#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kk7 n SER 37 N 0.00 4.27 -4.75 1.09 3.41 -1.26 -4.97 113.62 111.41 3kk7 n SER 37 Ca 0.00 -3.35 -0.40 0.00 -0.26 0.00 0.00 58.87 54.85 3kk7 n SER 37 Cb 0.00 -0.74 -0.04 0.00 -0.26 0.00 0.00 64.21 63.17 3kk7 n SER 37 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3kk7 s GLU 38 N -3.08 4.65 -0.02 4.33 2.12 -1.26 -4.44 118.70 121.01 3kk7 s GLU 38 Ca 0.53 1.75 0.00 0.00 0.36 0.00 0.00 54.97 57.61 3kk7 s GLU 38 Cb 0.44 -3.22 0.03 0.00 0.26 0.00 0.00 34.13 31.64 3kk7 s GLU 38 CO 0.11 0.21 0.03 -1.50 -0.54 0.00 0.00 175.26 173.57 3kk7 s ILE 39 N -0.93 -0.05 0.12 -3.70 1.10 -0.66 -5.02 121.20 112.06 3kk7 s ILE 39 Ca 0.45 0.21 -0.30 0.00 -0.51 0.00 0.00 60.65 60.50 3kk7 s ILE 39 Cb -0.31 -0.08 -0.06 0.00 0.15 0.00 0.00 42.46 42.16 3kk7 s ILE 39 CO 0.38 0.09 1.14 -0.63 -2.11 0.00 0.00 174.94 173.81 3kk7 s ILE 40 N 1.06 3.99 -0.06 2.00 1.01 -1.26 -1.28 121.20 126.66 3kk7 s ILE 40 Ca -0.09 1.56 0.19 0.00 0.00 0.00 0.00 60.65 62.30 3kk7 s ILE 40 Cb -0.13 -4.00 -0.28 0.00 0.01 0.00 0.00 42.46 38.06 3kk7 s ILE 40 CO -0.03 0.19 0.35 0.18 0.00 0.00 0.00 174.94 175.64 3kk7 n LEU 41 N 3.14 0.00 -3.68 2.97 4.77 -0.10 -4.92 117.00 119.18 3kk7 n LEU 41 Ca 0.06 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.93 3kk7 n LEU 41 Cb 0.46 0.08 -0.11 0.00 -2.33 0.00 0.00 43.42 41.53 3kk7 n LEU 41 CO 0.55 0.08 -0.02 -1.58 -1.33 0.00 0.00 177.39 175.09 3kk7 s GLN 42 N -3.16 0.29 0.52 3.23 0.74 -0.64 -4.97 119.66 115.67 3kk7 s GLN 42 Ca -0.07 0.85 -0.21 0.00 0.05 0.00 0.00 55.36 55.97 3kk7 s GLN 42 Cb 0.11 0.10 -0.06 0.00 1.10 0.00 0.00 33.01 34.26 3kk7 s GLN 42 CO 0.79 -0.22 1.20 -1.21 -0.55 0.00 0.00 175.29 175.29 3kk7 s GLU 43 N 2.10 3.39 0.13 1.67 0.41 -1.26 -1.91 118.70 123.22 3kk7 s GLU 43 Ca -0.04 1.83 -0.32 0.00 -0.41 0.00 0.00 54.97 56.02 3kk7 s GLU 43 Cb -0.11 -2.19 -0.12 0.00 -1.78 0.00 0.00 34.13 29.94 3kk7 s GLU 43 CO -0.11 -0.87 1.77 -2.13 -0.49 0.00 0.00 175.26 173.43 3kk7 n ARG 44 N -1.00 2.61 -1.71 1.61 0.63 -1.26 -4.53 116.66 113.01 3kk7 n ARG 44 Ca 0.10 0.95 -0.57 0.00 -0.92 0.00 0.00 57.85 57.41 3kk7 n ARG 44 Cb 0.49 -2.80 -0.07 0.00 0.45 0.00 0.00 32.46 30.52 3kk7 n ARG 44 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 3kk7 n ASN 45 N 4.95 2.38 0.17 6.15 2.85 -0.21 -4.81 115.26 126.73 3kk7 n ASN 45 Ca 0.18 1.08 0.13 0.00 -0.11 0.00 0.00 54.58 55.85 3kk7 n ASN 45 Cb 0.34 -1.15 0.55 0.00 1.24 0.00 0.00 39.78 40.76 3kk7 n ASN 45 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 3kk7 h SER 46 N 7.14 0.00 0.48 1.20 4.64 -1.90 -2.42 113.55 122.69 3kk7 h SER 46 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3kk7 h SER 46 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3kk7 h SER 46 CO 0.95 0.00 -0.44 -1.54 -0.87 0.00 0.00 176.83 174.94 3kk7 n SER 47 N -2.43 0.55 -4.77 4.97 3.41 -1.26 -4.85 113.62 109.24 3kk7 n SER 47 Ca 0.02 -0.31 -0.38 0.00 -0.26 0.00 0.00 58.87 57.93 3kk7 n SER 47 Cb 0.24 0.20 -0.01 0.00 -0.26 0.00 0.00 64.21 64.37 3kk7 n SER 47 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3kk7 s LEU 48 N -2.92 4.17 0.95 1.04 1.43 -0.91 -5.03 118.68 117.41 3kk7 s LEU 48 Ca 0.13 2.43 -0.12 0.00 -1.03 0.00 0.00 54.13 55.55 3kk7 s LEU 48 Cb 0.18 -4.02 0.16 0.00 0.03 0.00 0.00 46.19 42.54 3kk7 s LEU 48 CO 0.66 -0.77 1.09 -2.16 0.23 0.00 0.00 176.35 175.41 3kk7 s PRO 49 N -2.33 0.81 -0.82 1.29 0.05 -1.26 -4.98 135.00 127.76 3kk7 s PRO 49 Ca 0.58 0.63 0.02 0.00 0.05 0.00 0.00 61.00 62.28 3kk7 s PRO 49 Cb -0.33 -1.77 0.33 0.00 0.05 0.00 0.00 34.50 32.78 3kk7 s PRO 49 CO 0.41 -2.50 1.38 0.54 0.05 0.00 0.00 177.00 176.89 3kk7 n ARG 50 N -4.03 4.32 -4.03 4.56 1.74 -1.26 -4.83 116.66 113.14 3kk7 n ARG 50 Ca 0.06 -4.76 -0.31 0.00 -0.77 0.00 0.00 57.85 52.07 3kk7 n ARG 50 Cb 0.56 -2.36 -0.16 0.00 -1.02 0.00 0.00 32.46 29.48 3kk7 n ARG 50 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3kk7 s VAL 51 N -4.27 1.77 -0.96 1.55 1.01 -1.26 -4.97 120.40 113.27 3kk7 s VAL 51 Ca 0.43 -1.05 0.19 0.00 0.00 0.00 0.00 61.98 61.55 3kk7 s VAL 51 Cb 0.22 -1.80 -0.20 0.00 0.00 0.00 0.00 36.38 34.61 3kk7 s VAL 51 CO -0.12 0.22 0.83 0.79 0.00 0.00 0.00 175.10 176.82 3kk7 n TRP 52 N 4.65 0.00 -3.82 5.22 5.03 -1.26 -4.55 117.44 122.70 3kk7 n TRP 52 Ca -0.16 0.00 -0.09 0.00 3.03 0.00 0.00 57.50 60.29 3kk7 n TRP 52 Cb 0.47 0.00 -0.03 0.00 -1.03 0.00 0.00 31.31 30.72 3kk7 n TRP 52 CO 0.00 0.00 0.00 -1.54 -0.03 0.00 0.00 177.69 176.12 3kk7 s SER 53 N -2.80 -0.25 -0.05 -0.99 1.04 -1.26 -4.70 113.70 104.70 3kk7 s SER 53 Ca 0.08 -0.60 0.01 0.00 0.48 0.00 0.00 55.95 55.93 3kk7 s SER 53 Cb 0.15 0.65 0.02 0.00 0.10 0.00 0.00 66.02 66.93 3kk7 s SER 53 CO 0.78 -1.19 -0.06 -0.54 0.98 0.00 0.00 173.24 173.20 3kk7 s LYS 54 N -3.91 1.00 -1.28 4.02 1.02 -1.19 -5.07 119.74 114.33 3kk7 s LYS 54 Ca 0.12 -0.18 -0.13 0.00 0.02 0.00 0.00 55.97 55.80 3kk7 s LYS 54 Cb -0.03 -0.94 0.14 0.00 -0.52 0.00 0.00 37.83 36.48 3kk7 s LYS 54 CO 0.03 -0.04 1.74 0.36 -0.92 0.00 0.00 175.35 176.53 3kk7 n LYS 55 N 3.92 3.37 0.00 1.68 -0.00 -1.26 -4.66 118.16 121.20 3kk7 n LYS 55 Ca -0.24 -3.49 0.00 0.00 -0.00 0.00 0.00 58.31 54.58 3kk7 n LYS 55 Cb 0.51 -3.10 0.00 0.00 -0.00 0.00 0.00 35.03 32.44 3kk7 n LYS 55 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 3kk7 n THR 56 N 4.48 0.00 -2.67 0.58 -1.04 -1.26 -5.21 114.28 109.16 3kk7 n THR 56 Ca 0.42 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 62.39 3kk7 n THR 56 Cb 0.40 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 68.96 3kk7 n THR 56 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 3kk7 n PHE 66 N 0.00 -0.73 0.08 -1.42 3.72 -1.26 -5.20 117.46 112.66 3kk7 n PHE 66 Ca 0.00 -0.69 -0.05 0.00 -0.05 0.00 0.00 57.45 56.66 3kk7 n PHE 66 Cb 0.00 1.10 -0.02 0.00 -0.94 0.00 0.00 39.48 39.62 3kk7 n PHE 66 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 3kk7 h THR 67 N 2.22 0.00 -1.24 4.37 2.02 -2.03 -3.47 112.91 114.79 3kk7 h THR 67 Ca -0.07 0.00 -0.64 0.00 0.77 0.00 0.00 66.41 66.47 3kk7 h THR 67 Cb 1.18 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 67.46 3kk7 h THR 67 CO -0.13 0.00 -0.56 1.51 0.37 0.00 0.00 175.52 176.71 3kk7 s ASP 68 N -2.71 4.02 0.40 4.18 1.47 -1.26 -5.04 116.67 117.73 3kk7 s ASP 68 Ca -0.04 -1.43 0.28 0.00 1.18 0.00 0.00 52.55 52.54 3kk7 s ASP 68 Cb 0.01 -0.11 1.40 0.00 -0.34 0.00 0.00 42.92 43.88 3kk7 s ASP 68 CO 0.15 -0.60 1.85 0.00 0.68 0.00 0.00 175.17 177.25 3kk7 h ALA 69 N 1.59 1.00 0.00 2.11 0.00 -1.91 -2.33 119.26 119.72 3kk7 h ALA 69 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3kk7 h ALA 69 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3kk7 h ALA 69 CO 0.77 0.00 -0.63 0.25 0.00 0.00 0.00 179.25 179.64 3kk7 n THR 70 N -2.51 0.32 1.25 0.00 -2.24 -1.26 -4.08 114.28 105.75 3kk7 n THR 70 Ca -0.01 -0.25 0.12 0.00 -2.27 0.00 0.00 64.05 61.64 3kk7 n THR 70 Cb 0.12 -0.09 0.64 0.00 -2.10 0.00 0.00 70.33 68.90 3kk7 n THR 70 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3kk7 n ASP 71 N -2.06 0.00 0.09 3.42 8.00 -0.88 -3.32 116.55 121.81 3kk7 n ASP 71 Ca 0.03 -0.26 0.13 0.00 0.71 0.00 0.00 54.79 55.40 3kk7 n ASP 71 Cb 0.43 -0.20 0.40 0.00 -0.02 0.00 0.00 41.12 41.73 3kk7 n ASP 71 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3kk7 n PHE 72 N -1.20 0.81 -2.07 1.24 3.72 -1.26 -4.82 117.46 113.89 3kk7 n PHE 72 Ca 0.13 0.24 -0.41 0.00 -0.05 0.00 0.00 57.45 57.36 3kk7 n PHE 72 Cb 0.16 -0.87 -0.02 0.00 -0.94 0.00 0.00 39.48 37.80 3kk7 n PHE 72 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 3kk7 s LEU 73 N -4.37 4.40 0.00 4.37 2.96 -1.21 -2.12 118.68 122.71 3kk7 s LEU 73 Ca 0.10 2.62 0.00 0.00 -0.22 0.00 0.00 54.13 56.63 3kk7 s LEU 73 Cb 0.13 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 43.19 3kk7 s LEU 73 CO 0.61 -0.64 0.00 0.61 -1.32 0.00 0.00 176.35 175.61 3kk7 n GLY 74 N 1.98 0.48 3.90 7.98 0.00 0.21 -4.90 105.19 114.84 3kk7 n GLY 74 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 3kk7 n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kk7 s SER 76 N -3.36 4.86 -0.04 0.00 1.04 0.57 -0.50 113.70 116.27 3kk7 s SER 76 Ca 0.45 1.97 0.02 0.00 0.48 0.00 0.00 55.95 58.87 3kk7 s SER 76 Cb -0.10 -2.55 0.01 0.00 0.10 0.00 0.00 66.02 63.48 3kk7 s SER 76 CO 0.32 -1.79 -0.09 -0.47 0.98 0.00 0.00 173.24 172.19 3kk7 s TYR 77 N -2.48 0.99 -0.30 5.02 6.14 0.16 -0.95 117.35 125.93 3kk7 s TYR 77 Ca 0.66 -0.28 -0.11 0.00 0.64 0.00 0.00 57.07 57.98 3kk7 s TYR 77 Cb -0.20 -0.74 -0.03 0.00 0.42 0.00 0.00 41.96 41.41 3kk7 s TYR 77 CO 0.46 -0.15 0.18 0.00 0.64 0.00 0.00 175.55 176.68 3kk7 s ALA 78 N 0.42 3.43 -0.02 3.97 0.00 0.22 -2.07 121.76 127.70 3kk7 s ALA 78 Ca -0.07 -1.22 -0.02 0.00 0.00 0.00 0.00 51.96 50.66 3kk7 s ALA 78 Cb -0.11 -2.45 -0.01 0.00 0.00 0.00 0.00 23.12 20.55 3kk7 s ALA 78 CO 0.01 -0.70 -0.04 0.28 0.00 0.00 0.00 175.76 175.31 3kk7 n VAL 79 N 5.04 0.22 -0.30 0.00 0.31 -1.26 -3.86 118.33 118.48 3kk7 n VAL 79 Ca -0.14 0.45 0.02 0.00 -0.01 0.00 0.00 64.34 64.67 3kk7 n VAL 79 Cb 0.51 -1.63 0.16 0.00 -0.91 0.00 0.00 33.84 31.97 3kk7 n VAL 79 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3kk7 h GLU 80 N -0.15 0.84 -0.47 5.55 4.81 -1.94 -2.59 114.58 120.63 3kk7 h GLU 80 Ca 0.00 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.04 3kk7 h GLU 80 Cb 0.11 -0.19 -0.08 0.00 0.63 0.00 0.00 28.75 29.22 3kk7 h GLU 80 CO 0.00 0.55 0.10 0.09 -0.73 0.00 0.00 179.01 179.02 3kk7 n ASN 81 N -4.69 3.83 -1.01 1.04 5.03 -1.26 -4.45 115.26 113.75 3kk7 n ASN 81 Ca 0.13 -3.31 0.00 0.00 0.87 0.00 0.00 54.58 52.27 3kk7 n ASN 81 Cb 0.24 -0.65 0.00 0.00 -1.02 0.00 0.00 39.78 38.35 3kk7 n ASN 81 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3kk7 n GLY 82 N -0.58 2.70 0.23 7.41 0.00 -0.98 -5.00 105.19 108.97 3kk7 n GLY 82 Ca 0.33 -2.09 0.15 0.00 0.00 0.00 0.00 46.02 44.40 3kk7 n GLY 82 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3kk7 h THR 83 N 0.10 0.00 0.00 2.61 1.35 -1.84 -3.47 112.91 111.65 3kk7 h THR 83 Ca 0.00 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 3kk7 h THR 83 Cb 0.00 1.64 0.00 0.00 -1.73 0.00 0.00 68.15 68.06 3kk7 h THR 83 CO 0.00 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 173.73 3kk7 n SER 84 N -2.97 -1.27 -4.60 5.36 3.41 -1.26 -4.88 113.62 107.40 3kk7 n SER 84 Ca 0.02 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.22 3kk7 n SER 84 Cb 0.39 -0.22 -0.06 0.00 -0.26 0.00 0.00 64.21 64.06 3kk7 n SER 84 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3kk7 s ILE 85 N -3.15 4.93 0.03 -1.33 -1.09 -1.26 -4.88 121.20 114.45 3kk7 s ILE 85 Ca 0.00 0.93 -0.30 0.00 -2.23 0.00 0.00 60.65 59.05 3kk7 s ILE 85 Cb 0.00 -4.00 -0.08 0.00 -1.58 0.00 0.00 42.46 36.80 3kk7 s ILE 85 CO 0.00 -0.12 1.76 -0.63 -1.23 0.00 0.00 174.94 174.72 3kk7 s ILE 86 N 2.62 3.16 0.00 2.92 1.01 -1.26 -2.26 121.20 127.39 3kk7 s ILE 86 Ca 0.26 0.39 0.00 0.00 0.00 0.00 0.00 60.65 61.30 3kk7 s ILE 86 Cb -0.15 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.07 3kk7 s ILE 86 CO 0.11 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.64 3kk7 n GLY 87 N 4.22 0.82 3.69 6.18 0.00 -1.26 -4.52 105.19 114.32 3kk7 n GLY 87 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3kk7 n GLY 87 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3kk7 s ASP 88 N -2.80 6.51 0.48 1.61 -1.08 -0.96 -3.06 116.67 117.38 3kk7 s ASP 88 Ca 0.00 2.62 0.19 0.00 -0.52 0.00 0.00 52.55 54.84 3kk7 s ASP 88 Cb 0.00 -2.56 1.22 0.00 -1.46 0.00 0.00 42.92 40.11 3kk7 s ASP 88 CO 0.00 -0.95 1.99 2.19 0.52 0.00 0.00 175.17 178.92 3kk7 h PHE 89 N 8.55 0.21 -0.29 -5.34 -5.15 -1.92 -0.91 116.94 112.10 3kk7 h PHE 89 Ca -0.44 0.01 0.08 0.00 -0.20 0.00 0.00 57.97 57.42 3kk7 h PHE 89 Cb 1.21 -0.07 -0.01 0.00 0.22 0.00 0.00 35.95 37.30 3kk7 h PHE 89 CO 0.79 0.09 0.23 0.00 -2.00 0.00 0.00 178.31 177.43 3kk7 h ALA 90 N 1.73 2.15 -0.00 12.09 0.00 -1.97 -1.17 119.26 132.09 3kk7 h ALA 90 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3kk7 h ALA 90 Cb 0.76 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.58 3kk7 h ALA 90 CO -0.04 -0.38 -0.04 0.09 0.00 0.00 0.00 179.25 178.87 3kk7 n ASN 91 N -4.22 0.09 -4.69 0.00 3.02 -0.34 -4.73 115.26 104.39 3kk7 n ASN 91 Ca 0.04 -0.02 -0.42 0.00 -0.03 0.00 0.00 54.58 54.15 3kk7 n ASN 91 Cb 0.39 -0.29 -0.03 0.00 -0.61 0.00 0.00 39.78 39.24 3kk7 n ASN 91 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kk7 s ALA 92 N -2.71 3.55 0.00 5.41 0.00 -0.45 -0.61 121.76 126.96 3kk7 s ALA 92 Ca 0.23 0.82 0.00 0.00 0.00 0.00 0.00 51.96 53.01 3kk7 s ALA 92 Cb 0.20 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.75 3kk7 s ALA 92 CO 0.50 -0.84 0.00 1.63 0.00 0.00 0.00 175.76 177.04 3kk7 n LYS 93 N 5.21 0.00 -4.26 0.00 4.76 -0.13 -4.97 118.16 118.77 3kk7 n LYS 93 Ca 0.12 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.42 3kk7 n LYS 93 Cb 0.44 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.53 3kk7 n LYS 93 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3kk7 s TYR 94 N 0.00 1.30 0.22 2.13 2.02 -1.26 -4.92 117.35 116.84 3kk7 s TYR 94 Ca 0.00 -0.74 -0.30 0.00 -0.37 0.00 0.00 57.07 55.66 3kk7 s TYR 94 Cb 0.00 -0.65 -0.09 0.00 -0.40 0.00 0.00 41.96 40.82 3kk7 s TYR 94 CO 0.00 0.10 1.25 -2.14 -1.57 0.00 0.00 175.55 173.19 3kk7 s PRO 95 N -3.71 4.44 -0.25 -1.71 0.01 -1.26 -0.32 135.00 132.20 3kk7 s PRO 95 Ca 0.17 1.99 -0.12 0.00 0.01 0.00 0.00 61.00 63.05 3kk7 s PRO 95 Cb 0.02 -3.19 -0.11 0.00 0.01 0.00 0.00 34.50 31.23 3kk7 s PRO 95 CO 0.01 -0.14 -0.32 0.28 0.01 0.00 0.00 177.00 176.84 3kk7 n VAL 96 N 2.23 1.39 -3.11 3.83 0.31 0.02 -4.52 118.33 118.47 3kk7 n VAL 96 Ca 0.04 -0.36 -0.39 0.00 -0.01 0.00 0.00 64.34 63.62 3kk7 n VAL 96 Cb 0.43 -1.82 -0.05 0.00 -0.91 0.00 0.00 33.84 31.49 3kk7 n VAL 96 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3kk7 s VAL 97 N -2.46 5.01 0.53 2.52 1.01 -0.29 -0.28 120.40 126.43 3kk7 s VAL 97 Ca -0.35 1.35 -0.17 0.00 0.00 0.00 0.00 61.98 62.80 3kk7 s VAL 97 Cb 0.13 -3.99 -0.07 0.00 0.00 0.00 0.00 36.38 32.46 3kk7 s VAL 97 CO 0.45 0.31 1.02 0.21 0.00 0.00 0.00 175.10 177.09 3kk7 s ASN 98 N 0.48 6.28 0.00 3.32 3.84 0.19 -4.64 114.94 124.42 3kk7 s ASN 98 Ca 0.35 1.75 0.00 0.00 0.21 0.00 0.00 52.86 55.16 3kk7 s ASN 98 Cb -0.18 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 37.99 3kk7 s ASN 98 CO 0.17 -0.82 0.00 1.17 -2.79 0.00 0.00 177.10 174.83 3kk7 n LYS 100 N -1.53 0.00 -0.19 0.43 4.81 -1.26 -1.28 118.16 119.15 3kk7 n LYS 100 Ca 0.08 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.43 3kk7 n LYS 100 Cb 0.53 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.60 3kk7 n LYS 100 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 3kk7 h LYS 101 N 0.00 0.86 -0.53 1.64 3.64 -1.97 -2.32 116.57 117.90 3kk7 h LYS 101 Ca 0.00 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 59.15 3kk7 h LYS 101 Cb 0.00 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 3kk7 h LYS 101 CO 0.00 0.83 0.30 1.25 -2.27 0.00 0.00 179.45 179.56 3kk7 h LEU 102 N 0.75 0.65 -0.38 5.20 5.85 -1.52 -2.99 115.31 122.87 3kk7 h LEU 102 Ca 0.16 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.73 3kk7 h LEU 102 Cb 0.37 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 3kk7 h LEU 102 CO 0.01 0.54 -0.33 -0.07 -0.34 0.00 0.00 178.44 178.24 3kk7 h LEU 103 N 0.70 0.00 -2.06 2.25 3.38 -1.75 0.67 115.31 118.50 3kk7 h LEU 103 Ca 0.19 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 3kk7 h LEU 103 Cb 0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 3kk7 h LEU 103 CO -0.03 0.33 -0.08 -0.33 0.09 0.00 0.00 178.44 178.42 3kk7 h GLU 104 N 0.00 0.00 0.00 1.13 5.08 -1.26 -2.97 114.58 116.55 3kk7 h GLU 104 Ca -0.00 0.00 -0.42 0.00 -1.00 0.00 0.00 59.36 57.93 3kk7 h GLU 104 Cb 1.11 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.29 3kk7 h GLU 104 CO 0.04 0.08 -2.49 -2.13 -1.00 0.00 0.00 179.01 173.52 3kk7 n ARG 105 N -3.87 0.60 -3.69 2.33 3.00 -0.91 -4.86 116.66 109.26 3kk7 n ARG 105 Ca -0.02 0.21 -0.28 0.00 -0.00 0.00 0.00 57.85 57.76 3kk7 n ARG 105 Cb 0.18 -1.48 -0.11 0.00 0.00 0.00 0.00 32.46 31.04 3kk7 n ARG 105 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 3kk7 s TYR 106 N -2.50 2.53 0.63 -0.14 2.02 0.18 -4.98 117.35 115.08 3kk7 s TYR 106 Ca -0.36 -2.90 0.41 0.00 -0.37 0.00 0.00 57.07 53.84 3kk7 s TYR 106 Cb 0.12 -1.98 2.24 0.00 -0.40 0.00 0.00 41.96 41.95 3kk7 s TYR 106 CO 0.52 -0.67 2.33 -1.00 -1.57 0.00 0.00 175.55 175.17 3kk7 h PRO 107 N 5.56 0.00 0.00 -1.71 0.13 -1.74 -2.39 132.00 131.85 3kk7 h PRO 107 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 3kk7 h PRO 107 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3kk7 h PRO 107 CO 0.57 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.21 3kk7 n SER 108 N -3.28 0.00 0.28 1.44 3.41 -1.26 -3.27 113.62 110.94 3kk7 n SER 108 Ca -0.03 -0.43 0.18 0.00 -0.26 0.00 0.00 58.87 58.34 3kk7 n SER 108 Cb 0.08 -0.18 0.82 0.00 -0.26 0.00 0.00 64.21 64.67 3kk7 n SER 108 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 3kk7 h TYR 109 N 0.00 0.00 -3.15 7.33 0.99 -1.81 -3.42 116.97 116.90 3kk7 h TYR 109 Ca 0.00 0.00 -0.63 0.00 2.00 0.00 0.00 58.73 60.10 3kk7 h TYR 109 Cb 0.18 0.00 -0.09 0.00 1.00 0.00 0.00 36.73 37.81 3kk7 h TYR 109 CO 0.00 0.00 -0.61 -1.50 -0.00 0.00 0.00 178.16 176.05 3kk7 s ILE 110 N -3.77 4.40 -0.34 -2.88 2.07 -1.20 -0.36 121.20 119.12 3kk7 s ILE 110 Ca -0.00 -0.86 0.04 0.00 -1.41 0.00 0.00 60.65 58.41 3kk7 s ILE 110 Cb 0.10 -3.13 0.16 0.00 0.13 0.00 0.00 42.46 39.72 3kk7 s ILE 110 CO 0.48 0.09 0.45 0.21 -1.91 0.00 0.00 174.94 174.27 3kk7 s ASN 111 N -2.47 0.16 0.31 4.50 2.47 -0.49 -4.96 114.94 114.45 3kk7 s ASN 111 Ca 0.29 -0.82 -0.12 0.00 0.42 0.00 0.00 52.86 52.63 3kk7 s ASN 111 Cb -0.12 1.15 -0.08 0.00 -1.45 0.00 0.00 41.25 40.75 3kk7 s ASN 111 CO 0.21 -0.29 0.68 -2.16 -3.72 0.00 0.00 177.10 171.83 3kk7 s PRO 112 N 2.07 3.88 -0.09 0.43 0.05 -1.26 -2.24 135.00 137.84 3kk7 s PRO 112 Ca 0.13 0.49 -0.04 0.00 0.05 0.00 0.00 61.00 61.63 3kk7 s PRO 112 Cb -0.12 -2.49 0.05 0.00 0.05 0.00 0.00 34.50 31.99 3kk7 s PRO 112 CO -0.17 0.17 0.19 0.15 0.05 0.00 0.00 177.00 177.39 3kk7 s LYS 113 N -3.13 0.09 0.31 4.56 1.02 -1.26 -5.01 119.74 116.32 3kk7 s LYS 113 Ca 0.51 0.58 -0.29 0.00 0.02 0.00 0.00 55.97 56.79 3kk7 s LYS 113 Cb -0.10 -0.18 -0.13 0.00 -0.52 0.00 0.00 37.83 36.89 3kk7 s LYS 113 CO 0.22 -0.27 1.34 0.39 -0.92 0.00 0.00 175.35 176.11 3kk7 n GLU 114 N 5.05 2.14 -4.23 1.68 1.02 -1.26 -4.54 120.64 120.50 3kk7 n GLU 114 Ca -0.10 0.75 -0.15 0.00 -0.02 0.00 0.00 57.16 57.64 3kk7 n GLU 114 Cb 0.50 -2.37 -0.10 0.00 -0.02 0.00 0.00 31.44 29.45 3kk7 n GLU 114 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3kk7 s LEU 115 N -0.68 2.47 -0.42 -4.62 1.43 0.17 -4.91 118.68 112.11 3kk7 s LEU 115 Ca 0.59 -0.91 0.05 0.00 -1.03 0.00 0.00 54.13 52.83 3kk7 s LEU 115 Cb -0.59 -0.38 0.17 0.00 0.03 0.00 0.00 46.19 45.43 3kk7 s LEU 115 CO 0.58 -0.27 0.47 -0.13 0.23 0.00 0.00 176.35 177.23 3kk7 s ARG 116 N -3.24 0.84 0.23 1.70 1.81 -1.25 -4.06 118.95 114.98 3kk7 s ARG 116 Ca 0.12 -1.26 -0.02 0.00 -1.72 0.00 0.00 55.73 52.85 3kk7 s ARG 116 Cb -0.01 -0.72 -0.03 0.00 -0.45 0.00 0.00 34.95 33.75 3kk7 s ARG 116 CO 0.01 -1.29 0.23 0.95 -0.68 0.00 0.00 175.30 174.52 3kk7 s THR 117 N 0.90 0.00 0.17 0.02 -4.23 -0.90 -4.87 115.64 106.74 3kk7 s THR 117 Ca 0.25 -1.87 0.08 0.00 -1.18 0.00 0.00 61.69 58.97 3kk7 s THR 117 Cb -0.05 -2.45 -0.04 0.00 1.34 0.00 0.00 72.50 71.29 3kk7 s THR 117 CO -0.08 0.00 -0.16 0.42 -0.54 0.00 0.00 174.62 174.25 3kk7 s THR 118 N -3.99 1.72 -0.14 3.99 -4.23 -1.26 -0.71 115.64 111.02 3kk7 s THR 118 Ca 0.36 -1.98 -0.08 0.00 -1.18 0.00 0.00 61.69 58.80 3kk7 s THR 118 Cb 0.05 -1.86 0.05 0.00 1.34 0.00 0.00 72.50 72.08 3kk7 s THR 118 CO 0.14 -0.42 0.34 -0.70 -0.54 0.00 0.00 174.62 173.44 3kk7 s GLU 119 N -3.04 0.33 -0.02 3.99 2.56 -0.65 -4.95 118.70 116.92 3kk7 s GLU 119 Ca 0.17 0.66 0.07 0.00 0.00 0.00 0.00 54.97 55.86 3kk7 s GLU 119 Cb -0.04 -0.03 -0.02 0.00 2.00 0.00 0.00 34.13 36.04 3kk7 s GLU 119 CO 0.06 -0.15 -0.22 0.95 -0.56 0.00 0.00 175.26 175.35 3kk7 s THR 120 N 1.19 1.71 -0.00 -1.70 -4.23 -1.26 -1.34 115.64 110.01 3kk7 s THR 120 Ca -0.08 -0.92 0.00 0.00 -1.18 0.00 0.00 61.69 59.51 3kk7 s THR 120 Cb -0.08 -1.42 0.00 0.00 1.34 0.00 0.00 72.50 72.34 3kk7 s THR 120 CO -0.10 0.48 -0.00 -0.54 -0.54 0.00 0.00 174.62 173.93 3kk7 s LYS 121 N -0.49 0.02 0.02 3.99 1.02 -0.88 -4.99 119.74 118.43 3kk7 s LYS 121 Ca 0.08 -0.01 0.06 0.00 0.02 0.00 0.00 55.97 56.12 3kk7 s LYS 121 Cb -0.09 -0.03 -0.02 0.00 -0.52 0.00 0.00 37.83 37.18 3kk7 s LYS 121 CO -0.01 0.00 -0.17 0.00 -0.92 0.00 0.00 175.35 174.26 3kk7 s ALA 122 N 0.02 1.42 -0.04 5.17 0.00 -1.26 -0.63 121.76 126.44 3kk7 s ALA 122 Ca -0.00 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.11 3kk7 s ALA 122 Cb -0.00 -0.29 0.02 0.00 0.00 0.00 0.00 23.12 22.85 3kk7 s ALA 122 CO -0.00 0.31 -0.02 -1.17 0.00 0.00 0.00 175.76 174.88 3kk7 s LEU 123 N -0.90 1.22 -0.05 0.00 2.96 0.09 -4.98 118.68 117.01 3kk7 s LEU 123 Ca 0.05 -0.08 0.04 0.00 -0.22 0.00 0.00 54.13 53.91 3kk7 s LEU 123 Cb -0.08 -0.36 -0.03 0.00 0.50 0.00 0.00 46.19 46.23 3kk7 s LEU 123 CO 0.01 -0.08 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.37 3kk7 s SER 124 N 1.02 4.01 -0.19 3.68 0.01 -1.26 -0.45 113.70 120.52 3kk7 s SER 124 Ca -0.10 -0.20 -0.09 0.00 1.31 0.00 0.00 55.95 56.87 3kk7 s SER 124 Cb -0.14 -0.86 0.07 0.00 0.21 0.00 0.00 66.02 65.31 3kk7 s SER 124 CO -0.01 0.34 0.43 -0.72 0.41 0.00 0.00 173.24 173.69 3kk7 s TYR 125 N -0.70 -0.71 -0.94 2.43 1.13 0.20 -4.93 117.35 113.83 3kk7 s TYR 125 Ca 0.11 1.43 0.27 0.00 -1.41 0.00 0.00 57.07 57.47 3kk7 s TYR 125 Cb -0.11 0.30 1.08 0.00 -1.10 0.00 0.00 41.96 42.14 3kk7 s TYR 125 CO 0.01 -0.41 1.84 0.43 -2.51 0.00 0.00 175.55 174.90 3kk7 n SER 126 N 4.74 0.16 -3.48 -0.18 7.64 -1.26 -0.16 113.62 121.08 3kk7 n SER 126 Ca -0.17 0.52 -0.03 0.00 1.01 0.00 0.00 58.87 60.20 3kk7 n SER 126 Cb 0.53 -0.56 0.01 0.00 -1.01 0.00 0.00 64.21 63.18 3kk7 n SER 126 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 3kk7 s ASP 127 N -3.30 -0.05 0.07 6.43 1.47 -1.26 -4.77 116.67 115.26 3kk7 s ASP 127 Ca 0.12 -0.58 0.28 0.00 1.18 0.00 0.00 52.55 53.55 3kk7 s ASP 127 Cb 0.16 0.48 1.03 0.00 -0.34 0.00 0.00 42.92 44.26 3kk7 s ASP 127 CO 0.50 -0.94 1.83 0.49 0.68 0.00 0.00 175.17 177.73 3kk7 n PHE 128 N -0.63 0.30 0.14 2.11 3.72 -1.26 -1.88 117.46 119.96 3kk7 n PHE 128 Ca -0.04 0.09 -0.25 0.00 -0.05 0.00 0.00 57.45 57.20 3kk7 n PHE 128 Cb 0.60 -0.63 -0.16 0.00 -0.94 0.00 0.00 39.48 38.36 3kk7 n PHE 128 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3kk7 h ASP 129 N 0.00 0.82 0.30 4.37 3.32 -1.97 -3.23 116.42 120.03 3kk7 h ASP 129 Ca 0.00 -0.92 0.00 0.00 0.02 0.00 0.00 57.03 56.13 3kk7 h ASP 129 Cb 0.58 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3kk7 h ASP 129 CO 0.00 1.71 0.00 0.03 -1.72 0.00 0.00 179.24 179.26 3kk7 h ARG 130 N 0.12 0.00 -1.08 3.56 2.47 -1.83 -2.62 114.38 115.00 3kk7 h ARG 130 Ca -0.26 0.00 0.30 0.00 -1.26 0.00 0.00 59.98 58.76 3kk7 h ARG 130 Cb 2.15 0.00 -0.11 0.00 -1.65 0.00 0.00 29.97 30.36 3kk7 h ARG 130 CO 0.27 0.00 0.68 1.25 0.56 0.00 0.00 179.97 182.73 3kk7 h LEU 131 N 0.00 0.44 -3.39 3.04 5.85 -1.39 0.18 115.31 120.04 3kk7 h LEU 131 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3kk7 h LEU 131 Cb 0.15 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.23 3kk7 h LEU 131 CO 0.00 0.02 0.00 -0.62 -0.34 0.00 0.00 178.44 177.50 3kk7 n GLU 132 N -4.72 4.55 -0.08 1.25 -0.58 -0.99 -4.59 120.64 115.49 3kk7 n GLU 132 Ca 0.28 -3.01 0.18 0.00 -0.42 0.00 0.00 57.16 54.19 3kk7 n GLU 132 Cb 0.97 -2.17 0.60 0.00 -0.57 0.00 0.00 31.44 30.28 3kk7 n GLU 132 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 3kk7 h LYS 133 N 3.93 0.20 -0.62 3.49 2.10 -1.09 0.14 116.57 124.71 3kk7 h LYS 133 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3kk7 h LYS 133 Cb 1.83 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 33.11 3kk7 h LYS 133 CO 0.42 0.13 0.00 0.09 -2.00 0.00 0.00 179.45 178.10 3kk7 n ASN 134 N -4.42 4.33 -3.44 7.07 3.02 -1.26 -4.97 115.26 115.58 3kk7 n ASN 134 Ca 0.12 -2.31 -0.25 0.00 -0.03 0.00 0.00 54.58 52.11 3kk7 n ASN 134 Cb 0.57 -0.52 0.01 0.00 -0.61 0.00 0.00 39.78 39.23 3kk7 n ASN 134 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3kk7 n LYS 135 N 1.12 -4.04 -0.02 3.52 5.02 0.48 -4.87 118.16 119.38 3kk7 n LYS 135 Ca 0.24 0.57 -0.09 0.00 -2.02 0.00 0.00 58.31 57.00 3kk7 n LYS 135 Cb 0.77 -5.34 -0.04 0.00 -0.02 0.00 0.00 35.03 30.41 3kk7 n LYS 135 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3kk7 h THR 136 N -1.27 0.89 0.07 -0.18 2.02 -1.85 -1.65 112.91 110.93 3kk7 h THR 136 Ca -0.48 -0.01 -0.16 0.00 0.77 0.00 0.00 66.41 66.52 3kk7 h THR 136 Cb 1.32 0.84 0.02 0.00 -1.74 0.00 0.00 68.15 68.59 3kk7 h THR 136 CO 0.58 0.01 -0.68 0.15 0.37 0.00 0.00 175.52 175.94 3kk7 h PHE 137 N 0.04 0.55 -0.77 3.16 3.57 -1.92 -3.37 116.94 118.21 3kk7 h PHE 137 Ca 0.07 -0.35 0.18 0.00 3.53 0.00 0.00 57.97 61.40 3kk7 h PHE 137 Cb 0.09 -0.04 -0.12 0.00 2.79 0.00 0.00 35.95 38.67 3kk7 h PHE 137 CO -0.16 1.22 0.16 1.15 -2.23 0.00 0.00 178.31 178.45 3kk7 h THR 138 N -0.26 0.44 0.00 4.41 2.02 -1.91 -0.24 112.91 117.36 3kk7 h THR 138 Ca -0.10 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.00 3kk7 h THR 138 Cb 1.46 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 3kk7 h THR 138 CO 0.13 0.04 0.00 2.29 0.37 0.00 0.00 175.52 178.35 3kk7 n LYS 139 N -5.20 0.15 0.22 6.66 2.85 -0.64 -2.46 118.16 119.74 3kk7 n LYS 139 Ca 0.16 0.23 0.11 0.00 -1.05 0.00 0.00 58.31 57.76 3kk7 n LYS 139 Cb 0.51 -1.71 0.40 0.00 -0.65 0.00 0.00 35.03 33.57 3kk7 n LYS 139 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 3kk7 h THR 140 N 0.00 0.34 -3.30 0.58 1.35 -1.18 0.01 112.91 110.70 3kk7 h THR 140 Ca 0.00 -1.10 -0.56 0.00 -0.55 0.00 0.00 66.41 64.20 3kk7 h THR 140 Cb 0.52 1.84 -0.04 0.00 -1.73 0.00 0.00 68.15 68.74 3kk7 h THR 140 CO 0.00 0.16 -0.00 -0.69 -0.25 0.00 0.00 175.52 174.74 3kk7 s VAL 141 N -3.47 4.69 -0.44 6.82 1.01 -1.03 -1.02 120.40 126.96 3kk7 s VAL 141 Ca 0.03 1.25 -0.46 0.00 0.00 0.00 0.00 61.98 62.79 3kk7 s VAL 141 Cb 0.08 -3.91 -0.20 0.00 0.00 0.00 0.00 36.38 32.35 3kk7 s VAL 141 CO 0.64 0.50 1.55 1.17 0.00 0.00 0.00 175.10 178.95 3kk7 n LYS 142 N 1.54 0.03 -1.62 2.72 4.81 -0.03 -4.25 118.16 121.36 3kk7 n LYS 142 Ca -0.09 0.01 -0.50 0.00 -0.87 0.00 0.00 58.31 56.86 3kk7 n LYS 142 Cb 0.51 -1.52 -0.05 0.00 0.02 0.00 0.00 35.03 33.99 3kk7 n LYS 142 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3kk7 n SER 143 N 3.77 2.13 0.00 3.14 2.88 -1.26 -2.11 113.62 122.17 3kk7 n SER 143 Ca 0.30 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.94 3kk7 n SER 143 Cb -0.04 -1.26 0.00 0.00 -0.75 0.00 0.00 64.21 62.16 3kk7 n SER 143 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3kk7 n GLY 144 N 2.89 3.09 3.76 0.46 0.00 -1.26 -5.06 105.19 109.07 3kk7 n GLY 144 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 3kk7 n GLY 144 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3kk7 s PHE 145 N -2.74 3.44 -0.63 1.61 5.36 -0.90 -4.96 117.98 119.17 3kk7 s PHE 145 Ca 0.00 1.66 -0.27 0.00 -0.96 0.00 0.00 56.93 57.36 3kk7 s PHE 145 Cb 0.00 -3.29 -0.00 0.00 -0.34 0.00 0.00 43.02 39.39 3kk7 s PHE 145 CO 0.00 -0.72 1.63 -1.12 -1.46 0.00 0.00 175.22 173.54 3kk7 s SER 146 N -1.00 5.68 -0.18 6.13 0.01 -1.26 -4.97 113.70 118.11 3kk7 s SER 146 Ca 0.48 0.16 -0.16 0.00 1.31 0.00 0.00 55.95 57.74 3kk7 s SER 146 Cb -0.31 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.34 3kk7 s SER 146 CO 0.39 -2.09 0.41 -0.22 0.41 0.00 0.00 173.24 172.14 3kk7 s LEU 147 N 7.58 4.19 -0.37 2.44 2.96 -1.26 -5.04 118.68 129.17 3kk7 s LEU 147 Ca 0.56 0.59 -0.19 0.00 -0.22 0.00 0.00 54.13 54.88 3kk7 s LEU 147 Cb -0.11 -2.55 0.01 0.00 0.50 0.00 0.00 46.19 44.03 3kk7 s LEU 147 CO 0.20 -0.04 0.56 0.21 -1.32 0.00 0.00 176.35 175.96 3kk7 s ASN 148 N 0.87 6.33 0.25 3.68 3.84 -1.26 -4.95 114.94 123.69 3kk7 s ASN 148 Ca 0.21 -0.11 0.25 0.00 0.21 0.00 0.00 52.86 53.41 3kk7 s ASN 148 Cb -0.15 -2.29 0.61 0.00 -0.55 0.00 0.00 41.25 38.88 3kk7 s ASN 148 CO 0.08 -0.57 1.65 -0.07 -2.79 0.00 0.00 177.10 175.40 3kk7 h LEU 149 N 9.26 0.00 -0.64 3.21 3.38 -1.96 -3.39 115.31 125.18 3kk7 h LEU 149 Ca -0.27 -0.03 0.12 0.00 0.09 0.00 0.00 57.88 57.79 3kk7 h LEU 149 Cb 1.11 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.74 3kk7 h LEU 149 CO 0.81 0.01 -0.30 1.23 0.09 0.00 0.00 178.44 180.28 3kk7 h GLY 150 N 4.39 0.04 1.22 0.83 0.00 -1.96 -1.03 103.07 106.56 3kk7 h GLY 150 Ca 0.00 0.39 -0.06 0.00 0.00 0.00 0.00 47.33 47.66 3kk7 h GLY 150 CO 0.00 -0.22 0.15 -2.55 0.00 0.00 0.00 176.54 173.91 3kk7 h PRO 151 N -0.12 0.97 -0.13 4.80 0.11 -1.95 0.16 132.00 135.83 3kk7 h PRO 151 Ca 0.26 -0.22 0.00 0.00 0.11 0.00 0.00 66.00 66.16 3kk7 h PRO 151 Cb 0.55 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 3kk7 h PRO 151 CO -0.71 0.87 0.09 0.35 -0.21 0.00 0.00 178.00 178.39 3kk7 h PHE 152 N 0.93 0.17 -0.54 0.65 3.57 -1.64 -0.53 116.94 119.55 3kk7 h PHE 152 Ca 0.20 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.62 3kk7 h PHE 152 Cb 0.34 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 3kk7 h PHE 152 CO 0.02 0.11 0.02 0.87 -2.23 0.00 0.00 178.31 177.11 3kk7 h LYS 153 N 0.17 0.91 -0.37 1.11 1.57 -0.72 -1.83 116.57 117.42 3kk7 h LYS 153 Ca 0.05 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 3kk7 h LYS 153 Cb -0.01 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 3kk7 h LYS 153 CO -0.01 0.89 0.20 0.35 -0.57 0.00 0.00 179.45 180.31 3kk7 h PHE 154 N 0.85 0.51 -0.64 -1.35 3.57 -0.53 -2.14 116.94 117.20 3kk7 h PHE 154 Ca 0.16 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 3kk7 h PHE 154 Cb 0.47 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 3kk7 h PHE 154 CO 0.03 0.40 0.21 0.78 -2.23 0.00 0.00 178.31 177.50 3kk7 h GLY 155 N 0.47 1.03 0.77 2.40 0.00 -0.75 -0.20 103.07 106.79 3kk7 h GLY 155 Ca 0.13 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 3kk7 h GLY 155 CO -0.02 0.54 0.01 -0.09 0.00 0.00 0.00 176.54 176.98 3kk7 h ARG 156 N 0.93 0.19 -0.95 4.80 9.65 -1.18 -1.49 114.38 126.32 3kk7 h ARG 156 Ca 0.21 -0.06 0.01 0.00 -1.10 0.00 0.00 59.98 59.05 3kk7 h ARG 156 Cb 0.25 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 28.76 3kk7 h ARG 156 CO -0.01 0.42 0.63 0.37 2.80 0.00 0.00 179.97 184.18 3kk7 h GLN 157 N -0.07 1.24 -0.57 0.20 4.15 -1.11 0.10 115.11 119.05 3kk7 h GLN 157 Ca 0.03 -0.07 0.01 0.00 0.77 0.00 0.00 58.65 59.39 3kk7 h GLN 157 Cb 0.33 -0.28 -0.03 0.00 0.21 0.00 0.00 27.48 27.71 3kk7 h GLN 157 CO 0.00 0.82 0.37 -0.22 -1.93 0.00 0.00 178.83 177.87 3kk7 h LYS 158 N 1.28 0.72 -0.23 1.69 3.64 -0.87 -0.61 116.57 122.19 3kk7 h LYS 158 Ca 0.35 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.67 3kk7 h LYS 158 Cb -0.12 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.52 3kk7 h LYS 158 CO -0.08 0.48 0.07 1.15 -2.27 0.00 0.00 179.45 178.80 3kk7 h THR 159 N 0.74 1.19 -0.39 1.00 2.02 -0.43 -1.23 112.91 115.81 3kk7 h THR 159 Ca 0.22 -0.60 0.06 0.00 0.77 0.00 0.00 66.41 66.85 3kk7 h THR 159 Cb -0.05 1.15 -0.05 0.00 -1.74 0.00 0.00 68.15 67.46 3kk7 h THR 159 CO -0.06 0.20 0.09 0.40 0.37 0.00 0.00 175.52 176.51 3kk7 h ILE 160 N 0.21 0.81 -0.21 3.11 1.08 -0.52 0.22 117.51 122.22 3kk7 h ILE 160 Ca 0.07 -0.08 -0.03 0.00 -0.39 0.00 0.00 64.86 64.44 3kk7 h ILE 160 Cb 0.23 0.57 -0.01 0.00 -3.07 0.00 0.00 36.82 34.54 3kk7 h ILE 160 CO -0.00 0.04 -0.02 0.11 -0.69 0.00 0.00 178.15 177.59 3kk7 h LYS 161 N 0.22 0.31 0.00 2.37 1.57 -0.87 -1.63 116.57 118.53 3kk7 h LYS 161 Ca 0.19 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.78 3kk7 h LYS 161 Cb 0.21 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 3kk7 h LYS 161 CO -0.23 0.35 -0.75 0.93 -0.57 0.00 0.00 179.45 179.17 3kk7 h GLU 162 N 0.30 0.00 0.00 3.15 5.08 -0.24 -3.34 114.58 119.52 3kk7 h GLU 162 Ca 0.07 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.21 3kk7 h GLU 162 Cb 0.24 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 3kk7 h GLU 162 CO 0.01 0.51 -1.30 1.15 -1.00 0.00 0.00 179.01 178.38 3kk7 h THR 163 N 0.00 0.97 -3.76 1.13 2.02 -0.00 -3.46 112.91 109.81 3kk7 h THR 163 Ca -0.04 -2.63 -0.69 0.00 0.77 0.00 0.00 66.41 63.82 3kk7 h THR 163 Cb 1.47 2.42 -0.21 0.00 -1.74 0.00 0.00 68.15 70.10 3kk7 h THR 163 CO 0.07 0.55 -0.72 -0.36 0.37 0.00 0.00 175.52 175.43 3kk7 s PHE 164 N -2.76 2.87 0.43 3.16 0.08 -0.67 -4.07 117.98 117.02 3kk7 s PHE 164 Ca -0.02 -0.05 -0.23 0.00 0.12 0.00 0.00 56.93 56.75 3kk7 s PHE 164 Cb 0.09 -1.70 -0.11 0.00 -0.57 0.00 0.00 43.02 40.73 3kk7 s PHE 164 CO 0.81 0.27 0.90 0.28 -0.10 0.00 0.00 175.22 177.38 3kk7 n VAL 165 N 2.31 2.39 -1.59 -0.44 0.31 -1.26 -4.80 118.33 115.24 3kk7 n VAL 165 Ca -0.18 -0.50 -0.46 0.00 -0.01 0.00 0.00 64.34 63.19 3kk7 n VAL 165 Cb 0.53 -1.01 -0.02 0.00 -0.91 0.00 0.00 33.84 32.42 3kk7 n VAL 165 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 3kk7 n HIS 166 N -0.66 1.35 -4.30 3.52 -0.00 -1.26 -5.01 115.22 108.86 3kk7 n HIS 166 Ca 0.10 0.67 -0.23 0.00 0.46 0.00 0.00 57.72 58.73 3kk7 n HIS 166 Cb 0.40 -2.28 -0.12 0.00 -0.12 0.00 0.00 29.99 27.87 3kk7 n HIS 166 CO 0.00 0.00 0.00 -0.80 0.46 0.00 0.00 176.34 176.00 3kk7 s ASN 167 N -0.31 2.55 0.00 0.26 0.01 -1.26 -5.00 114.94 111.18 3kk7 s ASN 167 Ca 0.64 -0.74 0.26 0.00 -0.71 0.00 0.00 52.86 52.31 3kk7 s ASN 167 Cb -0.74 -0.14 0.62 0.00 0.41 0.00 0.00 41.25 41.39 3kk7 s ASN 167 CO 0.57 0.02 1.49 0.41 -1.51 0.00 0.00 177.10 178.08 3kk7 n THR 168 N 0.84 0.00 -1.68 1.60 -1.04 -1.26 -5.04 114.28 107.70 3kk7 n THR 168 Ca -0.18 -0.31 -0.43 0.00 -2.04 0.00 0.00 64.05 61.09 3kk7 n THR 168 Cb 0.55 0.89 -0.01 0.00 -1.82 0.00 0.00 70.33 69.93 3kk7 n THR 168 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3kk7 n ASP 169 N 0.42 2.51 -4.59 8.00 8.00 -1.26 -4.90 116.55 124.73 3kk7 n ASP 169 Ca 0.15 1.19 -0.42 0.00 0.71 0.00 0.00 54.79 56.43 3kk7 n ASP 169 Cb 0.45 -1.44 -0.02 0.00 -0.02 0.00 0.00 41.12 40.08 3kk7 n ASP 169 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3kk7 s ASP 170 N -0.27 6.21 0.58 -2.24 -1.08 -1.26 -4.90 116.67 113.72 3kk7 s ASP 170 Ca 0.58 0.56 0.32 0.00 -0.52 0.00 0.00 52.55 53.49 3kk7 s ASP 170 Cb -0.60 -2.54 1.32 0.00 -1.46 0.00 0.00 42.92 39.64 3kk7 s ASP 170 CO 0.60 -1.59 1.62 0.77 0.52 0.00 0.00 175.17 177.09 3kk7 h SER 171 N 11.00 0.00 -0.61 -0.34 4.64 -1.96 0.21 113.55 126.49 3kk7 h SER 171 Ca -0.27 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.13 3kk7 h SER 171 Cb 1.10 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.15 3kk7 h SER 171 CO 1.13 0.00 0.41 -0.33 -0.87 0.00 0.00 176.83 177.17 3kk7 h GLU 172 N 0.00 0.51 -0.00 4.77 4.39 -1.94 -1.87 114.58 120.44 3kk7 h GLU 172 Ca 0.47 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.14 3kk7 h GLU 172 Cb 2.36 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 30.90 3kk7 h GLU 172 CO -0.00 0.34 -0.48 1.63 -1.16 0.00 0.00 179.01 179.33 3kk7 n LYS 173 N -4.48 0.04 -2.63 2.33 5.02 0.73 -4.48 118.16 114.69 3kk7 n LYS 173 Ca 0.09 -0.02 -0.41 0.00 -2.02 0.00 0.00 58.31 55.95 3kk7 n LYS 173 Cb 0.29 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.76 3kk7 n LYS 173 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3kk7 s VAL 174 N -2.98 4.22 0.02 -0.18 1.01 -0.70 -0.66 120.40 121.12 3kk7 s VAL 174 Ca 0.12 1.86 0.01 0.00 0.00 0.00 0.00 61.98 63.97 3kk7 s VAL 174 Cb 0.18 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 3kk7 s VAL 174 CO 0.69 0.29 -0.04 0.54 0.00 0.00 0.00 175.10 176.58 3kk7 s VAL 175 N -0.04 0.30 0.20 2.92 0.11 -0.62 -4.76 120.40 118.50 3kk7 s VAL 175 Ca 0.48 -0.62 0.08 0.00 -2.93 0.00 0.00 61.98 58.99 3kk7 s VAL 175 Cb -0.26 -0.34 -0.04 0.00 -1.53 0.00 0.00 36.38 34.21 3kk7 s VAL 175 CO 0.32 -0.22 0.03 -1.00 -3.33 0.00 0.00 175.10 170.90 3kk7 s HIS 176 N -0.83 2.86 0.02 1.54 3.76 0.77 -1.63 115.29 121.79 3kk7 s HIS 176 Ca -0.07 -0.14 -0.00 0.00 -0.15 0.00 0.00 55.06 54.70 3kk7 s HIS 176 Cb -0.06 -1.36 -0.02 0.00 1.11 0.00 0.00 32.58 32.26 3kk7 s HIS 176 CO -0.00 0.54 -0.02 0.20 -0.85 0.00 0.00 174.74 174.61 3kk7 s GLY 177 N -3.16 0.21 -0.00 -2.22 0.00 -0.58 -0.63 107.32 100.93 3kk7 s GLY 177 Ca 0.29 -0.51 0.01 0.00 0.00 0.00 0.00 44.72 44.51 3kk7 s GLY 177 CO 0.20 -0.57 -0.02 1.85 0.00 0.00 0.00 173.10 174.55 3kk7 s GLU 178 N -1.30 0.19 0.04 2.90 2.12 0.41 -0.19 118.70 122.86 3kk7 s GLU 178 Ca -0.14 -0.07 0.07 0.00 0.36 0.00 0.00 54.97 55.19 3kk7 s GLU 178 Cb -0.09 -0.19 -0.03 0.00 0.26 0.00 0.00 34.13 34.08 3kk7 s GLU 178 CO -0.01 0.04 -0.21 -1.17 -0.54 0.00 0.00 175.26 173.37 3kk7 s LEU 179 N 0.01 2.17 -0.05 2.70 2.96 0.85 -0.73 118.68 126.58 3kk7 s LEU 179 Ca 0.00 -0.53 0.02 0.00 -0.22 0.00 0.00 54.13 53.40 3kk7 s LEU 179 Cb -0.02 -1.00 0.02 0.00 0.50 0.00 0.00 46.19 45.70 3kk7 s LEU 179 CO -0.00 0.17 -0.08 -0.55 -1.32 0.00 0.00 176.35 174.56 3kk7 s SER 180 N -1.19 1.36 -0.17 3.68 0.15 0.20 -1.91 113.70 115.83 3kk7 s SER 180 Ca 0.08 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.51 3kk7 s SER 180 Cb -0.09 -0.64 0.04 0.00 -1.71 0.00 0.00 66.02 63.62 3kk7 s SER 180 CO 0.02 -0.01 -0.08 -0.63 1.20 0.00 0.00 173.24 173.74 3kk7 s ILE 181 N 0.78 1.32 -0.07 6.45 1.01 0.00 -2.08 121.20 128.61 3kk7 s ILE 181 Ca -0.13 -0.73 0.02 0.00 0.00 0.00 0.00 60.65 59.81 3kk7 s ILE 181 Cb -0.15 -1.42 0.02 0.00 0.01 0.00 0.00 42.46 40.91 3kk7 s ILE 181 CO 0.02 0.19 -0.10 -1.61 0.00 0.00 0.00 174.94 173.44 3kk7 s GLU 182 N 1.55 1.47 -0.36 2.79 2.02 -0.45 0.41 118.70 126.14 3kk7 s GLU 182 Ca 0.01 -0.32 -0.13 0.00 0.02 0.00 0.00 54.97 54.55 3kk7 s GLU 182 Cb -0.15 -1.29 -0.00 0.00 0.10 0.00 0.00 34.13 32.78 3kk7 s GLU 182 CO -0.08 -0.03 0.24 0.08 0.02 0.00 0.00 175.26 175.49 3kk7 s VAL 183 N 0.84 5.14 -0.20 2.63 1.01 -0.45 -1.64 120.40 127.73 3kk7 s VAL 183 Ca -0.12 -0.40 -0.09 0.00 0.00 0.00 0.00 61.98 61.38 3kk7 s VAL 183 Cb -0.15 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 3kk7 s VAL 183 CO 0.02 -0.09 0.10 -0.69 0.00 0.00 0.00 175.10 174.43 3kk7 s VAL 184 N 1.69 5.05 0.00 2.92 1.01 0.11 -1.87 120.40 129.30 3kk7 s VAL 184 Ca 0.05 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.09 3kk7 s VAL 184 Cb -0.18 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 32.91 3kk7 s VAL 184 CO 0.10 0.44 0.00 -3.20 0.00 0.00 0.00 175.10 172.43 3kk7 n ASN 185 N 3.64 4.36 0.00 3.32 5.15 -0.13 -2.12 115.26 129.48 3kk7 n ASN 185 Ca -0.16 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.82 3kk7 n ASN 185 Cb 0.52 0.67 0.00 0.00 -0.53 0.00 0.00 39.78 40.44 3kk7 n ASN 185 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3kk7 n GLY 186 N 2.41 4.10 3.64 8.20 0.00 -0.98 -0.66 105.19 121.89 3kk7 n GLY 186 Ca 0.00 -0.90 -0.06 0.00 0.00 0.00 0.00 46.02 45.06 3kk7 n GLY 186 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kk7 s LEU 188 N 0.00 -0.33 -0.01 0.99 1.02 -0.76 -1.51 118.68 118.08 3kk7 s LEU 188 Ca 0.00 0.60 0.02 0.00 0.02 0.00 0.00 54.13 54.77 3kk7 s LEU 188 Cb 0.00 1.60 -0.00 0.00 0.02 0.00 0.00 46.19 47.81 3kk7 s LEU 188 CO 0.00 -0.10 -0.06 0.20 0.02 0.00 0.00 176.35 176.41 3kk7 s ASN 189 N 0.42 0.81 -0.06 2.29 -0.87 -0.95 -2.25 114.94 114.33 3kk7 s ASN 189 Ca 0.01 -0.12 -0.09 0.00 -1.57 0.00 0.00 52.86 51.09 3kk7 s ASN 189 Cb -0.05 -0.15 -0.05 0.00 -0.02 0.00 0.00 41.25 40.99 3kk7 s ASN 189 CO -0.11 0.06 0.24 -0.22 -2.57 0.00 0.00 177.10 174.50 3kk7 s LEU 190 N 0.03 4.41 0.13 0.60 2.96 0.35 -1.40 118.68 125.75 3kk7 s LEU 190 Ca 0.00 0.62 -0.34 0.00 -0.22 0.00 0.00 54.13 54.19 3kk7 s LEU 190 Cb -0.05 -2.34 -0.13 0.00 0.50 0.00 0.00 46.19 44.17 3kk7 s LEU 190 CO -0.00 0.35 1.65 1.67 -1.32 0.00 0.00 176.35 178.70 3kk7 n GLN 191 N 1.75 2.24 -0.06 1.98 -0.06 0.51 -4.89 117.38 118.86 3kk7 n GLN 191 Ca -0.16 0.81 0.04 0.00 -2.00 0.00 0.00 57.00 55.69 3kk7 n GLN 191 Cb 0.54 -2.60 0.06 0.00 -4.06 0.00 0.00 30.24 24.18 3kk7 n GLN 191 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 3kk7 n THR 192 N 3.79 1.30 -1.68 1.69 -2.24 -1.26 -4.73 114.28 111.15 3kk7 n THR 192 Ca 0.18 -1.47 -0.44 0.00 -2.27 0.00 0.00 64.05 60.04 3kk7 n THR 192 Cb 0.30 0.19 -0.02 0.00 -2.10 0.00 0.00 70.33 68.70 3kk7 n THR 192 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kk7 n ALA 193 N -0.87 1.29 -0.33 6.98 0.00 -1.26 -4.69 120.51 121.63 3kk7 n ALA 193 Ca 0.07 0.40 0.18 0.00 0.00 0.00 0.00 53.44 54.10 3kk7 n ALA 193 Cb 0.46 -2.29 0.39 0.00 0.00 0.00 0.00 19.45 18.00 3kk7 n ALA 193 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3kk7 h PRO 194 N 4.17 0.43 -0.20 0.00 0.11 -1.99 0.39 132.00 134.91 3kk7 h PRO 194 Ca -0.45 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 3kk7 h PRO 194 Cb 1.27 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3kk7 h PRO 194 CO 0.75 0.28 -0.25 0.77 -0.21 0.00 0.00 178.00 179.34 3kk7 h SER 195 N 0.44 0.36 0.10 -2.05 0.02 -2.00 -0.22 113.55 110.21 3kk7 h SER 195 Ca 0.64 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 61.47 3kk7 h SER 195 Cb 1.31 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.75 3kk7 h SER 195 CO -0.54 0.62 -0.05 0.00 -1.14 0.00 0.00 176.83 175.72 3kk7 h ALA 196 N 1.41 -0.13 -0.79 3.77 0.00 -0.66 -2.61 119.26 120.24 3kk7 h ALA 196 Ca 0.05 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3kk7 h ALA 196 Cb 0.62 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 3kk7 h ALA 196 CO 0.04 -0.50 0.52 -0.07 0.00 0.00 0.00 179.25 179.25 3kk7 h LEU 197 N -0.29 0.87 -0.48 0.00 3.38 -0.50 -0.97 115.31 117.33 3kk7 h LEU 197 Ca -0.01 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 3kk7 h LEU 197 Cb 0.24 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3kk7 h LEU 197 CO 0.02 0.62 -0.17 0.03 0.09 0.00 0.00 178.44 179.03 3kk7 h ARG 198 N 1.02 0.96 -0.73 1.13 3.08 -1.04 -0.56 114.38 118.25 3kk7 h ARG 198 Ca 0.30 -0.39 0.06 0.00 0.07 0.00 0.00 59.98 60.02 3kk7 h ARG 198 Cb -0.04 -0.04 -0.06 0.00 0.08 0.00 0.00 29.97 29.91 3kk7 h ARG 198 CO -0.08 1.06 0.43 0.87 -1.07 0.00 0.00 179.97 181.18 3kk7 h LYS 199 N 0.82 0.76 -0.43 0.04 1.57 -0.92 -0.74 116.57 117.67 3kk7 h LYS 199 Ca 0.12 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 3kk7 h LYS 199 Cb 0.74 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 3kk7 h LYS 199 CO 0.06 0.50 0.18 0.82 -0.57 0.00 0.00 179.45 180.44 3kk7 h ILE 200 N 0.78 1.20 -0.17 1.86 2.04 -0.78 -2.39 117.51 120.05 3kk7 h ILE 200 Ca 0.32 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.61 3kk7 h ILE 200 Cb 0.18 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 3kk7 h ILE 200 CO -0.18 0.22 0.01 0.00 0.00 0.00 0.00 178.15 178.20 3kk7 h ALA 201 N 1.02 0.15 -0.86 1.87 0.00 -0.52 0.18 119.26 121.10 3kk7 h ALA 201 Ca 0.14 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.14 3kk7 h ALA 201 Cb 0.18 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 3kk7 h ALA 201 CO -0.01 -0.43 0.55 0.00 0.00 0.00 0.00 179.25 179.36 3kk7 h ALA 202 N 1.14 1.16 0.00 0.00 0.00 -1.04 -3.41 119.26 117.11 3kk7 h ALA 202 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3kk7 h ALA 202 Cb 0.09 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3kk7 h ALA 202 CO -0.13 0.36 -0.03 -0.25 0.00 0.00 0.00 179.25 179.21 3kk7 n ASP 203 N -4.57 0.14 -0.13 0.00 8.00 -0.91 -4.84 116.55 114.24 3kk7 n ASP 203 Ca 0.11 -0.03 0.09 0.00 0.71 0.00 0.00 54.79 55.67 3kk7 n ASP 203 Cb 0.12 0.10 0.14 0.00 -0.02 0.00 0.00 41.12 41.46 3kk7 n ASP 203 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3kk7 n TYR 204 N -0.11 0.00 -2.68 1.24 4.01 0.61 -4.80 117.16 115.42 3kk7 n TYR 204 Ca 0.00 -1.02 -0.36 0.00 -0.16 0.00 0.00 57.90 56.36 3kk7 n TYR 204 Cb 0.00 -0.16 -0.05 0.00 -0.31 0.00 0.00 39.34 38.82 3kk7 n TYR 204 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3kk7 s LEU 205 N -2.83 4.19 0.31 7.72 1.43 -1.18 0.54 118.68 128.87 3kk7 s LEU 205 Ca 0.32 1.90 -0.29 0.00 -1.03 0.00 0.00 54.13 55.03 3kk7 s LEU 205 Cb 0.28 -4.17 -0.11 0.00 0.03 0.00 0.00 46.19 42.22 3kk7 s LEU 205 CO 0.02 -0.30 1.44 -0.62 0.23 0.00 0.00 176.35 177.12 3kk7 s ASP 206 N -1.68 6.55 0.43 2.29 2.15 0.61 -4.51 116.67 122.52 3kk7 s ASP 206 Ca 0.55 2.83 0.14 0.00 0.43 0.00 0.00 52.55 56.50 3kk7 s ASP 206 Cb -0.19 -2.65 0.94 0.00 -0.30 0.00 0.00 42.92 40.73 3kk7 s ASP 206 CO 0.24 -0.74 1.96 1.05 -0.17 0.00 0.00 175.17 177.50 3kk7 h GLU 207 N 3.98 0.02 0.00 4.34 4.11 -1.93 -1.29 114.58 123.81 3kk7 h GLU 207 Ca -0.48 -0.00 -0.15 0.00 0.07 0.00 0.00 59.36 58.79 3kk7 h GLU 207 Cb 1.23 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 3kk7 h GLU 207 CO 0.71 0.23 -0.71 -0.07 0.07 0.00 0.00 179.01 179.24 3kk7 h LEU 208 N 0.02 0.00 -0.47 3.06 3.38 -1.91 0.69 115.31 120.07 3kk7 h LEU 208 Ca 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 3kk7 h LEU 208 Cb 0.38 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3kk7 h LEU 208 CO 0.03 0.71 -0.07 0.15 0.09 0.00 0.00 178.44 179.35 3kk7 h PHE 209 N 0.00 0.98 -0.83 1.13 3.57 -1.65 -1.87 116.94 118.27 3kk7 h PHE 209 Ca -0.01 -0.20 0.04 0.00 3.53 0.00 0.00 57.97 61.34 3kk7 h PHE 209 Cb 1.33 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 39.77 3kk7 h PHE 209 CO 0.00 0.95 0.53 0.28 -2.23 0.00 0.00 178.31 177.83 3kk7 h VAL 210 N 0.73 1.11 -0.45 1.41 2.07 -0.99 -0.83 116.25 119.30 3kk7 h VAL 210 Ca 0.13 -0.35 0.08 0.00 0.82 0.00 0.00 66.70 67.38 3kk7 h VAL 210 Cb 0.60 0.01 -0.07 0.00 -1.52 0.00 0.00 31.29 30.32 3kk7 h VAL 210 CO 0.04 0.18 0.06 -0.78 0.02 0.00 0.00 177.57 177.09 3kk7 h ASP 211 N 1.01 -0.07 0.13 0.57 3.58 -0.64 -2.28 116.42 118.73 3kk7 h ASP 211 Ca 0.34 0.09 -0.11 0.00 0.42 0.00 0.00 57.03 57.77 3kk7 h ASP 211 Cb 0.04 0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 3kk7 h ASP 211 CO -0.13 -0.00 -0.37 0.00 -2.88 0.00 0.00 179.24 175.86 3kk7 h ALA 212 N 1.37 1.09 -0.55 -0.78 0.00 -0.76 0.16 119.26 119.79 3kk7 h ALA 212 Ca 0.22 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3kk7 h ALA 212 Cb 0.31 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3kk7 h ALA 212 CO -0.32 0.58 0.26 1.25 0.00 0.00 0.00 179.25 181.02 3kk7 h LEU 213 N 0.28 0.72 0.00 0.00 5.85 -0.63 -2.87 115.31 118.66 3kk7 h LEU 213 Ca 0.03 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.62 3kk7 h LEU 213 Cb 0.78 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.63 3kk7 h LEU 213 CO 0.06 0.65 -1.49 -1.22 -0.34 0.00 0.00 178.44 176.10 3kk7 n TYR 214 N -4.56 0.00 0.24 1.25 4.01 -0.93 -4.62 117.16 112.55 3kk7 n TYR 214 Ca 0.03 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.81 3kk7 n TYR 214 Cb 0.12 -0.26 0.05 0.00 -0.31 0.00 0.00 39.34 38.95 3kk7 n TYR 214 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3kk7 n ASN 215 N -1.88 1.87 -3.75 7.72 3.02 0.54 -4.94 115.26 117.83 3kk7 n ASN 215 Ca -0.00 -1.47 -0.16 0.00 -0.03 0.00 0.00 54.58 52.92 3kk7 n ASN 215 Cb 0.44 -0.03 -0.09 0.00 -0.61 0.00 0.00 39.78 39.49 3kk7 n ASN 215 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3kk7 s SER 216 N -0.73 0.92 0.00 6.41 1.04 -1.08 -3.17 113.70 117.08 3kk7 s SER 216 Ca 0.11 -1.57 0.00 0.00 0.48 0.00 0.00 55.95 54.97 3kk7 s SER 216 Cb 0.07 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.67 3kk7 s SER 216 CO 0.10 -0.97 0.00 -1.54 0.98 0.00 0.00 173.24 171.81 3kk7 n SER 217 N -0.93 0.00 0.00 7.02 3.41 -1.26 -4.75 113.62 117.10 3kk7 n SER 217 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 3kk7 n SER 217 Cb 0.64 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.59 3kk7 n SER 217 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3kk7 n VAL 219 N 0.00 0.00 -0.21 -3.33 0.31 -1.26 -0.98 118.33 112.86 3kk7 n VAL 219 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 3kk7 n VAL 219 Cb 0.00 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 32.96 3kk7 n VAL 219 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3kk7 h GLU 220 N 0.00 0.95 -1.08 5.55 5.08 -1.87 -1.94 114.58 121.27 3kk7 h GLU 220 Ca 0.00 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 3kk7 h GLU 220 Cb 0.00 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.12 3kk7 h GLU 220 CO 0.00 0.87 0.00 -0.11 -1.00 0.00 0.00 179.01 178.77 3kk7 n LEU 221 N -4.36 0.05 0.00 1.33 0.00 -0.15 -1.84 117.00 112.03 3kk7 n LEU 221 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 56.01 56.02 3kk7 n LEU 221 Cb 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 43.42 43.64 3kk7 n LEU 221 CO 0.41 0.01 0.00 0.00 0.00 0.00 0.00 177.39 177.81 3kk7 n GLN 223 N 0.76 0.00 -0.05 1.96 6.02 -0.73 -0.87 117.38 124.47 3kk7 n GLN 223 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.84 3kk7 n GLN 223 Cb 0.01 0.00 -0.13 0.00 1.02 0.00 0.00 30.24 31.14 3kk7 n GLN 223 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3kk7 h SER 224 N 0.00 0.10 0.69 1.08 0.87 -1.66 -3.39 113.55 111.25 3kk7 h SER 224 Ca 0.00 -0.98 -0.26 0.00 -1.23 0.00 0.00 61.79 59.32 3kk7 h SER 224 Cb 0.00 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 61.90 3kk7 h SER 224 CO 0.00 1.10 -1.36 1.88 -0.53 0.00 0.00 176.83 177.92 3kk7 h TYR 225 N -0.86 0.14 0.00 2.24 -1.99 -1.26 -3.46 116.97 111.78 3kk7 h TYR 225 Ca -0.04 -0.11 0.00 0.00 2.00 0.00 0.00 58.73 60.58 3kk7 h TYR 225 Cb 1.15 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.87 3kk7 h TYR 225 CO 0.26 1.12 0.00 0.41 -0.00 0.00 0.00 178.16 179.95 3kk7 n GLY 226 N 1.50 -1.76 0.00 3.88 0.00 -1.26 -3.85 105.19 103.71 3kk7 n GLY 226 Ca -0.10 -1.97 0.06 0.00 0.00 0.00 0.00 46.02 44.01 3kk7 n GLY 226 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kk7 n GLU 227 N 0.00 1.83 -4.16 1.61 4.71 -0.88 -4.73 120.64 119.01 3kk7 n GLU 227 Ca 0.00 -0.05 -0.10 0.00 -0.01 0.00 0.00 57.16 57.00 3kk7 n GLU 227 Cb 0.00 -1.16 -0.10 0.00 -1.01 0.00 0.00 31.44 29.17 3kk7 n GLU 227 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 3kk7 s PHE 228 N -2.44 0.87 -0.13 -0.32 0.08 -1.14 -3.48 117.98 111.42 3kk7 s PHE 228 Ca 0.00 -1.01 -0.02 0.00 0.12 0.00 0.00 56.93 56.02 3kk7 s PHE 228 Cb 0.08 -0.52 -0.02 0.00 -0.57 0.00 0.00 43.02 41.99 3kk7 s PHE 228 CO 0.49 -0.26 -0.08 0.08 -0.10 0.00 0.00 175.22 175.35 3kk7 s VAL 229 N -3.75 3.52 -0.26 -0.44 1.01 0.25 0.37 120.40 121.10 3kk7 s VAL 229 Ca 0.15 -0.50 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 3kk7 s VAL 229 Cb 0.06 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.92 3kk7 s VAL 229 CO -0.03 0.52 1.53 -0.76 0.00 0.00 0.00 175.10 176.36 3kk7 s LEU 230 N 0.20 3.85 -0.01 3.92 1.43 0.34 -1.70 118.68 126.71 3kk7 s LEU 230 Ca -0.05 1.44 0.05 0.00 -1.03 0.00 0.00 54.13 54.55 3kk7 s LEU 230 Cb -0.14 -3.53 -0.08 0.00 0.03 0.00 0.00 46.19 42.46 3kk7 s LEU 230 CO 0.04 -1.25 0.11 0.35 0.23 0.00 0.00 176.35 175.83 3kk7 n THR 231 N 6.46 0.03 -3.38 5.49 -2.24 -0.00 -0.62 114.28 120.01 3kk7 n THR 231 Ca 0.18 -0.13 -0.09 0.00 -2.27 0.00 0.00 64.05 61.74 3kk7 n THR 231 Cb 0.46 0.28 -0.08 0.00 -2.10 0.00 0.00 70.33 68.89 3kk7 n THR 231 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3kk7 s GLY 232 N -2.70 -0.40 0.25 3.38 0.00 -0.83 -0.50 107.32 106.51 3kk7 s GLY 232 Ca -0.02 0.96 0.00 0.00 0.00 0.00 0.00 44.72 45.66 3kk7 s GLY 232 CO 0.22 2.63 0.24 -2.52 0.00 0.00 0.00 173.10 173.67 3kk7 s TYR 233 N 2.55 1.25 0.12 1.90 -0.85 -0.95 -1.30 117.35 120.07 3kk7 s TYR 233 Ca 0.12 -1.40 0.06 0.00 -0.52 0.00 0.00 57.07 55.33 3kk7 s TYR 233 Cb -0.15 -0.49 -0.04 0.00 0.38 0.00 0.00 41.96 41.65 3kk7 s TYR 233 CO -0.15 -0.78 -0.03 0.71 -1.52 0.00 0.00 175.55 173.77 3kk7 s TYR 234 N -3.84 2.87 0.17 -3.49 2.02 -0.17 -1.82 117.35 113.08 3kk7 s TYR 234 Ca 0.37 -0.10 0.10 0.00 -0.37 0.00 0.00 57.07 57.07 3kk7 s TYR 234 Cb 0.04 -1.46 -0.04 0.00 -0.40 0.00 0.00 41.96 40.10 3kk7 s TYR 234 CO 0.17 0.47 -0.20 0.95 -1.57 0.00 0.00 175.55 175.38 3kk7 s THR 235 N -1.40 2.63 0.00 -0.71 -4.23 -0.57 -1.68 115.64 109.67 3kk7 s THR 235 Ca 0.25 -1.81 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 3kk7 s THR 235 Cb -0.11 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 71.48 3kk7 s THR 235 CO 0.17 -0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.81 3kk7 n GLY 236 N 0.40 -0.39 3.28 3.99 0.00 -0.40 -0.96 105.19 111.12 3kk7 n GLY 236 Ca -0.13 -0.43 -0.20 0.00 0.00 0.00 0.00 46.02 45.25 3kk7 n GLY 236 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kk7 s GLY 237 N 0.00 1.22 -0.13 -0.02 0.00 -0.78 -1.25 107.32 106.36 3kk7 s GLY 237 Ca 0.00 -1.35 -0.11 0.00 0.00 0.00 0.00 44.72 43.26 3kk7 s GLY 237 CO 0.00 -1.40 0.34 -1.60 0.00 0.00 0.00 173.10 170.44 3kk7 s ARG 238 N -2.57 0.38 -0.13 2.90 3.52 -0.67 -1.34 118.95 121.04 3kk7 s ARG 238 Ca 0.11 0.50 -0.03 0.00 -0.13 0.00 0.00 55.73 56.18 3kk7 s ARG 238 Cb -0.06 0.15 -0.03 0.00 -1.56 0.00 0.00 34.95 33.44 3kk7 s ARG 238 CO 0.05 -0.07 -0.01 0.00 -0.81 0.00 0.00 175.30 174.46 3kk7 s ALA 239 N 0.37 3.17 -0.08 6.12 0.00 0.17 0.07 121.76 131.58 3kk7 s ALA 239 Ca -0.02 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.16 3kk7 s ALA 239 Cb -0.03 -1.57 0.01 0.00 0.00 0.00 0.00 23.12 21.53 3kk7 s ALA 239 CO -0.01 0.37 -0.15 0.45 0.00 0.00 0.00 175.76 176.42 3kk7 s SER 240 N -0.16 2.18 -0.04 0.00 0.15 -0.24 -0.82 113.70 114.77 3kk7 s SER 240 Ca 0.04 -0.37 0.03 0.00 0.70 0.00 0.00 55.95 56.35 3kk7 s SER 240 Cb -0.13 -0.99 0.00 0.00 -1.71 0.00 0.00 66.02 63.20 3kk7 s SER 240 CO 0.02 0.04 -0.12 0.00 1.20 0.00 0.00 173.24 174.39 3kk7 s ALA 241 N 0.75 1.10 0.03 5.45 0.00 -0.80 -0.87 121.76 127.41 3kk7 s ALA 241 Ca -0.12 -0.43 0.04 0.00 0.00 0.00 0.00 51.96 51.45 3kk7 s ALA 241 Cb -0.16 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 3kk7 s ALA 241 CO 0.03 0.16 -0.05 -0.51 0.00 0.00 0.00 175.76 175.39 3kk7 s LEU 242 N 0.28 3.24 0.03 0.00 1.43 -0.35 -0.10 118.68 123.21 3kk7 s LEU 242 Ca -0.06 -0.16 0.07 0.00 -1.03 0.00 0.00 54.13 52.94 3kk7 s LEU 242 Cb -0.11 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 44.19 3kk7 s LEU 242 CO 0.02 0.25 -0.20 -0.36 0.23 0.00 0.00 176.35 176.28 3kk7 s PHE 243 N -1.08 1.80 -0.21 0.29 0.40 0.73 -1.55 117.98 118.35 3kk7 s PHE 243 Ca 0.19 -0.37 -0.01 0.00 -0.60 0.00 0.00 56.93 56.14 3kk7 s PHE 243 Cb -0.11 -1.09 0.06 0.00 0.51 0.00 0.00 43.02 42.39 3kk7 s PHE 243 CO 0.10 0.06 0.01 -0.47 0.70 0.00 0.00 175.22 175.62 3kk7 s TYR 244 N -0.73 1.55 0.01 0.36 6.14 -0.29 -1.53 117.35 122.86 3kk7 s TYR 244 Ca 0.07 -1.22 0.06 0.00 0.64 0.00 0.00 57.07 56.63 3kk7 s TYR 244 Cb -0.09 -1.26 -0.03 0.00 0.42 0.00 0.00 41.96 41.01 3kk7 s TYR 244 CO 0.01 -0.68 -0.17 0.20 0.64 0.00 0.00 175.55 175.55 3kk7 s GLY 245 N 1.68 1.54 -0.39 8.97 0.00 -0.64 -1.37 107.32 117.11 3kk7 s GLY 245 Ca -0.02 -1.13 -0.10 0.00 0.00 0.00 0.00 44.72 43.47 3kk7 s GLY 245 CO -0.08 -0.98 0.23 0.14 0.00 0.00 0.00 173.10 172.40 3kk7 s VAL 246 N -0.85 4.38 -0.10 1.40 1.01 -0.04 -1.59 120.40 124.61 3kk7 s VAL 246 Ca 0.14 -1.13 -0.30 0.00 0.00 0.00 0.00 61.98 60.69 3kk7 s VAL 246 Cb -0.10 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 3kk7 s VAL 246 CO 0.04 -0.36 1.19 -0.62 0.00 0.00 0.00 175.10 175.35 3kk7 s ASP 247 N 1.82 7.04 0.18 3.32 -1.08 0.16 -1.37 116.67 126.75 3kk7 s ASP 247 Ca 0.02 1.73 -0.11 0.00 -0.52 0.00 0.00 52.55 53.68 3kk7 s ASP 247 Cb -0.21 -2.55 0.10 0.00 -1.46 0.00 0.00 42.92 38.80 3kk7 s ASP 247 CO 0.04 -0.62 1.74 0.74 0.52 0.00 0.00 175.17 177.59 3kk7 h THR 248 N 5.17 1.24 0.00 1.71 2.02 -1.71 -3.39 112.91 117.95 3kk7 h THR 248 Ca -0.31 -0.76 0.00 0.00 0.77 0.00 0.00 66.41 66.11 3kk7 h THR 248 Cb 1.14 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 3kk7 h THR 248 CO 0.91 0.30 -0.03 0.59 0.37 0.00 0.00 175.52 177.65 3kk7 n ASN 249 N -4.40 0.16 -4.51 4.18 4.13 -1.26 -5.02 115.26 108.54 3kk7 n ASN 249 Ca 0.05 -0.34 -0.33 0.00 1.68 0.00 0.00 54.58 55.63 3kk7 n ASN 249 Cb 0.18 0.71 -0.12 0.00 -1.54 0.00 0.00 39.78 39.00 3kk7 n ASN 249 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 3kk7 s SER 250 N -0.74 4.36 -0.00 6.41 0.01 -1.26 -4.98 113.70 117.49 3kk7 s SER 250 Ca 0.00 -0.13 0.08 0.00 1.31 0.00 0.00 55.95 57.21 3kk7 s SER 250 Cb 0.00 -1.17 -0.10 0.00 0.21 0.00 0.00 66.02 64.96 3kk7 s SER 250 CO 0.00 0.31 0.29 2.30 0.41 0.00 0.00 173.24 176.55 3kk7 n ILE 251 N 2.54 0.00 -2.11 1.44 -5.35 -1.26 -4.72 119.36 109.90 3kk7 n ILE 251 Ca -0.18 -0.27 -0.42 0.00 -0.27 0.00 0.00 62.75 61.61 3kk7 n ILE 251 Cb 0.53 0.78 -0.03 0.00 -1.74 0.00 0.00 39.64 39.17 3kk7 n ILE 251 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 3kk7 s GLN 252 N -2.02 4.30 0.30 6.28 -1.52 -1.26 -4.87 119.66 120.87 3kk7 s GLN 252 Ca 0.01 2.15 0.06 0.00 -1.95 0.00 0.00 55.36 55.64 3kk7 s GLN 252 Cb 0.06 -3.22 0.77 0.00 -0.22 0.00 0.00 33.01 30.40 3kk7 s GLN 252 CO 0.33 -0.47 1.75 0.27 -0.25 0.00 0.00 175.29 176.93 3kk7 h PHE 253 N 6.67 0.99 0.08 0.91 -5.15 -1.95 -1.53 116.94 116.96 3kk7 h PHE 253 Ca -0.42 0.04 -0.18 0.00 -0.20 0.00 0.00 57.97 57.20 3kk7 h PHE 253 Cb 1.21 -0.29 0.02 0.00 0.22 0.00 0.00 35.95 37.11 3kk7 h PHE 253 CO 0.65 0.15 -0.76 0.38 -2.00 0.00 0.00 178.31 176.73 3kk7 h ASP 254 N 0.66 0.54 -0.60 -0.68 2.03 -1.99 -2.48 116.42 113.89 3kk7 h ASP 254 Ca 0.59 -0.85 0.04 0.00 -0.73 0.00 0.00 57.03 56.08 3kk7 h ASP 254 Cb 1.01 -0.17 -0.05 0.00 -0.83 0.00 0.00 39.33 39.29 3kk7 h ASP 254 CO -0.43 1.34 0.34 0.28 -1.03 0.00 0.00 179.24 179.74 3kk7 h SER 255 N -0.18 0.52 -0.70 4.15 0.02 -1.82 -0.66 113.55 114.88 3kk7 h SER 255 Ca -0.12 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.79 3kk7 h SER 255 Cb 1.52 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.95 3kk7 h SER 255 CO 0.15 0.35 0.20 0.11 -1.14 0.00 0.00 176.83 176.50 3kk7 h LYS 256 N 0.65 1.11 -0.72 3.45 1.57 -1.35 -0.71 116.57 120.58 3kk7 h LYS 256 Ca 0.26 -0.25 -0.07 0.00 -1.87 0.00 0.00 60.65 58.73 3kk7 h LYS 256 Cb 0.11 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 3kk7 h LYS 256 CO -0.15 0.96 0.20 0.93 -0.57 0.00 0.00 179.45 180.82 3kk7 h GLU 257 N 1.06 1.14 -0.51 3.15 5.08 -0.92 -2.39 114.58 121.20 3kk7 h GLU 257 Ca 0.23 -0.26 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 3kk7 h GLU 257 Cb 0.33 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 3kk7 h GLU 257 CO -0.00 0.99 -0.09 -0.22 -1.00 0.00 0.00 179.01 178.69 3kk7 h LYS 258 N 1.09 0.93 -0.08 2.33 1.63 -0.84 0.32 116.57 121.96 3kk7 h LYS 258 Ca 0.23 -0.32 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 3kk7 h LYS 258 Cb 0.35 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.91 3kk7 h LYS 258 CO -0.00 0.98 0.00 -0.25 -3.45 0.00 0.00 179.45 176.73 3kk7 n ASP 259 N -4.16 0.08 0.00 4.20 8.00 -0.30 -1.58 116.55 122.79 3kk7 n ASP 259 Ca 0.02 -0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.37 3kk7 n ASP 259 Cb 0.38 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 3kk7 n ASP 259 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3kk7 n ASP 261 N 0.45 0.00 -0.03 -2.24 8.00 0.11 -1.29 116.55 121.54 3kk7 n ASP 261 Ca 0.00 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.33 3kk7 n ASP 261 Cb 0.02 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.06 3kk7 n ASP 261 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3kk7 h VAL 262 N 0.00 1.28 0.12 2.53 2.07 -1.54 -2.86 116.25 117.83 3kk7 h VAL 262 Ca 0.00 -1.92 -0.01 0.00 0.82 0.00 0.00 66.70 65.60 3kk7 h VAL 262 Cb 0.00 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 3kk7 h VAL 262 CO 0.00 0.61 -0.06 0.00 0.02 0.00 0.00 177.57 178.15 3kk7 h ALA 263 N 0.60 -0.16 -0.56 1.67 0.00 -1.45 -1.41 119.26 117.95 3kk7 h ALA 263 Ca -0.04 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 54.80 3kk7 h ALA 263 Cb 1.35 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 19.10 3kk7 h ALA 263 CO 0.15 -0.40 -0.07 0.82 0.00 0.00 0.00 179.25 179.76 3kk7 h ILE 264 N -0.54 0.49 0.00 0.00 2.04 -1.83 -0.80 117.51 116.87 3kk7 h ILE 264 Ca -0.02 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 3kk7 h ILE 264 Cb 0.43 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 3kk7 h ILE 264 CO 0.03 0.01 -0.12 -1.13 0.00 0.00 0.00 178.15 176.94 3kk7 h ASN 265 N 0.05 0.00 -0.11 1.72 -1.24 -1.36 -1.42 115.58 113.22 3kk7 h ASN 265 Ca 0.28 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.29 3kk7 h ASN 265 Cb 0.44 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.49 3kk7 h ASN 265 CO -0.53 0.12 0.00 0.00 -1.29 0.00 0.00 177.43 175.73 3kk7 n ALA 266 N -2.22 2.52 -0.37 1.57 0.00 -0.38 -4.48 120.51 117.15 3kk7 n ALA 266 Ca -0.01 -0.56 0.06 0.00 0.00 0.00 0.00 53.44 52.92 3kk7 n ALA 266 Cb 0.28 -1.06 0.16 0.00 0.00 0.00 0.00 19.45 18.83 3kk7 n ALA 266 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3kk7 n SER 267 N 0.52 3.01 -3.87 0.00 7.64 -0.54 -4.69 113.62 115.69 3kk7 n SER 267 Ca 0.17 -2.27 -0.09 0.00 1.01 0.00 0.00 58.87 57.69 3kk7 n SER 267 Cb 0.40 -0.28 -0.06 0.00 -1.01 0.00 0.00 64.21 63.26 3kk7 n SER 267 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 3kk7 s TYR 268 N -1.48 0.21 -0.04 1.43 1.13 -1.25 -0.18 117.35 117.16 3kk7 s TYR 268 Ca 0.25 -0.57 -0.01 0.00 -1.41 0.00 0.00 57.07 55.33 3kk7 s TYR 268 Cb 0.16 0.08 0.03 0.00 -1.10 0.00 0.00 41.96 41.13 3kk7 s TYR 268 CO 0.12 -0.75 0.03 -2.00 -2.51 0.00 0.00 175.55 170.44 3kk7 s GLU 269 N -3.92 0.12 -0.41 -3.49 2.12 0.78 -4.98 118.70 108.90 3kk7 s GLU 269 Ca 0.13 0.23 0.04 0.00 0.36 0.00 0.00 54.97 55.73 3kk7 s GLU 269 Cb 0.02 -0.51 0.11 0.00 0.26 0.00 0.00 34.13 34.01 3kk7 s GLU 269 CO -0.03 -0.25 0.14 -0.46 -0.54 0.00 0.00 175.26 174.13 3kk7 s TRP 270 N 1.63 3.43 0.04 5.30 -0.11 -1.26 -1.50 118.94 126.47 3kk7 s TRP 270 Ca -0.02 -3.02 -0.27 0.00 1.22 0.00 0.00 56.10 54.01 3kk7 s TRP 270 Cb -0.13 -2.82 -0.05 0.00 -1.50 0.00 0.00 33.47 28.97 3kk7 s TRP 270 CO -0.03 -0.86 0.85 0.15 -4.62 0.00 0.00 176.95 172.44 3kk7 s LYS 271 N 0.44 4.55 -1.08 5.86 1.02 -0.59 -4.41 119.74 125.52 3kk7 s LYS 271 Ca 0.13 1.20 -0.06 0.00 0.02 0.00 0.00 55.97 57.27 3kk7 s LYS 271 Cb -0.22 -3.40 -0.05 0.00 -0.52 0.00 0.00 37.83 33.64 3kk7 s LYS 271 CO -0.05 0.17 0.92 0.09 -0.92 0.00 0.00 175.35 175.56 3kk7 n ASN 272 N 3.15 -5.75 -3.33 2.83 3.02 -1.26 -2.40 115.26 111.51 3kk7 n ASN 272 Ca 0.01 -0.71 -0.31 0.00 -0.03 0.00 0.00 54.58 53.53 3kk7 n ASN 272 Cb 0.50 -5.08 -0.02 0.00 -0.61 0.00 0.00 39.78 34.56 3kk7 n ASN 272 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 3kk7 n LYS 273 N -3.44 2.43 -2.29 3.52 2.85 -1.26 -4.23 118.16 115.73 3kk7 n LYS 273 Ca -0.11 -1.80 -0.37 0.00 -1.05 0.00 0.00 58.31 54.98 3kk7 n LYS 273 Cb 0.63 -2.69 -0.01 0.00 -0.65 0.00 0.00 35.03 32.31 3kk7 n LYS 273 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3kk7 s LYS 274 N 3.38 3.81 0.51 -1.58 1.02 -1.26 -4.87 119.74 120.75 3kk7 s LYS 274 Ca 0.50 1.75 0.01 0.00 0.02 0.00 0.00 55.97 58.25 3kk7 s LYS 274 Cb 0.13 -2.43 0.10 0.00 -0.52 0.00 0.00 37.83 35.11 3kk7 s LYS 274 CO -0.02 -0.50 0.70 -0.35 -0.92 0.00 0.00 175.35 174.26 3kk7 n PRO 275 N -0.42 0.19 0.00 -1.68 -0.04 -1.26 -4.98 135.00 126.81 3kk7 n PRO 275 Ca 0.07 -2.02 0.00 0.00 -0.04 0.00 0.00 63.50 61.51 3kk7 n PRO 275 Cb 0.48 -0.43 0.00 0.00 -0.04 0.00 0.00 33.50 33.51 3kk7 n PRO 275 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 3kk7 n THR 276 N -2.37 0.00 0.00 0.52 5.66 -1.26 -5.03 114.28 111.80 3kk7 n THR 276 Ca 0.12 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.12 3kk7 n THR 276 Cb 0.43 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.21 3kk7 n THR 276 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3kk7 n GLY 287 N -1.22 2.87 3.46 1.09 0.00 -1.26 -4.91 105.19 105.21 3kk7 n GLY 287 Ca 0.00 -1.83 -0.33 0.00 0.00 0.00 0.00 46.02 43.86 3kk7 n GLY 287 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kk7 s ASN 288 N 0.00 4.09 -0.05 1.61 0.01 -1.01 -4.89 114.94 114.71 3kk7 s ASN 288 Ca 0.00 -0.22 0.01 0.00 -0.71 0.00 0.00 52.86 51.95 3kk7 s ASN 288 Cb 0.00 -1.12 0.02 0.00 0.41 0.00 0.00 41.25 40.56 3kk7 s ASN 288 CO 0.00 0.29 -0.07 -0.22 -1.51 0.00 0.00 177.10 175.59 3kk7 s LEU 289 N -0.40 1.44 -0.01 0.60 2.96 -1.26 -1.55 118.68 120.46 3kk7 s LEU 289 Ca 0.05 -0.18 -0.18 0.00 -0.22 0.00 0.00 54.13 53.59 3kk7 s LEU 289 Cb -0.12 -0.57 0.03 0.00 0.50 0.00 0.00 46.19 46.03 3kk7 s LEU 289 CO 0.02 -0.03 0.39 -0.94 -1.32 0.00 0.00 176.35 174.48 3kk7 s SER 290 N 0.82 -0.28 0.10 3.68 1.04 -0.56 0.33 113.70 118.82 3kk7 s SER 290 Ca -0.12 0.17 0.09 0.00 0.48 0.00 0.00 55.95 56.57 3kk7 s SER 290 Cb -0.15 0.37 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 3kk7 s SER 290 CO 0.01 -0.51 -0.21 -0.51 0.98 0.00 0.00 173.24 173.00 3kk7 s ILE 291 N -1.52 2.63 0.00 -1.02 2.07 -0.72 -0.16 121.20 122.49 3kk7 s ILE 291 Ca -0.12 -1.48 0.00 0.00 -1.41 0.00 0.00 60.65 57.64 3kk7 s ILE 291 Cb -0.03 -2.16 0.00 0.00 0.13 0.00 0.00 42.46 40.39 3kk7 s ILE 291 CO 0.04 0.17 0.00 0.61 -1.91 0.00 0.00 174.94 173.86 3kk7 n GLY 292 N 1.08 3.04 3.91 1.50 0.00 0.75 -1.60 105.19 113.86 3kk7 n GLY 292 Ca -0.16 -1.77 -0.20 0.00 0.00 0.00 0.00 46.02 43.88 3kk7 n GLY 292 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kk7 s THR 293 N -2.10 4.02 0.27 2.61 -4.23 -0.71 -4.35 115.64 111.15 3kk7 s THR 293 Ca 0.00 -1.19 -0.01 0.00 -1.18 0.00 0.00 61.69 59.31 3kk7 s THR 293 Cb 0.00 -3.37 -0.02 0.00 1.34 0.00 0.00 72.50 70.45 3kk7 s THR 293 CO 0.00 -0.20 0.28 -0.54 -0.54 0.00 0.00 174.62 173.62 3kk7 s LYS 294 N -4.04 1.53 0.00 3.99 1.02 -1.26 -4.63 119.74 116.34 3kk7 s LYS 294 Ca 0.41 -1.70 0.00 0.00 0.02 0.00 0.00 55.97 54.69 3kk7 s LYS 294 Cb -0.08 0.34 0.00 0.00 -0.52 0.00 0.00 37.83 37.58 3kk7 s LYS 294 CO 0.28 -0.57 0.00 2.89 -0.92 0.00 0.00 175.35 177.04 3kk7 n ARG 295 N -0.43 0.00 -0.13 1.68 1.85 -1.26 -1.93 116.66 116.44 3kk7 n ARG 295 Ca 0.03 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.82 3kk7 n ARG 295 Cb 0.64 0.00 0.02 0.00 -1.05 0.00 0.00 32.46 32.07 3kk7 n ARG 295 CO 0.00 0.00 0.00 1.05 -0.01 0.00 0.00 177.63 178.67 3kk7 h GLU 296 N 0.00 0.41 0.00 2.89 4.11 -2.02 -0.49 114.58 119.47 3kk7 h GLU 296 Ca 0.00 -0.02 -0.00 0.00 0.07 0.00 0.00 59.36 59.41 3kk7 h GLU 296 Cb 0.00 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 3kk7 h GLU 296 CO 0.00 0.27 -0.00 -0.91 0.07 0.00 0.00 179.01 178.44 3kk7 h ASN 297 N 0.42 0.00 0.08 3.06 4.21 -1.74 -2.77 115.58 118.84 3kk7 h ASN 297 Ca 0.17 0.00 -0.19 0.00 1.21 0.00 0.00 56.30 57.49 3kk7 h ASN 297 Cb 0.08 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.28 3kk7 h ASN 297 CO -0.12 0.00 -0.69 0.28 -1.29 0.00 0.00 177.43 175.61 3kk7 h SER 298 N 0.00 0.65 -0.96 5.81 0.02 -0.74 -2.84 113.55 115.48 3kk7 h SER 298 Ca -0.00 -0.40 0.08 0.00 -0.84 0.00 0.00 61.79 60.62 3kk7 h SER 298 Cb 0.00 -0.19 -0.07 0.00 0.14 0.00 0.00 62.40 62.28 3kk7 h SER 298 CO 0.00 1.16 0.61 -0.08 -1.14 0.00 0.00 176.83 177.38 3kk7 h GLU 299 N 0.39 1.05 -0.82 3.45 4.81 -1.54 -0.63 114.58 121.29 3kk7 h GLU 299 Ca -0.03 -0.06 0.21 0.00 -0.13 0.00 0.00 59.36 59.35 3kk7 h GLU 299 Cb 1.28 -0.24 -0.05 0.00 0.63 0.00 0.00 28.75 30.37 3kk7 h GLU 299 CO 0.13 0.69 0.57 1.15 -0.73 0.00 0.00 179.01 180.82 3kk7 h THR 300 N 1.08 0.66 0.00 0.32 2.02 -1.56 -1.38 112.91 114.05 3kk7 h THR 300 Ca 0.43 -0.08 -0.16 0.00 0.77 0.00 0.00 66.41 67.38 3kk7 h THR 300 Cb 0.24 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.05 3kk7 h THR 300 CO -0.20 0.04 -0.95 0.40 0.37 0.00 0.00 175.52 175.18 3kk7 h ILE 301 N 0.22 0.80 -0.04 3.11 2.04 -1.22 -3.38 117.51 119.05 3kk7 h ILE 301 Ca 0.41 -1.94 -0.04 0.00 1.00 0.00 0.00 64.86 64.30 3kk7 h ILE 301 Cb 1.27 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 39.20 3kk7 h ILE 301 CO -0.09 0.27 -0.14 0.71 0.00 0.00 0.00 178.15 178.90 3kk7 h THR 302 N -1.00 1.13 0.00 -0.27 1.35 -1.08 0.17 112.91 113.21 3kk7 h THR 302 Ca -0.24 -0.57 -0.00 0.00 -0.55 0.00 0.00 66.41 65.04 3kk7 h THR 302 Cb 1.08 1.25 -0.00 0.00 -1.73 0.00 0.00 68.15 68.75 3kk7 h THR 302 CO -0.14 0.17 -0.02 0.78 -0.25 0.00 0.00 175.52 176.05 3kk7 h ASN 303 N 0.06 0.00 0.00 5.36 2.35 -1.43 -3.22 115.58 118.70 3kk7 h ASN 303 Ca 0.01 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.67 3kk7 h ASN 303 Cb 0.29 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 3kk7 h ASN 303 CO 0.02 0.02 -1.47 0.29 -1.65 0.00 0.00 177.43 174.64 3kk7 n LYS 304 N -3.53 1.87 -5.04 0.81 4.76 -0.60 -5.00 118.16 111.42 3kk7 n LYS 304 Ca -0.03 -0.03 -0.29 0.00 -2.87 0.00 0.00 58.31 55.10 3kk7 n LYS 304 Cb 0.12 -1.20 -0.16 0.00 -1.84 0.00 0.00 35.03 31.95 3kk7 n LYS 304 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3kk7 s PHE 305 N -2.32 2.04 -0.34 2.13 0.08 0.51 -1.94 117.98 118.14 3kk7 s PHE 305 Ca -0.04 -0.58 0.25 0.00 0.12 0.00 0.00 56.93 56.69 3kk7 s PHE 305 Cb 0.03 -1.35 0.52 0.00 -0.57 0.00 0.00 43.02 41.65 3kk7 s PHE 305 CO 0.32 -0.17 1.67 0.77 -0.10 0.00 0.00 175.22 177.71 3kk7 h SER 306 N 6.10 0.00 -3.85 1.36 0.02 -1.48 -3.38 113.55 112.32 3kk7 h SER 306 Ca -0.33 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.60 3kk7 h SER 306 Cb 1.17 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 63.49 3kk7 h SER 306 CO 0.47 0.01 0.19 0.00 -1.14 0.00 0.00 176.83 176.36 3kk7 s ALA 307 N -3.29 -1.81 -0.08 3.77 0.00 -1.23 -4.98 121.76 114.13 3kk7 s ALA 307 Ca 0.06 2.01 -0.03 0.00 0.00 0.00 0.00 51.96 54.00 3kk7 s ALA 307 Cb 0.06 -1.23 0.04 0.00 0.00 0.00 0.00 23.12 21.99 3kk7 s ALA 307 CO 0.65 -0.32 0.08 -1.17 0.00 0.00 0.00 175.76 175.00 3kk7 s LEU 308 N 0.36 0.17 0.28 0.00 2.96 -1.26 -0.86 118.68 120.34 3kk7 s LEU 308 Ca 0.00 -0.10 0.11 0.00 -0.22 0.00 0.00 54.13 53.92 3kk7 s LEU 308 Cb -0.05 -0.13 -0.05 0.00 0.50 0.00 0.00 46.19 46.47 3kk7 s LEU 308 CO -0.00 -0.28 -0.09 -0.44 -1.32 0.00 0.00 176.35 174.21 3kk7 s SER 309 N 2.17 4.05 0.10 3.68 0.01 -0.47 -1.60 113.70 121.65 3kk7 s SER 309 Ca 0.04 -0.87 -0.08 0.00 1.31 0.00 0.00 55.95 56.35 3kk7 s SER 309 Cb -0.13 -0.55 -0.01 0.00 0.21 0.00 0.00 66.02 65.54 3kk7 s SER 309 CO -0.05 -0.01 0.19 -0.72 0.41 0.00 0.00 173.24 173.06 3kk7 s TYR 310 N -2.44 0.24 -0.03 2.43 1.13 0.76 -1.14 117.35 118.30 3kk7 s TYR 310 Ca 0.31 -0.66 -0.01 0.00 -1.41 0.00 0.00 57.07 55.29 3kk7 s TYR 310 Cb -0.05 -0.09 0.02 0.00 -1.10 0.00 0.00 41.96 40.74 3kk7 s TYR 310 CO 0.18 -0.57 0.06 0.45 -2.51 0.00 0.00 175.55 173.16 3kk7 s SER 311 N -2.89 -0.03 0.33 -0.18 0.15 -0.60 -1.34 113.70 109.14 3kk7 s SER 311 Ca 0.08 0.11 0.09 0.00 0.70 0.00 0.00 55.95 56.94 3kk7 s SER 311 Cb 0.05 0.07 -0.05 0.00 -1.71 0.00 0.00 66.02 64.38 3kk7 s SER 311 CO -0.09 -0.06 -0.03 0.27 1.20 0.00 0.00 173.24 174.53 3kk7 s ILE 312 N 0.43 2.61 -0.17 6.45 -4.36 -1.26 -1.21 121.20 123.69 3kk7 s ILE 312 Ca -0.03 -2.05 -0.12 0.00 -0.26 0.00 0.00 60.65 58.19 3kk7 s ILE 312 Cb -0.05 -2.72 0.05 0.00 1.25 0.00 0.00 42.46 40.99 3kk7 s ILE 312 CO -0.01 -0.23 0.44 -0.75 0.24 0.00 0.00 174.94 174.62 3kk7 s LYS 313 N -3.67 0.45 0.00 0.37 2.20 -0.05 -0.99 119.74 118.05 3kk7 s LYS 313 Ca 0.34 0.75 -0.01 0.00 -0.36 0.00 0.00 55.97 56.69 3kk7 s LYS 313 Cb -0.01 0.08 -0.04 0.00 -1.51 0.00 0.00 37.83 36.35 3kk7 s LYS 313 CO 0.18 -0.12 0.10 0.95 -0.36 0.00 0.00 175.35 176.10 3kk7 s THR 314 N 1.02 4.84 -0.24 3.43 -4.23 0.32 -1.08 115.64 119.70 3kk7 s THR 314 Ca -0.06 -0.40 -0.02 0.00 -1.18 0.00 0.00 61.69 60.03 3kk7 s THR 314 Cb -0.06 -3.23 0.02 0.00 1.34 0.00 0.00 72.50 70.56 3kk7 s THR 314 CO -0.09 0.33 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.49 3kk7 s LEU 315 N -1.83 3.04 0.00 4.79 1.43 0.11 -4.25 118.68 121.97 3kk7 s LEU 315 Ca 0.24 -0.77 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 3kk7 s LEU 315 Cb -0.12 -1.66 0.00 0.00 0.03 0.00 0.00 46.19 44.44 3kk7 s LEU 315 CO 0.16 -0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.25 3kk7 n GLY 316 N 4.69 -2.15 7.00 -3.19 0.00 -1.26 -1.67 105.19 108.61 3kk7 n GLY 316 Ca -0.17 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.39 3kk7 n GLY 316 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kk7 n GLY 317 N -0.23 -0.11 3.23 -0.02 0.00 -0.16 -4.87 105.19 103.04 3kk7 n GLY 317 Ca 0.00 -1.01 -0.10 0.00 0.00 0.00 0.00 46.02 44.91 3kk7 n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kk7 s ALA 318 N -1.68 0.72 -1.30 4.61 0.00 -1.26 -4.91 121.76 117.94 3kk7 s ALA 318 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.57 3kk7 s ALA 318 Cb 0.00 1.03 0.00 0.00 0.00 0.00 0.00 23.12 24.15 3kk7 s ALA 318 CO 0.00 -0.57 0.00 0.66 0.00 0.00 0.00 175.76 175.85 3kk7 n TYR 319 N -0.19 -0.71 0.00 0.00 4.01 -1.26 -3.93 117.16 115.08 3kk7 n TYR 319 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 3kk7 n TYR 319 Cb 0.64 -3.16 0.00 0.00 -0.31 0.00 0.00 39.34 36.51 3kk7 n TYR 319 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3kk7 n GLY 320 N -1.02 3.47 2.47 2.72 0.00 -1.26 -4.00 105.19 107.57 3kk7 n GLY 320 Ca -0.18 -0.68 -0.24 0.00 0.00 0.00 0.00 46.02 44.92 3kk7 n GLY 320 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kk7 s TYR 321 N 3.96 0.64 0.35 1.61 2.02 -1.26 -4.98 117.35 119.70 3kk7 s TYR 321 Ca 0.00 -1.91 0.27 0.00 -0.37 0.00 0.00 57.07 55.06 3kk7 s TYR 321 Cb 0.00 -0.75 1.36 0.00 -0.40 0.00 0.00 41.96 42.17 3kk7 s TYR 321 CO 0.00 -0.88 2.02 0.77 -1.57 0.00 0.00 175.55 175.89 3kk7 h SER 322 N 5.93 0.00 -3.49 2.29 0.02 -1.96 0.94 113.55 117.28 3kk7 h SER 322 Ca 0.20 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.48 3kk7 h SER 322 Cb 0.95 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.25 3kk7 h SER 322 CO 0.30 0.14 -0.73 -0.63 -1.14 0.00 0.00 176.83 174.76 3kk7 s ILE 323 N -4.05 3.32 0.17 3.27 1.01 -1.26 -4.79 121.20 118.87 3kk7 s ILE 323 Ca -0.02 -0.58 -0.32 0.00 0.00 0.00 0.00 60.65 59.72 3kk7 s ILE 323 Cb 0.12 -2.39 -0.16 0.00 0.01 0.00 0.00 42.46 40.04 3kk7 s ILE 323 CO 0.59 0.54 1.07 -1.20 0.00 0.00 0.00 174.94 175.94 3kk7 n SER 324 N 3.12 0.95 -4.82 3.58 7.64 -1.26 -4.81 113.62 118.01 3kk7 n SER 324 Ca -0.18 1.15 -0.32 0.00 1.01 0.00 0.00 58.87 60.53 3kk7 n SER 324 Cb 0.53 -1.17 0.01 0.00 -1.01 0.00 0.00 64.21 62.57 3kk7 n SER 324 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3kk7 s THR 325 N -0.34 4.05 1.10 0.44 -4.23 -0.16 -4.99 115.64 111.51 3kk7 s THR 325 Ca 0.72 0.87 -0.13 0.00 -1.18 0.00 0.00 61.69 61.97 3kk7 s THR 325 Cb -0.88 -3.47 0.23 0.00 1.34 0.00 0.00 72.50 69.71 3kk7 s THR 325 CO 0.54 -0.67 0.91 -2.65 -0.54 0.00 0.00 174.62 172.21 3kk7 n PRO 326 N -2.30 -1.81 -2.77 3.99 -0.02 -1.26 -4.61 135.00 126.23 3kk7 n PRO 326 Ca 0.08 -0.49 -0.39 0.00 -2.02 0.00 0.00 63.50 60.68 3kk7 n PRO 326 Cb 0.53 -2.16 -0.06 0.00 -0.02 0.00 0.00 33.50 31.80 3kk7 n PRO 326 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3kk7 s PRO 327 N -4.32 4.79 0.03 0.52 0.04 -1.26 -4.66 135.00 130.15 3kk7 s PRO 327 Ca 0.66 1.44 0.05 0.00 0.04 0.00 0.00 61.00 63.19 3kk7 s PRO 327 Cb -0.23 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.10 3kk7 s PRO 327 CO 0.64 0.48 -0.14 0.71 0.04 0.00 0.00 177.00 178.73 3kk7 s TYR 328 N -1.26 1.19 -0.02 0.56 2.02 -0.45 -4.91 117.35 114.48 3kk7 s TYR 328 Ca 0.42 -0.34 -0.30 0.00 -0.37 0.00 0.00 57.07 56.49 3kk7 s TYR 328 Cb -0.24 -0.71 -0.05 0.00 -0.40 0.00 0.00 41.96 40.56 3kk7 s TYR 328 CO 0.30 0.02 1.34 0.34 -1.57 0.00 0.00 175.55 175.98 3kk7 s ASP 329 N -1.03 6.91 0.46 2.29 -1.08 -1.26 -0.17 116.67 122.79 3kk7 s ASP 329 Ca 0.02 2.01 0.16 0.00 -0.52 0.00 0.00 52.55 54.22 3kk7 s ASP 329 Cb -0.07 -2.56 1.12 0.00 -1.46 0.00 0.00 42.92 39.95 3kk7 s ASP 329 CO 0.01 -0.68 1.99 -0.29 0.52 0.00 0.00 175.17 176.72 3kk7 h ILE 330 N 4.97 0.86 0.00 4.11 6.09 -1.58 -0.04 117.51 131.92 3kk7 h ILE 330 Ca -0.36 -0.10 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 3kk7 h ILE 330 Cb 1.17 0.53 0.00 0.00 0.47 0.00 0.00 36.82 38.99 3kk7 h ILE 330 CO 0.90 0.06 -0.43 0.35 -3.07 0.00 0.00 178.15 175.95 3kk7 n THR 331 N -4.46 0.10 -0.10 2.19 -2.24 -1.26 -1.74 114.28 106.76 3kk7 n THR 331 Ca 0.09 -0.07 -0.13 0.00 -2.27 0.00 0.00 64.05 61.67 3kk7 n THR 331 Cb 0.41 0.02 -0.12 0.00 -2.10 0.00 0.00 70.33 68.54 3kk7 n THR 331 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3kk7 n ASN 332 N -1.66 1.45 -3.90 3.42 5.15 -0.12 -4.83 115.26 114.77 3kk7 n ASN 332 Ca 0.05 -0.07 -0.23 0.00 -0.60 0.00 0.00 54.58 53.73 3kk7 n ASN 332 Cb 0.36 0.22 -0.17 0.00 -0.53 0.00 0.00 39.78 39.67 3kk7 n ASN 332 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 3kk7 s TYR 333 N -2.45 1.08 0.02 1.20 5.04 -0.64 -5.04 117.35 116.56 3kk7 s TYR 333 Ca -0.21 -0.41 0.06 0.00 -2.44 0.00 0.00 57.07 54.08 3kk7 s TYR 333 Cb 0.07 -0.92 -0.03 0.00 0.35 0.00 0.00 41.96 41.43 3kk7 s TYR 333 CO 0.63 -0.31 -0.18 -1.12 -1.34 0.00 0.00 175.55 173.23 3kk7 s SER 334 N 1.24 3.81 -0.10 4.32 0.01 -1.26 -4.65 113.70 117.06 3kk7 s SER 334 Ca -0.05 -0.38 0.04 0.00 1.31 0.00 0.00 55.95 56.86 3kk7 s SER 334 Cb -0.14 -0.65 -0.00 0.00 0.21 0.00 0.00 66.02 65.45 3kk7 s SER 334 CO -0.02 0.28 -0.23 -0.63 0.41 0.00 0.00 173.24 173.04 3kk7 s ILE 335 N -0.87 2.12 -0.36 1.44 1.01 -0.63 -5.01 121.20 118.90 3kk7 s ILE 335 Ca 0.14 -1.00 -0.23 0.00 0.00 0.00 0.00 60.65 59.56 3kk7 s ILE 335 Cb -0.10 -1.81 0.01 0.00 0.01 0.00 0.00 42.46 40.56 3kk7 s ILE 335 CO 0.04 0.56 0.77 -0.62 0.00 0.00 0.00 174.94 175.69 3kk7 s ASP 336 N 0.36 6.54 -0.09 3.58 2.15 -1.26 -1.75 116.67 126.21 3kk7 s ASP 336 Ca -0.18 0.34 0.17 0.00 0.43 0.00 0.00 52.55 53.31 3kk7 s ASP 336 Cb -0.18 -2.39 0.63 0.00 -0.30 0.00 0.00 42.92 40.69 3kk7 s ASP 336 CO 0.08 -0.71 1.52 0.18 -0.17 0.00 0.00 175.17 176.07 3kk7 n LEU 337 N 6.37 4.17 -0.01 -1.34 4.77 0.15 -4.64 117.00 126.47 3kk7 n LEU 337 Ca 0.03 -2.10 -0.10 0.00 -0.03 0.00 0.00 56.01 53.80 3kk7 n LEU 337 Cb 0.48 -0.53 -0.04 0.00 -2.33 0.00 0.00 43.42 41.00 3kk7 n LEU 337 CO 0.53 0.74 0.89 0.74 -1.33 0.00 0.00 177.39 178.97 3kk7 h THR 338 N 3.66 0.97 -0.77 -5.08 2.02 -1.86 0.13 112.91 111.98 3kk7 h THR 338 Ca 0.00 -0.03 0.07 0.00 0.77 0.00 0.00 66.41 67.21 3kk7 h THR 338 Cb 1.26 0.86 -0.06 0.00 -1.74 0.00 0.00 68.15 68.47 3kk7 h THR 338 CO 0.18 0.02 0.45 -0.65 0.37 0.00 0.00 175.52 175.89 3kk7 h PRO 339 N 0.09 0.78 -0.59 6.66 0.11 -1.89 -1.48 132.00 135.69 3kk7 h PRO 339 Ca 0.05 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 3kk7 h PRO 339 Cb 0.03 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 30.94 3kk7 h PRO 339 CO -0.06 0.52 0.30 2.35 -0.21 0.00 0.00 178.00 180.90 3kk7 h TRP 340 N 0.81 0.84 -0.44 0.65 7.01 -1.48 -0.86 115.95 122.47 3kk7 h TRP 340 Ca 0.35 -0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.31 3kk7 h TRP 340 Cb 0.22 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 26.99 3kk7 h TRP 340 CO -0.06 0.63 0.29 1.25 -2.79 0.00 0.00 178.44 177.77 3kk7 h LEU 341 N 0.80 0.51 0.00 0.65 5.85 -0.00 -1.87 115.31 121.25 3kk7 h LEU 341 Ca 0.20 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.91 3kk7 h LEU 341 Cb 0.10 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.00 3kk7 h LEU 341 CO -0.03 0.37 0.00 0.00 -0.34 0.00 0.00 178.44 178.44 3kk7 n GLN 342 N -4.78 0.03 0.26 1.25 10.64 -0.63 -1.79 117.38 122.35 3kk7 n GLN 342 Ca 0.01 0.02 0.15 0.00 -1.83 0.00 0.00 57.00 55.35 3kk7 n GLN 342 Cb 0.02 -1.50 0.59 0.00 -0.86 0.00 0.00 30.24 28.49 3kk7 n GLN 342 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3kk7 h SER 343 N 0.00 0.00 0.42 2.61 4.64 -0.30 -3.11 113.55 117.81 3kk7 h SER 343 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3kk7 h SER 343 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 3kk7 h SER 343 CO 0.00 0.07 0.00 0.18 -0.87 0.00 0.00 176.83 176.21 3kk7 n LEU 344 N -3.20 0.00 0.20 5.97 4.77 -0.74 -2.41 117.00 121.59 3kk7 n LEU 344 Ca 0.01 0.32 0.15 0.00 -0.03 0.00 0.00 56.01 56.45 3kk7 n LEU 344 Cb 0.35 -0.32 0.63 0.00 -2.33 0.00 0.00 43.42 41.75 3kk7 n LEU 344 CO 0.30 -0.11 0.93 0.78 -1.33 0.00 0.00 177.39 177.95 3kk7 h ASN 345 N 0.00 0.00 -2.94 -1.43 2.35 -1.72 -3.37 115.58 108.48 3kk7 h ASN 345 Ca 0.00 0.00 -0.71 0.00 -0.55 0.00 0.00 56.30 55.04 3kk7 h ASN 345 Cb 0.21 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 38.38 3kk7 h ASN 345 CO 0.00 0.00 0.08 -0.62 -1.65 0.00 0.00 177.43 175.24 3kk7 s ASP 346 N -4.80 6.18 0.09 5.81 2.15 -1.01 -4.94 116.67 120.15 3kk7 s ASP 346 Ca 0.02 -1.43 0.07 0.00 0.43 0.00 0.00 52.55 51.64 3kk7 s ASP 346 Cb 0.09 -2.29 0.38 0.00 -0.30 0.00 0.00 42.92 40.80 3kk7 s ASP 346 CO 0.43 -1.08 1.23 -0.81 -0.17 0.00 0.00 175.17 174.76 3kk7 n PRO 347 N 6.24 0.04 0.29 4.34 -0.04 -1.26 -0.78 135.00 143.83 3kk7 n PRO 347 Ca -0.10 0.51 0.18 0.00 -0.04 0.00 0.00 63.50 64.05 3kk7 n PRO 347 Cb 0.42 -1.62 0.85 0.00 -0.04 0.00 0.00 33.50 33.11 3kk7 n PRO 347 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3kk7 h LYS 348 N 0.00 0.00 -0.10 0.54 1.79 -1.93 -2.27 116.57 114.60 3kk7 h LYS 348 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3kk7 h LYS 348 Cb 0.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 3kk7 h LYS 348 CO 0.00 0.03 0.00 0.25 -1.08 0.00 0.00 179.45 178.65 3kk7 n THR 349 N -3.20 0.13 -1.99 -0.16 -2.24 0.04 -4.94 114.28 101.92 3kk7 n THR 349 Ca -0.01 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.19 3kk7 n THR 349 Cb 0.23 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 3kk7 n THR 349 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3kk7 s HIS 350 N -1.87 3.39 0.00 4.78 3.76 -0.86 -0.99 115.29 123.51 3kk7 s HIS 350 Ca 0.34 1.40 0.00 0.00 -0.15 0.00 0.00 55.06 56.64 3kk7 s HIS 350 Cb 0.18 -2.81 0.00 0.00 1.11 0.00 0.00 32.58 31.06 3kk7 s HIS 350 CO 0.28 -0.75 0.00 -2.37 -0.85 0.00 0.00 174.74 171.04 3kk7 n THR 351 N -2.38 0.00 0.00 1.30 5.66 -0.38 -4.41 114.28 114.07 3kk7 n THR 351 Ca 0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 3kk7 n THR 351 Cb 0.54 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.32 3kk7 n THR 351 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 175.07 174.32 3kk7 n ILE 353 N -0.69 0.00 -3.71 1.09 -5.35 -0.68 -1.28 119.36 108.74 3kk7 n ILE 353 Ca 0.00 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.47 3kk7 n ILE 353 Cb 0.00 0.00 -0.01 0.00 -1.74 0.00 0.00 39.64 37.89 3kk7 n ILE 353 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3kk7 s ASP 354 N 0.00 -0.11 0.04 7.28 -1.08 -1.17 -4.52 116.67 117.11 3kk7 s ASP 354 Ca 0.00 -0.30 0.05 0.00 -0.52 0.00 0.00 52.55 51.78 3kk7 s ASP 354 Cb 0.00 0.34 -0.03 0.00 -1.46 0.00 0.00 42.92 41.77 3kk7 s ASP 354 CO 0.00 -0.64 -0.10 -0.76 0.52 0.00 0.00 175.17 174.19 3kk7 s LEU 355 N -3.01 3.00 0.55 -1.34 1.43 -1.26 -1.00 118.68 117.04 3kk7 s LEU 355 Ca 0.14 -0.28 -0.16 0.00 -1.03 0.00 0.00 54.13 52.80 3kk7 s LEU 355 Cb 0.01 -1.76 -0.06 0.00 0.03 0.00 0.00 46.19 44.41 3kk7 s LEU 355 CO -0.00 0.25 1.02 -1.10 0.23 0.00 0.00 176.35 176.74 3kk7 s GLN 356 N -1.64 3.67 0.24 1.70 -0.21 -0.42 -4.83 119.66 118.17 3kk7 s GLN 356 Ca 0.18 1.09 -0.31 0.00 0.02 0.00 0.00 55.36 56.33 3kk7 s GLN 356 Cb -0.11 -2.09 -0.13 0.00 1.00 0.00 0.00 33.01 31.69 3kk7 s GLN 356 CO 0.09 -0.51 1.56 -0.25 -2.12 0.00 0.00 175.29 174.06 3kk7 n ASP 357 N -1.73 3.42 -1.51 5.90 8.00 -1.26 -0.50 116.55 128.88 3kk7 n ASP 357 Ca 0.08 1.12 -0.17 0.00 0.71 0.00 0.00 54.79 56.53 3kk7 n ASP 357 Cb 0.53 -1.51 -0.05 0.00 -0.02 0.00 0.00 41.12 40.07 3kk7 n ASP 357 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kk7 n GLY 358 N 2.70 0.99 0.08 0.44 0.00 -0.01 -4.89 105.19 104.50 3kk7 n GLY 358 Ca 0.12 -0.21 0.15 0.00 0.00 0.00 0.00 46.02 46.09 3kk7 n GLY 358 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kk7 n GLY 359 N -0.95 -0.88 3.14 -0.02 0.00 0.35 -4.44 105.19 102.40 3kk7 n GLY 359 Ca -0.18 -0.23 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 3kk7 n GLY 359 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kk7 s LEU 360 N -2.09 2.02 -0.00 0.99 1.43 -0.25 -0.82 118.68 119.95 3kk7 s LEU 360 Ca 0.43 -0.57 0.05 0.00 -1.03 0.00 0.00 54.13 53.01 3kk7 s LEU 360 Cb 0.22 -1.37 -0.03 0.00 0.03 0.00 0.00 46.19 45.04 3kk7 s LEU 360 CO 0.38 0.06 -0.13 -0.31 0.23 0.00 0.00 176.35 176.59 3kk7 s TYR 361 N 0.87 2.73 0.55 0.29 1.51 -0.69 -0.85 117.35 121.76 3kk7 s TYR 361 Ca -0.07 -0.14 -0.21 0.00 -1.01 0.00 0.00 57.07 55.64 3kk7 s TYR 361 Cb -0.15 -1.57 -0.05 0.00 -0.11 0.00 0.00 41.96 40.08 3kk7 s TYR 361 CO -0.02 0.28 1.31 -1.25 -1.11 0.00 0.00 175.55 174.76 3kk7 s PRO 362 N -1.21 3.17 0.49 -1.71 0.04 -1.26 -0.58 135.00 133.94 3kk7 s PRO 362 Ca 0.15 2.12 0.22 0.00 0.04 0.00 0.00 61.00 63.53 3kk7 s PRO 362 Cb -0.11 -2.22 1.27 0.00 0.04 0.00 0.00 34.50 33.48 3kk7 s PRO 362 CO 0.05 -1.13 1.97 0.82 0.04 0.00 0.00 177.00 178.74 3kk7 h ILE 363 N 1.39 0.76 0.00 0.56 2.04 -1.90 -1.50 117.51 118.86 3kk7 h ILE 363 Ca -0.51 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 3kk7 h ILE 363 Cb 1.30 0.59 -0.00 0.00 -0.74 0.00 0.00 36.82 37.97 3kk7 h ILE 363 CO 0.57 0.03 -0.04 0.77 0.00 0.00 0.00 178.15 179.48 3kk7 h SER 364 N 0.15 0.00 0.68 1.72 4.64 -1.89 0.29 113.55 119.15 3kk7 h SER 364 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 3kk7 h SER 364 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 3kk7 h SER 364 CO -0.04 0.04 0.00 0.47 -0.87 0.00 0.00 176.83 176.42 3kk7 n ASP 365 N -3.90 0.64 -1.15 4.97 8.00 -0.57 -3.40 116.55 121.14 3kk7 n ASP 365 Ca -0.03 0.67 0.09 0.00 0.71 0.00 0.00 54.79 56.23 3kk7 n ASP 365 Cb 0.13 -0.80 0.27 0.00 -0.02 0.00 0.00 41.12 40.70 3kk7 n ASP 365 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3kk7 n PHE 366 N -2.22 0.98 -4.12 1.24 3.01 0.09 -4.69 117.46 111.76 3kk7 n PHE 366 Ca 0.02 -0.58 -0.14 0.00 1.01 0.00 0.00 57.45 57.76 3kk7 n PHE 366 Cb 0.22 -0.13 -0.11 0.00 -0.01 0.00 0.00 39.48 39.45 3kk7 n PHE 366 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 3kk7 s ILE 367 N -1.49 0.77 -0.14 4.37 -4.36 -1.22 -4.27 121.20 114.85 3kk7 s ILE 367 Ca 0.41 -1.36 0.18 0.00 -0.26 0.00 0.00 60.65 59.62 3kk7 s ILE 367 Cb 0.25 -1.01 -0.14 0.00 1.25 0.00 0.00 42.46 42.81 3kk7 s ILE 367 CO 0.22 -0.45 0.78 0.18 0.24 0.00 0.00 174.94 175.91 3kk7 n LEU 368 N 1.03 0.74 -4.62 0.37 4.77 -1.26 -4.92 117.00 113.11 3kk7 n LEU 368 Ca -0.20 0.32 -0.43 0.00 -0.03 0.00 0.00 56.01 55.67 3kk7 n LEU 368 Cb 0.56 0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.70 3kk7 n LEU 368 CO 0.23 0.10 1.22 -1.61 -1.33 0.00 0.00 177.39 176.01 3kk7 s GLU 369 N -3.01 3.75 0.24 3.23 8.01 -1.26 -4.62 118.70 125.04 3kk7 s GLU 369 Ca -0.03 1.20 -0.10 0.00 0.01 0.00 0.00 54.97 56.04 3kk7 s GLU 369 Cb 0.09 -3.97 0.35 0.00 -4.31 0.00 0.00 34.13 26.30 3kk7 s GLU 369 CO 0.82 -1.33 1.60 1.49 0.01 0.00 0.00 175.26 177.84 3kk7 h GLU 370 N 10.13 0.01 -0.12 1.61 4.57 -1.06 -0.34 114.58 129.38 3kk7 h GLU 370 Ca -0.28 -0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 57.78 3kk7 h GLU 370 Cb 1.11 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.69 3kk7 h GLU 370 CO 1.05 0.01 -0.47 -2.95 -1.18 0.00 0.00 179.01 175.46 3kk7 h ASN 371 N 0.01 0.31 -0.02 1.04 -1.07 -1.92 -1.69 115.58 112.24 3kk7 h ASN 371 Ca 0.39 -0.15 -0.21 0.00 0.07 0.00 0.00 56.30 56.40 3kk7 h ASN 371 Cb 0.61 -0.09 0.00 0.00 -2.07 0.00 0.00 38.32 36.77 3kk7 h ASN 371 CO -0.80 0.74 -0.75 -0.26 0.07 0.00 0.00 177.43 176.44 3kk7 h PHE 372 N 0.23 0.90 0.27 4.14 0.04 -1.70 -1.53 116.94 119.30 3kk7 h PHE 372 Ca 0.01 -0.39 0.00 0.00 2.80 0.00 0.00 57.97 60.39 3kk7 h PHE 372 Cb 0.92 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 38.91 3kk7 h PHE 372 CO 0.02 1.20 -0.27 0.87 -0.60 0.00 0.00 178.31 179.53 3kk7 h LYS 373 N 0.46 -0.56 -0.70 1.51 1.57 -0.93 -0.20 116.57 117.72 3kk7 h LYS 373 Ca -0.04 0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3kk7 h LYS 373 Cb 1.35 0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.76 3kk7 h LYS 373 CO 0.15 -0.37 0.46 0.37 -0.57 0.00 0.00 179.45 179.49 3kk7 h GLN 374 N -0.58 0.92 -0.64 3.15 5.75 -1.33 -1.84 115.11 120.54 3kk7 h GLN 374 Ca -0.01 -0.06 -0.06 0.00 -0.15 0.00 0.00 58.65 58.38 3kk7 h GLN 374 Cb 0.53 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.85 3kk7 h GLN 374 CO -0.06 0.61 0.18 -0.09 -2.65 0.00 0.00 178.83 176.82 3kk7 h ARG 375 N 0.94 1.00 0.00 1.69 2.43 -1.02 0.39 114.38 119.81 3kk7 h ARG 375 Ca 0.26 -0.23 0.03 0.00 -0.81 0.00 0.00 59.98 59.23 3kk7 h ARG 375 Cb -0.10 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.27 3kk7 h ARG 375 CO -0.06 0.89 -0.26 -0.92 -1.51 0.00 0.00 179.97 178.11 3kk7 h TYR 376 N 0.93 -0.70 -0.43 2.20 3.20 -0.81 0.14 116.97 121.50 3kk7 h TYR 376 Ca 0.20 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.10 3kk7 h TYR 376 Cb 0.32 0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 3kk7 h TYR 376 CO 0.02 -0.35 0.28 -0.91 -1.64 0.00 0.00 178.16 175.56 3kk7 h ASN 377 N -0.40 0.49 0.21 -2.11 2.35 -0.86 0.20 115.58 115.46 3kk7 h ASN 377 Ca 0.06 -0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.70 3kk7 h ASN 377 Cb 0.48 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 3kk7 h ASN 377 CO -0.23 0.37 -0.35 0.44 -1.65 0.00 0.00 177.43 176.01 3kk7 h ASP 378 N 0.57 0.21 0.06 5.81 3.32 -0.11 -2.98 116.42 123.30 3kk7 h ASP 378 Ca 0.16 -0.08 -0.22 0.00 0.02 0.00 0.00 57.03 56.90 3kk7 h ASP 378 Cb -0.06 -0.06 0.02 0.00 0.22 0.00 0.00 39.33 39.46 3kk7 h ASP 378 CO -0.03 0.55 -0.91 0.74 -1.72 0.00 0.00 179.24 177.87 3kk7 h THR 379 N 0.18 1.37 0.00 0.35 2.02 -0.34 0.31 112.91 116.80 3kk7 h THR 379 Ca 0.02 -2.29 0.00 0.00 0.77 0.00 0.00 66.41 64.91 3kk7 h THR 379 Cb 0.71 2.68 0.00 0.00 -1.74 0.00 0.00 68.15 69.79 3kk7 h THR 379 CO 0.05 0.68 0.00 1.57 0.37 0.00 0.00 175.52 178.19 3kk7 n HIS 380 N -4.01 0.00 -2.15 3.16 -0.00 0.02 -4.51 115.22 107.74 3kk7 n HIS 380 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.60 3kk7 n HIS 380 Cb 0.83 -0.08 -0.00 0.00 -0.00 0.00 0.00 29.99 30.73 3kk7 n HIS 380 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 3kk7 n ASP 382 N 0.92 0.19 0.04 0.26 8.00 -1.03 -4.71 116.55 120.22 3kk7 n ASP 382 Ca 0.00 -1.84 -0.03 0.00 0.71 0.00 0.00 54.79 53.63 3kk7 n ASP 382 Cb 0.00 -0.14 -0.08 0.00 -0.02 0.00 0.00 41.12 40.88 3kk7 n ASP 382 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 3kk7 h PHE 383 N 0.30 0.00 -3.62 1.24 0.05 -0.62 -3.48 116.94 110.82 3kk7 h PHE 383 Ca -0.13 0.00 -0.15 0.00 3.82 0.00 0.00 57.97 61.51 3kk7 h PHE 383 Cb 1.49 0.00 -0.21 0.00 2.00 0.00 0.00 35.95 39.23 3kk7 h PHE 383 CO 0.03 0.73 -0.54 -0.65 -0.18 0.00 0.00 178.31 177.70 3kk7 s GLN 384 N -2.82 0.44 -0.29 1.51 -1.52 -1.00 -4.98 119.66 111.00 3kk7 s GLN 384 Ca -0.01 -0.44 0.03 0.00 -1.95 0.00 0.00 55.36 52.98 3kk7 s GLN 384 Cb 0.08 0.18 0.19 0.00 -0.22 0.00 0.00 33.01 33.24 3kk7 s GLN 384 CO 0.80 -0.10 0.57 -0.47 -0.25 0.00 0.00 175.29 175.84 3kk7 s TYR 385 N -1.39 -1.65 -0.31 0.91 5.04 -1.26 -4.02 117.35 114.66 3kk7 s TYR 385 Ca -0.15 1.26 -0.07 0.00 -2.44 0.00 0.00 57.07 55.67 3kk7 s TYR 385 Cb -0.08 0.37 0.01 0.00 0.35 0.00 0.00 41.96 42.61 3kk7 s TYR 385 CO 0.01 -0.98 0.10 -1.14 -1.34 0.00 0.00 175.55 172.20 3kk7 s GLN 386 N 2.81 3.03 0.17 4.97 0.74 -1.26 -5.00 119.66 125.11 3kk7 s GLN 386 Ca 0.14 -0.90 -0.16 0.00 0.05 0.00 0.00 55.36 54.49 3kk7 s GLN 386 Cb -0.12 -3.43 0.12 0.00 1.10 0.00 0.00 33.01 30.68 3kk7 s GLN 386 CO -0.24 -0.49 1.68 1.49 -0.55 0.00 0.00 175.29 177.19 3kk7 h GLU 387 N 8.26 0.07 -3.70 1.67 4.81 -1.99 -3.39 114.58 120.30 3kk7 h GLU 387 Ca -0.30 -0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.85 3kk7 h GLU 387 Cb 1.12 -0.02 -0.13 0.00 0.63 0.00 0.00 28.75 30.36 3kk7 h GLU 387 CO 0.61 0.04 -0.26 -1.54 -0.73 0.00 0.00 179.01 177.13 3kk7 s SER 388 N -5.24 -0.01 0.65 1.04 1.04 -1.26 -4.38 113.70 105.55 3kk7 s SER 388 Ca -0.14 -0.63 -0.18 0.00 0.48 0.00 0.00 55.95 55.49 3kk7 s SER 388 Cb 0.14 0.41 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 3kk7 s SER 388 CO 0.71 -0.83 1.26 -0.76 0.98 0.00 0.00 173.24 174.60 3kk7 s LEU 389 N -2.88 3.54 0.33 2.42 1.43 -1.26 -4.97 118.68 117.29 3kk7 s LEU 389 Ca 0.08 2.53 0.06 0.00 -1.03 0.00 0.00 54.13 55.77 3kk7 s LEU 389 Cb 0.03 -4.61 -0.03 0.00 0.03 0.00 0.00 46.19 41.61 3kk7 s LEU 389 CO -0.07 -1.98 0.23 -1.61 0.23 0.00 0.00 176.35 173.15 3kk7 s GLU 390 N -3.47 1.71 0.06 1.70 2.02 -0.09 -4.86 118.70 115.77 3kk7 s GLU 390 Ca 0.80 -2.00 -0.31 0.00 0.02 0.00 0.00 54.97 53.49 3kk7 s GLU 390 Cb -0.34 0.16 -0.07 0.00 0.10 0.00 0.00 34.13 33.98 3kk7 s GLU 390 CO 0.39 -0.59 1.39 -2.00 0.02 0.00 0.00 175.26 174.48 3kk7 s GLU 391 N -3.58 4.31 0.66 1.61 2.12 -1.26 -4.39 118.70 118.17 3kk7 s GLU 391 Ca 0.38 2.02 -0.11 0.00 0.36 0.00 0.00 54.97 57.62 3kk7 s GLU 391 Cb 0.03 -3.40 -0.01 0.00 0.26 0.00 0.00 34.13 31.01 3kk7 s GLU 391 CO 0.23 -0.49 1.06 -1.25 -0.54 0.00 0.00 175.26 174.27 3kk7 s PRO 392 N 1.67 3.18 -0.16 4.30 0.04 -1.26 -4.84 135.00 137.93 3kk7 s PRO 392 Ca 0.64 0.56 -0.30 0.00 0.04 0.00 0.00 61.00 61.94 3kk7 s PRO 392 Cb -0.34 -2.06 0.14 0.00 0.04 0.00 0.00 34.50 32.27 3kk7 s PRO 392 CO 0.29 -0.81 1.06 1.52 0.04 0.00 0.00 177.00 179.10 3kk7 s TYR 393 N -3.26 -0.29 -0.20 0.56 -0.85 -1.02 -4.42 117.35 107.88 3kk7 s TYR 393 Ca 0.56 0.42 -0.11 0.00 -0.52 0.00 0.00 57.07 57.43 3kk7 s TYR 393 Cb -0.11 0.48 -0.05 0.00 0.38 0.00 0.00 41.96 42.66 3kk7 s TYR 393 CO 0.52 -0.30 0.16 0.42 -1.52 0.00 0.00 175.55 174.82 3kk7 s ILE 394 N -1.52 5.39 -0.17 -3.49 1.01 -0.71 -0.40 121.20 121.30 3kk7 s ILE 394 Ca 0.02 0.23 -0.02 0.00 0.00 0.00 0.00 60.65 60.89 3kk7 s ILE 394 Cb -0.01 -3.50 -0.01 0.00 0.01 0.00 0.00 42.46 38.96 3kk7 s ILE 394 CO -0.02 0.42 -0.10 -1.83 0.00 0.00 0.00 174.94 173.40 3kk7 s GLU 395 N 0.50 3.34 -0.45 2.79 -1.05 -0.48 -1.30 118.70 122.05 3kk7 s GLU 395 Ca 0.09 -0.67 -0.20 0.00 -0.15 0.00 0.00 54.97 54.03 3kk7 s GLU 395 Cb -0.12 -2.78 0.03 0.00 -0.44 0.00 0.00 34.13 30.82 3kk7 s GLU 395 CO -0.00 -0.00 0.62 0.42 0.95 0.00 0.00 175.26 177.25 3kk7 s ILE 396 N 0.91 4.85 0.00 1.83 1.01 0.12 -0.38 121.20 129.55 3kk7 s ILE 396 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.55 3kk7 s ILE 396 Cb -0.15 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.10 3kk7 s ILE 396 CO -0.00 -0.64 0.00 2.30 0.00 0.00 0.00 174.94 176.60 3kk7 n ILE 397 N 5.76 0.00 -3.32 2.92 -5.35 -0.00 -1.56 119.36 117.80 3kk7 n ILE 397 Ca -0.03 0.00 -0.00 0.00 -0.27 0.00 0.00 62.75 62.44 3kk7 n ILE 397 Cb 0.47 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.37 3kk7 n ILE 397 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 3kk7 n LYS 398 N 0.00 1.31 -4.73 6.28 5.02 -0.87 -0.28 118.16 124.89 3kk7 n LYS 398 Ca 0.00 -0.06 -0.24 0.00 -2.02 0.00 0.00 58.31 55.99 3kk7 n LYS 398 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 34.85 3kk7 n LYS 398 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3kk7 s TYR 400 N 0.31 1.51 0.05 2.13 5.04 -1.18 -0.92 117.35 124.29 3kk7 s TYR 400 Ca 0.01 -0.41 -0.02 0.00 -2.44 0.00 0.00 57.07 54.21 3kk7 s TYR 400 Cb -0.00 -1.02 -0.01 0.00 0.35 0.00 0.00 41.96 41.28 3kk7 s TYR 400 CO 0.00 -0.13 -0.04 -0.89 -1.34 0.00 0.00 175.55 173.15 3kk7 n ILE 401 N 3.12 1.02 -3.83 3.14 2.08 -0.40 -4.80 119.36 119.70 3kk7 n ILE 401 Ca -0.18 0.31 -0.06 0.00 0.56 0.00 0.00 62.75 63.38 3kk7 n ILE 401 Cb 0.53 -1.57 -0.01 0.00 -0.75 0.00 0.00 39.64 37.85 3kk7 n ILE 401 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3kk7 s ARG 402 N -1.90 1.70 -0.01 0.38 1.70 -1.18 -5.03 118.95 114.60 3kk7 s ARG 402 Ca -0.03 -0.99 -0.18 0.00 -0.47 0.00 0.00 55.73 54.06 3kk7 s ARG 402 Cb 0.00 0.55 -0.06 0.00 -0.57 0.00 0.00 34.95 34.87 3kk7 s ARG 402 CO 0.05 -0.79 0.50 0.15 -1.08 0.00 0.00 175.30 174.13 3kk7 s LYS 403 N -3.29 4.16 1.06 3.89 1.02 -1.26 -0.80 119.74 124.52 3kk7 s LYS 403 Ca 0.13 0.56 -0.13 0.00 0.02 0.00 0.00 55.97 56.56 3kk7 s LYS 403 Cb -0.04 -3.30 0.22 0.00 -0.52 0.00 0.00 37.83 34.19 3kk7 s LYS 403 CO 0.07 0.50 1.08 -1.54 -0.92 0.00 0.00 175.35 174.53 3kk7 s SER 404 N -0.54 2.08 0.00 2.83 1.04 0.95 -4.84 113.70 115.23 3kk7 s SER 404 Ca 0.27 1.19 0.23 0.00 0.48 0.00 0.00 55.95 58.11 3kk7 s SER 404 Cb -0.17 -1.86 1.30 0.00 0.10 0.00 0.00 66.02 65.39 3kk7 s SER 404 CO 0.15 -3.47 1.74 -0.46 0.98 0.00 0.00 173.24 172.18 3kk7 n ASN 405 N -4.40 0.00 -0.87 7.02 0.23 -1.26 -1.22 115.26 114.75 3kk7 n ASN 405 Ca 0.05 -0.51 0.12 0.00 -0.53 0.00 0.00 54.58 53.70 3kk7 n ASN 405 Cb 0.57 -0.09 0.08 0.00 -2.08 0.00 0.00 39.78 38.27 3kk7 n ASN 405 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 3kk7 n SER 406 N -1.09 2.82 0.00 0.53 3.41 -1.26 -4.96 113.62 113.07 3kk7 n SER 406 Ca 0.15 -1.91 0.00 0.00 -0.26 0.00 0.00 58.87 56.85 3kk7 n SER 406 Cb 0.11 0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 3kk7 n SER 406 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kk7 n GLY 407 N 1.36 0.87 3.76 5.00 0.00 -0.36 -5.06 105.19 110.76 3kk7 n GLY 407 Ca 0.13 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 3kk7 n GLY 407 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3kk7 s GLU 408 N -0.68 4.24 0.12 1.61 2.12 -1.25 -4.72 118.70 120.14 3kk7 s GLU 408 Ca 0.00 0.52 -0.31 0.00 0.36 0.00 0.00 54.97 55.54 3kk7 s GLU 408 Cb 0.00 -3.36 -0.08 0.00 0.26 0.00 0.00 34.13 30.95 3kk7 s GLU 408 CO 0.00 0.34 1.38 0.15 -0.54 0.00 0.00 175.26 176.59 3kk7 s LYS 409 N 0.01 4.32 -0.04 4.30 1.02 -1.26 -0.03 119.74 128.06 3kk7 s LYS 409 Ca 0.27 2.07 0.06 0.00 0.02 0.00 0.00 55.97 58.39 3kk7 s LYS 409 Cb -0.16 -3.25 -0.02 0.00 -0.52 0.00 0.00 37.83 33.88 3kk7 s LYS 409 CO 0.13 -0.43 -0.23 -0.51 -0.92 0.00 0.00 175.35 173.40 3kk7 s LEU 410 N 1.06 2.24 0.07 3.17 1.43 0.02 -4.92 118.68 121.75 3kk7 s LEU 410 Ca 0.64 -0.42 0.05 0.00 -1.03 0.00 0.00 54.13 53.38 3kk7 s LEU 410 Cb -0.37 -1.41 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 3kk7 s LEU 410 CO 0.30 0.29 -0.15 -0.31 0.23 0.00 0.00 176.35 176.72 3kk7 s TYR 411 N -0.44 1.25 0.22 0.29 2.02 -1.26 -1.28 117.35 118.16 3kk7 s TYR 411 Ca 0.05 -0.44 0.04 0.00 -0.37 0.00 0.00 57.07 56.34 3kk7 s TYR 411 Cb -0.12 -0.71 -0.03 0.00 -0.40 0.00 0.00 41.96 40.70 3kk7 s TYR 411 CO 0.01 0.06 0.36 0.34 -1.57 0.00 0.00 175.55 174.75 3kk7 s ASP 412 N -1.66 6.33 -0.20 2.29 2.15 -1.26 -4.71 116.67 119.61 3kk7 s ASP 412 Ca -0.01 0.14 -0.08 0.00 0.43 0.00 0.00 52.55 53.03 3kk7 s ASP 412 Cb -0.10 -1.89 -0.04 0.00 -0.30 0.00 0.00 42.92 40.59 3kk7 s ASP 412 CO 0.02 -0.06 0.09 -0.63 -0.17 0.00 0.00 175.17 174.42 3kk7 s ILE 413 N -1.94 4.88 -0.00 4.11 1.01 -1.26 -4.23 121.20 123.76 3kk7 s ILE 413 Ca 0.35 0.00 0.01 0.00 0.00 0.00 0.00 60.65 61.01 3kk7 s ILE 413 Cb -0.10 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.15 3kk7 s ILE 413 CO 0.29 0.42 -0.02 -0.69 0.00 0.00 0.00 174.94 174.95 3kk7 s VAL 414 N 0.66 0.18 0.10 2.92 1.01 0.62 -4.96 120.40 120.92 3kk7 s VAL 414 Ca 0.04 -0.08 -0.29 0.00 0.00 0.00 0.00 61.98 61.66 3kk7 s VAL 414 Cb -0.13 -0.17 -0.06 0.00 0.00 0.00 0.00 36.38 36.02 3kk7 s VAL 414 CO 0.01 0.06 0.92 -2.16 0.00 0.00 0.00 175.10 173.94 3kk7 s PRO 415 N 0.06 4.66 -0.21 2.72 0.04 -1.26 -0.82 135.00 140.19 3kk7 s PRO 415 Ca -0.00 1.37 0.01 0.00 0.04 0.00 0.00 61.00 62.42 3kk7 s PRO 415 Cb -0.02 -3.37 0.05 0.00 0.04 0.00 0.00 34.50 31.19 3kk7 s PRO 415 CO -0.00 0.23 -0.10 0.08 0.04 0.00 0.00 177.00 177.25 3kk7 s VAL 416 N -0.02 1.65 -0.24 -0.36 1.01 0.49 -1.35 120.40 121.58 3kk7 s VAL 416 Ca 0.45 -1.06 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 3kk7 s VAL 416 Cb -0.23 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.41 3kk7 s VAL 416 CO 0.28 0.13 1.20 -0.22 0.00 0.00 0.00 175.10 176.49 3kk7 s LEU 417 N 1.39 4.04 -0.28 3.92 2.96 -0.41 -1.39 118.68 128.91 3kk7 s LEU 417 Ca -0.02 1.39 -0.21 0.00 -0.22 0.00 0.00 54.13 55.06 3kk7 s LEU 417 Cb -0.17 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 42.97 3kk7 s LEU 417 CO -0.08 -0.85 0.69 0.20 -1.32 0.00 0.00 176.35 174.99 3kk7 s ASN 418 N 1.99 6.60 0.91 3.68 0.02 0.46 -0.45 114.94 128.16 3kk7 s ASN 418 Ca 0.51 0.65 -0.15 0.00 -1.02 0.00 0.00 52.86 52.86 3kk7 s ASN 418 Cb -0.17 -2.36 0.16 0.00 0.02 0.00 0.00 41.25 38.90 3kk7 s ASN 418 CO 0.15 -0.47 1.28 0.42 0.02 0.00 0.00 177.10 178.50 3kk7 s THR 419 N 2.67 2.00 0.43 1.60 -4.23 -0.36 -2.42 115.64 115.33 3kk7 s THR 419 Ca 0.28 -0.00 0.11 0.00 -1.18 0.00 0.00 61.69 60.90 3kk7 s THR 419 Cb -0.15 -3.00 0.29 0.00 1.34 0.00 0.00 72.50 70.98 3kk7 s THR 419 CO 0.10 0.00 2.03 0.03 -0.54 0.00 0.00 174.62 176.24 3kk7 h ARG 420 N -1.45 0.45 0.00 3.99 3.08 -1.89 -1.26 114.38 117.30 3kk7 h ARG 420 Ca -0.45 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.57 3kk7 h ARG 420 Cb 1.27 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.21 3kk7 h ARG 420 CO 0.47 0.30 -0.18 1.04 -1.07 0.00 0.00 179.97 180.53 3kk7 n GLN 421 N -4.48 0.05 -0.87 0.04 3.00 -1.26 -0.91 117.38 112.95 3kk7 n GLN 421 Ca 0.06 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 3kk7 n GLN 421 Cb 0.20 -1.55 0.00 0.00 0.00 0.00 0.00 30.24 28.89 3kk7 n GLN 421 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3kk7 n GLY 422 N 1.46 0.81 3.85 1.08 0.00 -0.48 -4.89 105.19 107.03 3kk7 n GLY 422 Ca 0.06 -0.60 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 3kk7 n GLY 422 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kk7 s ASP 423 N -2.60 6.75 -0.33 1.61 1.01 -1.26 -4.80 116.67 117.05 3kk7 s ASP 423 Ca 0.00 1.31 -0.07 0.00 0.71 0.00 0.00 52.55 54.51 3kk7 s ASP 423 Cb 0.00 -2.39 0.04 0.00 1.01 0.00 0.00 42.92 41.58 3kk7 s ASP 423 CO 0.00 -0.27 0.10 -0.54 0.21 0.00 0.00 175.17 174.68 3kk7 s LYS 424 N -3.18 2.68 -0.74 8.23 1.02 -1.01 -1.22 119.74 125.52 3kk7 s LYS 424 Ca 0.55 -1.14 -0.15 0.00 0.02 0.00 0.00 55.97 55.25 3kk7 s LYS 424 Cb -0.10 -3.46 0.18 0.00 -0.52 0.00 0.00 37.83 33.94 3kk7 s LYS 424 CO 0.20 -0.64 0.70 -0.51 -0.92 0.00 0.00 175.35 174.17 3kk7 s LEU 425 N 1.42 6.48 -0.08 3.17 1.43 0.41 -0.09 118.68 131.42 3kk7 s LEU 425 Ca -0.01 -2.35 -0.30 0.00 -1.03 0.00 0.00 54.13 50.44 3kk7 s LEU 425 Cb -0.19 -2.22 -0.04 0.00 0.03 0.00 0.00 46.19 43.77 3kk7 s LEU 425 CO 0.03 -0.70 1.46 -0.63 0.23 0.00 0.00 176.35 176.74 3kk7 s ILE 426 N 0.78 3.85 -1.02 -0.59 1.01 0.91 -1.29 121.20 124.85 3kk7 s ILE 426 Ca 0.14 1.09 -0.17 0.00 0.00 0.00 0.00 60.65 61.71 3kk7 s ILE 426 Cb -0.16 -3.70 0.15 0.00 0.01 0.00 0.00 42.46 38.75 3kk7 s ILE 426 CO -0.05 -0.07 1.22 -0.36 0.00 0.00 0.00 174.94 175.68 3kk7 s PHE 427 N 3.43 3.26 0.52 3.97 0.40 -0.46 -0.88 117.98 128.24 3kk7 s PHE 427 Ca 0.65 -1.65 -0.09 0.00 -0.60 0.00 0.00 56.93 55.23 3kk7 s PHE 427 Cb -0.29 -4.28 -0.05 0.00 0.51 0.00 0.00 43.02 38.91 3kk7 s PHE 427 CO 0.24 -1.45 0.89 -1.54 0.70 0.00 0.00 175.22 174.06 3kk7 s SER 428 N 3.34 6.33 -0.46 1.36 1.04 -0.78 -4.39 113.70 120.14 3kk7 s SER 428 Ca 0.36 1.21 -0.04 0.00 0.48 0.00 0.00 55.95 57.96 3kk7 s SER 428 Cb -0.04 -2.37 0.12 0.00 0.10 0.00 0.00 66.02 63.83 3kk7 s SER 428 CO -0.06 -0.66 0.28 0.20 0.98 0.00 0.00 173.24 173.98 3kk7 s ASN 429 N -3.86 5.37 0.56 7.02 -0.87 -1.26 -2.45 114.94 119.43 3kk7 s ASN 429 Ca 0.52 -2.14 0.37 0.00 -1.57 0.00 0.00 52.86 50.03 3kk7 s ASN 429 Cb -0.11 -1.88 1.79 0.00 -0.02 0.00 0.00 41.25 41.03 3kk7 s ASN 429 CO 0.45 -0.55 2.10 1.55 -2.57 0.00 0.00 177.10 178.08 3kk7 h PRO 430 N 7.97 0.00 -0.01 -0.60 0.13 -1.96 0.13 132.00 137.66 3kk7 h PRO 430 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 3kk7 h PRO 430 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 3kk7 h PRO 430 CO 0.74 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.26 3kk7 n ASP 431 N -2.93 0.07 0.21 1.44 9.92 -1.26 -3.72 116.55 120.28 3kk7 n ASP 431 Ca -0.01 -1.31 0.06 0.00 -0.53 0.00 0.00 54.79 53.00 3kk7 n ASP 431 Cb 0.17 -0.00 0.47 0.00 -0.64 0.00 0.00 41.12 41.11 3kk7 n ASP 431 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3kk7 h ALA 432 N 3.72 1.31 0.00 2.24 0.00 -1.17 -2.84 119.26 122.53 3kk7 h ALA 432 Ca 0.00 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.54 3kk7 h ALA 432 Cb 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3kk7 h ALA 432 CO 0.00 0.36 -0.51 0.00 0.00 0.00 0.00 179.25 179.10 3kk7 h ALA 433 N 1.71 1.08 -0.53 0.00 0.00 -1.78 -3.03 119.26 116.71 3kk7 h ALA 433 Ca -0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 3kk7 h ALA 433 Cb 0.58 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 3kk7 h ALA 433 CO 0.04 0.64 0.22 0.77 0.00 0.00 0.00 179.25 180.91 3kk7 h SER 434 N 0.00 0.69 -3.94 0.00 0.02 -1.76 -3.45 113.55 105.11 3kk7 h SER 434 Ca -0.01 -0.08 -0.56 0.00 -0.84 0.00 0.00 61.79 60.31 3kk7 h SER 434 Cb 0.94 -0.18 0.15 0.00 0.14 0.00 0.00 62.40 63.46 3kk7 h SER 434 CO 0.07 0.62 0.49 0.00 -1.14 0.00 0.00 176.83 176.87 3kk7 n GLN 435 N -4.34 1.42 -2.43 3.45 6.02 -1.15 -4.92 117.38 115.43 3kk7 n GLN 435 Ca 0.04 0.53 -0.40 0.00 -0.01 0.00 0.00 57.00 57.17 3kk7 n GLN 435 Cb 0.15 -2.48 -0.04 0.00 1.02 0.00 0.00 30.24 28.89 3kk7 n GLN 435 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3kk7 s SER 436 N -1.07 7.08 0.09 1.08 1.04 -1.26 -4.87 113.70 115.79 3kk7 s SER 436 Ca 0.75 2.30 -0.07 0.00 0.48 0.00 0.00 55.95 59.41 3kk7 s SER 436 Cb -0.41 -2.62 0.10 0.00 0.10 0.00 0.00 66.02 63.18 3kk7 s SER 436 CO 0.47 -0.28 0.60 0.47 0.98 0.00 0.00 173.24 175.48 3kk7 n ASP 437 N 0.88 -0.25 0.11 7.02 9.92 -1.26 -0.57 116.55 132.41 3kk7 n ASP 437 Ca 0.00 0.68 0.02 0.00 -0.53 0.00 0.00 54.79 54.96 3kk7 n ASP 437 Cb 0.45 -0.16 0.36 0.00 -0.64 0.00 0.00 41.12 41.14 3kk7 n ASP 437 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 3kk7 h GLU 438 N 0.00 0.24 0.37 -1.24 3.07 -1.99 -0.77 114.58 114.27 3kk7 h GLU 438 Ca 0.14 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 58.92 3kk7 h GLU 438 Cb 0.24 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 3kk7 h GLU 438 CO -0.39 0.41 -0.18 0.93 -1.40 0.00 0.00 179.01 178.38 3kk7 h GLU 439 N 0.22 -0.49 -0.88 2.33 5.08 -1.20 -2.44 114.58 117.21 3kk7 h GLU 439 Ca 0.04 0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.49 3kk7 h GLU 439 Cb 0.44 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.74 3kk7 h GLU 439 CO 0.03 -0.22 0.55 -0.07 -1.00 0.00 0.00 179.01 178.30 3kk7 h LEU 440 N -0.69 0.88 -2.09 1.33 3.38 -1.36 -0.83 115.31 115.94 3kk7 h LEU 440 Ca -0.05 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3kk7 h LEU 440 Cb 0.49 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 3kk7 h LEU 440 CO 0.08 0.58 -0.07 0.50 0.09 0.00 0.00 178.44 179.62 3kk7 h LYS 441 N 1.02 0.00 0.00 1.13 3.64 -1.15 -1.95 116.57 119.26 3kk7 h LYS 441 Ca 0.37 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 3kk7 h LYS 441 Cb 0.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3kk7 h LYS 441 CO -0.16 0.07 0.00 0.00 -2.27 0.00 0.00 179.45 177.09 3kk7 n ALA 442 N -2.36 1.75 0.43 5.00 0.00 -0.32 -1.88 120.51 123.13 3kk7 n ALA 442 Ca -0.02 0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.60 3kk7 n ALA 442 Cb 0.16 -1.40 0.48 0.00 0.00 0.00 0.00 19.45 18.70 3kk7 n ALA 442 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3kk7 n ASN 443 N -2.23 0.69 -0.01 0.00 3.02 -0.73 -2.44 115.26 113.55 3kk7 n ASN 443 Ca 0.03 0.66 0.13 0.00 -0.03 0.00 0.00 54.58 55.36 3kk7 n ASN 443 Cb 0.26 -0.81 0.47 0.00 -0.61 0.00 0.00 39.78 39.09 3kk7 n ASN 443 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3kk7 n SER 444 N -2.24 0.25 -4.67 6.41 7.64 -0.79 -4.51 113.62 115.71 3kk7 n SER 444 Ca 0.03 0.08 -0.42 0.00 1.01 0.00 0.00 58.87 59.56 3kk7 n SER 444 Cb 0.25 -0.15 -0.03 0.00 -1.01 0.00 0.00 64.21 63.27 3kk7 n SER 444 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3kk7 s ILE 445 N -2.94 4.82 0.49 0.44 1.01 -1.02 -4.95 121.20 119.04 3kk7 s ILE 445 Ca 0.15 1.78 0.31 0.00 0.00 0.00 0.00 60.65 62.89 3kk7 s ILE 445 Cb 0.19 -4.20 0.51 0.00 0.01 0.00 0.00 42.46 38.96 3kk7 s ILE 445 CO 0.59 -0.03 1.76 -0.65 0.00 0.00 0.00 174.94 176.61 3kk7 h PRO 446 N 7.35 0.13 -0.16 2.79 0.11 -1.88 -1.79 132.00 138.55 3kk7 h PRO 446 Ca -0.27 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.72 3kk7 h PRO 446 Cb 1.12 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3kk7 h PRO 446 CO 0.87 0.09 -0.34 0.00 -0.21 0.00 0.00 178.00 178.41 3kk7 h ALA 447 N 1.47 0.26 -0.10 -0.75 0.00 -1.92 -1.53 119.26 116.69 3kk7 h ALA 447 Ca 0.62 -0.43 -0.15 0.00 0.00 0.00 0.00 54.91 54.95 3kk7 h ALA 447 Cb 2.15 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.89 3kk7 h ALA 447 CO -0.14 0.32 -0.58 1.15 0.00 0.00 0.00 179.25 179.99 3kk7 h THR 448 N 0.15 1.36 -0.18 0.00 2.02 -1.65 -2.66 112.91 111.96 3kk7 h THR 448 Ca 0.00 -1.91 -0.01 0.00 0.77 0.00 0.00 66.41 65.27 3kk7 h THR 448 Cb 0.94 1.92 -0.01 0.00 -1.74 0.00 0.00 68.15 69.27 3kk7 h THR 448 CO 0.08 0.57 0.08 0.15 0.37 0.00 0.00 175.52 176.77 3kk7 h PHE 449 N 0.25 0.26 -0.41 3.16 3.57 -1.31 -0.64 116.94 121.82 3kk7 h PHE 449 Ca -0.00 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.53 3kk7 h PHE 449 Cb 1.09 -0.08 -0.08 0.00 2.79 0.00 0.00 35.95 39.67 3kk7 h PHE 449 CO 0.03 0.30 -0.56 1.25 -2.23 0.00 0.00 178.31 177.10 3kk7 h LEU 450 N 0.14 -1.87 -0.80 0.59 6.46 -1.24 0.22 115.31 118.82 3kk7 h LEU 450 Ca 0.06 0.25 -0.00 0.00 -0.12 0.00 0.00 57.88 58.06 3kk7 h LEU 450 Cb 0.14 0.77 -0.04 0.00 -0.73 0.00 0.00 40.66 40.80 3kk7 h LEU 450 CO -0.01 -0.40 0.48 0.74 -0.62 0.00 0.00 178.44 178.63 3kk7 h THR 451 N -0.40 1.22 0.00 1.05 2.02 -1.28 -0.86 112.91 114.67 3kk7 h THR 451 Ca 0.07 -0.49 -0.06 0.00 0.77 0.00 0.00 66.41 66.70 3kk7 h THR 451 Cb 0.60 0.11 0.01 0.00 -1.74 0.00 0.00 68.15 67.12 3kk7 h THR 451 CO -0.60 0.23 -0.25 0.11 0.37 0.00 0.00 175.52 175.39 3kk7 h LYS 452 N 1.09 0.17 -0.33 6.66 1.57 -0.89 -1.84 116.57 123.00 3kk7 h LYS 452 Ca 0.29 -0.18 0.01 0.00 -1.87 0.00 0.00 60.65 58.90 3kk7 h LYS 452 Cb -0.04 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 3kk7 h LYS 452 CO -0.05 0.92 0.20 0.66 -0.57 0.00 0.00 179.45 180.61 3kk7 h SER 453 N -0.52 0.33 -0.22 0.86 4.64 -0.51 0.58 113.55 118.70 3kk7 h SER 453 Ca -0.03 -0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.24 3kk7 h SER 453 Cb 1.01 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.01 3kk7 h SER 453 CO 0.05 0.24 0.01 0.78 -0.87 0.00 0.00 176.83 177.04 3kk7 h ASN 454 N 0.41 0.46 -0.19 4.97 2.35 -1.24 0.05 115.58 122.38 3kk7 h ASN 454 Ca 0.13 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.72 3kk7 h ASN 454 Cb -0.02 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.23 3kk7 h ASN 454 CO -0.05 0.52 -0.17 0.00 -1.65 0.00 0.00 177.43 176.08 3kk7 h ALA 455 N 1.54 0.28 -0.34 -0.83 0.00 -0.52 -0.60 119.26 118.79 3kk7 h ALA 455 Ca 0.11 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.69 3kk7 h ALA 455 Cb 0.29 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3kk7 h ALA 455 CO 0.01 0.19 0.21 0.82 0.00 0.00 0.00 179.25 180.47 3kk7 h ILE 456 N 0.12 1.05 -0.22 0.00 2.04 -0.72 -1.21 117.51 118.57 3kk7 h ILE 456 Ca 0.03 -0.15 0.03 0.00 1.00 0.00 0.00 64.86 65.78 3kk7 h ILE 456 Cb 0.71 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 3kk7 h ILE 456 CO 0.04 0.08 0.01 0.50 0.00 0.00 0.00 178.15 178.78 3kk7 h LYS 457 N 0.43 0.08 -0.86 2.37 3.11 -0.96 0.13 116.57 120.87 3kk7 h LYS 457 Ca 0.13 -0.00 0.12 0.00 -2.81 0.00 0.00 60.65 58.08 3kk7 h LYS 457 Cb -0.02 -0.02 -0.08 0.00 -1.00 0.00 0.00 32.23 31.11 3kk7 h LYS 457 CO -0.05 0.05 0.49 -0.44 -2.81 0.00 0.00 179.45 176.69 3kk7 h ASP 458 N 0.08 0.67 0.40 4.20 3.32 -0.67 0.23 116.42 124.64 3kk7 h ASP 458 Ca 0.10 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.19 3kk7 h ASP 458 Cb 0.12 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3kk7 h ASP 458 CO -0.16 0.35 -0.19 -0.33 -1.72 0.00 0.00 179.24 177.18 3kk7 h GLU 459 N 0.76 -0.51 -0.51 3.56 4.39 -0.73 -3.32 114.58 118.23 3kk7 h GLU 459 Ca 0.44 0.03 0.06 0.00 0.34 0.00 0.00 59.36 60.23 3kk7 h GLU 459 Cb 0.48 0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.22 3kk7 h GLU 459 CO -0.29 -0.34 0.34 0.87 -1.16 0.00 0.00 179.01 178.43 3kk7 h LYS 460 N -0.81 0.45 -0.55 2.33 1.79 -0.58 -0.27 116.57 118.94 3kk7 h LYS 460 Ca -0.05 -0.03 0.16 0.00 -2.18 0.00 0.00 60.65 58.55 3kk7 h LYS 460 Cb 0.41 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.93 3kk7 h LYS 460 CO 0.09 0.30 0.54 1.03 -1.08 0.00 0.00 179.45 180.33 3kk7 h SER 461 N 0.47 0.00 0.63 0.86 0.87 -0.65 0.11 113.55 115.83 3kk7 h SER 461 Ca 0.22 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.76 3kk7 h SER 461 Cb 0.27 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.23 3kk7 h SER 461 CO -0.06 0.00 -0.10 0.11 -0.53 0.00 0.00 176.83 176.25 3kk7 h LYS 462 N 0.00 0.00 0.00 2.24 1.57 -1.13 -3.33 116.57 115.92 3kk7 h LYS 462 Ca 0.26 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.98 3kk7 h LYS 462 Cb 1.33 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.63 3kk7 h LYS 462 CO -0.00 0.10 -1.23 0.66 -0.57 0.00 0.00 179.45 178.41 3kk7 n TYR 463 N -3.36 0.00 -5.21 -1.35 4.01 0.20 -4.91 117.16 106.53 3kk7 n TYR 463 Ca -0.01 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.42 3kk7 n TYR 463 Cb 0.28 -0.16 -0.17 0.00 -0.31 0.00 0.00 39.34 38.98 3kk7 n TYR 463 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 3kk7 s TYR 464 N -2.08 2.47 -0.24 -0.72 1.51 -0.18 -4.38 117.35 113.73 3kk7 s TYR 464 Ca -0.02 -0.90 0.16 0.00 -1.01 0.00 0.00 57.07 55.30 3kk7 s TYR 464 Cb 0.01 -1.64 0.54 0.00 -0.11 0.00 0.00 41.96 40.76 3kk7 s TYR 464 CO 0.13 -0.33 1.44 1.04 -1.11 0.00 0.00 175.55 176.72 3kk7 n GLN 465 N 3.30 3.07 -2.46 -0.62 6.02 0.27 -4.31 117.38 122.65 3kk7 n GLN 465 Ca -0.18 -2.82 -0.23 0.00 -0.01 0.00 0.00 57.00 53.75 3kk7 n GLN 465 Cb 0.53 -1.85 0.06 0.00 1.02 0.00 0.00 30.24 30.00 3kk7 n GLN 465 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 3kk7 s LEU 466 N -2.71 3.06 -0.06 1.08 0.05 -1.25 -1.05 118.68 117.79 3kk7 s LEU 466 Ca 0.42 0.10 -0.34 0.00 0.05 0.00 0.00 54.13 54.36 3kk7 s LEU 466 Cb 0.33 -2.81 -0.12 0.00 -2.05 0.00 0.00 46.19 41.54 3kk7 s LEU 466 CO 0.10 -1.44 1.83 1.17 -0.55 0.00 0.00 176.35 177.46 3kk7 n LYS 467 N -2.64 2.11 -4.69 1.48 4.81 -1.26 -4.46 118.16 113.51 3kk7 n LYS 467 Ca 0.09 0.77 -0.33 0.00 -0.87 0.00 0.00 58.31 57.97 3kk7 n LYS 467 Cb 0.60 -2.60 -0.14 0.00 0.02 0.00 0.00 35.03 32.92 3kk7 n LYS 467 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 3kk7 s ILE 468 N 3.60 3.27 0.15 3.15 1.01 -0.80 -1.74 121.20 129.83 3kk7 s ILE 468 Ca 0.91 -0.59 0.02 0.00 0.00 0.00 0.00 60.65 60.99 3kk7 s ILE 468 Cb -0.71 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 3kk7 s ILE 468 CO 0.51 0.52 -0.03 -1.59 0.00 0.00 0.00 174.94 174.35 3kk7 s LYS 469 N 0.29 1.02 0.14 2.79 -2.85 -0.42 -0.93 119.74 119.78 3kk7 s LYS 469 Ca -0.08 -1.47 0.06 0.00 -1.00 0.00 0.00 55.97 53.48 3kk7 s LYS 469 Cb -0.15 -0.26 -0.04 0.00 -2.06 0.00 0.00 37.83 35.31 3kk7 s LYS 469 CO 0.05 -0.08 -0.12 0.00 0.10 0.00 0.00 175.35 175.29 3kk7 s ALA 470 N -3.63 1.54 -0.29 0.59 0.00 -0.40 0.11 121.76 119.67 3kk7 s ALA 470 Ca 0.20 -1.42 0.02 0.00 0.00 0.00 0.00 51.96 50.76 3kk7 s ALA 470 Cb 0.06 -0.03 0.19 0.00 0.00 0.00 0.00 23.12 23.34 3kk7 s ALA 470 CO 0.01 0.02 0.62 0.34 0.00 0.00 0.00 175.76 176.75 3kk7 s ASP 471 N -2.85 -1.47 0.60 0.00 -1.08 -0.60 -1.65 116.67 109.61 3kk7 s ASP 471 Ca 0.14 0.47 0.38 0.00 -0.52 0.00 0.00 52.55 53.02 3kk7 s ASP 471 Cb -0.01 2.05 1.82 0.00 -1.46 0.00 0.00 42.92 45.32 3kk7 s ASP 471 CO 0.03 -0.27 2.15 1.55 0.52 0.00 0.00 175.17 179.14 3kk7 h PRO 472 N 7.98 0.00 -0.06 4.34 0.13 -1.84 -2.65 132.00 139.89 3kk7 h PRO 472 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 3kk7 h PRO 472 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3kk7 h PRO 472 CO 0.18 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.04 3kk7 n ASN 473 N -3.07 2.59 -4.66 1.44 3.02 -1.26 -4.82 115.26 108.50 3kk7 n ASN 473 Ca -0.01 -1.86 -0.39 0.00 -0.03 0.00 0.00 54.58 52.30 3kk7 n ASN 473 Cb 0.20 -0.02 -0.07 0.00 -0.61 0.00 0.00 39.78 39.28 3kk7 n ASN 473 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3kk7 s LYS 474 N -1.95 4.17 0.13 3.52 2.20 -1.00 -5.06 119.74 121.74 3kk7 s LYS 474 Ca 0.32 0.34 0.05 0.00 -0.36 0.00 0.00 55.97 56.31 3kk7 s LYS 474 Cb 0.20 -3.57 -0.04 0.00 -1.51 0.00 0.00 37.83 32.92 3kk7 s LYS 474 CO 0.31 -0.14 0.07 0.95 -0.36 0.00 0.00 175.35 176.18 3kk7 s THR 475 N 1.61 4.28 -0.05 3.43 -4.23 -1.26 -2.06 115.64 117.37 3kk7 s THR 475 Ca 0.22 -1.03 0.00 0.00 -1.18 0.00 0.00 61.69 59.71 3kk7 s THR 475 Cb -0.15 -3.11 0.03 0.00 1.34 0.00 0.00 72.50 70.60 3kk7 s THR 475 CO 0.09 0.01 -0.01 -0.51 -0.54 0.00 0.00 174.62 173.65 3kk7 s ILE 476 N -1.55 0.35 -0.57 2.99 2.07 -0.09 -4.94 121.20 119.46 3kk7 s ILE 476 Ca 0.29 0.03 0.03 0.00 -1.41 0.00 0.00 60.65 59.58 3kk7 s ILE 476 Cb -0.11 -0.44 0.14 0.00 0.13 0.00 0.00 42.46 42.18 3kk7 s ILE 476 CO 0.21 0.20 0.33 0.21 -1.91 0.00 0.00 174.94 173.98 3kk7 s ASN 477 N 1.24 4.56 0.27 4.50 2.47 -1.26 -3.10 114.94 123.62 3kk7 s ASN 477 Ca -0.06 -3.09 0.17 0.00 0.42 0.00 0.00 52.86 50.30 3kk7 s ASN 477 Cb -0.13 -1.68 0.08 0.00 -1.45 0.00 0.00 41.25 38.06 3kk7 s ASN 477 CO -0.02 -0.24 1.34 1.55 -3.72 0.00 0.00 177.10 176.01 3kk7 h PRO 478 N 6.46 0.00 -0.65 0.43 0.13 -1.90 -2.32 132.00 134.14 3kk7 h PRO 478 Ca -0.04 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.03 3kk7 h PRO 478 Cb 0.89 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.99 3kk7 h PRO 478 CO 0.70 0.32 0.16 0.82 -0.23 0.00 0.00 178.00 179.78 3kk7 h ILE 479 N 0.00 1.25 -0.02 -3.56 2.04 -1.92 -3.04 117.51 112.27 3kk7 h ILE 479 Ca -0.03 -0.92 0.00 0.00 1.00 0.00 0.00 64.86 64.91 3kk7 h ILE 479 Cb 1.31 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.96 3kk7 h ILE 479 CO 0.04 0.35 -0.36 -0.38 0.00 0.00 0.00 178.15 177.81 3kk7 n ILE 480 N -4.25 0.00 -0.26 -0.67 5.41 -1.25 -5.23 119.36 113.11 3kk7 n ILE 480 Ca 0.05 -0.32 0.00 0.00 1.00 0.00 0.00 62.75 63.48 3kk7 n ILE 480 Cb 0.25 1.31 0.00 0.00 -0.71 0.00 0.00 39.64 40.49 3kk7 n ILE 480 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3kk7 n GLN 481 N 0.30 0.00 -3.48 0.38 6.02 -0.87 -5.13 117.38 114.60 3kk7 n GLN 481 Ca 0.10 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.71 3kk7 n GLN 481 Cb 0.49 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.67 3kk7 n GLN 481 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 3kk7 s LEU 484 N 0.00 4.12 0.12 1.08 2.34 -1.26 -4.90 118.68 120.18 3kk7 s LEU 484 Ca 0.00 0.34 0.09 0.00 0.06 0.00 0.00 54.13 54.61 3kk7 s LEU 484 Cb 0.00 -2.36 -0.04 0.00 -0.56 0.00 0.00 46.19 43.23 3kk7 s LEU 484 CO 0.00 -0.05 -0.16 -0.94 -1.06 0.00 0.00 176.35 174.13 3kk7 s SER 485 N 1.17 3.98 0.05 1.48 1.04 -1.26 -2.40 113.70 117.76 3kk7 s SER 485 Ca 0.14 -0.54 0.07 0.00 0.48 0.00 0.00 55.95 56.10 3kk7 s SER 485 Cb -0.15 -0.59 -0.03 0.00 0.10 0.00 0.00 66.02 65.35 3kk7 s SER 485 CO 0.07 0.17 -0.20 -0.36 0.98 0.00 0.00 173.24 173.91 3kk7 s PHE 486 N -1.21 1.72 -0.24 5.02 0.40 0.88 -4.95 117.98 119.60 3kk7 s PHE 486 Ca 0.19 -0.38 -0.11 0.00 -0.60 0.00 0.00 56.93 56.03 3kk7 s PHE 486 Cb -0.10 -1.01 -0.05 0.00 0.51 0.00 0.00 43.02 42.36 3kk7 s PHE 486 CO 0.11 0.10 0.19 -0.65 0.70 0.00 0.00 175.22 175.66 3kk7 s GLN 487 N -1.26 4.08 -0.27 0.44 -0.21 -1.26 -0.06 119.66 121.11 3kk7 s GLN 487 Ca 0.06 -0.22 0.03 0.00 0.02 0.00 0.00 55.36 55.25 3kk7 s GLN 487 Cb -0.09 -3.55 0.07 0.00 1.00 0.00 0.00 33.01 30.44 3kk7 s GLN 487 CO 0.02 0.04 -0.07 0.42 -2.12 0.00 0.00 175.29 173.58 3kk7 s ILE 488 N 1.12 2.10 0.54 1.08 1.01 -0.05 -4.97 121.20 122.03 3kk7 s ILE 488 Ca 0.09 -1.73 -0.18 0.00 0.00 0.00 0.00 60.65 58.83 3kk7 s ILE 488 Cb -0.14 -2.30 -0.06 0.00 0.01 0.00 0.00 42.46 39.97 3kk7 s ILE 488 CO 0.05 -0.16 1.06 0.20 0.00 0.00 0.00 174.94 176.09 3kk7 s ASN 489 N 1.10 6.03 -1.50 3.58 0.01 -1.26 -1.86 114.94 121.04 3kk7 s ASN 489 Ca -0.05 1.92 -0.11 0.00 -0.71 0.00 0.00 52.86 53.92 3kk7 s ASN 489 Cb -0.20 -2.55 0.07 0.00 0.41 0.00 0.00 41.25 38.98 3kk7 s ASN 489 CO -0.06 -1.00 0.86 0.59 -1.51 0.00 0.00 177.10 175.98 3kk7 n ASN 490 N -1.44 -3.57 -4.73 -1.22 3.02 -1.03 -4.89 115.26 101.40 3kk7 n ASN 490 Ca 0.09 -0.83 -0.42 0.00 -0.03 0.00 0.00 54.58 53.39 3kk7 n ASN 490 Cb 0.52 -3.71 -0.03 0.00 -0.61 0.00 0.00 39.78 35.95 3kk7 n ASN 490 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3kk7 s VAL 491 N -3.42 3.24 -0.28 2.41 1.01 -1.26 -4.81 120.40 117.30 3kk7 s VAL 491 Ca 0.49 0.97 0.00 0.00 0.00 0.00 0.00 61.98 63.44 3kk7 s VAL 491 Cb -0.25 -3.62 0.14 0.00 0.00 0.00 0.00 36.38 32.65 3kk7 s VAL 491 CO 0.84 0.12 0.36 -0.62 0.00 0.00 0.00 175.10 175.80 3kk7 s ASP 492 N 0.66 0.81 0.65 3.32 -1.08 -1.26 -5.02 116.67 114.75 3kk7 s ASP 492 Ca 0.60 -0.37 0.35 0.00 -0.52 0.00 0.00 52.55 52.61 3kk7 s ASP 492 Cb -0.37 0.88 1.93 0.00 -1.46 0.00 0.00 42.92 43.91 3kk7 s ASP 492 CO 0.35 -0.35 2.12 -0.33 0.52 0.00 0.00 175.17 177.48 3kk7 h GLU 493 N 8.20 0.00 0.00 4.34 3.07 -2.01 -1.95 114.58 126.23 3kk7 h GLU 493 Ca -0.13 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.73 3kk7 h GLU 493 Cb 1.11 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.02 3kk7 h GLU 493 CO 0.29 0.00 -0.01 0.87 -1.40 0.00 0.00 179.01 178.75 3kk7 h LYS 494 N 0.00 0.00 -2.74 2.33 1.57 -2.01 -3.50 116.57 112.22 3kk7 h LYS 494 Ca 0.02 0.00 -0.81 0.00 -1.87 0.00 0.00 60.65 58.00 3kk7 h LYS 494 Cb 0.40 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 32.44 3kk7 h LYS 494 CO -0.00 0.01 0.96 0.41 -0.57 0.00 0.00 179.45 180.27 3kk7 n GLY 495 N 0.95 5.45 3.67 3.86 0.00 -0.74 -5.13 105.19 113.26 3kk7 n GLY 495 Ca 0.03 -2.60 -0.02 0.00 0.00 0.00 0.00 46.02 43.43 3kk7 n GLY 495 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kk7 s TYR 497 N -3.07 -0.12 0.07 1.61 2.02 -0.54 -4.06 117.35 113.26 3kk7 s TYR 497 Ca 0.34 -0.08 -0.08 0.00 -0.37 0.00 0.00 57.07 56.88 3kk7 s TYR 497 Cb 0.10 0.59 -0.00 0.00 -0.40 0.00 0.00 41.96 42.24 3kk7 s TYR 497 CO 0.03 -0.55 0.16 -1.59 -1.57 0.00 0.00 175.55 172.04 3kk7 s LYS 498 N -2.88 0.77 0.06 -0.62 -2.85 -0.69 -0.57 119.74 112.97 3kk7 s LYS 498 Ca 0.12 -0.90 -0.19 0.00 -1.00 0.00 0.00 55.97 54.00 3kk7 s LYS 498 Cb 0.01 0.31 0.04 0.00 -2.06 0.00 0.00 37.83 36.13 3kk7 s LYS 498 CO -0.02 -0.23 0.45 -0.59 0.10 0.00 0.00 175.35 175.07 3kk7 s PHE 499 N -3.51 -0.32 -0.21 1.78 -0.71 -0.58 -0.65 117.98 113.78 3kk7 s PHE 499 Ca 0.02 0.25 -0.08 0.00 -1.04 0.00 0.00 56.93 56.08 3kk7 s PHE 499 Cb 0.04 0.28 -0.04 0.00 -1.21 0.00 0.00 43.02 42.08 3kk7 s PHE 499 CO -0.09 -0.63 0.09 0.21 -1.34 0.00 0.00 175.22 173.46 3kk7 s LYS 500 N -2.76 3.98 -0.08 1.99 2.20 -1.26 -0.88 119.74 122.93 3kk7 s LYS 500 Ca -0.04 -0.33 -0.30 0.00 -0.36 0.00 0.00 55.97 54.95 3kk7 s LYS 500 Cb -0.00 -3.33 -0.04 0.00 -1.51 0.00 0.00 37.83 32.95 3kk7 s LYS 500 CO -0.04 0.17 1.37 1.21 -0.36 0.00 0.00 175.35 177.69 3kk7 s ASN 501 N 0.68 6.88 0.18 1.43 3.84 -0.09 -4.93 114.94 122.93 3kk7 s ASN 501 Ca 0.05 1.92 -0.02 0.00 0.21 0.00 0.00 52.86 55.02 3kk7 s ASN 501 Cb -0.13 -2.55 0.07 0.00 -0.55 0.00 0.00 41.25 38.09 3kk7 s ASN 501 CO 0.01 -0.76 1.45 0.00 -2.79 0.00 0.00 177.10 175.02 3kk7 h ALA 502 N 8.26 0.62 -0.67 1.71 0.00 -1.97 0.29 119.26 127.49 3kk7 h ALA 502 Ca -0.33 -0.58 -0.04 0.00 0.00 0.00 0.00 54.91 53.96 3kk7 h ALA 502 Cb 1.15 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 3kk7 h ALA 502 CO 0.94 0.73 0.26 -0.91 0.00 0.00 0.00 179.25 180.27 3kk7 h ASN 503 N 0.33 0.94 0.00 0.00 2.35 -1.91 -3.34 115.58 113.94 3kk7 h ASN 503 Ca -0.02 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 3kk7 h ASN 503 Cb 1.24 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 39.37 3kk7 h ASN 503 CO 0.12 0.86 -0.81 0.35 -1.65 0.00 0.00 177.43 176.30 3kk7 n THR 504 N -4.39 0.00 -3.23 2.81 -2.24 -1.19 -5.01 114.28 101.03 3kk7 n THR 504 Ca 0.05 -0.25 -0.23 0.00 -2.27 0.00 0.00 64.05 61.35 3kk7 n THR 504 Cb 0.18 0.76 0.05 0.00 -2.10 0.00 0.00 70.33 69.22 3kk7 n THR 504 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3kk7 n ASN 505 N -1.44 -6.21 -4.79 3.42 3.02 0.10 -4.90 115.26 104.46 3kk7 n ASN 505 Ca 0.01 -0.38 -0.36 0.00 -0.03 0.00 0.00 54.58 53.82 3kk7 n ASN 505 Cb 0.20 -4.95 -0.07 0.00 -0.61 0.00 0.00 39.78 34.35 3kk7 n ASN 505 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3kk7 s ILE 506 N -3.23 5.19 -0.01 2.41 1.01 -1.22 -1.22 121.20 124.12 3kk7 s ILE 506 Ca 0.41 0.09 -0.20 0.00 0.00 0.00 0.00 60.65 60.96 3kk7 s ILE 506 Cb -0.18 -3.28 -0.05 0.00 0.01 0.00 0.00 42.46 38.96 3kk7 s ILE 506 CO 0.51 0.57 0.56 0.26 0.00 0.00 0.00 174.94 176.84 3kk7 s TRP 507 N -0.59 3.68 -0.23 3.97 0.52 0.38 -0.91 118.94 125.76 3kk7 s TRP 507 Ca 0.12 1.15 0.02 0.00 0.02 0.00 0.00 56.10 57.41 3kk7 s TRP 507 Cb -0.12 -2.56 0.05 0.00 -1.15 0.00 0.00 33.47 29.69 3kk7 s TRP 507 CO 0.02 0.38 -0.12 0.71 0.02 0.00 0.00 176.95 177.96 3kk7 s TYR 508 N -0.25 2.93 -0.29 -1.98 2.02 -0.06 -1.66 117.35 118.06 3kk7 s TYR 508 Ca 0.30 -2.01 -0.10 0.00 -0.37 0.00 0.00 57.07 54.88 3kk7 s TYR 508 Cb -0.18 -1.83 -0.03 0.00 -0.40 0.00 0.00 41.96 39.51 3kk7 s TYR 508 CO 0.16 -0.83 0.16 0.42 -1.57 0.00 0.00 175.55 173.90 3kk7 s ILE 509 N 1.22 4.97 0.03 2.71 1.01 -0.12 -1.53 121.20 129.49 3kk7 s ILE 509 Ca -0.05 -0.05 0.04 0.00 0.00 0.00 0.00 60.65 60.59 3kk7 s ILE 509 Cb -0.18 -3.41 -0.02 0.00 0.01 0.00 0.00 42.46 38.86 3kk7 s ILE 509 CO -0.07 0.21 -0.11 -0.72 0.00 0.00 0.00 174.94 174.24 3kk7 s TYR 510 N 1.70 0.98 -0.43 3.97 1.13 0.26 -0.35 117.35 124.61 3kk7 s TYR 510 Ca 0.06 -0.34 -0.09 0.00 -1.41 0.00 0.00 57.07 55.29 3kk7 s TYR 510 Cb -0.16 -0.59 0.09 0.00 -1.10 0.00 0.00 41.96 40.20 3kk7 s TYR 510 CO 0.09 0.00 0.28 1.21 -2.51 0.00 0.00 175.55 174.62 3kk7 s ASN 511 N -1.07 5.65 0.00 -0.18 3.84 0.16 -1.47 114.94 121.87 3kk7 s ASN 511 Ca -0.01 -1.61 0.19 0.00 0.21 0.00 0.00 52.86 51.64 3kk7 s ASN 511 Cb -0.07 -1.99 1.12 0.00 -0.55 0.00 0.00 41.25 39.75 3kk7 s ASN 511 CO 0.01 -0.58 1.72 -0.81 -2.79 0.00 0.00 177.10 174.65 3kk7 n PRO 512 N 4.91 1.00 -0.07 0.43 -0.04 -1.26 -2.81 135.00 137.16 3kk7 n PRO 512 Ca -0.09 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.15 3kk7 n PRO 512 Cb 0.42 -1.29 -0.13 0.00 -0.04 0.00 0.00 33.50 32.46 3kk7 n PRO 512 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3kk7 n THR 513 N -0.79 1.62 0.00 0.52 -1.04 -1.26 -5.08 114.28 108.25 3kk7 n THR 513 Ca 0.14 -0.53 0.00 0.00 -2.04 0.00 0.00 64.05 61.62 3kk7 n THR 513 Cb 0.06 -1.66 0.00 0.00 -1.82 0.00 0.00 70.33 66.91 3kk7 n THR 513 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 3kk7 n SER 514 N -3.58 0.00 0.00 8.00 7.64 -1.12 -5.18 113.62 119.37 3kk7 n SER 514 Ca -0.40 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.49 3kk7 n SER 514 Cb 0.97 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.96 3kk7 n SER 514 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kk7 n TYR 516 N -1.91 0.00 -3.66 1.43 0.18 -1.23 -4.94 117.16 107.03 3kk7 n TYR 516 Ca 0.00 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.69 3kk7 n TYR 516 Cb 0.00 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 38.87 3kk7 n TYR 516 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3kk7 s PHE 518 N 1.45 3.32 0.20 0.00 0.08 0.52 -0.19 117.98 123.37 3kk7 s PHE 518 Ca -0.09 0.19 0.08 0.00 0.12 0.00 0.00 56.93 57.23 3kk7 s PHE 518 Cb -0.06 -2.15 -0.04 0.00 -0.57 0.00 0.00 43.02 40.19 3kk7 s PHE 518 CO -0.16 0.17 -0.03 0.00 -0.10 0.00 0.00 175.22 175.11 3kk7 s ALA 519 N 0.54 3.11 -0.24 5.36 0.00 0.20 -0.95 121.76 129.78 3kk7 s ALA 519 Ca 0.06 -1.48 -0.26 0.00 0.00 0.00 0.00 51.96 50.28 3kk7 s ALA 519 Cb -0.12 -0.85 0.11 0.00 0.00 0.00 0.00 23.12 22.25 3kk7 s ALA 519 CO 0.00 0.41 0.94 1.52 0.00 0.00 0.00 175.76 178.64 3kk7 s TYR 520 N -1.89 -0.53 0.57 0.00 1.13 -0.66 -1.03 117.35 114.94 3kk7 s TYR 520 Ca 0.28 1.21 -0.21 0.00 -1.41 0.00 0.00 57.07 56.94 3kk7 s TYR 520 Cb -0.08 0.36 -0.04 0.00 -1.10 0.00 0.00 41.96 41.10 3kk7 s TYR 520 CO 0.18 -0.31 1.33 -0.47 -2.51 0.00 0.00 175.55 173.77 3kk7 s TYR 521 N -0.09 2.24 -1.32 -3.49 5.04 -1.26 -0.47 117.35 118.00 3kk7 s TYR 521 Ca 0.01 1.41 -0.17 0.00 -2.44 0.00 0.00 57.07 55.88 3kk7 s TYR 521 Cb -0.04 -3.75 0.05 0.00 0.35 0.00 0.00 41.96 38.57 3kk7 s TYR 521 CO -0.02 -2.85 1.88 -3.47 -1.34 0.00 0.00 175.55 169.75 3kk7 n ASP 522 N -1.29 4.51 -3.64 4.32 2.03 -0.36 -4.79 116.55 117.33 3kk7 n ASP 522 Ca 0.12 -2.88 -0.20 0.00 0.52 0.00 0.00 54.79 52.35 3kk7 n ASP 522 Cb 0.46 -1.71 -0.16 0.00 -0.72 0.00 0.00 41.12 38.99 3kk7 n ASP 522 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3kk7 s ASP 523 N 4.11 1.22 0.59 1.67 -1.08 -1.26 -5.03 116.67 116.88 3kk7 s ASP 523 Ca 0.53 0.03 0.29 0.00 -0.52 0.00 0.00 52.55 52.88 3kk7 s ASP 523 Cb 0.07 0.07 1.40 0.00 -1.46 0.00 0.00 42.92 42.99 3kk7 s ASP 523 CO 0.04 -0.27 1.80 0.44 0.52 0.00 0.00 175.17 177.69 3kk7 h ASP 524 N 8.39 0.00 -0.62 -0.34 3.32 -2.02 -1.12 116.42 124.03 3kk7 h ASP 524 Ca -0.13 0.00 0.16 0.00 0.02 0.00 0.00 57.03 57.07 3kk7 h ASP 524 Cb 1.13 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.65 3kk7 h ASP 524 CO 0.19 0.00 0.43 0.10 -1.72 0.00 0.00 179.24 178.24 3kk7 h TYR 525 N 0.00 0.13 0.45 4.55 -0.00 -1.96 -1.12 116.97 119.02 3kk7 h TYR 525 Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.98 3kk7 h TYR 525 Cb 1.49 -0.04 0.00 0.00 0.00 0.00 0.00 36.73 38.19 3kk7 h TYR 525 CO 0.00 0.05 -0.21 0.82 -0.00 0.00 0.00 178.16 178.82 3kk7 h ILE 526 N 0.11 0.00 -0.72 -0.90 2.04 -1.53 -1.20 117.51 115.31 3kk7 h ILE 526 Ca 0.30 -0.49 0.19 0.00 1.00 0.00 0.00 64.86 65.86 3kk7 h ILE 526 Cb 1.01 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 3kk7 h ILE 526 CO -0.03 0.00 0.50 1.55 0.00 0.00 0.00 178.15 180.17 3kk7 h PRO 527 N -1.09 0.13 -0.24 2.37 0.13 -1.68 -0.50 132.00 131.13 3kk7 h PRO 527 Ca -0.06 -0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 64.96 3kk7 h PRO 527 Cb 0.46 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.55 3kk7 h PRO 527 CO 0.10 0.09 -0.28 -0.44 -0.23 0.00 0.00 178.00 177.24 3kk7 h ASP 528 N 0.14 0.48 -0.63 1.44 3.32 -1.15 0.29 116.42 120.31 3kk7 h ASP 528 Ca 0.35 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3kk7 h ASP 528 Cb 1.19 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.57 3kk7 h ASP 528 CO -0.05 0.75 0.41 0.00 -1.72 0.00 0.00 179.24 178.63 3kk7 h ALA 529 N 1.29 1.53 -0.01 3.45 0.00 0.20 -1.70 119.26 124.01 3kk7 h ALA 529 Ca 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3kk7 h ALA 529 Cb 0.70 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3kk7 h ALA 529 CO 0.05 0.43 -0.13 0.66 0.00 0.00 0.00 179.25 180.26 3kk7 n TYR 530 N -4.43 0.00 -3.63 0.00 4.02 -0.87 -4.51 117.16 107.74 3kk7 n TYR 530 Ca 0.06 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.74 3kk7 n TYR 530 Cb 0.05 -0.07 0.05 0.00 -0.02 0.00 0.00 39.34 39.35 3kk7 n TYR 530 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3kk7 n GLY 531 N 1.26 -0.34 0.03 2.72 0.00 -0.03 -3.89 105.19 104.94 3kk7 n GLY 531 Ca 0.16 0.13 0.01 0.00 0.00 0.00 0.00 46.02 46.31 3kk7 n GLY 531 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3kk7 n ILE 532 N -4.31 0.67 -0.15 -0.61 -5.35 -0.48 -0.57 119.36 108.56 3kk7 n ILE 532 Ca -0.25 -0.70 -0.08 0.00 -0.27 0.00 0.00 62.75 61.45 3kk7 n ILE 532 Cb 0.66 0.62 0.01 0.00 -1.74 0.00 0.00 39.64 39.18 3kk7 n ILE 532 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 3kk7 h LEU 533 N 0.00 0.57 0.55 7.28 5.85 -1.88 -0.33 115.31 127.35 3kk7 h LEU 533 Ca 0.00 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 3kk7 h LEU 533 Cb 0.75 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 3kk7 h LEU 533 CO 0.00 0.49 -0.48 0.44 -0.34 0.00 0.00 178.44 178.54 3kk7 h ASP 534 N 0.60 -1.30 -0.64 1.25 3.32 -1.91 -1.63 116.42 116.11 3kk7 h ASP 534 Ca 0.16 0.10 0.13 0.00 0.02 0.00 0.00 57.03 57.44 3kk7 h ASP 534 Cb 0.04 0.42 -0.12 0.00 0.22 0.00 0.00 39.33 39.88 3kk7 h ASP 534 CO -0.03 -0.66 -0.17 -0.25 -1.72 0.00 0.00 179.24 176.42 3kk7 h TRP 535 N -1.01 -0.36 -0.44 4.55 7.01 -1.73 -1.35 115.95 122.63 3kk7 h TRP 535 Ca -0.07 0.06 -0.06 0.00 2.11 0.00 0.00 58.89 60.92 3kk7 h TRP 535 Cb 0.86 0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 28.16 3kk7 h TRP 535 CO -0.21 -0.28 0.01 0.28 -2.79 0.00 0.00 178.44 175.45 3kk7 h VAL 536 N -0.01 1.23 -0.41 2.65 2.07 -0.89 -2.21 116.25 118.68 3kk7 h VAL 536 Ca 0.30 -0.92 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 3kk7 h VAL 536 Cb 0.47 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 3kk7 h VAL 536 CO -0.66 0.32 0.13 0.78 0.02 0.00 0.00 177.57 178.16 3kk7 h ASN 537 N 0.66 0.54 1.01 0.57 2.35 -0.26 -2.18 115.58 118.26 3kk7 h ASN 537 Ca 0.13 -0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.76 3kk7 h ASN 537 Cb 0.40 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 3kk7 h ASN 537 CO 0.01 0.52 -0.26 1.23 -1.65 0.00 0.00 177.43 177.28 3kk7 h GLY 538 N 0.77 0.00 -4.85 2.83 0.00 -1.01 -3.45 103.07 97.36 3kk7 h GLY 538 Ca 0.14 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.94 3kk7 h GLY 538 CO -0.01 0.00 1.03 1.39 0.00 0.00 0.00 176.54 178.95 3kk7 n ILE 539 N -3.38 0.15 -2.38 2.60 5.41 -0.82 -4.95 119.36 115.99 3kk7 n ILE 539 Ca 0.00 -0.03 -0.40 0.00 1.00 0.00 0.00 62.75 63.33 3kk7 n ILE 539 Cb 0.47 -1.99 -0.03 0.00 -0.71 0.00 0.00 39.64 37.37 3kk7 n ILE 539 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3kk7 s PRO 540 N 1.77 4.43 -0.12 0.38 0.04 -1.26 -4.76 135.00 135.48 3kk7 s PRO 540 Ca 0.78 1.86 -0.29 0.00 0.04 0.00 0.00 61.00 63.39 3kk7 s PRO 540 Cb -0.52 -3.01 -0.02 0.00 0.04 0.00 0.00 34.50 30.99 3kk7 s PRO 540 CO 0.35 0.00 1.28 0.42 0.04 0.00 0.00 177.00 179.09 3kk7 s ILE 541 N -1.25 4.20 -0.18 0.56 1.01 -1.26 -1.70 121.20 122.58 3kk7 s ILE 541 Ca 0.49 1.48 -0.04 0.00 0.00 0.00 0.00 60.65 62.58 3kk7 s ILE 541 Cb -0.32 -3.95 0.09 0.00 0.01 0.00 0.00 42.46 38.28 3kk7 s ILE 541 CO 0.42 -0.09 0.27 -0.75 0.00 0.00 0.00 174.94 174.78 3kk7 s LYS 542 N 3.16 0.20 0.43 2.79 2.20 0.17 -4.88 119.74 123.81 3kk7 s LYS 542 Ca 0.57 0.47 -0.24 0.00 -0.36 0.00 0.00 55.97 56.41 3kk7 s LYS 542 Cb -0.24 -0.63 -0.08 0.00 -1.51 0.00 0.00 37.83 35.38 3kk7 s LYS 542 CO 0.18 -0.51 1.18 0.00 -0.36 0.00 0.00 175.35 175.84 3kk7 s ALA 543 N 2.40 3.08 0.05 3.13 0.00 -1.26 -4.36 121.76 124.79 3kk7 s ALA 543 Ca 0.06 0.98 0.01 0.00 0.00 0.00 0.00 51.96 53.01 3kk7 s ALA 543 Cb -0.14 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.56 3kk7 s ALA 543 CO -0.11 -0.62 -0.05 0.08 0.00 0.00 0.00 175.76 175.05 3kk7 s VAL 544 N -1.46 0.39 0.00 0.00 1.01 -1.26 -5.09 120.40 114.00 3kk7 s VAL 544 Ca 0.60 -1.29 0.00 0.00 0.00 0.00 0.00 61.98 61.29 3kk7 s VAL 544 Cb -0.30 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.24 3kk7 s VAL 544 CO 0.38 -0.60 0.00 0.35 0.00 0.00 0.00 175.10 175.23 3kk7 n THR 545 N 1.03 0.00 0.00 3.92 -2.24 -1.26 -4.89 114.28 110.85 3kk7 n THR 545 Ca -0.20 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 3kk7 n THR 545 Cb 0.57 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 3kk7 n THR 545 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3kk7 n THR 547 N 0.00 0.00 -0.18 4.28 -2.24 -1.26 -1.55 114.28 113.33 3kk7 n THR 547 Ca 0.00 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.71 3kk7 n THR 547 Cb 0.00 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.25 3kk7 n THR 547 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3kk7 h THR 548 N 0.00 1.15 0.50 4.28 2.02 -1.98 0.02 112.91 118.89 3kk7 h THR 548 Ca 0.00 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 3kk7 h THR 548 Cb 0.00 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 3kk7 h THR 548 CO 0.00 0.15 -0.33 0.25 0.37 0.00 0.00 175.52 175.96 3kk7 h LEU 549 N 0.71 -0.85 -0.23 2.58 5.85 -1.62 -1.42 115.31 120.33 3kk7 h LEU 549 Ca 0.19 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.97 3kk7 h LEU 549 Cb -0.05 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.24 3kk7 h LEU 549 CO -0.04 -0.51 0.00 0.10 -0.34 0.00 0.00 178.44 177.65 3kk7 h TYR 550 N -0.80 0.00 0.00 1.25 -0.00 -1.82 0.22 116.97 115.82 3kk7 h TYR 550 Ca -0.05 0.00 -0.19 0.00 0.00 0.00 0.00 58.73 58.49 3kk7 h TYR 550 Cb 0.66 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.37 3kk7 h TYR 550 CO -0.12 0.00 -1.06 1.96 -0.00 0.00 0.00 178.16 178.94 3kk7 h GLN 551 N 0.00 0.00 0.00 0.10 4.20 -0.83 -3.40 115.11 115.18 3kk7 h GLN 551 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3kk7 h GLN 551 Cb 0.75 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.53 3kk7 h GLN 551 CO 0.00 0.66 0.00 0.54 -0.67 0.00 0.00 178.83 179.36 3kk7 n ARG 552 N -3.19 5.67 -4.41 1.46 1.74 -0.55 -5.05 116.66 112.33 3kk7 n ARG 552 Ca -0.04 -0.05 -0.25 0.00 -0.77 0.00 0.00 57.85 56.74 3kk7 n ARG 552 Cb 0.89 -0.52 -0.10 0.00 -1.02 0.00 0.00 32.46 31.71 3kk7 n ARG 552 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3kk7 s TYR 553 N -0.82 2.40 -0.18 -1.55 1.51 0.75 -4.89 117.35 114.56 3kk7 s TYR 553 Ca 0.00 -0.31 -0.15 0.00 -1.01 0.00 0.00 57.07 55.60 3kk7 s TYR 553 Cb 0.00 -1.10 -0.04 0.00 -0.11 0.00 0.00 41.96 40.71 3kk7 s TYR 553 CO 0.00 0.62 0.35 0.15 -1.11 0.00 0.00 175.55 175.57 3kk7 s LYS 554 N -3.24 4.23 -0.17 -0.62 -0.14 -1.26 -4.70 119.74 113.84 3kk7 s LYS 554 Ca 0.27 0.16 -0.02 0.00 -1.36 0.00 0.00 55.97 55.02 3kk7 s LYS 554 Cb -0.06 -3.48 -0.01 0.00 -1.68 0.00 0.00 37.83 32.59 3kk7 s LYS 554 CO 0.14 0.10 -0.08 0.42 -0.76 0.00 0.00 175.35 175.18 3kk7 s ILE 555 N 0.87 3.34 -0.12 2.17 1.01 -1.26 -1.00 121.20 126.20 3kk7 s ILE 555 Ca 0.18 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.32 3kk7 s ILE 555 Cb -0.14 -2.46 0.01 0.00 0.01 0.00 0.00 42.46 39.88 3kk7 s ILE 555 CO 0.06 0.48 -0.21 -0.31 0.00 0.00 0.00 174.94 174.97 3kk7 s TYR 556 N 0.76 2.46 -0.08 3.97 2.02 0.74 -0.37 117.35 126.85 3kk7 s TYR 556 Ca -0.03 -1.16 -0.26 0.00 -0.37 0.00 0.00 57.07 55.24 3kk7 s TYR 556 Cb -0.15 -1.69 -0.03 0.00 -0.40 0.00 0.00 41.96 39.70 3kk7 s TYR 556 CO 0.02 -0.53 0.84 0.20 -1.57 0.00 0.00 175.55 174.51 3kk7 s GLY 557 N 0.73 2.51 0.00 0.71 0.00 -1.26 0.59 107.32 110.59 3kk7 s GLY 557 Ca -0.10 0.23 0.30 0.00 0.00 0.00 0.00 44.72 45.15 3kk7 s GLY 557 CO 0.01 1.54 1.93 1.04 0.00 0.00 0.00 173.10 177.62