ca -0.60 -0.01 0.06 0.00 -2.06 0.00 0.00 59.70 57.10 3lpk h MET 440 Cb 1.38 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.03 3lpk h MET 440 CO 0.74 0.30 0.16 0.93 1.06 0.00 0.00 176.91 180.10 3lpk h GLU 441 N 0.02 0.00 0.00 1.72 4.39 -1.98 0.21 114.58 118.94 3lpk h GLU 441 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3lpk h GLU 441 Cb 0.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 3lpk h GLU 441 CO 0.04 0.00 0.00 -0.25 -1.16 0.00 0.00 179.01 177.64 3lpk n ASP 442 N -4.35 0.00 0.20 1.42 8.00 -0.77 -2.47 116.55 118.58 3lpk n ASP 442 Ca 0.02 0.20 0.12 0.00 0.71 0.00 0.00 54.79 55.83 3lpk n ASP 442 Cb 0.30 -0.38 0.14 0.00 -0.02 0.00 0.00 41.12 41.16 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 -4.24 2.87 0.14 0.00 0.00 -1.03 -4.03 107.32 101.02 3lpk s GLY 444 Ca 0.06 0.76 -0.10 0.00 0.00 0.00 0.00 44.72 45.44 3lpk s GLY 444 CO 0.69 1.26 0.46 -0.47 0.00 0.00 0.00 173.10 175.04 3lpk s TYR 445 N -1.47 3.53 -0.09 1.90 5.04 -1.26 -4.98 117.35 120.02 3lpk s TYR 445 Ca 0.52 0.83 -0.00 0.00 -2.44 0.00 0.00 57.07 55.98 3lpk s TYR 445 Cb -0.26 -2.20 0.02 0.00 0.35 0.00 0.00 41.96 39.88 3lpk s TYR 445 CO 0.32 0.43 -0.06 -0.80 -1.34 0.00 0.00 175.55 174.10 3lpk s ASN 446 N -2.00 1.92 0.00 4.32 0.01 -1.26 -4.99 114.94 112.94 3lpk s ASN 446 Ca 0.39 -0.23 0.00 0.00 -0.71 0.00 0.00 52.86 52.30 3lpk s ASN 446 Cb -0.13 -0.71 0.00 0.00 0.41 0.00 0.00 41.25 40.82 3lpk s ASN 446 CO 0.20 -0.12 0.45 -0.38 -1.51 0.00 0.00 177.10 175.73