#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k4b s TYR 47 N 0.00 2.45 0.02 5.64 1.51 -0.62 -5.02 117.35 121.33 3k4b s TYR 47 Ca 0.00 -0.43 -0.19 0.00 -1.01 0.00 0.00 57.07 55.44 3k4b s TYR 47 Cb 0.00 -1.33 -0.21 0.00 -0.11 0.00 0.00 41.96 40.32 3k4b s TYR 47 CO 0.00 0.58 1.17 -0.44 -1.11 0.00 0.00 175.55 175.75 3k4b h ASP 48 N 1.99 0.54 -4.14 2.29 5.19 -1.54 -2.86 116.42 117.90 3k4b h ASP 48 Ca -0.42 -0.69 -0.32 0.00 -0.62 0.00 0.00 57.03 54.98 3k4b h ASP 48 Cb 1.25 -0.16 -0.27 0.00 0.18 0.00 0.00 39.33 40.33 3k4b h ASP 48 CO 0.67 1.16 -0.75 -0.69 -3.12 0.00 0.00 179.24 176.50 3k4b s VAL 49 N -3.47 0.48 -0.02 -1.35 1.01 -0.87 -1.10 120.40 115.08 3k4b s VAL 49 Ca -0.13 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.43 3k4b s VAL 49 Cb 0.04 -0.45 -0.01 0.00 0.00 0.00 0.00 36.38 35.96 3k4b s VAL 49 CO 0.82 -0.01 -0.18 0.68 0.00 0.00 0.00 175.10 176.41 3k4b s VAL 50 N -0.46 1.41 -0.12 2.92 -7.23 0.18 -1.39 120.40 115.71 3k4b s VAL 50 Ca -0.01 -0.74 0.03 0.00 -1.81 0.00 0.00 61.98 59.45 3k4b s VAL 50 Cb -0.04 -1.18 0.00 0.00 0.56 0.00 0.00 36.38 35.72 3k4b s VAL 50 CO -0.00 0.40 -0.23 -0.63 -0.31 0.00 0.00 175.10 174.33 3k4b s ILE 51 N -0.29 2.05 -0.34 -0.62 1.01 0.39 -0.58 121.20 122.82 3k4b s ILE 51 Ca 0.04 -0.99 -0.13 0.00 0.00 0.00 0.00 60.65 59.56 3k4b s ILE 51 Cb -0.08 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 3k4b s ILE 51 CO 0.00 0.55 0.26 -0.69 0.00 0.00 0.00 174.94 175.06 3k4b s VAL 52 N 0.57 5.27 0.00 2.92 1.01 -0.26 -1.28 120.40 128.63 3k4b s VAL 52 Ca -0.13 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.65 3k4b s VAL 52 Cb -0.17 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.47 3k4b s VAL 52 CO 0.04 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.71 3k4b n GLY 53 N 5.09 1.51 1.21 4.51 0.00 -0.01 -0.45 105.19 117.05 3k4b n GLY 53 Ca -0.12 -1.45 -0.06 0.00 0.00 0.00 0.00 46.02 44.39 3k4b n GLY 53 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k4b n SER 54 N -0.07 2.64 -3.86 1.61 3.41 -1.26 -4.43 113.62 111.66 3k4b n SER 54 Ca 0.00 -3.81 -0.30 0.00 -0.26 0.00 0.00 58.87 54.50 3k4b n SER 54 Cb 0.00 -0.63 0.22 0.00 -0.26 0.00 0.00 64.21 63.55 3k4b n SER 54 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3k4b s GLY 55 N -2.62 1.70 0.58 5.00 0.00 -1.26 -1.92 107.32 108.79 3k4b s GLY 55 Ca 0.45 -1.17 0.35 0.00 0.00 0.00 0.00 44.72 44.35 3k4b s GLY 55 CO -0.01 -0.30 2.14 -0.56 0.00 0.00 0.00 173.10 174.37 3k4b h PRO 56 N -2.18 0.00 -0.00 2.90 0.13 -1.91 0.38 132.00 131.32 3k4b h PRO 56 Ca -0.44 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.63 3k4b h PRO 56 Cb 1.25 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.39 3k4b h PRO 56 CO 0.32 0.05 -0.26 0.82 -0.23 0.00 0.00 178.00 178.70 3k4b h ILE 57 N 0.00 1.55 -0.72 -3.56 1.08 -1.92 -0.76 117.51 113.18 3k4b h ILE 57 Ca -0.00 -1.95 0.14 0.00 -0.39 0.00 0.00 64.86 62.66 3k4b h ILE 57 Cb 0.28 2.77 -0.10 0.00 -3.07 0.00 0.00 36.82 36.70 3k4b h ILE 57 CO 0.01 0.54 0.24 1.23 -0.69 0.00 0.00 178.15 179.47 3k4b h GLY 58 N -0.50 1.05 2.00 5.37 0.00 -1.74 -1.36 103.07 107.90 3k4b h GLY 58 Ca -0.03 -0.10 -0.04 0.00 0.00 0.00 0.00 47.33 47.17 3k4b h GLY 58 CO 0.05 -0.13 -0.17 0.00 0.00 0.00 0.00 176.54 176.29 3k4b h THR 60 N 0.00 1.25 -0.37 0.00 2.02 -0.03 0.55 112.91 116.33 3k4b h THR 60 Ca -0.00 -0.77 0.03 0.00 0.77 0.00 0.00 66.41 66.44 3k4b h THR 60 Cb 0.56 1.60 -0.03 0.00 -1.74 0.00 0.00 68.15 68.54 3k4b h THR 60 CO 0.02 0.22 0.18 1.88 0.37 0.00 0.00 175.52 178.19 3k4b h TYR 61 N -0.13 0.33 0.44 3.16 0.05 -0.92 -1.28 116.97 118.62 3k4b h TYR 61 Ca 0.02 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.81 3k4b h TYR 61 Cb 0.34 -0.10 -0.02 0.00 1.01 0.00 0.00 36.73 37.96 3k4b h TYR 61 CO 0.03 0.17 -0.41 0.00 -1.05 0.00 0.00 178.16 176.91 3k4b h ALA 62 N 1.20 -0.91 -0.66 3.88 0.00 -0.77 -1.29 119.26 120.71 3k4b h ALA 62 Ca 0.16 -0.15 0.14 0.00 0.00 0.00 0.00 54.91 55.06 3k4b h ALA 62 Cb 0.07 0.58 -0.12 0.00 0.00 0.00 0.00 17.79 18.32 3k4b h ALA 62 CO -0.12 -1.05 -0.05 -0.09 0.00 0.00 0.00 179.25 177.94 3k4b h ARG 63 N -0.85 0.07 -0.35 0.00 2.43 -0.81 0.44 114.38 115.30 3k4b h ARG 63 Ca -0.04 -0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.01 3k4b h ARG 63 Cb 0.75 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 3k4b h ARG 63 CO -0.05 0.05 -0.24 0.93 -1.51 0.00 0.00 179.97 179.14 3k4b h GLU 64 N 0.07 0.70 0.04 0.20 4.39 -1.13 -2.80 114.58 116.05 3k4b h GLU 64 Ca 0.34 -0.29 -0.37 0.00 0.34 0.00 0.00 59.36 59.39 3k4b h GLU 64 Cb 0.55 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.12 3k4b h GLU 64 CO -0.61 0.88 -2.21 1.28 -1.16 0.00 0.00 179.01 177.19 3k4b n LEU 65 N -4.11 2.10 0.10 1.33 4.77 -0.50 -1.40 117.00 119.30 3k4b n LEU 65 Ca -0.00 0.07 0.02 0.00 -0.03 0.00 0.00 56.01 56.06 3k4b n LEU 65 Cb 0.44 -0.60 0.37 0.00 -2.33 0.00 0.00 43.42 41.29 3k4b n LEU 65 CO 0.44 0.77 0.88 0.58 -1.33 0.00 0.00 177.39 178.73 3k4b h VAL 66 N 0.02 1.19 0.02 4.08 2.07 -0.28 -0.95 116.25 122.40 3k4b h VAL 66 Ca -0.49 -0.83 -0.21 0.00 0.82 0.00 0.00 66.70 65.99 3k4b h VAL 66 Cb 2.02 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.98 3k4b h VAL 66 CO 0.01 0.26 -0.95 1.23 0.02 0.00 0.00 177.57 178.14 3k4b h GLY 67 N 0.79 0.14 1.30 2.17 0.00 -1.52 -2.71 103.07 103.24 3k4b h GLY 67 Ca 0.05 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.09 3k4b h GLY 67 CO 0.02 0.26 0.00 0.00 0.00 0.00 0.00 176.54 176.82 3k4b n ALA 68 N -2.43 2.28 -0.35 3.60 0.00 -0.49 -4.91 120.51 118.21 3k4b n ALA 68 Ca -0.03 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.28 3k4b n ALA 68 Cb 0.86 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.93 3k4b n ALA 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k4b n GLY 69 N 0.59 0.80 3.79 0.00 0.00 -1.02 -4.92 105.19 104.43 3k4b n GLY 69 Ca 0.14 -0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 3k4b n GLY 69 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k4b s TYR 70 N -2.00 3.15 -0.58 1.61 1.51 -0.39 -4.68 117.35 115.98 3k4b s TYR 70 Ca 0.00 1.61 -0.27 0.00 -1.01 0.00 0.00 57.07 57.40 3k4b s TYR 70 Cb 0.00 -3.11 0.00 0.00 -0.11 0.00 0.00 41.96 38.74 3k4b s TYR 70 CO 0.00 -0.73 1.59 0.21 -1.11 0.00 0.00 175.55 175.52 3k4b s LYS 71 N -2.79 3.06 -0.15 -0.62 2.20 -1.26 -4.33 119.74 115.84 3k4b s LYS 71 Ca 0.62 0.52 -0.05 0.00 -0.36 0.00 0.00 55.97 56.70 3k4b s LYS 71 Cb -0.20 -4.23 -0.04 0.00 -1.51 0.00 0.00 37.83 31.86 3k4b s LYS 71 CO 0.25 -2.23 0.03 0.08 -0.36 0.00 0.00 175.35 173.11 3k4b s VAL 72 N 7.15 4.51 0.02 4.02 1.01 0.04 -1.36 120.40 135.79 3k4b s VAL 72 Ca 0.58 -0.15 0.06 0.00 0.00 0.00 0.00 61.98 62.48 3k4b s VAL 72 Cb -0.12 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.24 3k4b s VAL 72 CO 0.23 0.51 -0.18 0.00 0.00 0.00 0.00 175.10 175.67 3k4b s ALA 73 N -0.03 2.59 -0.02 5.51 0.00 -0.48 -1.23 121.76 128.09 3k4b s ALA 73 Ca 0.05 -1.14 0.03 0.00 0.00 0.00 0.00 51.96 50.90 3k4b s ALA 73 Cb -0.12 -0.78 -0.00 0.00 0.00 0.00 0.00 23.12 22.21 3k4b s ALA 73 CO 0.02 0.57 -0.11 1.41 0.00 0.00 0.00 175.76 177.65 3k4b s MET 74 N -1.23 1.05 0.04 0.00 1.75 0.01 -0.46 119.30 120.45 3k4b s MET 74 Ca 0.14 -0.37 0.09 0.00 -1.25 0.00 0.00 55.69 54.29 3k4b s MET 74 Cb -0.10 -0.98 -0.03 0.00 2.84 0.00 0.00 34.83 36.56 3k4b s MET 74 CO 0.04 0.17 -0.25 -0.06 -0.65 0.00 0.00 175.02 174.27 3k4b s PHE 75 N 0.04 2.37 0.02 4.11 0.08 -0.40 0.17 117.98 124.37 3k4b s PHE 75 Ca -0.01 -0.38 0.03 0.00 0.12 0.00 0.00 56.93 56.68 3k4b s PHE 75 Cb -0.08 -1.41 -0.01 0.00 -0.57 0.00 0.00 43.02 40.95 3k4b s PHE 75 CO 0.00 0.14 -0.09 0.34 -0.10 0.00 0.00 175.22 175.52 3k4b s ASP 76 N -1.25 1.02 0.44 1.36 -1.08 -0.09 -0.83 116.67 116.24 3k4b s ASP 76 Ca 0.12 -0.32 0.26 0.00 -0.52 0.00 0.00 52.55 52.09 3k4b s ASP 76 Cb -0.10 -0.06 0.68 0.00 -1.46 0.00 0.00 42.92 41.98 3k4b s ASP 76 CO 0.02 -0.01 1.73 -0.29 0.52 0.00 0.00 175.17 177.15 3k4b h ILE 77 N 4.73 0.00 -4.50 4.11 2.10 -1.78 0.26 117.51 122.44 3k4b h ILE 77 Ca -0.33 -0.79 -0.09 0.00 1.08 0.00 0.00 64.86 64.72 3k4b h ILE 77 Cb 1.19 1.78 0.01 0.00 -1.09 0.00 0.00 36.82 38.71 3k4b h ILE 77 CO 0.46 0.00 -0.01 0.61 -1.08 0.00 0.00 178.15 178.13 3k4b n GLY 78 N 0.80 1.97 3.47 8.18 0.00 -1.26 -3.86 105.19 114.49 3k4b n GLY 78 Ca 0.03 -2.15 -0.23 0.00 0.00 0.00 0.00 46.02 43.67 3k4b n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k4b s GLU 79 N -2.51 1.65 -0.12 1.61 2.02 -1.26 -1.14 118.70 118.95 3k4b s GLU 79 Ca 0.12 -1.82 -0.30 0.00 0.02 0.00 0.00 54.97 52.99 3k4b s GLU 79 Cb -0.01 -1.42 -0.02 0.00 0.10 0.00 0.00 34.13 32.78 3k4b s GLU 79 CO 0.07 0.12 1.14 0.42 0.02 0.00 0.00 175.26 177.04 3k4b s ILE 80 N -2.80 4.46 0.00 -1.63 1.01 -1.26 -1.51 121.20 119.46 3k4b s ILE 80 Ca 0.30 1.76 0.04 0.00 0.00 0.00 0.00 60.65 62.75 3k4b s ILE 80 Cb 0.02 -4.13 0.07 0.00 0.01 0.00 0.00 42.46 38.42 3k4b s ILE 80 CO 0.13 -0.06 0.84 -0.90 0.00 0.00 0.00 174.94 174.96 3k4b n ASP 81 N 5.65 -0.03 -1.17 3.58 5.75 -1.26 -4.96 116.55 124.11 3k4b n ASP 81 Ca 0.11 -1.64 0.01 0.00 -0.01 0.00 0.00 54.79 53.26 3k4b n ASP 81 Cb 0.46 -0.05 0.24 0.00 -1.03 0.00 0.00 41.12 40.74 3k4b n ASP 81 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 3k4b n SER 82 N 0.08 3.45 -0.08 -1.12 7.64 -1.26 -5.09 113.62 117.24 3k4b n SER 82 Ca -0.04 -3.35 0.00 0.00 1.01 0.00 0.00 58.87 56.49 3k4b n SER 82 Cb 0.70 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 3k4b n SER 82 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3k4b n GLY 83 N -0.74 -1.79 0.26 0.23 0.00 -1.26 -4.35 105.19 97.54 3k4b n GLY 83 Ca 0.30 -1.35 0.15 0.00 0.00 0.00 0.00 46.02 45.12 3k4b n GLY 83 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3k4b h LEU 84 N 0.00 0.00 -8.56 0.99 3.38 -2.03 -3.38 115.31 105.71 3k4b h LEU 84 Ca 0.00 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.38 3k4b h LEU 84 Cb 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.65 3k4b h LEU 84 CO 0.00 0.03 0.69 -0.54 0.09 0.00 0.00 178.44 178.70 3k4b s LYS 85 N -3.54 3.43 0.04 1.13 1.02 -1.26 -4.98 119.74 115.58 3k4b s LYS 85 Ca 0.03 -0.02 -0.30 0.00 0.02 0.00 0.00 55.97 55.69 3k4b s LYS 85 Cb 0.08 -4.01 -0.07 0.00 -0.52 0.00 0.00 37.83 33.31 3k4b s LYS 85 CO 0.59 -1.48 1.52 0.42 -0.92 0.00 0.00 175.35 175.47 3k4b s ILE 86 N 4.19 3.38 0.00 2.17 1.01 -1.26 -2.40 121.20 128.29 3k4b s ILE 86 Ca 0.36 0.81 0.00 0.00 0.00 0.00 0.00 60.65 61.81 3k4b s ILE 86 Cb -0.11 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.85 3k4b s ILE 86 CO 0.23 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.78 3k4b n GLY 87 N 3.80 0.59 3.86 6.18 0.00 -1.26 -4.28 105.19 114.07 3k4b n GLY 87 Ca 0.14 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3k4b n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k4b s ALA 88 N -2.00 2.08 -0.00 4.61 0.00 -1.01 -3.06 121.76 122.38 3k4b s ALA 88 Ca 0.00 -0.89 -0.30 0.00 0.00 0.00 0.00 51.96 50.77 3k4b s ALA 88 Cb 0.00 -2.89 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 3k4b s ALA 88 CO 0.00 -2.33 1.20 -1.58 0.00 0.00 0.00 175.76 173.05 3k4b s HIS 89 N -3.59 3.30 -0.47 0.00 2.46 -1.26 -4.53 115.29 111.19 3k4b s HIS 89 Ca 0.68 1.26 0.24 0.00 0.47 0.00 0.00 55.06 57.71 3k4b s HIS 89 Cb -0.09 -3.41 0.99 0.00 -0.13 0.00 0.00 32.58 29.94 3k4b s HIS 89 CO 0.52 -1.27 1.71 1.63 -2.47 0.00 0.00 174.74 174.87 3k4b n LYS 90 N 4.62 0.20 0.12 2.88 5.02 -0.01 -2.12 118.16 128.86 3k4b n LYS 90 Ca 0.10 0.43 0.12 0.00 -2.02 0.00 0.00 58.31 56.94 3k4b n LYS 90 Cb 0.46 -1.88 0.45 0.00 -0.02 0.00 0.00 35.03 34.05 3k4b n LYS 90 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 3k4b n LYS 91 N -2.25 0.22 -1.04 1.97 4.81 -1.26 -4.16 118.16 116.46 3k4b n LYS 91 Ca 0.02 0.32 -0.17 0.00 -0.87 0.00 0.00 58.31 57.61 3k4b n LYS 91 Cb 0.23 -1.83 -0.03 0.00 0.02 0.00 0.00 35.03 33.42 3k4b n LYS 91 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3k4b n ASN 92 N -2.23 6.15 -4.46 3.14 3.02 -0.90 -4.30 115.26 115.67 3k4b n ASN 92 Ca 0.04 -2.94 -0.29 0.00 -0.03 0.00 0.00 54.58 51.36 3k4b n ASN 92 Cb 0.33 -1.17 -0.12 0.00 -0.61 0.00 0.00 39.78 38.21 3k4b n ASN 92 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3k4b s THR 93 N -1.51 2.66 0.24 3.41 -4.23 -1.26 -5.02 115.64 109.94 3k4b s THR 93 Ca 0.41 -1.66 -0.04 0.00 -1.18 0.00 0.00 61.69 59.21 3k4b s THR 93 Cb 0.26 -2.23 0.22 0.00 1.34 0.00 0.00 72.50 72.09 3k4b s THR 93 CO -0.07 0.04 1.82 0.58 -0.54 0.00 0.00 174.62 176.46 3k4b h VAL 94 N 3.49 0.95 -0.63 2.29 2.07 -1.97 -2.49 116.25 119.96 3k4b h VAL 94 Ca -0.49 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 3k4b h VAL 94 Cb 1.18 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 3k4b h VAL 94 CO 0.45 0.16 0.34 -0.08 0.02 0.00 0.00 177.57 178.46 3k4b h GLU 95 N 0.85 0.88 -0.15 1.57 4.57 -1.95 -1.33 114.58 119.02 3k4b h GLU 95 Ca 0.39 -0.10 -0.15 0.00 -1.18 0.00 0.00 59.36 58.32 3k4b h GLU 95 Cb 0.31 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 3k4b h GLU 95 CO -0.22 0.67 -0.53 1.88 -1.18 0.00 0.00 179.01 179.62 3k4b h TYR 96 N 0.86 0.54 -0.00 0.92 0.05 -1.76 -1.57 116.97 116.00 3k4b h TYR 96 Ca 0.22 -0.19 0.00 0.00 0.05 0.00 0.00 58.73 58.82 3k4b h TYR 96 Cb 0.05 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 37.68 3k4b h TYR 96 CO -0.01 0.87 -0.07 1.04 -1.05 0.00 0.00 178.16 178.95 3k4b n GLN 97 N -3.95 0.39 0.01 4.88 6.02 -0.97 -1.38 117.38 122.39 3k4b n GLN 97 Ca -0.03 -0.07 0.11 0.00 -0.01 0.00 0.00 57.00 57.01 3k4b n GLN 97 Cb 0.58 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 30.39 3k4b n GLN 97 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3k4b n LYS 98 N -1.24 0.16 -3.14 -1.09 5.02 -0.52 -4.47 118.16 112.88 3k4b n LYS 98 Ca 0.12 -0.01 -0.17 0.00 -2.02 0.00 0.00 58.31 56.24 3k4b n LYS 98 Cb 0.28 -1.55 -0.02 0.00 -0.02 0.00 0.00 35.03 33.72 3k4b n LYS 98 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3k4b n ASN 99 N -1.75 0.72 -0.13 4.39 3.02 -0.62 -5.00 115.26 115.88 3k4b n ASN 99 Ca 0.03 -3.02 -0.08 0.00 -0.03 0.00 0.00 54.58 51.48 3k4b n ASN 99 Cb 0.39 -0.50 0.07 0.00 -0.61 0.00 0.00 39.78 39.13 3k4b n ASN 99 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3k4b h ILE 100 N 1.20 1.27 -0.90 2.41 -0.00 -1.45 -0.81 117.51 119.23 3k4b h ILE 100 Ca 0.08 -1.26 0.30 0.00 -0.00 0.00 0.00 64.86 63.98 3k4b h ILE 100 Cb 0.99 1.05 -0.08 0.00 -0.00 0.00 0.00 36.82 38.77 3k4b h ILE 100 CO 0.48 0.44 0.58 -0.90 -0.00 0.00 0.00 178.15 178.75 3k4b n ASP 101 N -4.14 0.12 0.10 2.19 5.75 -1.26 -0.72 116.55 118.59 3k4b n ASP 101 Ca 0.01 0.85 0.13 0.00 -0.01 0.00 0.00 54.79 55.77 3k4b n ASP 101 Cb 0.40 -0.42 0.42 0.00 -1.03 0.00 0.00 41.12 40.50 3k4b n ASP 101 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3k4b n LYS 102 N -3.86 0.25 0.19 0.11 4.76 -0.31 -3.78 118.16 115.51 3k4b n LYS 102 Ca 0.25 0.22 0.05 0.00 -2.87 0.00 0.00 58.31 55.97 3k4b n LYS 102 Cb 1.01 -1.80 0.37 0.00 -1.84 0.00 0.00 35.03 32.76 3k4b n LYS 102 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 3k4b h PHE 103 N 0.00 0.00 -1.01 2.13 3.57 -1.10 -2.19 116.94 118.35 3k4b h PHE 103 Ca 0.00 0.00 0.34 0.00 3.53 0.00 0.00 57.97 61.84 3k4b h PHE 103 Cb 0.70 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 39.29 3k4b h PHE 103 CO 0.00 0.37 0.57 0.28 -2.23 0.00 0.00 178.31 177.30 3k4b h VAL 104 N 0.00 0.24 -0.23 1.41 2.07 -1.65 0.80 116.25 118.89 3k4b h VAL 104 Ca -0.00 -0.09 -0.09 0.00 0.82 0.00 0.00 66.70 67.33 3k4b h VAL 104 Cb 0.82 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3k4b h VAL 104 CO 0.05 0.05 -0.25 0.78 0.02 0.00 0.00 177.57 178.21 3k4b h ASN 105 N 0.26 0.44 -0.45 0.57 4.21 -1.67 -0.74 115.58 118.20 3k4b h ASN 105 Ca 0.76 -0.15 -0.05 0.00 1.21 0.00 0.00 56.30 58.07 3k4b h ASN 105 Cb 1.79 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 38.85 3k4b h ASN 105 CO -0.63 0.69 0.09 0.58 -1.29 0.00 0.00 177.43 176.87 3k4b h VAL 106 N 0.39 1.24 -0.51 2.81 2.07 -0.97 -1.11 116.25 120.17 3k4b h VAL 106 Ca 0.06 -0.86 -0.05 0.00 0.82 0.00 0.00 66.70 66.67 3k4b h VAL 106 Cb 0.65 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 3k4b h VAL 106 CO 0.05 0.30 0.14 0.40 0.02 0.00 0.00 177.57 178.48 3k4b h ILE 107 N 0.61 1.24 -0.30 4.57 2.04 -1.13 -2.78 117.51 121.75 3k4b h ILE 107 Ca 0.14 -0.83 -0.07 0.00 1.00 0.00 0.00 64.86 65.11 3k4b h ILE 107 Cb 0.35 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 3k4b h ILE 107 CO 0.00 0.30 -0.10 1.56 0.00 0.00 0.00 178.15 179.92 3k4b h GLN 108 N 0.70 0.50 0.00 2.37 4.20 -1.04 -1.15 115.11 120.69 3k4b h GLN 108 Ca 0.16 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3k4b h GLN 108 Cb 0.31 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.04 3k4b h GLN 108 CO -0.00 0.60 0.00 0.41 -0.67 0.00 0.00 178.83 179.17 3k4b n GLY 109 N -0.69 -1.14 0.36 3.46 0.00 -0.43 -3.21 105.19 103.54 3k4b n GLY 109 Ca 0.01 0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.13 3k4b n GLY 109 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k4b n GLN 110 N -1.96 0.82 -3.72 1.61 10.64 -0.47 -4.92 117.38 119.38 3k4b n GLN 110 Ca 0.02 -2.12 -0.38 0.00 -1.83 0.00 0.00 57.00 52.69 3k4b n GLN 110 Cb 0.19 -1.10 -0.11 0.00 -0.86 0.00 0.00 30.24 28.36 3k4b n GLN 110 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 3k4b s LEU 111 N -1.82 4.90 -0.29 2.61 1.43 -1.03 -3.95 118.68 120.54 3k4b s LEU 111 Ca 0.23 -1.61 -0.13 0.00 -1.03 0.00 0.00 54.13 51.59 3k4b s LEU 111 Cb 0.21 -1.88 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 3k4b s LEU 111 CO -0.00 -0.48 0.28 -0.04 0.23 0.00 0.00 176.35 176.34 3k4b s MET 112 N 1.30 3.91 0.26 1.70 -1.94 -0.14 -4.84 119.30 119.55 3k4b s MET 112 Ca 0.03 -0.20 -0.31 0.00 -1.71 0.00 0.00 55.69 53.50 3k4b s MET 112 Cb -0.22 -3.68 -0.13 0.00 2.01 0.00 0.00 34.83 32.81 3k4b s MET 112 CO -0.00 -0.27 1.47 0.43 -0.01 0.00 0.00 175.02 176.64 3k4b n SER 113 N 5.20 3.15 0.13 3.03 7.64 -1.26 -1.04 113.62 130.47 3k4b n SER 113 Ca -0.11 1.15 -0.14 0.00 1.01 0.00 0.00 58.87 60.78 3k4b n SER 113 Cb 0.51 -1.49 -0.08 0.00 -1.01 0.00 0.00 64.21 62.14 3k4b n SER 113 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3k4b h VAL 114 N 3.14 0.83 -3.08 0.44 2.07 -1.44 -3.45 116.25 114.76 3k4b h VAL 114 Ca -0.46 -0.46 -0.34 0.00 0.82 0.00 0.00 66.70 66.26 3k4b h VAL 114 Cb 1.26 1.09 -0.37 0.00 -1.52 0.00 0.00 31.29 31.75 3k4b h VAL 114 CO 0.77 0.10 -0.68 -0.55 0.02 0.00 0.00 177.57 177.23 3k4b s SER 115 N -5.11 1.14 -0.22 0.57 0.15 -1.26 -4.64 113.70 104.33 3k4b s SER 115 Ca -0.15 0.08 -0.02 0.00 0.70 0.00 0.00 55.95 56.56 3k4b s SER 115 Cb 0.03 0.11 0.01 0.00 -1.71 0.00 0.00 66.02 64.45 3k4b s SER 115 CO 0.60 -0.27 -0.09 -0.69 1.20 0.00 0.00 173.24 174.00 3k4b s VAL 116 N 2.24 2.95 0.73 4.45 1.01 -1.26 -4.78 120.40 125.74 3k4b s VAL 116 Ca 0.04 -0.70 -0.13 0.00 0.00 0.00 0.00 61.98 61.19 3k4b s VAL 116 Cb -0.13 -2.35 0.04 0.00 0.00 0.00 0.00 36.38 33.94 3k4b s VAL 116 CO -0.06 0.41 1.12 -2.16 0.00 0.00 0.00 175.10 174.41 3k4b s PRO 117 N 1.40 2.39 0.29 2.72 0.04 -1.26 -0.42 135.00 140.16 3k4b s PRO 117 Ca 0.05 1.36 -0.29 0.00 0.04 0.00 0.00 61.00 62.15 3k4b s PRO 117 Cb -0.14 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.37 3k4b s PRO 117 CO -0.06 -1.57 1.34 0.28 0.04 0.00 0.00 177.00 177.04 3k4b n VAL 118 N -3.00 1.50 -3.12 -0.36 0.31 -1.26 -4.70 118.33 107.71 3k4b n VAL 118 Ca 0.10 -0.38 -0.39 0.00 -0.01 0.00 0.00 64.34 63.67 3k4b n VAL 118 Cb 0.52 -1.53 -0.06 0.00 -0.91 0.00 0.00 33.84 31.87 3k4b n VAL 118 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3k4b s ASN 119 N -0.02 7.13 -0.11 4.52 3.84 -1.26 -4.98 114.94 124.06 3k4b s ASN 119 Ca 0.61 1.34 0.14 0.00 0.21 0.00 0.00 52.86 55.17 3k4b s ASN 119 Cb -0.60 -2.42 0.29 0.00 -0.55 0.00 0.00 41.25 37.97 3k4b s ASN 119 CO 0.56 0.13 1.15 0.35 -2.79 0.00 0.00 177.10 176.50 3k4b n THR 120 N 2.36 1.41 -2.49 -5.21 -2.24 -1.26 -4.84 114.28 102.00 3k4b n THR 120 Ca -0.06 -1.98 -0.39 0.00 -2.27 0.00 0.00 64.05 59.34 3k4b n THR 120 Cb 0.50 0.05 -0.04 0.00 -2.10 0.00 0.00 70.33 68.74 3k4b n THR 120 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3k4b s LEU 121 N -2.11 4.47 -0.24 3.22 1.43 -1.26 -4.98 118.68 119.21 3k4b s LEU 121 Ca 0.28 2.22 -0.17 0.00 -1.03 0.00 0.00 54.13 55.43 3k4b s LEU 121 Cb 0.27 -3.75 -0.03 0.00 0.03 0.00 0.00 46.19 42.71 3k4b s LEU 121 CO -0.03 -0.21 0.48 -0.69 0.23 0.00 0.00 176.35 176.13 3k4b s VAL 122 N -1.27 5.11 -0.40 -1.59 1.01 -1.26 -5.03 120.40 116.98 3k4b s VAL 122 Ca 0.47 0.83 -0.03 0.00 0.00 0.00 0.00 61.98 63.25 3k4b s VAL 122 Cb -0.30 -3.80 0.10 0.00 0.00 0.00 0.00 36.38 32.39 3k4b s VAL 122 CO 0.38 0.13 0.19 -0.69 0.00 0.00 0.00 175.10 175.11 3k4b s VAL 123 N 2.03 3.31 -0.46 2.92 1.01 -1.26 -4.95 120.40 122.99 3k4b s VAL 123 Ca 0.20 -1.95 0.10 0.00 0.00 0.00 0.00 61.98 60.33 3k4b s VAL 123 Cb -0.15 -3.22 0.27 0.00 0.00 0.00 0.00 36.38 33.28 3k4b s VAL 123 CO 0.09 -0.62 1.21 -0.90 0.00 0.00 0.00 175.10 174.88 3k4b n ASP 124 N 4.61 2.83 -1.70 3.32 5.68 -1.26 -4.41 116.55 125.63 3k4b n ASP 124 Ca -0.04 -2.32 -0.12 0.00 -0.50 0.00 0.00 54.79 51.82 3k4b n ASP 124 Cb 0.42 -0.26 0.21 0.00 -1.14 0.00 0.00 41.12 40.35 3k4b n ASP 124 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3k4b n THR 125 N -0.14 2.86 -1.52 2.12 -2.24 -1.26 -4.99 114.28 109.11 3k4b n THR 125 Ca 0.11 -2.20 -0.34 0.00 -2.27 0.00 0.00 64.05 59.35 3k4b n THR 125 Cb 0.50 -0.38 0.08 0.00 -2.10 0.00 0.00 70.33 68.43 3k4b n THR 125 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3k4b s LEU 126 N -3.21 3.35 0.51 3.22 1.43 -1.26 -5.00 118.68 117.71 3k4b s LEU 126 Ca 0.51 2.29 -0.23 0.00 -1.03 0.00 0.00 54.13 55.67 3k4b s LEU 126 Cb 0.44 -4.58 -0.06 0.00 0.03 0.00 0.00 46.19 42.02 3k4b s LEU 126 CO 0.07 -2.11 1.31 -0.55 0.23 0.00 0.00 176.35 175.29 3k4b s SER 127 N -2.12 5.61 0.57 2.29 0.15 -1.26 -4.90 113.70 114.05 3k4b s SER 127 Ca 0.73 2.65 0.28 0.00 0.70 0.00 0.00 55.95 60.30 3k4b s SER 127 Cb -0.27 -2.63 1.49 0.00 -1.71 0.00 0.00 66.02 62.90 3k4b s SER 127 CO 0.44 -1.33 1.97 -0.65 1.20 0.00 0.00 173.24 174.87 3k4b h PRO 128 N 1.75 0.00 0.00 5.44 0.11 -1.99 -1.74 132.00 135.57 3k4b h PRO 128 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3k4b h PRO 128 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3k4b h PRO 128 CO 0.59 0.00 -0.09 1.79 -0.21 0.00 0.00 178.00 180.08 3k4b h THR 129 N 0.00 0.00 -3.62 -1.15 1.35 -2.04 -3.46 112.91 103.99 3k4b h THR 129 Ca 0.21 -0.72 -0.51 0.00 -0.55 0.00 0.00 66.41 64.84 3k4b h THR 129 Cb 1.02 1.67 -0.03 0.00 -1.73 0.00 0.00 68.15 69.08 3k4b h THR 129 CO -0.00 0.00 0.15 -0.44 -0.25 0.00 0.00 175.52 174.98 3k4b s SER 130 N -5.26 7.11 0.16 5.36 0.01 -0.66 -4.99 113.70 115.43 3k4b s SER 130 Ca 0.08 1.49 -0.34 0.00 1.31 0.00 0.00 55.95 58.50 3k4b s SER 130 Cb 0.09 -2.45 -0.14 0.00 0.21 0.00 0.00 66.02 63.73 3k4b s SER 130 CO 0.65 0.02 1.54 1.87 0.41 0.00 0.00 173.24 177.72 3k4b n TRP 131 N 0.70 2.18 -4.45 2.43 -0.00 -1.26 -4.91 117.44 112.14 3k4b n TRP 131 Ca -0.02 0.32 -0.22 0.00 -0.00 0.00 0.00 57.50 57.58 3k4b n TRP 131 Cb 0.51 -2.51 -0.16 0.00 -0.00 0.00 0.00 31.31 29.14 3k4b n TRP 131 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 177.69 176.55 3k4b s GLN 132 N 0.79 1.22 0.53 5.87 0.74 -1.26 -5.11 119.66 122.44 3k4b s GLN 132 Ca 0.79 -0.33 -0.22 0.00 0.05 0.00 0.00 55.36 55.65 3k4b s GLN 132 Cb -0.71 -1.09 -0.05 0.00 1.10 0.00 0.00 33.01 32.26 3k4b s GLN 132 CO 0.39 0.07 1.33 0.00 -0.55 0.00 0.00 175.29 176.53 3k4b s ALA 133 N 0.44 2.84 -0.70 1.58 0.00 -1.26 -4.96 121.76 119.70 3k4b s ALA 133 Ca -0.08 1.28 0.20 0.00 0.00 0.00 0.00 51.96 53.36 3k4b s ALA 133 Cb -0.12 -3.54 -0.24 0.00 0.00 0.00 0.00 23.12 19.22 3k4b s ALA 133 CO 0.02 -1.28 0.74 0.43 0.00 0.00 0.00 175.76 175.66 3k4b n SER 134 N -0.96 0.78 -4.08 0.00 7.64 -1.26 -5.02 113.62 110.73 3k4b n SER 134 Ca 0.10 -0.71 -0.11 0.00 1.01 0.00 0.00 58.87 59.15 3k4b n SER 134 Cb 0.45 1.24 -0.08 0.00 -1.01 0.00 0.00 64.21 64.82 3k4b n SER 134 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3k4b s THR 135 N -3.00 0.00 -1.20 0.44 -4.23 -1.26 -5.06 115.64 101.32 3k4b s THR 135 Ca 0.04 -1.76 -0.12 0.00 -1.18 0.00 0.00 61.69 58.66 3k4b s THR 135 Cb 0.14 -2.39 0.19 0.00 1.34 0.00 0.00 72.50 71.79 3k4b s THR 135 CO 0.82 0.00 1.42 0.49 -0.54 0.00 0.00 174.62 176.81 3k4b n PHE 136 N -0.33 4.81 -2.15 3.99 3.72 -1.26 -5.00 117.46 121.23 3k4b n PHE 136 Ca 0.01 -3.39 -0.27 0.00 -0.05 0.00 0.00 57.45 53.75 3k4b n PHE 136 Cb 0.64 -2.07 0.06 0.00 -0.94 0.00 0.00 39.48 37.18 3k4b n PHE 136 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 3k4b s PHE 137 N 0.89 3.01 -0.40 1.38 -0.71 -1.26 -4.88 117.98 116.01 3k4b s PHE 137 Ca 0.40 0.57 -0.28 0.00 -1.04 0.00 0.00 56.93 56.59 3k4b s PHE 137 Cb -0.03 -3.17 -0.02 0.00 -1.21 0.00 0.00 43.02 38.59 3k4b s PHE 137 CO -0.01 -1.37 1.83 0.08 -1.34 0.00 0.00 175.22 174.42 3k4b s VAL 138 N -3.27 3.43 0.16 -2.49 1.01 -1.26 -4.82 120.40 113.16 3k4b s VAL 138 Ca 0.59 0.41 0.11 0.00 0.00 0.00 0.00 61.98 63.08 3k4b s VAL 138 Cb -0.11 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 3k4b s VAL 138 CO 0.46 -0.50 -0.22 -0.13 0.00 0.00 0.00 175.10 174.71 3k4b s ARG 139 N 6.06 1.61 -1.35 2.72 0.52 -1.26 -4.89 118.95 122.36 3k4b s ARG 139 Ca 0.78 -1.38 -0.01 0.00 -0.52 0.00 0.00 55.73 54.60 3k4b s ARG 139 Cb -0.20 -1.95 0.01 0.00 0.52 0.00 0.00 34.95 33.33 3k4b s ARG 139 CO 0.30 0.43 0.63 0.09 0.02 0.00 0.00 175.30 176.78 3k4b n ASN 140 N 0.50 -1.11 0.00 0.23 3.02 -1.26 -1.94 115.26 114.70 3k4b n ASN 140 Ca -0.14 -0.87 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 3k4b n ASN 140 Cb 0.54 -3.75 0.00 0.00 -0.61 0.00 0.00 39.78 35.96 3k4b n ASN 140 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k4b n GLY 141 N -1.69 0.03 3.67 7.41 0.00 -1.26 -4.99 105.19 108.35 3k4b n GLY 141 Ca -0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 3k4b n GLY 141 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k4b n SER 142 N -0.87 0.45 -4.33 1.61 3.41 -0.82 -4.80 113.62 108.27 3k4b n SER 142 Ca 0.00 0.47 -0.42 0.00 -0.26 0.00 0.00 58.87 58.65 3k4b n SER 142 Cb 0.43 -1.48 -0.09 0.00 -0.26 0.00 0.00 64.21 62.82 3k4b n SER 142 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3k4b s ASN 143 N -2.46 5.89 0.00 4.04 2.47 0.44 -4.85 114.94 120.47 3k4b s ASN 143 Ca 0.69 -1.41 0.11 0.00 0.42 0.00 0.00 52.86 52.67 3k4b s ASN 143 Cb -0.25 -2.08 0.49 0.00 -1.45 0.00 0.00 41.25 37.96 3k4b s ASN 143 CO 0.56 -0.59 1.36 -0.81 -3.72 0.00 0.00 177.10 173.91 3k4b n PRO 144 N 5.06 0.00 0.16 0.43 -0.04 -1.26 -2.11 135.00 137.24 3k4b n PRO 144 Ca -0.11 0.31 0.12 0.00 -0.04 0.00 0.00 63.50 63.78 3k4b n PRO 144 Cb 0.43 -1.51 0.26 0.00 -0.04 0.00 0.00 33.50 32.65 3k4b n PRO 144 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3k4b h GLU 145 N 0.00 0.00 -5.85 0.54 4.39 -1.96 -3.46 114.58 108.25 3k4b h GLU 145 Ca 0.00 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.12 3k4b h GLU 145 Cb 0.19 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 28.77 3k4b h GLU 145 CO 0.00 0.00 0.27 -1.14 -1.16 0.00 0.00 179.01 176.98 3k4b s GLN 146 N -3.17 4.28 -0.20 2.33 2.00 -0.89 -5.00 119.66 119.00 3k4b s GLN 146 Ca 0.08 0.86 -0.29 0.00 -2.00 0.00 0.00 55.36 54.01 3k4b s GLN 146 Cb 0.09 -3.57 -0.01 0.00 0.80 0.00 0.00 33.01 30.32 3k4b s GLN 146 CO 0.65 -0.27 1.27 0.34 -0.50 0.00 0.00 175.29 176.78 3k4b s ASP 147 N 1.15 6.87 0.61 6.67 -1.08 -1.26 -4.71 116.67 124.92 3k4b s ASP 147 Ca 0.35 1.57 0.35 0.00 -0.52 0.00 0.00 52.55 54.29 3k4b s ASP 147 Cb -0.16 -2.54 2.01 0.00 -1.46 0.00 0.00 42.92 40.76 3k4b s ASP 147 CO 0.12 -0.84 2.29 1.55 0.52 0.00 0.00 175.17 178.80 3k4b h PRO 148 N 8.48 0.00 -0.20 4.34 0.13 -1.96 -1.78 132.00 141.02 3k4b h PRO 148 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3k4b h PRO 148 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3k4b h PRO 148 CO 0.99 0.01 0.00 1.28 -0.23 0.00 0.00 178.00 180.04 3k4b n LEU 149 N -3.59 1.92 -2.72 1.56 4.77 -1.26 -4.04 117.00 113.63 3k4b n LEU 149 Ca -0.03 -0.81 -0.05 0.00 -0.03 0.00 0.00 56.01 55.09 3k4b n LEU 149 Cb 0.09 -0.13 0.05 0.00 -2.33 0.00 0.00 43.42 41.10 3k4b n LEU 149 CO 0.25 0.40 0.01 0.54 -1.33 0.00 0.00 177.39 177.26 3k4b n ARG 150 N 0.49 1.36 -4.19 3.23 1.74 -0.67 -4.97 116.66 113.65 3k4b n ARG 150 Ca 0.16 -3.12 -0.23 0.00 -0.77 0.00 0.00 57.85 53.89 3k4b n ARG 150 Cb 0.37 -1.18 -0.07 0.00 -1.02 0.00 0.00 32.46 30.56 3k4b n ARG 150 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3k4b s ASN 151 N -3.10 4.52 -1.01 0.55 2.47 -1.22 -1.27 114.94 115.89 3k4b s ASN 151 Ca 0.26 -0.82 -0.04 0.00 0.42 0.00 0.00 52.86 52.67 3k4b s ASN 151 Cb 0.41 -0.69 0.27 0.00 -1.45 0.00 0.00 41.25 39.79 3k4b s ASN 151 CO -0.01 -0.25 1.12 0.18 -3.72 0.00 0.00 177.10 174.42 3k4b n LEU 152 N -1.06 5.31 0.12 3.21 4.77 -1.26 -4.78 117.00 123.30 3k4b n LEU 152 Ca -0.04 -5.16 0.15 0.00 -0.03 0.00 0.00 56.01 50.93 3k4b n LEU 152 Cb 0.61 -1.24 0.67 0.00 -2.33 0.00 0.00 43.42 41.13 3k4b n LEU 152 CO 0.43 1.58 1.13 0.77 -1.33 0.00 0.00 177.39 179.97 3k4b h SER 153 N 5.85 0.00 0.92 -1.43 4.64 -1.81 -0.49 113.55 121.22 3k4b h SER 153 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 3k4b h SER 153 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3k4b h SER 153 CO 1.06 0.00 -0.12 0.61 -0.87 0.00 0.00 176.83 177.51 3k4b n GLY 154 N -1.59 -1.46 3.76 -0.77 0.00 0.27 -4.86 105.19 100.54 3k4b n GLY 154 Ca 0.04 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 3k4b n GLY 154 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3k4b s GLN 155 N -3.01 4.31 0.13 1.61 -1.52 -0.20 -3.55 119.66 117.44 3k4b s GLN 155 Ca 0.13 2.26 -0.07 0.00 -1.95 0.00 0.00 55.36 55.73 3k4b s GLN 155 Cb 0.18 -3.09 -0.01 0.00 -0.22 0.00 0.00 33.01 29.87 3k4b s GLN 155 CO 0.57 -0.31 0.20 0.00 -0.25 0.00 0.00 175.29 175.50 3k4b s ALA 156 N -0.55 0.11 0.23 6.09 0.00 -1.26 -1.10 121.76 125.28 3k4b s ALA 156 Ca 0.54 -0.93 0.09 0.00 0.00 0.00 0.00 51.96 51.66 3k4b s ALA 156 Cb -0.41 0.71 -0.05 0.00 0.00 0.00 0.00 23.12 23.38 3k4b s ALA 156 CO 0.48 -0.56 -0.15 0.14 0.00 0.00 0.00 175.76 175.67 3k4b s VAL 157 N -3.95 1.91 -0.17 0.00 -7.23 -0.21 -4.84 120.40 105.92 3k4b s VAL 157 Ca 0.14 -2.25 0.00 0.00 -1.81 0.00 0.00 61.98 58.06 3k4b s VAL 157 Cb 0.05 -2.15 0.04 0.00 0.56 0.00 0.00 36.38 34.88 3k4b s VAL 157 CO -0.04 -0.52 -0.09 -0.89 -0.31 0.00 0.00 175.10 173.25 3k4b s THR 158 N -2.86 1.39 -0.79 5.32 2.01 -1.25 -0.97 115.64 118.48 3k4b s THR 158 Ca 0.25 -0.72 -0.06 0.00 0.31 0.00 0.00 61.69 61.47 3k4b s THR 158 Cb -0.01 -1.45 0.20 0.00 0.01 0.00 0.00 72.50 71.25 3k4b s THR 158 CO 0.09 0.24 0.67 -0.13 -0.69 0.00 0.00 174.62 174.80 3k4b s ARG 159 N 1.53 3.14 0.12 4.92 0.52 -1.26 -4.66 118.95 123.25 3k4b s ARG 159 Ca 0.01 -2.79 -0.10 0.00 -0.52 0.00 0.00 55.73 52.33 3k4b s ARG 159 Cb -0.15 -4.02 0.00 0.00 0.52 0.00 0.00 34.95 31.31 3k4b s ARG 159 CO -0.09 -1.23 0.25 0.14 0.02 0.00 0.00 175.30 174.39 3k4b s VAL 160 N -0.49 0.11 0.04 3.52 -7.23 -1.26 -4.30 120.40 110.79 3k4b s VAL 160 Ca 0.21 -1.15 -0.31 0.00 -1.81 0.00 0.00 61.98 58.93 3k4b s VAL 160 Cb -0.13 -1.47 -0.07 0.00 0.56 0.00 0.00 36.38 35.27 3k4b s VAL 160 CO -0.07 -0.49 1.49 -0.69 -0.31 0.00 0.00 175.10 175.03 3k4b s VAL 161 N -3.88 3.39 0.00 1.32 1.01 -0.57 -1.23 120.40 120.43 3k4b s VAL 161 Ca 0.08 0.84 0.00 0.00 0.00 0.00 0.00 61.98 62.90 3k4b s VAL 161 Cb 0.04 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.88 3k4b s VAL 161 CO -0.08 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.64 3k4b n GLY 162 N 3.75 0.64 7.00 4.51 0.00 -0.81 -4.24 105.19 116.04 3k4b n GLY 162 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3k4b n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k4b n GLY 163 N -1.92 2.24 0.01 -0.02 0.00 -0.36 -1.79 105.19 103.35 3k4b n GLY 163 Ca 0.00 -0.49 0.11 0.00 0.00 0.00 0.00 46.02 45.65 3k4b n GLY 163 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3k4b n MET 164 N 10.32 0.02 0.00 1.61 2.81 -1.26 -2.39 117.12 128.23 3k4b n MET 164 Ca 0.00 0.12 0.12 0.00 -1.81 0.00 0.00 57.70 56.13 3k4b n MET 164 Cb 0.00 -1.53 0.67 0.00 -0.71 0.00 0.00 33.22 31.65 3k4b n MET 164 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3k4b n SER 165 N -1.57 0.00 0.04 7.83 3.41 -0.74 -1.15 113.62 121.43 3k4b n SER 165 Ca 0.05 -0.45 0.14 0.00 -0.26 0.00 0.00 58.87 58.36 3k4b n SER 165 Cb 0.28 -0.13 0.54 0.00 -0.26 0.00 0.00 64.21 64.65 3k4b n SER 165 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3k4b n THR 166 N -1.13 0.21 -0.74 6.66 -2.24 -1.01 -4.15 114.28 111.89 3k4b n THR 166 Ca 0.15 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 3k4b n THR 166 Cb 0.13 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 67.82 3k4b n THR 166 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k4b n HIS 167 N -1.76 0.00 -0.99 4.78 1.44 -0.70 -0.83 115.22 117.17 3k4b n HIS 167 Ca 0.06 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.48 3k4b n HIS 167 Cb 0.37 0.00 0.17 0.00 0.12 0.00 0.00 29.99 30.65 3k4b n HIS 167 CO 0.00 0.00 0.00 1.67 -2.81 0.00 0.00 176.34 175.20 3k4b s TRP 168 N 0.00 1.97 -2.02 -1.40 1.48 -0.30 -4.95 118.94 113.73 3k4b s TRP 168 Ca 0.00 1.26 0.30 0.00 -1.06 0.00 0.00 56.10 56.60 3k4b s TRP 168 Cb 0.00 -3.18 1.44 0.00 -1.16 0.00 0.00 33.47 30.56 3k4b s TRP 168 CO 0.00 -2.87 1.97 0.43 -4.06 0.00 0.00 176.95 172.42 3k4b n SER 169 N -4.22 0.58 -0.48 -2.66 7.64 -1.26 -4.94 113.62 108.28 3k4b n SER 169 Ca 0.06 -0.99 -0.06 0.00 1.01 0.00 0.00 58.87 58.89 3k4b n SER 169 Cb 0.55 -0.03 -0.03 0.00 -1.01 0.00 0.00 64.21 63.69 3k4b n SER 169 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3k4b s ALA 171 N -1.97 3.39 -0.41 0.00 0.00 -1.26 -0.91 121.76 120.60 3k4b s ALA 171 Ca 0.00 0.41 0.09 0.00 0.00 0.00 0.00 51.96 52.46 3k4b s ALA 171 Cb 0.00 -3.44 0.29 0.00 0.00 0.00 0.00 23.12 19.97 3k4b s ALA 171 CO 0.00 -0.59 0.63 0.25 0.00 0.00 0.00 175.76 176.05 3k4b n THR 172 N 4.50 -0.13 -2.19 0.00 -2.24 -0.38 -4.82 114.28 109.03 3k4b n THR 172 Ca 0.09 -4.37 -0.36 0.00 -2.27 0.00 0.00 64.05 57.14 3k4b n THR 172 Cb 0.49 -1.35 0.00 0.00 -2.10 0.00 0.00 70.33 67.37 3k4b n THR 172 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3k4b s PRO 173 N -1.81 3.48 0.49 -0.78 0.04 -1.26 -4.75 135.00 130.41 3k4b s PRO 173 Ca 0.38 1.77 -0.18 0.00 0.04 0.00 0.00 61.00 63.00 3k4b s PRO 173 Cb 0.24 -2.21 -0.09 0.00 0.04 0.00 0.00 34.50 32.48 3k4b s PRO 173 CO -0.09 -0.78 0.98 1.03 0.04 0.00 0.00 177.00 178.18 3k4b s ARG 174 N -2.98 3.98 0.10 4.56 0.52 -1.26 -4.68 118.95 119.19 3k4b s ARG 174 Ca 0.69 1.07 -0.13 0.00 -0.52 0.00 0.00 55.73 56.84 3k4b s ARG 174 Cb -0.28 -2.14 -0.06 0.00 0.52 0.00 0.00 34.95 32.98 3k4b s ARG 174 CO 0.33 -0.24 0.48 -0.06 0.02 0.00 0.00 175.30 175.83 3k4b s PHE 175 N -2.39 3.64 0.84 -0.53 0.40 -1.26 -5.02 117.98 113.66 3k4b s PHE 175 Ca 0.61 0.99 -0.11 0.00 -0.60 0.00 0.00 56.93 57.82 3k4b s PHE 175 Cb -0.11 -2.30 0.14 0.00 0.51 0.00 0.00 43.02 41.26 3k4b s PHE 175 CO 0.24 0.51 1.18 0.16 0.70 0.00 0.00 175.22 178.01 3k4b s ASP 176 N -1.57 3.92 0.21 1.36 -4.77 -1.26 -4.84 116.67 109.71 3k4b s ASP 176 Ca 0.33 0.31 -0.09 0.00 -3.30 0.00 0.00 52.55 49.80 3k4b s ASP 176 Cb -0.15 -0.62 0.24 0.00 -1.09 0.00 0.00 42.92 41.30 3k4b s ASP 176 CO 0.18 -2.21 1.81 0.03 0.70 0.00 0.00 175.17 175.68 3k4b h ARG 177 N -1.15 0.68 -0.59 2.11 3.08 -1.99 -2.57 114.38 113.95 3k4b h ARG 177 Ca -0.44 -0.04 0.16 0.00 0.07 0.00 0.00 59.98 59.73 3k4b h ARG 177 Cb 1.27 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 31.14 3k4b h ARG 177 CO 0.48 0.45 0.42 1.49 -1.07 0.00 0.00 179.97 181.74 3k4b h GLU 178 N 0.70 0.09 0.00 0.04 4.81 -1.99 -2.69 114.58 115.54 3k4b h GLU 178 Ca 0.30 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.48 3k4b h GLU 178 Cb 0.17 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 3k4b h GLU 178 CO -0.17 0.06 -1.36 1.04 -0.73 0.00 0.00 179.01 177.85 3k4b n GLN 179 N -4.40 0.62 -3.45 1.92 6.02 -0.98 -4.81 117.38 112.31 3k4b n GLN 179 Ca 0.11 0.06 -0.38 0.00 -0.01 0.00 0.00 57.00 56.78 3k4b n GLN 179 Cb 0.60 -1.74 -0.06 0.00 1.02 0.00 0.00 30.24 30.06 3k4b n GLN 179 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3k4b s ARG 180 N -3.29 3.97 0.51 -1.09 3.52 -1.02 -4.48 118.95 117.08 3k4b s ARG 180 Ca -0.03 0.47 -0.20 0.00 -0.13 0.00 0.00 55.73 55.84 3k4b s ARG 180 Cb 0.10 -3.19 -0.07 0.00 -1.56 0.00 0.00 34.95 30.23 3k4b s ARG 180 CO 0.82 0.66 1.08 -1.25 -0.81 0.00 0.00 175.30 175.80 3k4b s PRO 181 N -1.20 3.59 0.28 5.12 0.04 -1.26 -4.97 135.00 136.59 3k4b s PRO 181 Ca 0.26 1.46 -0.29 0.00 0.04 0.00 0.00 61.00 62.47 3k4b s PRO 181 Cb -0.17 -2.05 -0.10 0.00 0.04 0.00 0.00 34.50 32.22 3k4b s PRO 181 CO 0.15 -0.63 1.20 -0.51 0.04 0.00 0.00 177.00 177.26 3k4b s LEU 182 N -3.66 4.49 -0.02 -3.56 1.43 -1.26 -4.91 118.68 111.18 3k4b s LEU 182 Ca 0.69 2.41 0.17 0.00 -1.03 0.00 0.00 54.13 56.38 3k4b s LEU 182 Cb -0.20 -3.63 -0.26 0.00 0.03 0.00 0.00 46.19 42.14 3k4b s LEU 182 CO 0.24 -0.34 0.40 0.18 0.23 0.00 0.00 176.35 177.06 3k4b n LEU 183 N 1.38 0.07 -3.68 1.79 4.77 -1.26 -4.92 117.00 115.15 3k4b n LEU 183 Ca 0.01 -0.05 -0.21 0.00 -0.03 0.00 0.00 56.01 55.72 3k4b n LEU 183 Cb 0.44 0.00 -0.18 0.00 -2.33 0.00 0.00 43.42 41.35 3k4b n LEU 183 CO 0.56 0.02 -0.35 -0.69 -1.33 0.00 0.00 177.39 175.61 3k4b s VAL 184 N -3.12 -0.02 0.59 4.08 1.01 -1.26 -5.04 120.40 116.65 3k4b s VAL 184 Ca -0.05 0.28 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 3k4b s VAL 184 Cb 0.11 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 36.17 3k4b s VAL 184 CO 0.70 0.12 1.14 -0.54 0.00 0.00 0.00 175.10 176.53 3k4b s LYS 185 N 2.13 3.07 -1.13 2.72 1.02 -1.26 -4.08 119.74 122.21 3k4b s LYS 185 Ca 0.04 1.59 -0.02 0.00 0.02 0.00 0.00 55.97 57.60 3k4b s LYS 185 Cb -0.13 -1.97 0.02 0.00 -0.52 0.00 0.00 37.83 35.23 3k4b s LYS 185 CO -0.04 -1.07 0.15 -0.25 -0.92 0.00 0.00 175.35 173.21 3k4b n ASP 186 N -1.74 -3.97 -2.75 2.83 8.00 -1.26 -4.79 116.55 112.87 3k4b n ASP 186 Ca 0.12 0.03 -0.06 0.00 0.71 0.00 0.00 54.79 55.58 3k4b n ASP 186 Cb 0.51 -3.34 0.04 0.00 -0.02 0.00 0.00 41.12 38.31 3k4b n ASP 186 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3k4b n ASP 187 N -1.96 -2.98 -0.08 -2.24 -0.08 -1.26 -5.04 116.55 102.92 3k4b n ASP 187 Ca -0.11 -3.06 -0.08 0.00 -1.51 0.00 0.00 54.79 50.03 3k4b n ASP 187 Cb 0.59 1.74 -0.01 0.00 2.34 0.00 0.00 41.12 45.78 3k4b n ASP 187 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3k4b h ALA 188 N 4.29 0.34 -0.87 -1.67 0.00 -1.86 0.30 119.26 119.78 3k4b h ALA 188 Ca -0.08 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.84 3k4b h ALA 188 Cb 1.07 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 3k4b h ALA 188 CO 0.19 -0.25 0.57 -0.44 0.00 0.00 0.00 179.25 179.32 3k4b h ASP 189 N 0.29 1.01 -0.60 0.00 3.32 -1.97 0.28 116.42 118.74 3k4b h ASP 189 Ca 0.12 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.08 3k4b h ASP 189 Cb 0.04 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.31 3k4b h ASP 189 CO -0.09 0.74 0.18 0.00 -1.72 0.00 0.00 179.24 178.36 3k4b h ALA 190 N 1.44 0.79 -0.47 3.45 0.00 -1.62 -1.72 119.26 121.13 3k4b h ALA 190 Ca 0.32 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3k4b h ALA 190 Cb -0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3k4b h ALA 190 CO -0.07 0.47 0.18 0.22 0.00 0.00 0.00 179.25 180.06 3k4b h ASP 191 N 0.86 0.65 -0.83 0.00 3.58 0.15 -2.02 116.42 118.81 3k4b h ASP 191 Ca 0.19 -0.17 0.13 0.00 0.42 0.00 0.00 57.03 57.60 3k4b h ASP 191 Cb 0.30 -0.17 -0.09 0.00 1.72 0.00 0.00 39.33 41.10 3k4b h ASP 191 CO -0.00 0.65 0.43 0.44 -2.88 0.00 0.00 179.24 177.88 3k4b h ASP 192 N 0.61 0.56 -0.31 2.28 3.32 -0.36 -2.50 116.42 120.03 3k4b h ASP 192 Ca 0.16 0.08 -0.12 0.00 0.02 0.00 0.00 57.03 57.16 3k4b h ASP 192 Cb 0.20 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 3k4b h ASP 192 CO -0.01 0.27 -0.27 0.00 -1.72 0.00 0.00 179.24 177.50 3k4b h ALA 193 N 1.52 0.45 -0.62 3.45 0.00 -0.93 -0.41 119.26 122.72 3k4b h ALA 193 Ca 0.43 -0.40 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3k4b h ALA 193 Cb 0.55 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3k4b h ALA 193 CO -0.32 0.45 0.41 1.49 0.00 0.00 0.00 179.25 181.28 3k4b h GLU 194 N 0.48 0.81 -0.18 0.00 4.57 -1.20 0.09 114.58 119.15 3k4b h GLU 194 Ca 0.05 -0.05 -0.18 0.00 -1.18 0.00 0.00 59.36 58.01 3k4b h GLU 194 Cb 0.84 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.24 3k4b h GLU 194 CO 0.07 0.54 -0.62 -1.49 -1.18 0.00 0.00 179.01 176.33 3k4b h TRP 195 N 0.84 0.78 -0.95 0.92 4.06 -1.28 -0.39 115.95 119.93 3k4b h TRP 195 Ca 0.23 -0.30 0.02 0.00 2.06 0.00 0.00 58.89 60.90 3k4b h TRP 195 Cb -0.10 -0.14 -0.05 0.00 -1.00 0.00 0.00 29.16 27.88 3k4b h TRP 195 CO -0.03 1.07 0.63 0.22 -3.56 0.00 0.00 178.44 176.76 3k4b h ASP 196 N 0.45 1.07 -0.27 -3.49 3.58 -0.78 0.15 116.42 117.12 3k4b h ASP 196 Ca -0.01 -0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.37 3k4b h ASP 196 Cb 1.19 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.97 3k4b h ASP 196 CO 0.12 0.76 -0.05 -0.09 -2.88 0.00 0.00 179.24 177.09 3k4b h ARG 197 N 1.25 0.52 -0.10 0.28 2.43 0.31 -2.10 114.38 116.96 3k4b h ARG 197 Ca 0.36 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 59.30 3k4b h ARG 197 Cb -0.08 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.43 3k4b h ARG 197 CO -0.09 0.72 -0.10 -0.07 -1.51 0.00 0.00 179.97 178.91 3k4b h LEU 198 N 0.28 0.25 -1.48 3.80 3.38 -0.79 -2.79 115.31 117.97 3k4b h LEU 198 Ca 0.07 -0.49 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 3k4b h LEU 198 Cb 0.52 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 3k4b h LEU 198 CO 0.02 0.69 0.08 1.88 0.09 0.00 0.00 178.44 181.21 3k4b h TYR 199 N -0.18 0.42 -0.27 1.13 0.05 -0.76 -0.25 116.97 117.11 3k4b h TYR 199 Ca 0.01 -0.02 -0.11 0.00 0.05 0.00 0.00 58.73 58.67 3k4b h TYR 199 Cb 0.62 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.22 3k4b h TYR 199 CO 0.09 0.37 -0.30 1.15 -1.05 0.00 0.00 178.16 178.42 3k4b h THR 200 N 0.42 1.28 -0.09 -2.88 2.02 -1.22 0.12 112.91 112.56 3k4b h THR 200 Ca 0.10 -1.38 -0.16 0.00 0.77 0.00 0.00 66.41 65.75 3k4b h THR 200 Cb 0.15 1.40 0.01 0.00 -1.74 0.00 0.00 68.15 67.97 3k4b h THR 200 CO -0.01 0.44 -0.56 0.50 0.37 0.00 0.00 175.52 176.26 3k4b h LYS 201 N 0.47 0.53 -0.94 6.66 3.64 -1.11 -2.71 116.57 123.11 3k4b h LYS 201 Ca 0.06 -0.46 0.05 0.00 -1.27 0.00 0.00 60.65 59.03 3k4b h LYS 201 Cb 0.75 0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 32.62 3k4b h LYS 201 CO 0.06 1.09 0.62 0.00 -2.27 0.00 0.00 179.45 178.95 3k4b h ALA 202 N 0.45 1.42 -0.59 5.00 0.00 -0.48 -0.84 119.26 124.23 3k4b h ALA 202 Ca -0.05 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 3k4b h ALA 202 Cb 1.22 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 3k4b h ALA 202 CO 0.12 0.47 0.08 0.93 0.00 0.00 0.00 179.25 180.84 3k4b h GLU 203 N 1.15 0.97 -0.09 0.00 5.08 -0.78 -1.46 114.58 119.45 3k4b h GLU 203 Ca 0.39 -0.25 0.04 0.00 -1.00 0.00 0.00 59.36 58.53 3k4b h GLU 203 Cb 0.08 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.16 3k4b h GLU 203 CO -0.13 0.91 -0.20 1.03 -1.00 0.00 0.00 179.01 179.62 3k4b h SER 204 N 0.91 -0.62 -0.65 1.42 0.87 -0.86 0.20 113.55 114.82 3k4b h SER 204 Ca 0.18 0.10 0.04 0.00 -1.23 0.00 0.00 61.79 60.88 3k4b h SER 204 Cb 0.43 0.28 -0.04 0.00 -0.44 0.00 0.00 62.40 62.62 3k4b h SER 204 CO 0.01 -0.26 0.39 1.88 -0.53 0.00 0.00 176.83 178.33 3k4b h TYR 205 N -0.28 0.73 0.00 2.24 -1.99 -0.74 -2.41 116.97 114.52 3k4b h TYR 205 Ca 0.09 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.84 3k4b h TYR 205 Cb 0.40 -0.24 0.00 0.00 2.00 0.00 0.00 36.73 38.90 3k4b h TYR 205 CO -0.29 0.40 -0.23 1.19 -0.00 0.00 0.00 178.16 179.23 3k4b n PHE 206 N -4.72 0.50 -3.28 4.88 3.72 -0.60 -4.02 117.46 113.95 3k4b n PHE 206 Ca 0.07 0.15 -0.17 0.00 -0.05 0.00 0.00 57.45 57.44 3k4b n PHE 206 Cb 0.10 -0.68 0.06 0.00 -0.94 0.00 0.00 39.48 38.02 3k4b n PHE 206 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3k4b n GLN 207 N -1.95 -5.74 -1.94 -1.08 1.13 0.56 -4.09 117.38 104.26 3k4b n GLN 207 Ca 0.05 0.61 -0.41 0.00 -1.94 0.00 0.00 57.00 55.31 3k4b n GLN 207 Cb 0.40 -4.97 -0.02 0.00 0.11 0.00 0.00 30.24 25.76 3k4b n GLN 207 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 3k4b s THR 208 N -3.24 2.41 0.13 5.09 2.01 -0.38 -2.93 115.64 118.73 3k4b s THR 208 Ca 0.39 0.38 -0.10 0.00 0.31 0.00 0.00 61.69 62.67 3k4b s THR 208 Cb -0.17 -3.24 0.00 0.00 0.01 0.00 0.00 72.50 69.10 3k4b s THR 208 CO 0.53 0.08 0.26 -0.83 -0.69 0.00 0.00 174.62 173.97 3k4b s GLY 209 N 0.04 0.20 -0.11 4.40 0.00 -0.54 -4.87 107.32 106.43 3k4b s GLY 209 Ca 0.56 -0.65 0.14 0.00 0.00 0.00 0.00 44.72 44.77 3k4b s GLY 209 CO 0.52 -0.74 1.14 -1.30 0.00 0.00 0.00 173.10 172.72 3k4b n THR 210 N -0.15 1.36 -0.83 0.90 -2.24 -1.26 -1.66 114.28 110.39 3k4b n THR 210 Ca -0.12 -1.93 0.00 0.00 -2.27 0.00 0.00 64.05 59.73 3k4b n THR 210 Cb 0.63 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 3k4b n THR 210 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3k4b n ASP 211 N -0.82 0.34 0.29 3.42 5.75 -1.26 -4.56 116.55 119.70 3k4b n ASP 211 Ca 0.12 -1.17 0.17 0.00 -0.01 0.00 0.00 54.79 53.90 3k4b n ASP 211 Cb 0.73 0.00 0.83 0.00 -1.03 0.00 0.00 41.12 41.66 3k4b n ASP 211 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 3k4b h GLN 212 N 0.00 0.00 -0.36 0.11 7.50 -1.94 -2.63 115.11 117.78 3k4b h GLN 212 Ca 0.00 0.00 -0.09 0.00 0.50 0.00 0.00 58.65 59.06 3k4b h GLN 212 Cb 0.91 0.00 -0.06 0.00 0.05 0.00 0.00 27.48 28.39 3k4b h GLN 212 CO 0.00 0.06 0.03 1.19 -1.50 0.00 0.00 178.83 178.60 3k4b n PHE 213 N -3.32 1.23 0.31 2.96 3.01 -1.26 -4.71 117.46 115.67 3k4b n PHE 213 Ca -0.01 -1.16 0.14 0.00 1.01 0.00 0.00 57.45 57.42 3k4b n PHE 213 Cb 0.22 -0.43 0.39 0.00 -0.01 0.00 0.00 39.48 39.65 3k4b n PHE 213 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 3k4b h LYS 214 N 1.64 0.00 -0.13 -1.08 2.10 -1.83 -2.42 116.57 114.85 3k4b h LYS 214 Ca 0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.77 3k4b h LYS 214 Cb 1.66 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.99 3k4b h LYS 214 CO 0.36 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 178.20 3k4b n GLU 215 N -2.92 1.69 -3.18 0.07 -0.58 -1.26 -4.92 120.64 109.54 3k4b n GLU 215 Ca 0.03 -1.02 -0.39 0.00 -0.42 0.00 0.00 57.16 55.36 3k4b n GLU 215 Cb 0.42 -1.41 -0.06 0.00 -0.57 0.00 0.00 31.44 29.82 3k4b n GLU 215 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3k4b s SER 216 N -1.67 6.75 0.02 1.62 0.15 -0.91 -4.93 113.70 114.73 3k4b s SER 216 Ca 0.34 0.91 -0.25 0.00 0.70 0.00 0.00 55.95 57.65 3k4b s SER 216 Cb 0.18 -2.34 -0.18 0.00 -1.71 0.00 0.00 66.02 61.97 3k4b s SER 216 CO 0.28 -0.13 1.44 0.40 1.20 0.00 0.00 173.24 176.43 3k4b h ILE 217 N 4.90 1.15 -0.50 6.45 2.04 -1.90 -2.13 117.51 127.52 3k4b h ILE 217 Ca -0.38 -0.66 0.07 0.00 1.00 0.00 0.00 64.86 64.90 3k4b h ILE 217 Cb 1.17 1.59 -0.06 0.00 -0.74 0.00 0.00 36.82 38.78 3k4b h ILE 217 CO 0.76 0.17 0.18 0.03 0.00 0.00 0.00 178.15 179.28 3k4b h ARG 218 N -0.35 0.34 -0.45 2.37 3.08 -1.94 -0.65 114.38 116.79 3k4b h ARG 218 Ca -0.01 -0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.09 3k4b h ARG 218 Cb 0.32 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.24 3k4b h ARG 218 CO 0.01 0.23 0.11 1.25 -1.07 0.00 0.00 179.97 180.50 3k4b h HIS 219 N 0.35 0.19 -0.05 3.04 2.76 -1.77 -2.37 115.15 117.30 3k4b h HIS 219 Ca 0.24 0.03 -0.18 0.00 -2.20 0.00 0.00 60.37 58.26 3k4b h HIS 219 Cb 0.26 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.19 3k4b h HIS 219 CO -0.16 0.04 -0.74 -0.91 -1.30 0.00 0.00 177.93 174.86 3k4b h ASN 220 N 0.26 0.33 -0.14 3.26 2.35 -1.06 -1.30 115.58 119.28 3k4b h ASN 220 Ca 0.22 -0.23 0.01 0.00 -0.55 0.00 0.00 56.30 55.75 3k4b h ASN 220 Cb 0.25 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 3k4b h ASN 220 CO -0.26 0.96 0.04 0.25 -1.65 0.00 0.00 177.43 176.77 3k4b h LEU 221 N 0.18 0.04 0.22 1.61 5.85 -0.94 0.22 115.31 122.49 3k4b h LEU 221 Ca -0.03 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 3k4b h LEU 221 Cb 1.31 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.35 3k4b h LEU 221 CO 0.12 0.04 -0.10 0.58 -0.34 0.00 0.00 178.44 178.74 3k4b h VAL 222 N 0.11 0.82 -0.40 1.05 2.07 -1.41 -2.68 116.25 115.81 3k4b h VAL 222 Ca 0.06 -0.86 0.08 0.00 0.82 0.00 0.00 66.70 66.80 3k4b h VAL 222 Cb 0.04 1.27 -0.09 0.00 -1.52 0.00 0.00 31.29 30.99 3k4b h VAL 222 CO -0.06 0.17 -0.18 0.25 0.02 0.00 0.00 177.57 177.77 3k4b h LEU 223 N -0.77 -0.62 -0.46 2.57 5.85 -1.12 -2.03 115.31 118.72 3k4b h LEU 223 Ca -0.03 0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 3k4b h LEU 223 Cb 0.51 0.34 -0.02 0.00 0.37 0.00 0.00 40.66 41.86 3k4b h LEU 223 CO 0.05 -0.22 0.08 0.78 -0.34 0.00 0.00 178.44 178.79 3k4b h ASN 224 N -0.11 0.73 -0.53 1.25 2.35 -0.64 -1.72 115.58 116.91 3k4b h ASN 224 Ca 0.20 -0.26 0.03 0.00 -0.55 0.00 0.00 56.30 55.72 3k4b h ASN 224 Cb 0.41 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.55 3k4b h ASN 224 CO -0.47 0.81 0.31 0.50 -1.65 0.00 0.00 177.43 176.92 3k4b h LYS 225 N 0.63 0.59 -0.32 0.81 1.63 -1.25 -1.26 116.57 117.40 3k4b h LYS 225 Ca 0.14 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.87 3k4b h LYS 225 Cb 0.38 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.87 3k4b h LYS 225 CO 0.01 0.39 0.06 -0.07 -3.45 0.00 0.00 179.45 176.39 3k4b h LEU 226 N 0.61 0.50 -0.77 5.20 3.38 -1.11 0.24 115.31 123.36 3k4b h LEU 226 Ca 0.21 -0.25 0.07 0.00 0.09 0.00 0.00 57.88 58.00 3k4b h LEU 226 Cb 0.04 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.59 3k4b h LEU 226 CO -0.10 0.63 0.45 0.74 0.09 0.00 0.00 178.44 180.24 3k4b h THR 227 N 0.36 0.98 -0.13 0.22 2.02 -1.14 -1.24 112.91 113.98 3k4b h THR 227 Ca 0.10 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 3k4b h THR 227 Cb 0.33 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 3k4b h THR 227 CO 0.00 0.15 0.03 -0.08 0.37 0.00 0.00 175.52 175.99 3k4b h GLU 228 N 0.81 0.21 -0.45 6.66 4.81 -0.52 -2.95 114.58 123.14 3k4b h GLU 228 Ca 0.35 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.47 3k4b h GLU 228 Cb 0.23 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3k4b h GLU 228 CO -0.20 0.38 0.03 0.93 -0.73 0.00 0.00 179.01 179.43 3k4b h GLU 229 N 0.01 0.72 -0.68 1.92 4.39 -0.03 -3.12 114.58 117.78 3k4b h GLU 229 Ca 0.04 -0.17 -0.27 0.00 0.34 0.00 0.00 59.36 59.30 3k4b h GLU 229 Cb 0.26 -0.10 -0.16 0.00 -0.10 0.00 0.00 28.75 28.66 3k4b h GLU 229 CO 0.00 0.71 0.28 0.66 -1.16 0.00 0.00 179.01 179.49 3k4b n TYR 230 N -4.25 2.19 -1.33 4.33 4.02 -0.52 -5.01 117.16 116.58 3k4b n TYR 230 Ca 0.03 -1.43 -0.57 0.00 -0.01 0.00 0.00 57.90 55.92 3k4b n TYR 230 Cb 0.26 -0.68 -0.10 0.00 -0.02 0.00 0.00 39.34 38.80 3k4b n TYR 230 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 3k4b n LYS 231 N -0.67 0.41 -1.28 -0.72 4.81 -1.12 0.21 118.16 119.81 3k4b n LYS 231 Ca 0.43 0.11 -0.10 0.00 -0.87 0.00 0.00 58.31 57.88 3k4b n LYS 231 Cb 1.34 -1.86 -0.04 0.00 0.02 0.00 0.00 35.03 34.49 3k4b n LYS 231 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3k4b n GLY 232 N 7.07 1.11 0.00 3.14 0.00 -1.26 -4.85 105.19 110.40 3k4b n GLY 232 Ca 0.49 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.99 3k4b n GLY 232 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3k4b n GLN 233 N -2.59 0.91 -3.99 1.61 6.02 0.13 -5.09 117.38 114.39 3k4b n GLN 233 Ca -0.10 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.79 3k4b n GLN 233 Cb 0.33 -0.96 -0.11 0.00 1.02 0.00 0.00 30.24 30.52 3k4b n GLN 233 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3k4b s ARG 234 N -1.92 0.32 -0.13 -1.09 0.52 -0.91 -5.12 118.95 110.62 3k4b s ARG 234 Ca 0.00 -0.58 -0.07 0.00 -0.52 0.00 0.00 55.73 54.56 3k4b s ARG 234 Cb 0.00 0.03 -0.04 0.00 0.52 0.00 0.00 34.95 35.46 3k4b s ARG 234 CO 0.00 -0.03 0.12 -0.51 0.02 0.00 0.00 175.30 174.90 3k4b s ASP 235 N -1.34 6.17 0.11 0.23 1.01 -1.26 -4.75 116.67 116.84 3k4b s ASP 235 Ca -0.13 0.37 0.09 0.00 0.71 0.00 0.00 52.55 53.59 3k4b s ASP 235 Cb -0.09 -1.99 -0.04 0.00 1.01 0.00 0.00 42.92 41.81 3k4b s ASP 235 CO -0.01 0.36 -0.18 -0.36 0.21 0.00 0.00 175.17 175.20 3k4b s PHE 236 N -0.75 2.55 0.37 4.23 0.40 -1.26 -4.45 117.98 119.07 3k4b s PHE 236 Ca 0.13 -0.26 -0.10 0.00 -0.60 0.00 0.00 56.93 56.11 3k4b s PHE 236 Cb -0.12 -1.36 0.04 0.00 0.51 0.00 0.00 43.02 42.09 3k4b s PHE 236 CO 0.03 0.38 0.67 0.00 0.70 0.00 0.00 175.22 176.99 3k4b n GLN 237 N 0.86 0.96 -2.64 0.44 10.64 -0.76 -5.01 117.38 121.87 3k4b n GLN 237 Ca -0.16 -2.42 -0.36 0.00 -1.83 0.00 0.00 57.00 52.24 3k4b n GLN 237 Cb 0.53 2.71 -0.05 0.00 -0.86 0.00 0.00 30.24 32.57 3k4b n GLN 237 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.06 174.09 3k4b s GLN 238 N -2.36 4.23 0.09 2.61 0.74 -1.26 -1.79 119.66 121.91 3k4b s GLN 238 Ca 0.21 1.39 -0.31 0.00 0.05 0.00 0.00 55.36 56.70 3k4b s GLN 238 Cb -0.03 -2.49 -0.08 0.00 1.10 0.00 0.00 33.01 31.51 3k4b s GLN 238 CO 0.15 -0.06 1.53 0.42 -0.55 0.00 0.00 175.29 176.77 3k4b s ILE 239 N -1.77 3.12 0.13 -2.34 1.01 -0.15 -4.73 121.20 116.48 3k4b s ILE 239 Ca 0.58 0.69 -0.31 0.00 0.00 0.00 0.00 60.65 61.61 3k4b s ILE 239 Cb -0.18 -3.44 -0.10 0.00 0.01 0.00 0.00 42.46 38.74 3k4b s ILE 239 CO 0.23 0.02 1.67 -2.84 0.00 0.00 0.00 174.94 174.03 3k4b s PRO 240 N 1.86 4.18 -0.02 2.79 0.02 -1.26 -4.83 135.00 137.73 3k4b s PRO 240 Ca 0.69 2.43 0.02 0.00 0.02 0.00 0.00 61.00 64.17 3k4b s PRO 240 Cb -0.39 -3.37 0.00 0.00 0.02 0.00 0.00 34.50 30.77 3k4b s PRO 240 CO 0.30 -0.71 -0.08 -0.51 -0.33 0.00 0.00 177.00 175.67 3k4b s LEU 241 N 1.93 1.76 -0.93 -5.54 1.43 -0.67 -1.25 118.68 115.42 3k4b s LEU 241 Ca 0.74 -0.16 -0.23 0.00 -1.03 0.00 0.00 54.13 53.45 3k4b s LEU 241 Cb -0.44 -0.49 0.06 0.00 0.03 0.00 0.00 46.19 45.35 3k4b s LEU 241 CO 0.33 0.05 1.33 0.00 0.23 0.00 0.00 176.35 178.29 3k4b s ALA 242 N 0.23 2.85 -0.21 4.21 0.00 -0.09 -1.47 121.76 127.30 3k4b s ALA 242 Ca -0.03 -2.16 -0.28 0.00 0.00 0.00 0.00 51.96 49.49 3k4b s ALA 242 Cb -0.08 -4.36 0.12 0.00 0.00 0.00 0.00 23.12 18.80 3k4b s ALA 242 CO 0.00 -3.40 0.99 0.00 0.00 0.00 0.00 175.76 173.35 3k4b s ALA 243 N 4.67 -1.94 -0.11 0.00 0.00 -1.15 -0.78 121.76 122.45 3k4b s ALA 243 Ca 0.40 1.70 -0.00 0.00 0.00 0.00 0.00 51.96 54.06 3k4b s ALA 243 Cb -0.03 -0.98 0.03 0.00 0.00 0.00 0.00 23.12 22.13 3k4b s ALA 243 CO -0.04 -0.28 -0.08 0.99 0.00 0.00 0.00 175.76 176.35 3k4b s THR 244 N -0.54 1.02 0.20 0.00 2.01 0.11 -4.59 115.64 113.85 3k4b s THR 244 Ca -0.00 -0.29 -0.30 0.00 0.31 0.00 0.00 61.69 61.41 3k4b s THR 244 Cb -0.02 -1.04 -0.08 0.00 0.01 0.00 0.00 72.50 71.36 3k4b s THR 244 CO -0.01 0.36 1.21 -0.60 -0.69 0.00 0.00 174.62 174.89 3k4b s ARG 245 N 1.71 4.48 -0.15 4.92 3.52 -1.26 0.12 118.95 132.29 3k4b s ARG 245 Ca 0.05 1.91 0.10 0.00 -0.13 0.00 0.00 55.73 57.66 3k4b s ARG 245 Cb -0.13 -3.22 -0.17 0.00 -1.56 0.00 0.00 34.95 29.87 3k4b s ARG 245 CO -0.08 -0.09 0.00 0.54 -0.81 0.00 0.00 175.30 174.86 3k4b n ARG 246 N 2.37 1.35 -3.80 5.12 5.12 -0.43 -4.88 116.66 121.50 3k4b n ARG 246 Ca 0.04 0.02 -0.09 0.00 -1.93 0.00 0.00 57.85 55.89 3k4b n ARG 246 Cb 0.44 -1.37 0.03 0.00 -1.16 0.00 0.00 32.46 30.40 3k4b n ARG 246 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 3k4b s SER 247 N -5.03 0.03 0.32 0.55 1.04 -0.98 -4.97 113.70 104.67 3k4b s SER 247 Ca -0.11 -1.20 0.25 0.00 0.48 0.00 0.00 55.95 55.37 3k4b s SER 247 Cb 0.05 0.86 1.14 0.00 0.10 0.00 0.00 66.02 68.17 3k4b s SER 247 CO 0.56 -1.73 1.76 -0.65 0.98 0.00 0.00 173.24 174.16 3k4b h PRO 248 N 2.00 0.00 0.00 4.02 0.11 -2.00 -3.01 132.00 133.12 3k4b h PRO 248 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3k4b h PRO 248 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3k4b h PRO 248 CO 0.42 0.00 -0.04 0.25 -0.21 0.00 0.00 178.00 178.42 3k4b n THR 249 N -2.37 0.91 -3.72 -1.15 -2.24 -1.26 -4.84 114.28 99.61 3k4b n THR 249 Ca 0.01 -0.99 -0.14 0.00 -2.27 0.00 0.00 64.05 60.67 3k4b n THR 249 Cb 0.18 0.44 -0.14 0.00 -2.10 0.00 0.00 70.33 68.71 3k4b n THR 249 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3k4b s PHE 250 N -1.12 -0.27 -0.13 4.78 2.19 -1.14 -4.91 117.98 117.39 3k4b s PHE 250 Ca 0.07 0.69 0.02 0.00 0.33 0.00 0.00 56.93 58.04 3k4b s PHE 250 Cb 0.06 -0.05 0.01 0.00 -1.31 0.00 0.00 43.02 41.73 3k4b s PHE 250 CO 0.01 -0.23 -0.21 0.08 1.83 0.00 0.00 175.22 176.70 3k4b s VAL 251 N 1.53 1.92 -0.69 3.12 1.01 -1.26 -1.31 120.40 124.71 3k4b s VAL 251 Ca -0.06 -0.90 -0.23 0.00 0.00 0.00 0.00 61.98 60.79 3k4b s VAL 251 Cb -0.11 -1.70 0.07 0.00 0.00 0.00 0.00 36.38 34.63 3k4b s VAL 251 CO -0.07 0.52 1.03 -0.70 0.00 0.00 0.00 175.10 175.88 3k4b s GLU 252 N 0.80 3.14 0.11 2.72 2.12 0.12 -4.84 118.70 122.88 3k4b s GLU 252 Ca -0.08 -0.77 -0.30 0.00 0.36 0.00 0.00 54.97 54.18 3k4b s GLU 252 Cb -0.16 -4.26 -0.07 0.00 0.26 0.00 0.00 34.13 29.91 3k4b s GLU 252 CO -0.01 -1.88 1.19 -1.58 -0.54 0.00 0.00 175.26 172.45 3k4b s TRP 253 N 4.31 3.45 0.69 5.30 0.52 -1.26 -0.71 118.94 131.24 3k4b s TRP 253 Ca 0.25 1.37 -0.11 0.00 0.02 0.00 0.00 56.10 57.63 3k4b s TRP 253 Cb -0.15 -3.41 0.01 0.00 -1.15 0.00 0.00 33.47 28.77 3k4b s TRP 253 CO 0.10 -1.19 1.06 -1.12 0.02 0.00 0.00 176.95 175.82 3k4b s SER 254 N 0.63 5.41 0.00 2.95 0.01 0.04 -4.56 113.70 118.18 3k4b s SER 254 Ca 0.56 1.61 0.00 0.00 1.31 0.00 0.00 55.95 59.43 3k4b s SER 254 Cb -0.31 -2.49 0.00 0.00 0.21 0.00 0.00 66.02 63.43 3k4b s SER 254 CO 0.32 -1.42 0.00 -1.54 0.41 0.00 0.00 173.24 171.01 3k4b n SER 255 N -3.11 0.00 -0.34 2.44 3.41 -1.26 -4.76 113.62 109.99 3k4b n SER 255 Ca 0.07 -0.78 0.13 0.00 -0.26 0.00 0.00 58.87 58.03 3k4b n SER 255 Cb 0.54 0.00 0.33 0.00 -0.26 0.00 0.00 64.21 64.81 3k4b n SER 255 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k4b h ALA 256 N 2.00 1.70 -0.47 7.33 0.00 -1.78 0.14 119.26 128.18 3k4b h ALA 256 Ca 0.00 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3k4b h ALA 256 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3k4b h ALA 256 CO 0.00 -0.04 0.31 -0.97 0.00 0.00 0.00 179.25 178.55 3k4b h ASN 257 N 0.77 0.50 -0.20 0.00 -0.73 -1.67 -0.69 115.58 113.57 3k4b h ASN 257 Ca 0.56 -0.01 -0.10 0.00 1.87 0.00 0.00 56.30 58.62 3k4b h ASN 257 Cb 0.85 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 39.31 3k4b h ASN 257 CO -0.34 0.36 -0.21 0.74 -0.37 0.00 0.00 177.43 177.61 3k4b h THR 258 N 0.59 1.26 -0.04 -3.57 2.02 -1.06 -2.89 112.91 109.22 3k4b h THR 258 Ca 0.18 -1.26 -0.06 0.00 0.77 0.00 0.00 66.41 66.04 3k4b h THR 258 Cb -0.00 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3k4b h THR 258 CO -0.04 0.41 -0.19 0.58 0.37 0.00 0.00 175.52 176.65 3k4b h VAL 259 N 0.57 1.46 -2.46 3.16 2.07 -0.98 -3.46 116.25 116.61 3k4b h VAL 259 Ca 0.09 -1.65 -0.08 0.00 0.82 0.00 0.00 66.70 65.88 3k4b h VAL 259 Cb 0.67 2.42 -0.24 0.00 -1.52 0.00 0.00 31.29 32.61 3k4b h VAL 259 CO 0.05 0.46 -0.18 0.12 0.02 0.00 0.00 177.57 178.03 3k4b s PHE 260 N -3.63 -0.71 -1.38 1.57 5.36 -0.42 -4.78 117.98 113.98 3k4b s PHE 260 Ca -0.15 1.51 0.28 0.00 -0.96 0.00 0.00 56.93 57.61 3k4b s PHE 260 Cb 0.02 0.34 1.39 0.00 -0.34 0.00 0.00 43.02 44.43 3k4b s PHE 260 CO 0.74 -0.37 1.95 -0.40 -1.46 0.00 0.00 175.22 175.68 3k4b n ASP 261 N 3.96 0.00 -0.34 6.13 5.68 -1.22 -4.01 116.55 126.75 3k4b n ASP 261 Ca -0.20 -0.05 -0.04 0.00 -0.50 0.00 0.00 54.79 54.00 3k4b n ASP 261 Cb 0.56 -0.31 -0.02 0.00 -1.14 0.00 0.00 41.12 40.22 3k4b n ASP 261 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3k4b n LEU 262 N -1.31 0.32 -4.76 -2.12 4.77 -1.26 -4.16 117.00 108.48 3k4b n LEU 262 Ca 0.13 0.11 -0.41 0.00 -0.03 0.00 0.00 56.01 55.81 3k4b n LEU 262 Cb 0.23 -2.28 -0.04 0.00 -2.33 0.00 0.00 43.42 39.01 3k4b n LEU 262 CO 0.22 -0.87 0.83 -1.10 -1.33 0.00 0.00 177.39 175.14 3k4b s GLN 263 N -2.14 4.57 0.48 3.23 -1.52 -1.26 -4.77 119.66 118.25 3k4b s GLN 263 Ca 0.00 1.87 -0.23 0.00 -1.95 0.00 0.00 55.36 55.05 3k4b s GLN 263 Cb 0.00 -3.19 -0.07 0.00 -0.22 0.00 0.00 33.01 29.54 3k4b s GLN 263 CO 0.00 0.10 1.30 -0.80 -0.25 0.00 0.00 175.29 175.64 3k4b s ASN 264 N -0.61 5.82 0.08 5.90 0.01 -1.26 -4.88 114.94 119.99 3k4b s ASN 264 Ca 0.47 2.64 0.03 0.00 -0.71 0.00 0.00 52.86 55.28 3k4b s ASN 264 Cb -0.33 -2.63 -0.03 0.00 0.41 0.00 0.00 41.25 38.67 3k4b s ASN 264 CO 0.42 -1.19 -0.09 -0.13 -1.51 0.00 0.00 177.10 174.60 3k4b s ARG 265 N -2.64 0.74 0.61 -0.60 0.52 0.10 -4.39 118.95 113.29 3k4b s ARG 265 Ca 0.65 -1.06 -0.19 0.00 -0.52 0.00 0.00 55.73 54.60 3k4b s ARG 265 Cb -0.37 -0.39 -0.02 0.00 0.52 0.00 0.00 34.95 34.68 3k4b s ARG 265 CO 0.46 0.05 1.33 -2.30 0.02 0.00 0.00 175.30 174.86 3k4b n PRO 266 N 0.74 1.35 -3.32 3.54 -0.02 -0.11 -1.75 135.00 135.43 3k4b n PRO 266 Ca -0.17 0.52 -0.10 0.00 -2.02 0.00 0.00 63.50 61.72 3k4b n PRO 266 Cb 0.57 -2.56 -0.01 0.00 -0.02 0.00 0.00 33.50 31.48 3k4b n PRO 266 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3k4b n ASN 267 N -1.57 -1.17 -0.22 2.55 0.23 -0.95 -4.97 115.26 109.16 3k4b n ASN 267 Ca 0.14 -2.38 -0.08 0.00 -0.53 0.00 0.00 54.58 51.73 3k4b n ASN 267 Cb 0.47 2.12 0.03 0.00 -2.08 0.00 0.00 39.78 40.31 3k4b n ASN 267 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 3k4b h THR 268 N 1.76 1.25 -0.00 5.53 2.02 -1.96 0.12 112.91 121.62 3k4b h THR 268 Ca -0.21 -0.88 0.00 0.00 0.77 0.00 0.00 66.41 66.09 3k4b h THR 268 Cb 0.90 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 3k4b h THR 268 CO 0.29 0.33 -0.06 0.47 0.37 0.00 0.00 175.52 176.92 3k4b n ASP 269 N -4.36 0.55 -3.09 4.18 8.00 -1.26 -4.18 116.55 116.39 3k4b n ASP 269 Ca 0.03 -0.85 -0.20 0.00 0.71 0.00 0.00 54.79 54.48 3k4b n ASP 269 Cb 0.23 -0.04 -0.04 0.00 -0.02 0.00 0.00 41.12 41.24 3k4b n ASP 269 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k4b n ALA 270 N -0.75 1.57 0.95 2.24 0.00 0.25 -5.02 120.51 119.76 3k4b n ALA 270 Ca 0.18 -2.96 0.14 0.00 0.00 0.00 0.00 53.44 50.79 3k4b n ALA 270 Cb 0.25 -0.93 0.59 0.00 0.00 0.00 0.00 19.45 19.36 3k4b n ALA 270 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3k4b n PRO 271 N 1.40 0.01 -0.28 0.00 -0.04 -0.20 -2.24 135.00 133.65 3k4b n PRO 271 Ca 0.18 0.03 0.07 0.00 -0.04 0.00 0.00 63.50 63.74 3k4b n PRO 271 Cb 0.56 -1.52 0.19 0.00 -0.04 0.00 0.00 33.50 32.69 3k4b n PRO 271 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3k4b n GLU 272 N -1.54 2.73 -4.16 0.54 -0.58 -1.26 -4.70 120.64 111.67 3k4b n GLU 272 Ca 0.07 -2.45 -0.22 0.00 -0.42 0.00 0.00 57.16 54.13 3k4b n GLU 272 Cb 0.33 -1.56 -0.06 0.00 -0.57 0.00 0.00 31.44 29.59 3k4b n GLU 272 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 3k4b s GLU 273 N -2.11 2.59 -0.24 3.49 2.02 -1.10 -4.94 118.70 118.41 3k4b s GLU 273 Ca 0.32 -1.28 -0.04 0.00 0.02 0.00 0.00 54.97 53.99 3k4b s GLU 273 Cb 0.24 -2.35 0.08 0.00 0.10 0.00 0.00 34.13 32.20 3k4b s GLU 273 CO 0.10 0.33 0.10 1.03 0.02 0.00 0.00 175.26 176.84 3k4b s ARG 274 N -3.79 0.27 -0.09 1.61 0.52 -1.26 -0.94 118.95 115.28 3k4b s ARG 274 Ca 0.33 -0.43 -0.05 0.00 -0.52 0.00 0.00 55.73 55.06 3k4b s ARG 274 Cb -0.06 -1.61 0.04 0.00 0.52 0.00 0.00 34.95 33.83 3k4b s ARG 274 CO 0.23 -0.85 0.21 0.12 0.02 0.00 0.00 175.30 175.03 3k4b s PHE 275 N 2.02 -0.26 -0.04 -0.53 5.36 -0.72 -0.78 117.98 123.04 3k4b s PHE 275 Ca 0.05 0.64 0.04 0.00 -0.96 0.00 0.00 56.93 56.70 3k4b s PHE 275 Cb -0.16 0.03 -0.00 0.00 -0.34 0.00 0.00 43.02 42.55 3k4b s PHE 275 CO -0.22 -0.17 -0.16 -0.80 -1.46 0.00 0.00 175.22 172.41 3k4b s ASN 276 N 0.84 1.98 -0.18 6.13 -0.87 -0.36 0.02 114.94 122.49 3k4b s ASN 276 Ca -0.06 -0.32 -0.07 0.00 -1.57 0.00 0.00 52.86 50.83 3k4b s ASN 276 Cb -0.07 -0.56 -0.04 0.00 -0.02 0.00 0.00 41.25 40.55 3k4b s ASN 276 CO -0.05 0.13 0.06 -0.22 -2.57 0.00 0.00 177.10 174.46 3k4b s LEU 277 N 0.09 3.80 -0.52 0.60 2.96 -1.26 -0.81 118.68 123.54 3k4b s LEU 277 Ca -0.04 0.07 -0.01 0.00 -0.22 0.00 0.00 54.13 53.93 3k4b s LEU 277 Cb -0.11 -1.96 0.13 0.00 0.50 0.00 0.00 46.19 44.75 3k4b s LEU 277 CO 0.02 0.17 0.30 -0.36 -1.32 0.00 0.00 176.35 175.16 3k4b s PHE 278 N 0.41 3.47 0.65 5.38 0.08 0.13 -4.97 117.98 123.13 3k4b s PHE 278 Ca 0.03 -2.71 -0.14 0.00 0.12 0.00 0.00 56.93 54.23 3k4b s PHE 278 Cb -0.12 -3.13 -0.01 0.00 -0.57 0.00 0.00 43.02 39.19 3k4b s PHE 278 CO 0.00 -0.88 1.07 -1.25 -0.10 0.00 0.00 175.22 174.06 3k4b s PRO 279 N 0.37 3.00 -1.14 0.24 0.05 -1.26 -0.91 135.00 135.35 3k4b s PRO 279 Ca 0.14 1.15 -0.04 0.00 0.05 0.00 0.00 61.00 62.30 3k4b s PRO 279 Cb -0.22 -1.99 0.00 0.00 0.05 0.00 0.00 34.50 32.35 3k4b s PRO 279 CO -0.04 -1.06 0.53 0.00 0.05 0.00 0.00 177.00 176.49 3k4b n ALA 280 N -2.59 -0.77 -4.02 8.56 0.00 -0.09 -4.85 120.51 116.75 3k4b n ALA 280 Ca 0.09 0.23 -0.31 0.00 0.00 0.00 0.00 53.44 53.45 3k4b n ALA 280 Cb 0.53 -3.27 -0.16 0.00 0.00 0.00 0.00 19.45 16.56 3k4b n ALA 280 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3k4b s VAL 281 N -3.06 1.77 -0.24 0.00 1.01 -0.23 -0.67 120.40 118.98 3k4b s VAL 281 Ca 0.26 -1.12 -0.26 0.00 0.00 0.00 0.00 61.98 60.86 3k4b s VAL 281 Cb -0.12 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.43 3k4b s VAL 281 CO 0.33 0.16 0.91 0.00 0.00 0.00 0.00 175.10 176.50 3k4b s ALA 282 N 1.33 3.66 -0.18 5.51 0.00 -0.24 -2.45 121.76 129.40 3k4b s ALA 282 Ca -0.02 -0.02 -0.17 0.00 0.00 0.00 0.00 51.96 51.75 3k4b s ALA 282 Cb -0.17 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 3k4b s ALA 282 CO -0.08 -1.00 0.43 0.00 0.00 0.00 0.00 175.76 175.11 3k4b n GLU 284 N 4.26 1.20 -3.67 0.00 1.02 -0.07 -4.94 120.64 118.43 3k4b n GLU 284 Ca -0.08 0.04 -0.14 0.00 -0.02 0.00 0.00 57.16 56.96 3k4b n GLU 284 Cb 0.51 -1.34 -0.08 0.00 -0.02 0.00 0.00 31.44 30.51 3k4b n GLU 284 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3k4b s ARG 285 N -2.33 0.70 -0.01 3.49 0.52 -1.23 -4.74 118.95 115.35 3k4b s ARG 285 Ca -0.14 0.60 -0.02 0.00 -0.52 0.00 0.00 55.73 55.65 3k4b s ARG 285 Cb 0.05 0.33 -0.04 0.00 0.52 0.00 0.00 34.95 35.81 3k4b s ARG 285 CO 0.48 -0.12 0.16 0.14 0.02 0.00 0.00 175.30 175.98 3k4b s VAL 286 N -0.06 5.30 -0.34 3.52 -7.23 -1.26 -0.51 120.40 119.82 3k4b s VAL 286 Ca -0.03 -0.21 -0.14 0.00 -1.81 0.00 0.00 61.98 59.79 3k4b s VAL 286 Cb -0.03 -3.47 -0.02 0.00 0.56 0.00 0.00 36.38 33.42 3k4b s VAL 286 CO 0.02 0.33 0.32 -0.69 -0.31 0.00 0.00 175.10 174.77 3k4b s VAL 287 N -1.30 5.21 0.40 1.32 1.01 0.39 -4.79 120.40 122.65 3k4b s VAL 287 Ca 0.26 -0.02 -0.24 0.00 0.00 0.00 0.00 61.98 61.98 3k4b s VAL 287 Cb -0.12 -3.78 -0.09 0.00 0.00 0.00 0.00 36.38 32.39 3k4b s VAL 287 CO 0.18 -0.05 1.05 -0.13 0.00 0.00 0.00 175.10 176.15 3k4b s ARG 288 N 1.92 4.14 0.87 2.72 0.52 -1.26 -0.88 118.95 126.98 3k4b s ARG 288 Ca 0.10 1.51 -0.12 0.00 -0.52 0.00 0.00 55.73 56.70 3k4b s ARG 288 Cb -0.17 -2.52 0.11 0.00 0.52 0.00 0.00 34.95 32.90 3k4b s ARG 288 CO 0.11 -0.16 1.13 0.54 0.02 0.00 0.00 175.30 176.93 3k4b s ASN 289 N -1.57 3.85 0.40 0.23 4.22 -0.39 -4.85 114.94 116.81 3k4b s ASN 289 Ca 0.58 1.07 0.11 0.00 -2.14 0.00 0.00 52.86 52.48 3k4b s ASN 289 Cb -0.22 -1.69 0.82 0.00 1.28 0.00 0.00 41.25 41.44 3k4b s ASN 289 CO 0.27 -2.35 1.93 0.00 -2.04 0.00 0.00 177.10 174.91 3k4b h ALA 290 N -1.36 1.54 0.00 3.54 0.00 -1.97 -1.26 119.26 119.75 3k4b h ALA 290 Ca -0.49 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.22 3k4b h ALA 290 Cb 1.31 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3k4b h ALA 290 CO 0.61 0.33 0.00 1.28 0.00 0.00 0.00 179.25 181.47 3k4b n LEU 291 N -4.28 0.28 -3.87 0.00 4.77 -1.26 -4.90 117.00 107.75 3k4b n LEU 291 Ca -0.01 0.56 -0.27 0.00 -0.03 0.00 0.00 56.01 56.25 3k4b n LEU 291 Cb 0.27 -0.50 0.02 0.00 -2.33 0.00 0.00 43.42 40.88 3k4b n LEU 291 CO 0.38 -0.30 0.02 0.59 -1.33 0.00 0.00 177.39 176.75 3k4b n ASN 292 N -1.80 -3.28 0.00 -1.43 3.02 -0.48 -4.91 115.26 106.39 3k4b n ASN 292 Ca 0.04 -0.82 0.00 0.00 -0.03 0.00 0.00 54.58 53.77 3k4b n ASN 292 Cb 0.24 -3.83 0.00 0.00 -0.61 0.00 0.00 39.78 35.59 3k4b n ASN 292 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3k4b n SER 293 N -2.91 0.24 -3.55 6.41 3.41 -1.26 -4.44 113.62 111.52 3k4b n SER 293 Ca -0.09 -0.62 -0.15 0.00 -0.26 0.00 0.00 58.87 57.76 3k4b n SER 293 Cb 0.58 0.74 -0.06 0.00 -0.26 0.00 0.00 64.21 65.22 3k4b n SER 293 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3k4b s GLU 294 N -0.74 0.86 0.04 4.33 2.12 -1.26 -1.42 118.70 122.63 3k4b s GLU 294 Ca 0.00 0.32 -0.18 0.00 0.36 0.00 0.00 54.97 55.47 3k4b s GLU 294 Cb 0.00 0.41 -0.06 0.00 0.26 0.00 0.00 34.13 34.74 3k4b s GLU 294 CO 0.00 -0.25 0.52 0.42 -0.54 0.00 0.00 175.26 175.41 3k4b s ILE 295 N -0.93 4.85 -0.06 -3.70 -1.09 -1.26 -1.27 121.20 117.74 3k4b s ILE 295 Ca -0.06 1.09 0.08 0.00 -2.23 0.00 0.00 60.65 59.53 3k4b s ILE 295 Cb -0.01 -3.84 -0.11 0.00 -1.58 0.00 0.00 42.46 36.92 3k4b s ILE 295 CO 0.06 0.55 0.08 -0.62 -1.23 0.00 0.00 174.94 173.77 3k4b n GLU 296 N 1.87 1.96 -3.56 2.79 -0.58 -0.06 -4.94 120.64 118.12 3k4b n GLU 296 Ca -0.11 -0.03 -0.10 0.00 -0.42 0.00 0.00 57.16 56.50 3k4b n GLU 296 Cb 0.51 -1.22 -0.02 0.00 -0.57 0.00 0.00 31.44 30.15 3k4b n GLU 296 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3k4b s SER 297 N -3.76 -0.45 -0.14 1.62 1.04 -1.25 -4.69 113.70 106.08 3k4b s SER 297 Ca -0.04 -0.17 0.01 0.00 0.48 0.00 0.00 55.95 56.23 3k4b s SER 297 Cb 0.03 0.60 -0.00 0.00 0.10 0.00 0.00 66.02 66.75 3k4b s SER 297 CO 0.35 -1.02 -0.17 -0.22 0.98 0.00 0.00 173.24 173.16 3k4b s LEU 298 N -2.77 2.43 -0.21 2.42 2.96 0.15 -0.46 118.68 123.20 3k4b s LEU 298 Ca 0.05 -0.47 -0.13 0.00 -0.22 0.00 0.00 54.13 53.36 3k4b s LEU 298 Cb -0.02 -1.54 -0.05 0.00 0.50 0.00 0.00 46.19 45.08 3k4b s LEU 298 CO -0.07 0.11 0.27 -1.00 -1.32 0.00 0.00 176.35 174.35 3k4b s HIS 299 N 0.64 3.37 0.24 5.38 3.76 0.34 0.09 115.29 129.11 3k4b s HIS 299 Ca -0.09 0.44 0.06 0.00 -0.15 0.00 0.00 55.06 55.33 3k4b s HIS 299 Cb -0.16 -2.37 -0.05 0.00 1.11 0.00 0.00 32.58 31.11 3k4b s HIS 299 CO 0.02 0.08 -0.08 0.96 -0.85 0.00 0.00 174.74 174.88 3k4b s ILE 300 N 1.01 1.51 -0.22 0.60 -4.36 0.19 -0.89 121.20 119.04 3k4b s ILE 300 Ca 0.13 -2.13 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 3k4b s ILE 300 Cb -0.14 -2.26 0.06 0.00 1.25 0.00 0.00 42.46 41.36 3k4b s ILE 300 CO 0.05 -0.43 -0.05 -2.28 0.24 0.00 0.00 174.94 172.48 3k4b s HIS 301 N -3.11 2.16 -0.31 1.37 5.65 0.53 -0.76 115.29 120.83 3k4b s HIS 301 Ca 0.26 -1.55 -0.29 0.00 0.25 0.00 0.00 55.06 53.73 3k4b s HIS 301 Cb 0.03 -1.49 0.01 0.00 -1.18 0.00 0.00 32.58 29.94 3k4b s HIS 301 CO 0.09 -0.73 1.20 0.34 -0.65 0.00 0.00 174.74 174.99 3k4b s ASP 302 N 1.48 6.79 0.41 9.88 -1.08 -0.01 -1.07 116.67 133.06 3k4b s ASP 302 Ca -0.04 1.14 0.22 0.00 -0.52 0.00 0.00 52.55 53.35 3k4b s ASP 302 Cb -0.18 -2.54 0.48 0.00 -1.46 0.00 0.00 42.92 39.22 3k4b s ASP 302 CO -0.07 -0.99 1.64 -0.07 0.52 0.00 0.00 175.17 176.20 3k4b h LEU 303 N 10.52 0.00 0.07 -1.34 3.38 -1.19 0.18 115.31 126.93 3k4b h LEU 303 Ca -0.24 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.60 3k4b h LEU 303 Cb 1.08 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.84 3k4b h LEU 303 CO 1.03 0.18 -0.60 0.40 0.09 0.00 0.00 178.44 179.54 3k4b h ILE 304 N 0.00 1.52 0.00 1.22 2.04 -1.91 -3.33 117.51 117.05 3k4b h ILE 304 Ca -0.00 -2.42 -0.01 0.00 1.00 0.00 0.00 64.86 63.43 3k4b h ILE 304 Cb 1.01 3.14 -0.00 0.00 -0.74 0.00 0.00 36.82 40.23 3k4b h ILE 304 CO 0.02 0.64 -0.35 0.77 0.00 0.00 0.00 178.15 179.23 3k4b h SER 305 N -0.66 0.00 0.00 1.72 4.64 -1.94 -3.47 113.55 113.83 3k4b h SER 305 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 3k4b h SER 305 Cb 1.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 3k4b h SER 305 CO 0.05 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 3k4b n GLY 306 N 1.14 1.34 3.84 -0.77 0.00 0.63 -5.01 105.19 106.36 3k4b n GLY 306 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 3k4b n GLY 306 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3k4b s ASP 307 N -3.16 6.78 -0.03 1.61 1.01 -1.20 -4.80 116.67 116.89 3k4b s ASP 307 Ca 0.00 1.40 -0.01 0.00 0.71 0.00 0.00 52.55 54.66 3k4b s ASP 307 Cb 0.00 -2.43 -0.04 0.00 1.01 0.00 0.00 42.92 41.47 3k4b s ASP 307 CO 0.00 -0.30 0.05 -0.13 0.21 0.00 0.00 175.17 175.00 3k4b s ARG 308 N -3.21 3.00 0.33 8.23 0.52 -1.26 -0.83 118.95 125.73 3k4b s ARG 308 Ca 0.56 -0.47 0.04 0.00 -0.52 0.00 0.00 55.73 55.34 3k4b s ARG 308 Cb -0.10 -2.82 -0.03 0.00 0.52 0.00 0.00 34.95 32.52 3k4b s ARG 308 CO 0.19 0.66 0.19 -0.06 0.02 0.00 0.00 175.30 176.30 3k4b s PHE 309 N -1.08 1.67 0.14 -0.53 0.08 0.06 -5.00 117.98 113.32 3k4b s PHE 309 Ca 0.19 -1.44 0.10 0.00 0.12 0.00 0.00 56.93 55.90 3k4b s PHE 309 Cb -0.12 -0.87 -0.04 0.00 -0.57 0.00 0.00 43.02 41.42 3k4b s PHE 309 CO 0.10 -0.58 -0.24 -1.21 -0.10 0.00 0.00 175.22 173.19 3k4b s GLU 310 N -3.70 1.32 -0.08 0.44 8.01 -1.26 -0.64 118.70 122.80 3k4b s GLU 310 Ca 0.35 -1.33 -0.00 0.00 0.01 0.00 0.00 54.97 54.00 3k4b s GLU 310 Cb 0.04 -1.66 0.02 0.00 -4.31 0.00 0.00 34.13 28.22 3k4b s GLU 310 CO 0.20 0.38 -0.05 0.42 0.01 0.00 0.00 175.26 176.22 3k4b s ILE 311 N -1.32 0.68 -0.04 -1.63 -1.09 0.11 -4.95 121.20 112.96 3k4b s ILE 311 Ca 0.13 -0.12 -0.15 0.00 -2.23 0.00 0.00 60.65 58.28 3k4b s ILE 311 Cb -0.09 -0.74 -0.05 0.00 -1.58 0.00 0.00 42.46 40.00 3k4b s ILE 311 CO 0.06 0.29 0.40 -0.75 -1.23 0.00 0.00 174.94 173.72 3k4b s LYS 312 N 1.48 4.03 0.10 2.79 2.47 -1.26 -0.68 119.74 128.67 3k4b s LYS 312 Ca -0.01 0.37 -0.04 0.00 -1.56 0.00 0.00 55.97 54.73 3k4b s LYS 312 Cb -0.13 -3.29 -0.03 0.00 -1.46 0.00 0.00 37.83 32.93 3k4b s LYS 312 CO -0.04 0.54 0.09 0.00 0.16 0.00 0.00 175.35 176.10 3k4b s ALA 313 N -0.57 0.37 0.15 3.13 0.00 -1.26 -1.59 121.76 121.99 3k4b s ALA 313 Ca 0.23 -1.10 -0.09 0.00 0.00 0.00 0.00 51.96 51.00 3k4b s ALA 313 Cb -0.16 0.57 -0.01 0.00 0.00 0.00 0.00 23.12 23.52 3k4b s ALA 313 CO 0.11 -0.47 1.45 -0.44 0.00 0.00 0.00 175.76 176.41 3k4b h ASP 314 N 2.89 0.88 -3.31 0.00 3.32 -1.16 -3.46 116.42 115.58 3k4b h ASP 314 Ca -0.34 -0.46 -0.53 0.00 0.02 0.00 0.00 57.03 55.72 3k4b h ASP 314 Cb 1.18 -0.25 -0.35 0.00 0.22 0.00 0.00 39.33 40.13 3k4b h ASP 314 CO 0.59 1.23 -0.82 -0.69 -1.72 0.00 0.00 179.24 177.84 3k4b s VAL 315 N -4.16 1.18 -0.19 -1.35 1.01 -0.26 -4.80 120.40 111.84 3k4b s VAL 315 Ca -0.10 -0.46 -0.03 0.00 0.00 0.00 0.00 61.98 61.40 3k4b s VAL 315 Cb 0.11 -1.12 -0.01 0.00 0.00 0.00 0.00 36.38 35.36 3k4b s VAL 315 CO 0.87 0.38 -0.07 -0.31 0.00 0.00 0.00 175.10 175.97 3k4b s TYR 316 N 1.05 2.93 -0.17 5.22 1.51 -0.42 -0.64 117.35 126.82 3k4b s TYR 316 Ca -0.07 -0.81 -0.00 0.00 -1.01 0.00 0.00 57.07 55.18 3k4b s TYR 316 Cb -0.15 -2.02 0.00 0.00 -0.11 0.00 0.00 41.96 39.69 3k4b s TYR 316 CO -0.01 -0.41 -0.15 0.08 -1.11 0.00 0.00 175.55 173.95 3k4b s VAL 317 N 1.06 2.62 -0.31 0.71 1.01 0.25 -1.07 120.40 124.67 3k4b s VAL 317 Ca 0.01 -0.77 -0.10 0.00 0.00 0.00 0.00 61.98 61.12 3k4b s VAL 317 Cb -0.15 -2.12 -0.00 0.00 0.00 0.00 0.00 36.38 34.11 3k4b s VAL 317 CO -0.01 0.50 0.15 -0.76 0.00 0.00 0.00 175.10 174.99 3k4b s LEU 318 N 1.08 4.14 -0.41 3.92 1.43 0.15 -1.11 118.68 127.89 3k4b s LEU 318 Ca -0.00 -0.57 0.11 0.00 -1.03 0.00 0.00 54.13 52.64 3k4b s LEU 318 Cb -0.14 -2.00 0.37 0.00 0.03 0.00 0.00 46.19 44.45 3k4b s LEU 318 CO -0.04 -0.21 0.84 0.35 0.23 0.00 0.00 176.35 177.52 3k4b n THR 319 N 4.98 0.88 -0.24 5.49 -2.24 0.40 -1.19 114.28 122.36 3k4b n THR 319 Ca -0.14 -4.51 0.11 0.00 -2.27 0.00 0.00 64.05 57.25 3k4b n THR 319 Cb 0.49 -0.37 0.29 0.00 -2.10 0.00 0.00 70.33 68.64 3k4b n THR 319 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k4b n ALA 320 N 0.05 2.37 0.00 6.98 0.00 -1.17 -4.28 120.51 124.47 3k4b n ALA 320 Ca 0.24 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.44 3k4b n ALA 320 Cb 0.64 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 19.20 3k4b n ALA 320 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k4b n GLY 321 N 1.56 1.92 0.32 0.00 0.00 -1.26 -4.14 105.19 103.59 3k4b n GLY 321 Ca 0.23 -1.92 -0.01 0.00 0.00 0.00 0.00 46.02 44.31 3k4b n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k4b h ALA 322 N 0.00 1.33 0.03 4.61 0.00 -1.91 -0.65 119.26 122.67 3k4b h ALA 322 Ca 0.00 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 3k4b h ALA 322 Cb 0.00 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.56 3k4b h ALA 322 CO 0.00 0.51 -0.39 0.28 0.00 0.00 0.00 179.25 179.65 3k4b h VAL 323 N 0.85 1.57 0.00 0.00 2.07 -1.95 -3.35 116.25 115.44 3k4b h VAL 323 Ca 0.20 -2.17 0.00 0.00 0.82 0.00 0.00 66.70 65.55 3k4b h VAL 323 Cb 0.14 2.96 0.00 0.00 -1.52 0.00 0.00 31.29 32.87 3k4b h VAL 323 CO -0.02 0.60 -0.34 0.45 0.02 0.00 0.00 177.57 178.27 3k4b h HIS 324 N -0.50 0.00 -0.87 1.57 -0.00 -1.67 -1.62 115.15 112.06 3k4b h HIS 324 Ca -0.06 0.00 0.01 0.00 -0.00 0.00 0.00 60.37 60.33 3k4b h HIS 324 Cb 1.20 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 28.56 3k4b h HIS 324 CO 0.20 0.00 0.57 -0.91 -0.00 0.00 0.00 177.93 177.79 3k4b h ASN 325 N 0.00 0.98 0.14 2.45 2.35 -1.31 -0.93 115.58 119.26 3k4b h ASN 325 Ca 0.00 -0.02 -0.25 0.00 -0.55 0.00 0.00 56.30 55.47 3k4b h ASN 325 Cb 0.98 -0.24 0.01 0.00 0.05 0.00 0.00 38.32 39.12 3k4b h ASN 325 CO 0.00 0.71 -1.02 0.74 -1.65 0.00 0.00 177.43 176.21 3k4b h THR 326 N 1.16 1.33 -0.05 2.81 2.02 -1.50 -1.73 112.91 116.95 3k4b h THR 326 Ca 0.32 -2.34 -0.00 0.00 0.77 0.00 0.00 66.41 65.17 3k4b h THR 326 Cb -0.11 2.41 -0.00 0.00 -1.74 0.00 0.00 68.15 68.71 3k4b h THR 326 CO -0.08 0.71 0.03 -0.61 0.37 0.00 0.00 175.52 175.94 3k4b h GLN 327 N 0.33 0.07 -0.81 6.66 4.15 -1.28 0.16 115.11 124.40 3k4b h GLN 327 Ca -0.11 -0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.41 3k4b h GLN 327 Cb 1.66 -0.01 -0.08 0.00 0.21 0.00 0.00 27.48 29.26 3k4b h GLN 327 CO 0.19 0.17 0.43 1.25 -1.93 0.00 0.00 178.83 178.94 3k4b h LEU 328 N -0.04 0.57 -0.01 -2.39 5.85 -1.08 0.20 115.31 118.42 3k4b h LEU 328 Ca 0.02 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 3k4b h LEU 328 Cb 0.12 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 3k4b h LEU 328 CO -0.00 0.30 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.32 3k4b h LEU 329 N 0.69 0.01 -1.67 2.25 3.38 -0.93 -2.49 115.31 116.55 3k4b h LEU 329 Ca 0.41 -0.49 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 3k4b h LEU 329 Cb 0.46 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 3k4b h LEU 329 CO -0.29 0.51 -0.07 0.58 0.09 0.00 0.00 178.44 179.26 3k4b h VAL 330 N -0.48 1.10 0.00 1.22 2.07 -0.89 0.43 116.25 119.71 3k4b h VAL 330 Ca 0.00 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.08 3k4b h VAL 330 Cb 0.50 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 3k4b h VAL 330 CO 0.00 0.14 0.00 -3.20 0.02 0.00 0.00 177.57 174.53 3k4b n ASN 331 N -4.39 0.00 -0.28 0.57 5.15 0.68 -2.71 115.26 114.28 3k4b n ASN 331 Ca -0.02 0.15 0.03 0.00 -0.60 0.00 0.00 54.58 54.14 3k4b n ASN 331 Cb 0.19 -0.32 0.06 0.00 -0.53 0.00 0.00 39.78 39.18 3k4b n ASN 331 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 3k4b n SER 332 N -1.32 2.23 0.00 1.20 7.64 0.15 -4.85 113.62 118.66 3k4b n SER 332 Ca 0.07 -1.84 0.00 0.00 1.01 0.00 0.00 58.87 58.10 3k4b n SER 332 Cb 0.13 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 3k4b n SER 332 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3k4b n GLY 333 N 0.04 0.83 3.92 0.23 0.00 -1.05 -4.74 105.19 104.41 3k4b n GLY 333 Ca 0.05 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 3k4b n GLY 333 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k4b s PHE 334 N -2.00 3.49 0.00 1.61 0.40 -0.88 -4.69 117.98 115.90 3k4b s PHE 334 Ca 0.00 0.38 0.00 0.00 -0.60 0.00 0.00 56.93 56.71 3k4b s PHE 334 Cb 0.00 -1.88 0.00 0.00 0.51 0.00 0.00 43.02 41.65 3k4b s PHE 334 CO 0.00 0.42 0.00 0.41 0.70 0.00 0.00 175.22 176.75 3k4b n GLY 335 N -0.35 1.76 2.82 4.36 0.00 0.11 -3.83 105.19 110.06 3k4b n GLY 335 Ca -0.04 -0.56 -0.21 0.00 0.00 0.00 0.00 46.02 45.21 3k4b n GLY 335 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k4b s GLN 336 N 0.00 0.64 0.23 1.61 0.74 -1.26 -4.53 119.66 117.08 3k4b s GLN 336 Ca 0.00 0.03 -0.30 0.00 0.05 0.00 0.00 55.36 55.14 3k4b s GLN 336 Cb 0.00 -0.85 -0.09 0.00 1.10 0.00 0.00 33.01 33.17 3k4b s GLN 336 CO 0.00 -0.20 0.95 -1.17 -0.55 0.00 0.00 175.29 174.32 3k4b s LEU 337 N 1.47 4.63 0.00 3.68 2.96 -1.26 -4.71 118.68 125.44 3k4b s LEU 337 Ca -0.03 1.94 0.00 0.00 -0.22 0.00 0.00 54.13 55.83 3k4b s LEU 337 Cb -0.13 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.95 3k4b s LEU 337 CO -0.03 0.12 0.00 0.61 -1.32 0.00 0.00 176.35 175.73 3k4b n GLY 338 N 1.57 -0.21 3.67 7.98 0.00 0.24 -4.83 105.19 113.60 3k4b n GLY 338 Ca -0.01 -1.87 -0.48 0.00 0.00 0.00 0.00 46.02 43.66 3k4b n GLY 338 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3k4b n ARG 339 N -0.29 2.03 -1.55 1.61 0.63 -1.26 -4.43 116.66 113.40 3k4b n ARG 339 Ca 0.00 0.74 -0.54 0.00 -0.92 0.00 0.00 57.85 57.13 3k4b n ARG 339 Cb 0.00 -2.52 -0.06 0.00 0.45 0.00 0.00 32.46 30.33 3k4b n ARG 339 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 3k4b n PRO 340 N 4.57 0.73 -3.69 -0.14 -0.02 -1.26 -4.92 135.00 130.26 3k4b n PRO 340 Ca 0.19 0.26 -0.29 0.00 -2.02 0.00 0.00 63.50 61.64 3k4b n PRO 340 Cb 0.28 -1.81 -0.15 0.00 -0.02 0.00 0.00 33.50 31.79 3k4b n PRO 340 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3k4b s ASN 341 N 0.20 3.71 0.43 2.55 3.04 -1.26 -4.99 114.94 118.61 3k4b s ASN 341 Ca 0.84 -1.41 0.30 0.00 0.04 0.00 0.00 52.86 52.63 3k4b s ASN 341 Cb -1.04 -0.70 1.30 0.00 -1.54 0.00 0.00 41.25 39.27 3k4b s ASN 341 CO 0.51 -0.40 1.89 1.55 -3.04 0.00 0.00 177.10 177.61 3k4b h PRO 342 N 8.19 0.00 -0.15 0.43 0.13 -2.03 -2.64 132.00 135.94 3k4b h PRO 342 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 3k4b h PRO 342 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 3k4b h PRO 342 CO 0.44 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.21 3k4b n ALA 343 N -1.94 2.49 -3.46 -0.56 0.00 -1.26 -4.23 120.51 111.55 3k4b n ALA 343 Ca 0.01 -0.27 -0.29 0.00 0.00 0.00 0.00 53.44 52.89 3k4b n ALA 343 Cb 0.23 -1.01 -0.12 0.00 0.00 0.00 0.00 19.45 18.55 3k4b n ALA 343 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3k4b s ASN 344 N -1.06 2.67 0.64 0.00 0.02 -0.99 -5.14 114.94 111.08 3k4b s ASN 344 Ca 0.12 -2.39 -0.14 0.00 -1.02 0.00 0.00 52.86 49.43 3k4b s ASN 344 Cb 0.06 -0.43 -0.02 0.00 0.02 0.00 0.00 41.25 40.89 3k4b s ASN 344 CO 0.09 -0.28 1.06 -2.84 0.02 0.00 0.00 177.10 175.15 3k4b s PRO 345 N 0.82 3.11 0.75 -0.60 0.02 -1.26 -4.87 135.00 132.98 3k4b s PRO 345 Ca 0.21 1.15 -0.13 0.00 0.02 0.00 0.00 61.00 62.25 3k4b s PRO 345 Cb -0.17 -2.01 0.05 0.00 0.02 0.00 0.00 34.50 32.39 3k4b s PRO 345 CO -0.03 -0.97 1.14 -2.14 -0.33 0.00 0.00 177.00 174.66 3k4b s PRO 346 N -4.40 2.14 0.07 5.54 0.02 -1.26 -4.93 135.00 132.19 3k4b s PRO 346 Ca 0.62 1.49 -0.13 0.00 0.02 0.00 0.00 61.00 63.00 3k4b s PRO 346 Cb -0.16 -1.86 -0.24 0.00 0.02 0.00 0.00 34.50 32.26 3k4b s PRO 346 CO 0.43 -1.78 1.17 1.49 -0.33 0.00 0.00 177.00 177.98 3k4b h GLU 347 N -0.68 0.62 -5.49 5.54 4.81 -1.90 -3.45 114.58 114.03 3k4b h GLU 347 Ca -0.46 -0.74 -0.47 0.00 -0.13 0.00 0.00 59.36 57.56 3k4b h GLU 347 Cb 1.26 0.23 -0.25 0.00 0.63 0.00 0.00 28.75 30.63 3k4b h GLU 347 CO 0.50 1.32 -0.80 -0.51 -0.73 0.00 0.00 179.01 178.79 3k4b s LEU 348 N -7.92 2.18 -1.21 1.64 1.43 -1.26 -4.89 118.68 108.65 3k4b s LEU 348 Ca -0.09 -0.48 -0.18 0.00 -1.03 0.00 0.00 54.13 52.34 3k4b s LEU 348 Cb 0.07 -0.67 0.00 0.00 0.03 0.00 0.00 46.19 45.61 3k4b s LEU 348 CO 0.92 0.05 0.68 0.18 0.23 0.00 0.00 176.35 178.41 3k4b n LEU 349 N 1.83 -2.27 -0.13 1.79 4.77 -1.26 -0.72 117.00 121.01 3k4b n LEU 349 Ca -0.18 -1.06 0.23 0.00 -0.03 0.00 0.00 56.01 54.96 3k4b n LEU 349 Cb 0.54 -2.22 0.65 0.00 -2.33 0.00 0.00 43.42 40.06 3k4b n LEU 349 CO 0.23 0.52 1.22 1.55 -1.33 0.00 0.00 177.39 179.58 3k4b h PRO 350 N -2.00 0.12 -0.00 3.23 0.13 -1.90 0.70 132.00 132.27 3k4b h PRO 350 Ca -0.67 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 3k4b h PRO 350 Cb 1.37 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.48 3k4b h PRO 350 CO 0.52 0.08 -0.03 0.43 -0.23 0.00 0.00 178.00 178.77 3k4b n SER 351 N -4.37 0.41 -4.75 1.44 7.64 -1.26 -4.83 113.62 107.90 3k4b n SER 351 Ca 0.15 -0.91 -0.42 0.00 1.01 0.00 0.00 58.87 58.70 3k4b n SER 351 Cb 0.75 -0.05 -0.02 0.00 -1.01 0.00 0.00 64.21 63.89 3k4b n SER 351 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3k4b s LEU 352 N -2.17 4.35 0.00 -3.43 2.96 0.24 -2.08 118.68 118.55 3k4b s LEU 352 Ca 0.40 2.90 0.00 0.00 -0.22 0.00 0.00 54.13 57.21 3k4b s LEU 352 Cb 0.21 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 43.27 3k4b s LEU 352 CO 0.40 -0.89 0.00 0.61 -1.32 0.00 0.00 176.35 175.15 3k4b n GLY 353 N 2.37 0.41 3.91 7.98 0.00 -0.54 -4.82 105.19 114.50 3k4b n GLY 353 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 3k4b n GLY 353 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k4b s SER 354 N -2.40 5.58 -1.08 1.61 0.01 -0.88 -0.92 113.70 115.61 3k4b s SER 354 Ca 0.00 -0.37 0.00 0.00 1.31 0.00 0.00 55.95 56.89 3k4b s SER 354 Cb 0.00 -1.08 0.00 0.00 0.21 0.00 0.00 66.02 65.15 3k4b s SER 354 CO 0.00 -0.39 0.00 -1.22 0.41 0.00 0.00 173.24 172.04 3k4b n TYR 355 N -1.49 -0.28 -2.32 2.43 4.02 -0.75 -4.62 117.16 114.15 3k4b n TYR 355 Ca -0.01 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.50 3k4b n TYR 355 Cb 0.59 -2.37 -0.02 0.00 -0.02 0.00 0.00 39.34 37.51 3k4b n TYR 355 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 3k4b s ILE 356 N -2.50 3.21 0.08 -0.72 -4.36 -1.02 -4.35 121.20 111.54 3k4b s ILE 356 Ca 0.00 1.02 0.09 0.00 -0.26 0.00 0.00 60.65 61.50 3k4b s ILE 356 Cb 0.00 -3.57 -0.03 0.00 1.25 0.00 0.00 42.46 40.11 3k4b s ILE 356 CO 0.00 0.09 -0.24 0.42 0.24 0.00 0.00 174.94 175.46 3k4b s THR 357 N -1.42 2.42 0.01 8.37 -4.23 -0.42 -4.51 115.64 115.86 3k4b s THR 357 Ca 0.57 -1.46 -0.06 0.00 -1.18 0.00 0.00 61.69 59.55 3k4b s THR 357 Cb -0.30 -2.02 -0.00 0.00 1.34 0.00 0.00 72.50 71.52 3k4b s THR 357 CO 0.38 0.25 0.11 -0.70 -0.54 0.00 0.00 174.62 174.12 3k4b s GLU 358 N -1.63 0.48 0.15 3.99 2.56 -1.26 -0.76 118.70 122.23 3k4b s GLU 358 Ca 0.14 -0.48 -0.18 0.00 0.00 0.00 0.00 54.97 54.44 3k4b s GLU 358 Cb -0.10 0.20 -0.07 0.00 2.00 0.00 0.00 34.13 36.15 3k4b s GLU 358 CO 0.05 -0.11 0.62 -0.65 -0.56 0.00 0.00 175.26 174.61 3k4b s GLN 359 N -1.60 4.17 0.16 4.30 -0.21 -1.26 -4.53 119.66 120.69 3k4b s GLN 359 Ca -0.13 0.73 -0.30 0.00 0.02 0.00 0.00 55.36 55.67 3k4b s GLN 359 Cb -0.07 -3.03 -0.07 0.00 1.00 0.00 0.00 33.01 30.84 3k4b s GLN 359 CO 0.00 0.51 1.12 -1.12 -2.12 0.00 0.00 175.29 173.68 3k4b s SER 360 N -1.47 7.23 -0.14 5.90 0.01 -1.24 -4.64 113.70 119.35 3k4b s SER 360 Ca 0.37 2.09 0.02 0.00 1.31 0.00 0.00 55.95 59.74 3k4b s SER 360 Cb -0.17 -2.60 0.01 0.00 0.21 0.00 0.00 66.02 63.46 3k4b s SER 360 CO 0.20 -0.27 -0.22 -0.22 0.41 0.00 0.00 173.24 173.15 3k4b s LEU 361 N -0.18 2.09 0.09 2.44 2.96 -1.26 -0.05 118.68 124.78 3k4b s LEU 361 Ca 0.51 -0.60 0.04 0.00 -0.22 0.00 0.00 54.13 53.87 3k4b s LEU 361 Cb -0.30 -1.43 -0.04 0.00 0.50 0.00 0.00 46.19 44.93 3k4b s LEU 361 CO 0.34 0.08 0.02 0.68 -1.32 0.00 0.00 176.35 176.15 3k4b s VAL 362 N 0.82 4.15 -0.07 1.68 -7.23 -0.74 -0.53 120.40 118.48 3k4b s VAL 362 Ca -0.07 -0.95 -0.10 0.00 -1.81 0.00 0.00 61.98 59.05 3k4b s VAL 362 Cb -0.15 -2.99 0.02 0.00 0.56 0.00 0.00 36.38 33.81 3k4b s VAL 362 CO -0.02 0.11 0.25 0.12 -0.31 0.00 0.00 175.10 175.26 3k4b s PHE 363 N -1.35 -0.22 0.38 2.82 5.36 -0.72 -1.29 117.98 122.96 3k4b s PHE 363 Ca 0.27 0.49 -0.10 0.00 -0.96 0.00 0.00 56.93 56.64 3k4b s PHE 363 Cb -0.12 0.08 0.04 0.00 -0.34 0.00 0.00 43.02 42.68 3k4b s PHE 363 CO 0.19 -0.21 0.67 0.00 -1.46 0.00 0.00 175.22 174.41 3k4b s GLN 365 N -2.44 0.71 0.14 0.00 -0.21 -0.94 -0.85 119.66 116.07 3k4b s GLN 365 Ca 0.22 -0.66 0.07 0.00 0.02 0.00 0.00 55.36 55.01 3k4b s GLN 365 Cb -0.03 -0.64 -0.04 0.00 1.00 0.00 0.00 33.01 33.30 3k4b s GLN 365 CO 0.16 0.15 -0.01 0.95 -2.12 0.00 0.00 175.29 174.42 3k4b s THR 366 N -0.89 3.78 -0.20 -0.19 -4.23 -0.23 -0.18 115.64 113.50 3k4b s THR 366 Ca -0.02 -1.28 -0.10 0.00 -1.18 0.00 0.00 61.69 59.10 3k4b s THR 366 Cb -0.07 -2.86 -0.05 0.00 1.34 0.00 0.00 72.50 70.85 3k4b s THR 366 CO 0.01 -0.03 0.15 -0.69 -0.54 0.00 0.00 174.62 173.52 3k4b s VAL 367 N -1.56 5.40 0.39 2.29 1.01 0.11 -2.17 120.40 125.86 3k4b s VAL 367 Ca 0.26 0.21 -0.28 0.00 0.00 0.00 0.00 61.98 62.18 3k4b s VAL 367 Cb -0.10 -3.49 -0.11 0.00 0.00 0.00 0.00 36.38 32.69 3k4b s VAL 367 CO 0.18 0.42 1.48 -0.32 0.00 0.00 0.00 175.10 176.87 3k4b s MET 368 N 0.46 4.05 0.63 2.72 1.75 -0.22 -3.09 119.30 125.61 3k4b s MET 368 Ca 0.09 2.56 -0.16 0.00 -1.25 0.00 0.00 55.69 56.92 3k4b s MET 368 Cb -0.11 -2.93 -0.01 0.00 2.84 0.00 0.00 34.83 34.61 3k4b s MET 368 CO -0.01 -0.57 1.13 -1.54 -0.65 0.00 0.00 175.02 173.38 3k4b s SER 369 N -0.18 5.16 0.26 1.11 1.04 0.02 -4.88 113.70 116.22 3k4b s SER 369 Ca 0.54 2.11 -0.03 0.00 0.48 0.00 0.00 55.95 59.04 3k4b s SER 369 Cb -0.46 -2.57 0.40 0.00 0.10 0.00 0.00 66.02 63.49 3k4b s SER 369 CO 0.63 -1.60 1.86 0.74 0.98 0.00 0.00 173.24 175.84 3k4b h THR 370 N 0.34 1.03 -0.69 2.02 2.02 -1.91 -2.15 112.91 113.57 3k4b h THR 370 Ca -0.48 -0.35 0.01 0.00 0.77 0.00 0.00 66.41 66.36 3k4b h THR 370 Cb 1.26 -0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 3k4b h THR 370 CO 0.54 0.19 0.45 -0.08 0.37 0.00 0.00 175.52 176.99 3k4b h GLU 371 N 1.03 0.88 -0.16 6.66 4.81 -1.97 -1.41 114.58 124.43 3k4b h GLU 371 Ca 0.42 -0.05 -0.19 0.00 -0.13 0.00 0.00 59.36 59.41 3k4b h GLU 371 Cb 0.24 -0.20 0.01 0.00 0.63 0.00 0.00 28.75 29.43 3k4b h GLU 371 CO -0.19 0.58 -0.62 -0.07 -0.73 0.00 0.00 179.01 177.97 3k4b h LEU 372 N 0.91 0.82 -0.34 1.64 3.38 -1.77 -2.04 115.31 117.91 3k4b h LEU 372 Ca 0.26 -0.61 -0.00 0.00 0.09 0.00 0.00 57.88 57.61 3k4b h LEU 372 Cb -0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 3k4b h LEU 372 CO -0.07 1.30 0.21 0.40 0.09 0.00 0.00 178.44 180.37 3k4b h ILE 373 N 0.40 1.11 -0.68 1.22 1.08 -1.24 -1.87 117.51 117.53 3k4b h ILE 373 Ca -0.03 -0.25 0.02 0.00 -0.39 0.00 0.00 64.86 64.21 3k4b h ILE 373 Cb 1.25 0.67 -0.04 0.00 -3.07 0.00 0.00 36.82 35.64 3k4b h ILE 373 CO 0.13 0.11 0.45 0.44 -0.69 0.00 0.00 178.15 178.59 3k4b h ASP 374 N 0.44 0.75 -0.23 1.72 3.32 -1.20 -2.65 116.42 118.56 3k4b h ASP 374 Ca 0.12 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 3k4b h ASP 374 Cb -0.00 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 3k4b h ASP 374 CO -0.02 0.53 0.13 0.77 -1.72 0.00 0.00 179.24 178.92 3k4b h SER 375 N 0.88 0.32 -0.85 6.45 4.64 -0.59 -2.01 113.55 122.39 3k4b h SER 375 Ca 0.26 -0.02 0.22 0.00 -0.47 0.00 0.00 61.79 61.78 3k4b h SER 375 Cb -0.03 -0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 61.93 3k4b h SER 375 CO -0.07 0.27 0.59 0.58 -0.87 0.00 0.00 176.83 177.34 3k4b h VAL 376 N 0.36 0.64 -0.05 0.95 2.07 -1.22 -1.54 116.25 117.47 3k4b h VAL 376 Ca 0.09 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 3k4b h VAL 376 Cb 0.04 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 3k4b h VAL 376 CO -0.01 0.04 -0.22 2.29 0.02 0.00 0.00 177.57 179.69 3k4b n LYS 377 N -4.41 1.56 0.23 1.57 2.85 -0.77 -4.72 118.16 114.48 3k4b n LYS 377 Ca 0.18 -2.95 0.09 0.00 -1.05 0.00 0.00 58.31 54.58 3k4b n LYS 377 Cb 0.78 -1.60 0.53 0.00 -0.65 0.00 0.00 35.03 34.10 3k4b n LYS 377 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3k4b h SER 378 N 0.62 0.00 0.66 -5.58 4.64 -1.15 -2.02 113.55 110.73 3k4b h SER 378 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3k4b h SER 378 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3k4b h SER 378 CO 0.05 0.23 -0.33 0.47 -0.87 0.00 0.00 176.83 176.37 3k4b n ASP 379 N -3.59 0.34 -4.73 4.97 8.00 -1.26 -4.91 116.55 115.37 3k4b n ASP 379 Ca -0.01 -0.01 -0.41 0.00 0.71 0.00 0.00 54.79 55.07 3k4b n ASP 379 Cb 0.36 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.42 3k4b n ASP 379 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 3k4b s MET 380 N -2.99 4.55 -0.09 -1.24 -1.94 -0.76 -4.65 119.30 112.18 3k4b s MET 380 Ca 0.12 1.22 -0.16 0.00 -1.71 0.00 0.00 55.69 55.17 3k4b s MET 380 Cb 0.18 -3.41 -0.05 0.00 2.01 0.00 0.00 34.83 33.56 3k4b s MET 380 CO 0.64 0.13 0.41 0.99 -0.01 0.00 0.00 175.02 177.18 3k4b s THR 381 N 0.43 5.16 -0.07 2.05 2.01 0.71 -4.93 115.64 120.99 3k4b s THR 381 Ca 0.44 0.81 0.03 0.00 0.31 0.00 0.00 61.69 63.28 3k4b s THR 381 Cb -0.21 -3.73 0.01 0.00 0.01 0.00 0.00 72.50 68.58 3k4b s THR 381 CO 0.25 0.44 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.82 3k4b s ILE 382 N -0.05 1.42 0.09 1.82 1.01 -1.26 -1.21 121.20 123.02 3k4b s ILE 382 Ca 0.23 -0.66 0.08 0.00 0.00 0.00 0.00 60.65 60.29 3k4b s ILE 382 Cb -0.15 -1.26 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 3k4b s ILE 382 CO 0.10 0.42 -0.21 -0.13 0.00 0.00 0.00 174.94 175.12 3k4b s ARG 383 N 0.44 1.19 0.88 2.79 0.52 -0.12 -5.00 118.95 119.65 3k4b s ARG 383 Ca -0.13 -1.11 0.00 0.00 -0.52 0.00 0.00 55.73 53.97 3k4b s ARG 383 Cb -0.15 -1.42 0.00 0.00 0.52 0.00 0.00 34.95 33.89 3k4b s ARG 383 CO 0.05 0.34 0.00 0.41 0.02 0.00 0.00 175.30 176.12 3k4b n GLY 384 N 1.28 -2.13 3.11 -3.53 0.00 -1.26 -1.13 105.19 101.54 3k4b n GLY 384 Ca -0.19 -1.45 -0.26 0.00 0.00 0.00 0.00 46.02 44.12 3k4b n GLY 384 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3k4b s THR 385 N -0.11 1.40 0.47 2.61 -1.32 -1.26 -4.87 115.64 112.56 3k4b s THR 385 Ca 0.00 -0.67 -0.19 0.00 -1.21 0.00 0.00 61.69 59.62 3k4b s THR 385 Cb 0.00 -1.23 -0.15 0.00 -1.51 0.00 0.00 72.50 69.62 3k4b s THR 385 CO 0.00 0.41 0.02 -2.65 -2.21 0.00 0.00 174.62 170.18 3k4b n PRO 386 N 3.42 0.06 -0.65 7.08 -0.02 -1.26 -2.58 135.00 141.05 3k4b n PRO 386 Ca -0.20 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 3k4b n PRO 386 Cb 0.53 -1.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.94 3k4b n PRO 386 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k4b n GLY 387 N 2.37 0.91 3.70 -1.23 0.00 -1.26 -5.03 105.19 104.64 3k4b n GLY 387 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 3k4b n GLY 387 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k4b s GLU 388 N -0.32 2.44 0.00 1.61 2.02 -1.06 -5.01 118.70 118.38 3k4b s GLU 388 Ca 0.00 -1.36 0.29 0.00 0.02 0.00 0.00 54.97 53.92 3k4b s GLU 388 Cb 0.00 -2.25 1.30 0.00 0.10 0.00 0.00 34.13 33.28 3k4b s GLU 388 CO 0.00 0.33 1.94 1.28 0.02 0.00 0.00 175.26 178.84 3k4b n LEU 389 N -0.99 0.00 -0.26 1.80 4.77 -1.26 -2.22 117.00 118.84 3k4b n LEU 389 Ca -0.06 0.43 0.14 0.00 -0.03 0.00 0.00 56.01 56.49 3k4b n LEU 389 Cb 0.59 -0.43 0.51 0.00 -2.33 0.00 0.00 43.42 41.76 3k4b n LEU 389 CO 0.41 -0.01 0.79 0.35 -1.33 0.00 0.00 177.39 177.61 3k4b n THR 390 N -1.43 0.00 -2.22 -5.08 -2.24 -1.26 -4.93 114.28 97.12 3k4b n THR 390 Ca 0.09 -0.13 -0.40 0.00 -2.27 0.00 0.00 64.05 61.33 3k4b n THR 390 Cb 0.30 0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 68.75 3k4b n THR 390 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3k4b s TYR 391 N -2.34 3.18 -0.12 4.78 5.04 -0.94 -4.60 117.35 122.35 3k4b s TYR 391 Ca 0.30 1.50 -0.07 0.00 -2.44 0.00 0.00 57.07 56.37 3k4b s TYR 391 Cb 0.20 -3.56 0.05 0.00 0.35 0.00 0.00 41.96 39.00 3k4b s TYR 391 CO 0.45 -1.49 0.29 0.45 -1.34 0.00 0.00 175.55 173.91 3k4b s SER 392 N -0.64 -0.33 -0.19 4.32 0.15 -0.28 -5.00 113.70 111.73 3k4b s SER 392 Ca 0.48 0.62 -0.00 0.00 0.70 0.00 0.00 55.95 57.75 3k4b s SER 392 Cb -0.37 0.51 0.02 0.00 -1.71 0.00 0.00 66.02 64.47 3k4b s SER 392 CO 0.49 -0.17 -0.16 -0.69 1.20 0.00 0.00 173.24 173.91 3k4b s VAL 393 N 1.20 2.37 0.10 4.45 1.01 -1.26 -0.94 120.40 127.33 3k4b s VAL 393 Ca -0.09 -0.88 0.05 0.00 0.00 0.00 0.00 61.98 61.06 3k4b s VAL 393 Cb -0.09 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 3k4b s VAL 393 CO -0.09 0.48 -0.12 0.42 0.00 0.00 0.00 175.10 175.79 3k4b s THR 394 N 1.32 1.08 0.06 3.92 -4.23 -0.35 -4.94 115.64 112.51 3k4b s THR 394 Ca 0.04 -1.60 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 3k4b s THR 394 Cb -0.14 -1.35 -0.04 0.00 1.34 0.00 0.00 72.50 72.31 3k4b s THR 394 CO -0.10 -0.46 -0.04 -0.72 -0.54 0.00 0.00 174.62 172.75 3k4b s TYR 395 N -2.14 0.64 -0.46 3.99 1.13 -1.26 -0.21 117.35 119.03 3k4b s TYR 395 Ca 0.05 -0.95 -0.16 0.00 -1.41 0.00 0.00 57.07 54.60 3k4b s TYR 395 Cb -0.05 -0.42 0.06 0.00 -1.10 0.00 0.00 41.96 40.45 3k4b s TYR 395 CO 0.01 -0.27 0.43 0.99 -2.51 0.00 0.00 175.55 174.20 3k4b s THR 396 N -3.53 5.16 0.86 -3.49 2.01 -1.26 -5.05 115.64 110.34 3k4b s THR 396 Ca 0.06 -0.83 -0.13 0.00 0.31 0.00 0.00 61.69 61.10 3k4b s THR 396 Cb 0.05 -4.12 0.05 0.00 0.01 0.00 0.00 72.50 68.49 3k4b s THR 396 CO -0.07 -0.56 0.76 -2.65 -0.69 0.00 0.00 174.62 171.40 3k4b n PRO 397 N 5.41 -0.06 -0.16 4.92 -0.02 -1.26 -1.39 135.00 142.44 3k4b n PRO 397 Ca -0.11 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 3k4b n PRO 397 Cb 0.45 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 3k4b n PRO 397 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k4b n GLY 398 N 1.10 0.16 3.68 -1.23 0.00 -1.26 -4.90 105.19 102.73 3k4b n GLY 398 Ca 0.10 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.67 3k4b n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k4b n ALA 399 N 0.95 1.76 -0.34 4.61 0.00 -0.48 -4.85 120.51 122.16 3k4b n ALA 399 Ca 0.00 0.42 0.10 0.00 0.00 0.00 0.00 53.44 53.96 3k4b n ALA 399 Cb 0.00 -2.41 0.27 0.00 0.00 0.00 0.00 19.45 17.31 3k4b n ALA 399 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3k4b h SER 400 N 6.42 0.73 -0.19 0.00 4.64 -1.90 0.41 113.55 123.66 3k4b h SER 400 Ca -0.45 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 3k4b h SER 400 Cb 1.24 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3k4b h SER 400 CO 0.91 0.31 0.00 0.35 -0.87 0.00 0.00 176.83 177.53 3k4b n THR 401 N -4.77 0.70 -2.54 2.95 -2.24 -1.26 -4.82 114.28 102.29 3k4b n THR 401 Ca 0.20 -0.40 -0.43 0.00 -2.27 0.00 0.00 64.05 61.16 3k4b n THR 401 Cb 0.48 -0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 68.42 3k4b n THR 401 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3k4b s ASN 402 N -0.46 7.02 0.21 3.42 -0.87 0.13 -4.94 114.94 119.46 3k4b s ASN 402 Ca 0.16 1.52 0.24 0.00 -1.57 0.00 0.00 52.86 53.21 3k4b s ASN 402 Cb 0.11 -2.54 0.91 0.00 -0.02 0.00 0.00 41.25 39.72 3k4b s ASN 402 CO 0.06 -0.72 1.72 0.29 -2.57 0.00 0.00 177.10 175.89 3k4b n LYS 403 N 6.48 0.19 -4.44 -0.60 4.76 -1.26 -4.84 118.16 118.45 3k4b n LYS 403 Ca 0.13 0.32 -0.23 0.00 -2.87 0.00 0.00 58.31 55.67 3k4b n LYS 403 Cb 0.45 -1.80 -0.10 0.00 -1.84 0.00 0.00 35.03 31.74 3k4b n LYS 403 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 3k4b s HIS 404 N -3.21 2.13 0.82 2.13 3.76 -1.26 -5.14 115.29 114.52 3k4b s HIS 404 Ca 0.07 -0.43 -0.11 0.00 -0.15 0.00 0.00 55.06 54.44 3k4b s HIS 404 Cb 0.11 -0.99 0.08 0.00 1.11 0.00 0.00 32.58 32.89 3k4b s HIS 404 CO 0.45 0.59 1.09 -2.14 -0.85 0.00 0.00 174.74 173.88 3k4b s PRO 405 N -3.57 1.90 0.47 8.40 0.02 -1.26 -4.82 135.00 136.14 3k4b s PRO 405 Ca 0.28 0.99 0.13 0.00 0.02 0.00 0.00 61.00 62.42 3k4b s PRO 405 Cb -0.03 -1.87 1.09 0.00 0.02 0.00 0.00 34.50 33.71 3k4b s PRO 405 CO 0.13 -1.84 2.09 -0.44 -0.33 0.00 0.00 177.00 176.61 3k4b h ASP 406 N -1.26 0.23 -0.08 2.53 3.32 -1.99 -2.31 116.42 116.86 3k4b h ASP 406 Ca -0.46 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.57 3k4b h ASP 406 Cb 1.25 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.74 3k4b h ASP 406 CO 0.53 0.16 -0.00 4.11 -1.72 0.00 0.00 179.24 182.32 3k4b h TRP 407 N 0.27 0.15 0.02 4.55 5.08 -1.99 0.63 115.95 124.64 3k4b h TRP 407 Ca 0.10 -0.03 0.03 0.00 1.08 0.00 0.00 58.89 60.07 3k4b h TRP 407 Cb 0.08 -0.04 -0.05 0.00 -3.00 0.00 0.00 29.16 26.15 3k4b h TRP 407 CO -0.00 0.41 -0.39 2.35 -1.28 0.00 0.00 178.44 179.52 3k4b h TRP 408 N -0.15 -1.11 -0.92 0.12 2.91 -1.87 -1.77 115.95 113.16 3k4b h TRP 408 Ca 0.02 0.03 0.17 0.00 1.13 0.00 0.00 58.89 60.24 3k4b h TRP 408 Cb 0.35 0.48 -0.08 0.00 -0.51 0.00 0.00 29.16 29.41 3k4b h TRP 408 CO 0.03 -0.48 0.59 -0.91 -1.03 0.00 0.00 178.44 176.65 3k4b h ASN 409 N -0.56 0.62 -0.45 2.65 2.35 -1.29 -1.28 115.58 117.62 3k4b h ASN 409 Ca 0.05 0.05 -0.13 0.00 -0.55 0.00 0.00 56.30 55.72 3k4b h ASN 409 Cb 0.63 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 3k4b h ASN 409 CO -0.29 0.28 -0.22 -0.08 -1.65 0.00 0.00 177.43 175.47 3k4b h GLU 410 N 0.64 0.95 -0.60 0.81 4.57 -0.46 0.24 114.58 120.73 3k4b h GLU 410 Ca 0.48 -0.42 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 3k4b h GLU 410 Cb 0.86 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.40 3k4b h GLU 410 CO -0.23 1.08 0.29 0.87 -1.18 0.00 0.00 179.01 179.84 3k4b h LYS 411 N 0.79 0.87 0.06 1.92 1.57 -0.82 0.05 116.57 121.01 3k4b h LYS 411 Ca 0.10 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3k4b h LYS 411 Cb 0.80 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3k4b h LYS 411 CO 0.07 0.71 -0.03 0.28 -0.57 0.00 0.00 179.45 179.90 3k4b h VAL 412 N 0.83 1.21 -0.49 0.50 2.07 -0.94 -1.36 116.25 118.06 3k4b h VAL 412 Ca 0.21 -0.99 0.10 0.00 0.82 0.00 0.00 66.70 66.84 3k4b h VAL 412 Cb 0.12 1.84 -0.10 0.00 -1.52 0.00 0.00 31.29 31.64 3k4b h VAL 412 CO -0.03 0.24 -0.14 0.50 0.02 0.00 0.00 177.57 178.16 3k4b h LYS 413 N -0.53 -0.03 -0.92 1.57 3.64 -0.93 -1.43 116.57 117.94 3k4b h LYS 413 Ca -0.01 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 3k4b h LYS 413 Cb 0.46 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.25 3k4b h LYS 413 CO 0.01 -0.02 0.52 -0.91 -2.27 0.00 0.00 179.45 176.78 3k4b h ASN 414 N -0.03 1.14 -0.48 4.20 2.35 -0.86 -2.10 115.58 119.79 3k4b h ASN 414 Ca 0.24 -0.09 -0.09 0.00 -0.55 0.00 0.00 56.30 55.81 3k4b h ASN 414 Cb 0.39 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 3k4b h ASN 414 CO -0.52 0.90 -0.05 -0.74 -1.65 0.00 0.00 177.43 175.37 3k4b h HIS 415 N 1.28 0.98 -0.03 1.19 -0.00 -0.71 -0.52 115.15 117.33 3k4b h HIS 415 Ca 0.32 -0.19 -0.11 0.00 -0.00 0.00 0.00 60.37 60.40 3k4b h HIS 415 Cb 0.01 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.15 3k4b h HIS 415 CO 0.01 0.93 -0.49 0.52 -0.00 0.00 0.00 177.93 178.91 3k4b h MET 416 N 0.74 0.08 0.11 5.26 2.86 -1.03 -1.31 114.93 121.63 3k4b h MET 416 Ca 0.13 -0.04 -0.29 0.00 -2.06 0.00 0.00 59.70 57.44 3k4b h MET 416 Cb 0.58 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 3k4b h MET 416 CO 0.03 0.55 -1.46 0.52 1.06 0.00 0.00 176.91 177.62 3k4b h MET 417 N 0.06 0.23 0.00 1.72 2.07 -1.28 -3.33 114.93 114.40 3k4b h MET 417 Ca 0.00 -0.38 0.00 0.00 -2.07 0.00 0.00 59.70 57.25 3k4b h MET 417 Cb 0.89 0.14 0.00 0.00 -1.87 0.00 0.00 31.60 30.76 3k4b h MET 417 CO 0.07 1.09 -0.37 1.96 1.07 0.00 0.00 176.91 180.73 3k4b h GLN 418 N 0.06 0.00 -2.14 1.72 4.20 -1.09 -3.38 115.11 114.49 3k4b h GLN 418 Ca -0.21 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 57.92 3k4b h GLN 418 Cb 1.99 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 29.38 3k4b h GLN 418 CO 0.16 0.00 -0.97 0.72 -0.67 0.00 0.00 178.83 178.08 3k4b n HIS 419 N -2.26 0.49 0.74 2.96 8.25 -0.50 -4.94 115.22 119.97 3k4b n HIS 419 Ca 0.04 -3.67 0.12 0.00 -0.26 0.00 0.00 57.72 53.95 3k4b n HIS 419 Cb 0.45 -0.32 0.49 0.00 1.12 0.00 0.00 29.99 31.73 3k4b n HIS 419 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 3k4b n GLN 420 N 1.52 0.07 0.01 -0.41 6.02 -1.25 -1.66 117.38 121.69 3k4b n GLN 420 Ca 0.24 0.15 0.13 0.00 -0.01 0.00 0.00 57.00 57.51 3k4b n GLN 420 Cb 0.49 -1.60 0.56 0.00 1.02 0.00 0.00 30.24 30.71 3k4b n GLN 420 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 3k4b n GLU 421 N -1.72 0.02 -3.88 -1.09 0.00 -1.26 -4.41 120.64 108.30 3k4b n GLU 421 Ca 0.05 0.06 -0.35 0.00 0.00 0.00 0.00 57.16 56.92 3k4b n GLU 421 Cb 0.30 -1.53 -0.09 0.00 0.00 0.00 0.00 31.44 30.13 3k4b n GLU 421 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 3k4b s ASP 422 N -3.13 5.91 0.00 -1.84 2.15 -0.66 -4.99 116.67 114.11 3k4b s ASP 422 Ca 0.13 0.16 0.29 0.00 0.43 0.00 0.00 52.55 53.56 3k4b s ASP 422 Cb 0.17 -2.02 1.29 0.00 -0.30 0.00 0.00 42.92 42.07 3k4b s ASP 422 CO 0.50 0.19 1.88 -0.81 -0.17 0.00 0.00 175.17 176.76 3k4b n PRO 423 N 3.45 1.46 -4.62 4.34 -0.04 -1.26 -4.86 135.00 133.47 3k4b n PRO 423 Ca -0.16 -0.68 -0.30 0.00 -0.04 0.00 0.00 63.50 62.31 3k4b n PRO 423 Cb 0.52 -1.49 -0.13 0.00 -0.04 0.00 0.00 33.50 32.37 3k4b n PRO 423 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3k4b s LEU 424 N -2.01 2.52 0.00 1.53 1.43 -1.26 -5.03 118.68 115.87 3k4b s LEU 424 Ca 0.41 -0.51 0.30 0.00 -1.03 0.00 0.00 54.13 53.30 3k4b s LEU 424 Cb 0.21 -1.46 1.38 0.00 0.03 0.00 0.00 46.19 46.36 3k4b s LEU 424 CO 0.35 0.24 1.99 -0.81 0.23 0.00 0.00 176.35 178.34 3k4b n PRO 425 N 1.40 0.26 -3.06 1.29 -0.04 -1.26 -4.84 135.00 128.75 3k4b n PRO 425 Ca -0.16 -0.01 -0.40 0.00 -0.04 0.00 0.00 63.50 62.89 3k4b n PRO 425 Cb 0.52 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 3k4b n PRO 425 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3k4b s ILE 426 N -2.74 5.03 0.44 0.52 1.01 -1.26 -4.62 121.20 119.58 3k4b s ILE 426 Ca 0.23 1.37 -0.25 0.00 0.00 0.00 0.00 60.65 62.00 3k4b s ILE 426 Cb 0.20 -4.01 -0.08 0.00 0.01 0.00 0.00 42.46 38.57 3k4b s ILE 426 CO 0.49 0.20 1.35 -2.84 0.00 0.00 0.00 174.94 174.15 3k4b s PRO 427 N 1.19 3.76 0.31 2.79 0.02 -1.26 -4.92 135.00 136.89 3k4b s PRO 427 Ca 0.35 2.26 0.07 0.00 0.02 0.00 0.00 61.00 63.69 3k4b s PRO 427 Cb -0.17 -2.65 0.80 0.00 0.02 0.00 0.00 34.50 32.50 3k4b s PRO 427 CO 0.15 -0.70 1.73 0.74 -0.33 0.00 0.00 177.00 178.59 3k4b h PHE 428 N 2.38 0.93 -0.63 6.54 0.04 -1.97 -2.08 116.94 122.16 3k4b h PHE 428 Ca -0.50 0.04 -0.13 0.00 2.80 0.00 0.00 57.97 60.17 3k4b h PHE 428 Cb 1.26 -0.26 -0.08 0.00 2.20 0.00 0.00 35.95 39.07 3k4b h PHE 428 CO 0.51 0.08 0.17 0.39 -0.60 0.00 0.00 178.31 178.86 3k4b n GLU 429 N -4.90 3.86 -2.22 1.51 -0.58 -1.26 -4.94 120.64 112.12 3k4b n GLU 429 Ca 0.24 -2.81 -0.42 0.00 -0.42 0.00 0.00 57.16 53.76 3k4b n GLU 429 Cb 0.67 -2.16 -0.03 0.00 -0.57 0.00 0.00 31.44 29.35 3k4b n GLU 429 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3k4b s ASP 430 N -0.80 6.86 0.84 1.62 2.15 -0.79 -4.94 116.67 121.61 3k4b s ASP 430 Ca 0.50 2.20 -0.12 0.00 0.43 0.00 0.00 52.55 55.56 3k4b s ASP 430 Cb 0.39 -2.57 0.10 0.00 -0.30 0.00 0.00 42.92 40.54 3k4b s ASP 430 CO 0.13 -0.66 1.16 -2.84 -0.17 0.00 0.00 175.17 172.79 3k4b s PRO 431 N 1.65 1.51 0.57 4.34 0.02 -1.26 -4.97 135.00 136.85 3k4b s PRO 431 Ca 0.64 1.58 -0.17 0.00 0.02 0.00 0.00 61.00 63.07 3k4b s PRO 431 Cb -0.34 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.36 3k4b s PRO 431 CO 0.29 -2.28 1.07 -1.83 -0.33 0.00 0.00 177.00 173.93 3k4b s GLU 432 N -4.44 3.33 0.69 5.54 1.03 -1.26 -4.49 118.70 119.11 3k4b s GLU 432 Ca 0.69 1.34 -0.17 0.00 0.03 0.00 0.00 54.97 56.86 3k4b s GLU 432 Cb -0.24 -2.03 0.01 0.00 -0.80 0.00 0.00 34.13 31.07 3k4b s GLU 432 CO 0.54 -0.82 1.13 -2.30 -1.33 0.00 0.00 175.26 172.47 3k4b n PRO 433 N -1.76 0.73 -2.94 -4.83 -0.01 -1.26 -4.55 135.00 120.38 3k4b n PRO 433 Ca 0.10 0.31 -0.14 0.00 -0.01 0.00 0.00 63.50 63.75 3k4b n PRO 433 Cb 0.52 -2.37 0.01 0.00 -0.01 0.00 0.00 33.50 31.66 3k4b n PRO 433 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 175.50 176.53 3k4b n GLN 434 N -1.99 0.84 -4.16 -0.52 1.13 -1.24 -3.27 117.38 108.15 3k4b n GLN 434 Ca 0.14 -2.44 -0.28 0.00 -1.94 0.00 0.00 57.00 52.48 3k4b n GLN 434 Cb 0.49 -1.35 -0.08 0.00 0.11 0.00 0.00 30.24 29.41 3k4b n GLN 434 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3k4b s VAL 435 N -0.39 3.89 -0.04 5.09 1.01 0.31 -0.97 120.40 129.29 3k4b s VAL 435 Ca 0.32 -1.18 -0.14 0.00 0.00 0.00 0.00 61.98 60.98 3k4b s VAL 435 Cb 0.24 -2.90 0.03 0.00 0.00 0.00 0.00 36.38 33.75 3k4b s VAL 435 CO -0.15 0.02 0.32 0.28 0.00 0.00 0.00 175.10 175.57 3k4b s THR 436 N -1.49 0.04 -0.22 3.92 -1.32 -0.74 -0.32 115.64 115.51 3k4b s THR 436 Ca 0.26 -0.35 -0.02 0.00 -1.21 0.00 0.00 61.69 60.37 3k4b s THR 436 Cb -0.11 -0.58 0.01 0.00 -1.51 0.00 0.00 72.50 70.31 3k4b s THR 436 CO 0.18 -0.19 -0.07 0.28 -2.21 0.00 0.00 174.62 172.61 3k4b s THR 437 N -0.94 3.02 0.57 5.08 -1.32 -1.26 -1.82 115.64 118.96 3k4b s THR 437 Ca -0.10 -0.72 -0.19 0.00 -1.21 0.00 0.00 61.69 59.47 3k4b s THR 437 Cb -0.05 -2.40 -0.04 0.00 -1.51 0.00 0.00 72.50 68.50 3k4b s THR 437 CO 0.03 0.38 1.20 -0.76 -2.21 0.00 0.00 174.62 173.26 3k4b s LEU 438 N 1.41 3.72 -0.16 9.08 1.43 -1.26 -3.83 118.68 129.07 3k4b s LEU 438 Ca 0.04 2.37 -0.35 0.00 -1.03 0.00 0.00 54.13 55.16 3k4b s LEU 438 Cb -0.15 -4.54 -0.17 0.00 0.03 0.00 0.00 46.19 41.37 3k4b s LEU 438 CO -0.05 -1.47 1.05 0.33 0.23 0.00 0.00 176.35 176.44 3k4b n PHE 439 N -1.40 0.89 -4.30 0.29 -0.00 -1.11 -4.94 117.46 106.89 3k4b n PHE 439 Ca 0.13 0.90 -0.16 0.00 -0.00 0.00 0.00 57.45 58.32 3k4b n PHE 439 Cb 0.49 -1.77 -0.10 0.00 -0.00 0.00 0.00 39.48 38.10 3k4b n PHE 439 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 3k4b s GLN 440 N 0.97 1.28 0.21 -4.13 -1.52 -0.71 -4.94 119.66 110.82 3k4b s GLN 440 Ca 0.80 -1.64 -0.12 0.00 -1.95 0.00 0.00 55.36 52.45 3k4b s GLN 440 Cb -1.12 -0.50 0.27 0.00 -0.22 0.00 0.00 33.01 31.43 3k4b s GLN 440 CO 0.55 -0.12 1.67 -1.35 -0.25 0.00 0.00 175.29 175.79 3k4b h PRO 441 N 2.53 0.11 0.00 2.91 0.11 -1.97 0.20 132.00 135.88 3k4b h PRO 441 Ca -0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3k4b h PRO 441 Cb 1.22 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3k4b h PRO 441 CO 0.64 0.07 0.00 -1.13 -0.21 0.00 0.00 178.00 177.37 3k4b n SER 442 N -5.27 0.39 -3.15 -2.05 3.41 -1.26 -3.84 113.62 101.85 3k4b n SER 442 Ca 0.08 0.59 -0.20 0.00 -0.26 0.00 0.00 58.87 59.08 3k4b n SER 442 Cb 0.33 -0.67 -0.05 0.00 -0.26 0.00 0.00 64.21 63.56 3k4b n SER 442 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k4b n HIS 443 N -1.92 -1.60 -2.00 7.33 1.44 0.45 -5.05 115.22 113.86 3k4b n HIS 443 Ca 0.03 -2.84 -0.42 0.00 -2.01 0.00 0.00 57.72 52.48 3k4b n HIS 443 Cb 0.22 0.47 -0.00 0.00 0.12 0.00 0.00 29.99 30.80 3k4b n HIS 443 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 3k4b n PRO 444 N 2.34 3.63 -3.73 -1.40 -0.04 0.18 -1.73 135.00 134.24 3k4b n PRO 444 Ca 0.23 -3.13 -0.13 0.00 -0.04 0.00 0.00 63.50 60.42 3k4b n PRO 444 Cb 0.53 -2.94 -0.08 0.00 -0.04 0.00 0.00 33.50 30.96 3k4b n PRO 444 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 3k4b s TRP 445 N 0.98 -0.22 0.29 0.54 -2.14 -1.26 -4.35 118.94 112.78 3k4b s TRP 445 Ca 0.48 0.29 -0.11 0.00 2.66 0.00 0.00 56.10 59.41 3k4b s TRP 445 Cb 0.13 0.13 -0.08 0.00 -3.10 0.00 0.00 33.47 30.56 3k4b s TRP 445 CO -0.04 -0.44 0.65 -1.58 -2.66 0.00 0.00 176.95 172.87 3k4b s HIS 446 N -1.61 3.42 -0.01 1.66 5.65 -0.56 -2.74 115.29 121.10 3k4b s HIS 446 Ca -0.11 1.00 0.02 0.00 0.25 0.00 0.00 55.06 56.22 3k4b s HIS 446 Cb -0.04 -2.37 -0.00 0.00 -1.18 0.00 0.00 32.58 28.99 3k4b s HIS 446 CO 0.03 0.14 -0.07 0.95 -0.65 0.00 0.00 174.74 175.14 3k4b s THR 447 N -1.98 0.58 -0.04 0.89 -4.23 -1.25 -0.70 115.64 108.91 3k4b s THR 447 Ca 0.50 -0.30 0.02 0.00 -1.18 0.00 0.00 61.69 60.73 3k4b s THR 447 Cb -0.11 -0.50 0.01 0.00 1.34 0.00 0.00 72.50 73.24 3k4b s THR 447 CO 0.22 0.17 -0.08 -1.10 -0.54 0.00 0.00 174.62 173.29 3k4b s GLN 448 N -0.10 1.01 -0.39 3.99 -0.21 0.07 -4.17 119.66 119.86 3k4b s GLN 448 Ca 0.02 -0.26 0.01 0.00 0.02 0.00 0.00 55.36 55.15 3k4b s GLN 448 Cb -0.04 -0.93 0.13 0.00 1.00 0.00 0.00 33.01 33.17 3k4b s GLN 448 CO -0.00 0.05 0.20 0.42 -2.12 0.00 0.00 175.29 173.84 3k4b s ILE 449 N 0.43 1.08 0.00 1.08 1.01 0.56 -1.28 121.20 124.08 3k4b s ILE 449 Ca -0.07 -2.15 0.00 0.00 0.00 0.00 0.00 60.65 58.43 3k4b s ILE 449 Cb -0.11 -1.77 0.00 0.00 0.01 0.00 0.00 42.46 40.59 3k4b s ILE 449 CO 0.01 -0.86 0.00 0.00 0.00 0.00 0.00 174.94 174.09 3k4b n HIS 450 N 3.93 -0.06 -3.72 3.97 1.44 -0.45 -0.53 115.22 119.80 3k4b n HIS 450 Ca 0.07 0.00 -0.23 0.00 -2.01 0.00 0.00 57.72 55.54 3k4b n HIS 450 Cb 0.37 0.00 -0.17 0.00 0.12 0.00 0.00 29.99 30.30 3k4b n HIS 450 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 3k4b s ARG 451 N 0.80 0.37 -0.03 -1.40 6.06 -1.20 0.10 118.95 123.65 3k4b s ARG 451 Ca 0.00 0.07 0.04 0.00 -2.50 0.00 0.00 55.73 53.34 3k4b s ARG 451 Cb 0.00 -1.14 -0.03 0.00 0.06 0.00 0.00 34.95 33.84 3k4b s ARG 451 CO 0.00 -0.41 -0.14 0.34 -2.50 0.00 0.00 175.30 172.59 3k4b s ASP 452 N 2.03 4.07 0.43 -2.12 -1.08 -1.26 -5.01 116.67 113.73 3k4b s ASP 452 Ca 0.04 -0.22 0.14 0.00 -0.52 0.00 0.00 52.55 51.98 3k4b s ASP 452 Cb -0.13 -0.84 0.93 0.00 -1.46 0.00 0.00 42.92 41.41 3k4b s ASP 452 CO -0.06 0.32 1.95 0.00 0.52 0.00 0.00 175.17 177.91 3k4b h ALA 453 N 5.11 1.62 -0.14 3.66 0.00 -1.97 -3.34 119.26 124.19 3k4b h ALA 453 Ca -0.47 -0.21 -0.27 0.00 0.00 0.00 0.00 54.91 53.96 3k4b h ALA 453 Cb 1.15 -0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.81 3k4b h ALA 453 CO 0.50 0.29 -0.17 0.34 0.00 0.00 0.00 179.25 180.21 3k4b n PHE 454 N -4.26 0.42 -1.05 0.00 7.35 -1.26 -3.59 117.46 115.08 3k4b n PHE 454 Ca -0.02 -1.60 -0.33 0.00 -0.76 0.00 0.00 57.45 54.73 3k4b n PHE 454 Cb 0.29 -1.51 0.13 0.00 0.35 0.00 0.00 39.48 38.75 3k4b n PHE 454 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 3k4b n SER 455 N 2.03 0.89 -1.10 -2.13 3.41 -1.26 -4.93 113.62 110.54 3k4b n SER 455 Ca 0.43 0.56 0.10 0.00 -0.26 0.00 0.00 58.87 59.70 3k4b n SER 455 Cb 0.81 -1.50 0.26 0.00 -0.26 0.00 0.00 64.21 63.52 3k4b n SER 455 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3k4b n TYR 456 N -3.42 0.78 -3.53 7.33 0.53 -1.26 -4.98 117.16 112.61 3k4b n TYR 456 Ca 0.13 -0.48 -0.11 0.00 -1.02 0.00 0.00 57.90 56.42 3k4b n TYR 456 Cb 0.51 -0.01 -0.03 0.00 -1.03 0.00 0.00 39.34 38.78 3k4b n TYR 456 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 3k4b s GLY 457 N -1.02 -0.45 0.03 2.72 0.00 -1.26 -5.11 107.32 102.23 3k4b s GLY 457 Ca 0.40 0.24 -0.38 0.00 0.00 0.00 0.00 44.72 44.97 3k4b s GLY 457 CO 0.27 -0.02 1.22 0.00 0.00 0.00 0.00 173.10 174.57 3k4b n ALA 458 N -0.34 -2.28 -2.37 3.20 0.00 -1.26 -4.82 120.51 112.65 3k4b n ALA 458 Ca -0.15 0.56 -0.31 0.00 0.00 0.00 0.00 53.44 53.53 3k4b n ALA 458 Cb 0.64 -1.92 -0.05 0.00 0.00 0.00 0.00 19.45 18.12 3k4b n ALA 458 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3k4b s VAL 459 N 0.32 4.90 0.45 0.00 0.11 -1.26 -5.05 120.40 119.87 3k4b s VAL 459 Ca 0.88 0.45 -0.22 0.00 -2.93 0.00 0.00 61.98 60.16 3k4b s VAL 459 Cb -1.12 -3.66 -0.08 0.00 -1.53 0.00 0.00 36.38 29.99 3k4b s VAL 459 CO 0.52 -0.23 1.08 -1.58 -3.33 0.00 0.00 175.10 171.57 3k4b s GLN 460 N -3.20 3.88 0.00 1.54 2.00 -1.26 -4.95 119.66 117.67 3k4b s GLN 460 Ca 0.48 1.55 0.00 0.00 -2.00 0.00 0.00 55.36 55.39 3k4b s GLN 460 Cb -0.11 -2.33 0.00 0.00 0.80 0.00 0.00 33.01 31.37 3k4b s GLN 460 CO 0.25 -0.39 0.05 1.04 -0.50 0.00 0.00 175.29 175.73 3k4b n GLN 461 N -0.54 3.72 0.02 1.67 1.13 -1.26 -4.80 117.38 117.32 3k4b n GLN 461 Ca 0.07 -0.05 -0.19 0.00 -1.94 0.00 0.00 57.00 54.90 3k4b n GLN 461 Cb 0.50 -0.40 -0.10 0.00 0.11 0.00 0.00 30.24 30.34 3k4b n GLN 461 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3k4b h SER 462 N 0.00 0.73 -3.19 1.08 0.87 -2.04 -3.43 113.55 107.57 3k4b h SER 462 Ca 0.00 -0.73 -0.60 0.00 -1.23 0.00 0.00 61.79 59.23 3k4b h SER 462 Cb 0.03 -0.22 -0.08 0.00 -0.44 0.00 0.00 62.40 61.68 3k4b h SER 462 CO 0.00 1.37 -0.28 -0.63 -0.53 0.00 0.00 176.83 176.76 3k4b s ILE 463 N -3.32 5.24 0.21 2.23 -1.09 -1.26 -5.03 121.20 118.18 3k4b s ILE 463 Ca -0.12 0.65 -0.32 0.00 -2.23 0.00 0.00 60.65 58.63 3k4b s ILE 463 Cb 0.05 -3.66 -0.13 0.00 -1.58 0.00 0.00 42.46 37.14 3k4b s ILE 463 CO 0.87 0.44 1.52 -0.67 -1.23 0.00 0.00 174.94 175.87 3k4b n ASP 464 N 3.09 3.08 0.05 3.58 -0.08 -1.26 -4.86 116.55 120.15 3k4b n ASP 464 Ca -0.12 1.11 0.05 0.00 -1.51 0.00 0.00 54.79 54.32 3k4b n ASP 464 Cb 0.52 -1.45 0.47 0.00 2.34 0.00 0.00 41.12 43.00 3k4b n ASP 464 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3k4b h SER 465 N 5.21 0.38 0.02 1.67 4.64 -1.95 -1.26 113.55 122.26 3k4b h SER 465 Ca -0.45 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3k4b h SER 465 Cb 1.26 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3k4b h SER 465 CO 0.83 0.28 0.00 0.03 -0.87 0.00 0.00 176.83 177.10 3k4b h ARG 466 N 0.45 0.00 0.00 4.77 3.08 -1.97 -1.93 114.38 118.79 3k4b h ARG 466 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 3k4b h ARG 466 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 3k4b h ARG 466 CO -0.03 0.00 -0.59 1.28 -1.07 0.00 0.00 179.97 179.57 3k4b n LEU 467 N -3.04 0.56 -4.69 3.04 4.77 -0.48 -4.93 117.00 112.24 3k4b n LEU 467 Ca -0.03 0.06 -0.39 0.00 -0.03 0.00 0.00 56.01 55.62 3k4b n LEU 467 Cb 0.07 -0.22 -0.06 0.00 -2.33 0.00 0.00 43.42 40.89 3k4b n LEU 467 CO 0.20 0.07 0.31 -0.63 -1.33 0.00 0.00 177.39 176.00 3k4b s ILE 468 N -3.07 5.08 -0.04 -0.08 1.01 -0.73 -1.06 121.20 122.32 3k4b s ILE 468 Ca 0.09 1.15 0.06 0.00 0.00 0.00 0.00 60.65 61.95 3k4b s ILE 468 Cb 0.16 -3.92 -0.01 0.00 0.01 0.00 0.00 42.46 38.70 3k4b s ILE 468 CO 0.72 0.21 -0.22 -0.69 0.00 0.00 0.00 174.94 174.95 3k4b s VAL 469 N 1.30 1.78 0.22 2.92 1.01 -0.92 -4.95 120.40 121.76 3k4b s VAL 469 Ca 0.29 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 61.22 3k4b s VAL 469 Cb -0.16 -1.50 -0.07 0.00 0.00 0.00 0.00 36.38 34.65 3k4b s VAL 469 CO 0.12 0.50 0.58 -1.81 0.00 0.00 0.00 175.10 174.49 3k4b s ASP 470 N -0.26 6.72 -0.10 3.32 1.11 0.29 -1.06 116.67 126.68 3k4b s ASP 470 Ca 0.01 1.03 0.00 0.00 0.18 0.00 0.00 52.55 53.77 3k4b s ASP 470 Cb -0.11 -2.27 0.02 0.00 1.07 0.00 0.00 42.92 41.63 3k4b s ASP 470 CO 0.01 -0.03 -0.08 0.26 1.18 0.00 0.00 175.17 176.51 3k4b s TRP 471 N -1.73 1.43 -0.16 4.23 0.52 -0.03 -1.34 118.94 121.86 3k4b s TRP 471 Ca 0.45 -0.67 -0.01 0.00 0.02 0.00 0.00 56.10 55.90 3k4b s TRP 471 Cb -0.12 -1.17 0.04 0.00 -1.15 0.00 0.00 33.47 31.07 3k4b s TRP 471 CO 0.20 -0.45 -0.03 1.03 0.02 0.00 0.00 176.95 177.72 3k4b s ARG 472 N 1.48 1.21 -0.08 4.98 0.52 -0.40 -1.95 118.95 124.70 3k4b s ARG 472 Ca 0.01 -0.46 0.01 0.00 -0.52 0.00 0.00 55.73 54.76 3k4b s ARG 472 Cb -0.13 -1.95 -0.03 0.00 0.52 0.00 0.00 34.95 33.36 3k4b s ARG 472 CO -0.06 -0.47 -0.09 -0.06 0.02 0.00 0.00 175.30 174.65 3k4b s PHE 473 N 1.70 2.88 -0.13 -0.53 0.40 -0.41 -0.75 117.98 121.13 3k4b s PHE 473 Ca 0.00 -0.14 0.01 0.00 -0.60 0.00 0.00 56.93 56.20 3k4b s PHE 473 Cb -0.15 -1.74 0.02 0.00 0.51 0.00 0.00 43.02 41.65 3k4b s PHE 473 CO -0.07 0.19 -0.15 -0.06 0.70 0.00 0.00 175.22 175.82 3k4b s PHE 474 N -0.50 2.11 0.32 0.36 0.40 0.12 -1.80 117.98 118.99 3k4b s PHE 474 Ca 0.07 -1.10 -0.00 0.00 -0.60 0.00 0.00 56.93 55.30 3k4b s PHE 474 Cb -0.12 -1.53 -0.04 0.00 0.51 0.00 0.00 43.02 41.84 3k4b s PHE 474 CO 0.02 -0.58 0.53 0.20 0.70 0.00 0.00 175.22 176.08 3k4b s GLY 475 N 1.24 1.45 0.06 4.36 0.00 0.93 -1.50 107.32 113.87 3k4b s GLY 475 Ca -0.01 -0.86 -0.15 0.00 0.00 0.00 0.00 44.72 43.70 3k4b s GLY 475 CO -0.06 -0.79 0.48 1.09 0.00 0.00 0.00 173.10 173.81 3k4b s ARG 476 N -4.11 3.98 -0.19 2.90 1.70 -1.26 -3.58 118.95 118.39 3k4b s ARG 476 Ca 0.40 0.48 -0.01 0.00 -0.47 0.00 0.00 55.73 56.14 3k4b s ARG 476 Cb -0.10 -3.13 0.01 0.00 -0.57 0.00 0.00 34.95 31.16 3k4b s ARG 476 CO 0.34 0.61 -0.14 0.99 -1.08 0.00 0.00 175.30 176.03 3k4b s THR 477 N -1.22 2.61 0.17 4.99 2.01 -1.26 -4.73 115.64 118.21 3k4b s THR 477 Ca 0.29 -0.76 -0.34 0.00 0.31 0.00 0.00 61.69 61.20 3k4b s THR 477 Cb -0.17 -2.13 -0.14 0.00 0.01 0.00 0.00 72.50 70.07 3k4b s THR 477 CO 0.17 0.50 1.52 -0.62 -0.69 0.00 0.00 174.62 175.50 3k4b n GLU 478 N 4.53 2.04 -2.89 4.92 1.02 -1.26 -4.09 120.64 124.91 3k4b n GLU 478 Ca -0.20 0.73 -0.40 0.00 -0.02 0.00 0.00 57.16 57.27 3k4b n GLU 478 Cb 0.51 -2.47 -0.05 0.00 -0.02 0.00 0.00 31.44 29.41 3k4b n GLU 478 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3k4b s PRO 479 N 0.61 4.56 0.02 3.49 0.04 -1.26 -4.84 135.00 137.63 3k4b s PRO 479 Ca 0.77 1.20 0.03 0.00 0.04 0.00 0.00 61.00 63.05 3k4b s PRO 479 Cb -0.70 -3.37 -0.02 0.00 0.04 0.00 0.00 34.50 30.45 3k4b s PRO 479 CO 0.41 0.24 -0.10 0.15 0.04 0.00 0.00 177.00 177.74 3k4b s LYS 480 N 0.03 0.70 0.28 4.56 -0.14 -1.26 -4.98 119.74 118.93 3k4b s LYS 480 Ca 0.42 -0.57 -0.02 0.00 -1.36 0.00 0.00 55.97 54.44 3k4b s LYS 480 Cb -0.21 -0.64 0.38 0.00 -1.68 0.00 0.00 37.83 35.68 3k4b s LYS 480 CO 0.25 0.16 1.88 1.49 -0.76 0.00 0.00 175.35 178.37 3k4b h GLU 481 N 5.22 0.98 0.00 1.68 4.81 -1.93 -2.01 114.58 123.33 3k4b h GLU 481 Ca -0.34 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 3k4b h GLU 481 Cb 1.19 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.39 3k4b h GLU 481 CO 0.45 0.77 0.00 -0.85 -0.73 0.00 0.00 179.01 178.65 3k4b n GLU 482 N -4.33 0.11 -3.05 1.92 0.00 -1.26 -4.03 120.64 110.01 3k4b n GLU 482 Ca 0.06 0.29 -0.41 0.00 0.00 0.00 0.00 57.16 57.10 3k4b n GLU 482 Cb 0.14 -1.69 -0.06 0.00 0.00 0.00 0.00 31.44 29.83 3k4b n GLU 482 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 3k4b s ASN 483 N -3.71 6.62 0.02 -1.84 0.01 -0.82 -4.81 114.94 110.41 3k4b s ASN 483 Ca 0.07 0.70 0.01 0.00 -0.71 0.00 0.00 52.86 52.93 3k4b s ASN 483 Cb 0.11 -2.36 -0.01 0.00 0.41 0.00 0.00 41.25 39.39 3k4b s ASN 483 CO 0.39 -0.45 -0.05 -0.54 -1.51 0.00 0.00 177.10 174.94 3k4b s LYS 484 N 2.65 0.35 -0.15 -0.60 1.02 -0.63 -1.81 119.74 120.56 3k4b s LYS 484 Ca 0.28 -0.47 -0.03 0.00 0.02 0.00 0.00 55.97 55.76 3k4b s LYS 484 Cb -0.15 -0.14 -0.03 0.00 -0.52 0.00 0.00 37.83 36.99 3k4b s LYS 484 CO 0.09 0.02 -0.04 -1.17 -0.92 0.00 0.00 175.35 173.34 3k4b s LEU 485 N -0.99 3.26 0.21 3.17 2.96 -0.10 -1.52 118.68 125.66 3k4b s LEU 485 Ca -0.08 -0.12 -0.00 0.00 -0.22 0.00 0.00 54.13 53.72 3k4b s LEU 485 Cb -0.07 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.80 3k4b s LEU 485 CO -0.00 0.18 0.10 -1.66 -1.32 0.00 0.00 176.35 173.65 3k4b s TRP 486 N 0.28 1.24 -0.04 5.38 1.48 0.32 -4.57 118.94 123.02 3k4b s TRP 486 Ca -0.03 -1.26 0.03 0.00 -1.06 0.00 0.00 56.10 53.78 3k4b s TRP 486 Cb -0.14 -0.67 0.00 0.00 -1.16 0.00 0.00 33.47 31.50 3k4b s TRP 486 CO 0.03 -0.49 -0.14 -0.06 -4.06 0.00 0.00 176.95 172.23 3k4b s PHE 487 N -3.97 1.45 0.41 1.66 0.08 -1.26 -0.44 117.98 115.91 3k4b s PHE 487 Ca 0.35 -0.44 -0.25 0.00 0.12 0.00 0.00 56.93 56.72 3k4b s PHE 487 Cb 0.07 -1.01 -0.08 0.00 -0.57 0.00 0.00 43.02 41.43 3k4b s PHE 487 CO 0.10 -0.18 1.15 0.45 -0.10 0.00 0.00 175.22 176.65 3k4b s SER 488 N 0.23 6.51 0.00 1.36 0.15 -0.70 0.80 113.70 122.05 3k4b s SER 488 Ca -0.06 2.31 0.26 0.00 0.70 0.00 0.00 55.95 59.15 3k4b s SER 488 Cb -0.12 -2.61 0.65 0.00 -1.71 0.00 0.00 66.02 62.24 3k4b s SER 488 CO 0.02 -0.68 1.52 -0.90 1.20 0.00 0.00 173.24 174.40 3k4b n ASP 489 N -0.01 2.07 0.00 5.45 5.68 -1.26 -4.07 116.55 124.40 3k4b n ASP 489 Ca 0.05 -1.65 0.00 0.00 -0.50 0.00 0.00 54.79 52.68 3k4b n ASP 489 Cb 0.47 0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 3k4b n ASP 489 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 3k4b n LYS 490 N 0.56 0.00 -2.92 0.11 4.81 -1.26 -5.04 118.16 114.42 3k4b n LYS 490 Ca 0.16 0.00 -0.40 0.00 -0.87 0.00 0.00 58.31 57.20 3k4b n LYS 490 Cb 0.45 -0.75 -0.05 0.00 0.02 0.00 0.00 35.03 34.70 3k4b n LYS 490 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 3k4b s ILE 491 N -1.98 4.48 0.16 3.15 -1.09 -1.26 -4.99 121.20 119.66 3k4b s ILE 491 Ca 0.00 1.77 0.08 0.00 -2.23 0.00 0.00 60.65 60.27 3k4b s ILE 491 Cb 0.00 -4.18 -0.04 0.00 -1.58 0.00 0.00 42.46 36.66 3k4b s ILE 491 CO 0.00 0.44 -0.17 0.42 -1.23 0.00 0.00 174.94 174.40 3k4b s THR 492 N -0.61 1.71 0.25 2.92 -4.23 -1.26 -0.33 115.64 114.09 3k4b s THR 492 Ca 0.39 -1.91 -0.00 0.00 -1.18 0.00 0.00 61.69 58.98 3k4b s THR 492 Cb -0.23 -1.80 0.05 0.00 1.34 0.00 0.00 72.50 71.86 3k4b s THR 492 CO 0.26 -0.37 0.34 -0.90 -0.54 0.00 0.00 174.62 173.41 3k4b n ASP 493 N 0.26 0.44 0.22 3.99 5.68 0.48 -4.72 116.55 122.90 3k4b n ASP 493 Ca -0.13 -1.38 0.15 0.00 -0.50 0.00 0.00 54.79 52.94 3k4b n ASP 493 Cb 0.57 -0.22 0.80 0.00 -1.14 0.00 0.00 41.12 41.13 3k4b n ASP 493 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k4b h ALA 494 N -0.54 1.00 -0.25 2.12 0.00 -1.99 0.13 119.26 119.73 3k4b h ALA 494 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3k4b h ALA 494 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3k4b h ALA 494 CO 0.12 0.00 0.00 0.66 0.00 0.00 0.00 179.25 180.03 3k4b n TYR 495 N -2.55 0.85 -2.45 0.00 4.02 -1.26 -4.95 117.16 110.82 3k4b n TYR 495 Ca -0.02 -0.86 -0.15 0.00 -0.01 0.00 0.00 57.90 56.85 3k4b n TYR 495 Cb 0.07 -0.29 0.00 0.00 -0.02 0.00 0.00 39.34 39.10 3k4b n TYR 495 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3k4b n ASN 496 N -0.52 -4.66 -4.82 7.72 5.03 0.03 -4.99 115.26 113.05 3k4b n ASN 496 Ca 0.20 -0.08 -0.22 0.00 0.87 0.00 0.00 54.58 55.36 3k4b n ASN 496 Cb 0.85 -3.71 -0.04 0.00 -1.02 0.00 0.00 39.78 35.85 3k4b n ASN 496 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 3k4b s MET 497 N -4.95 2.59 0.15 3.52 -1.94 -1.26 -4.83 119.30 112.58 3k4b s MET 497 Ca 0.07 -1.41 -0.33 0.00 -1.71 0.00 0.00 55.69 52.32 3k4b s MET 497 Cb -0.03 -2.37 -0.12 0.00 2.01 0.00 0.00 34.83 34.32 3k4b s MET 497 CO 0.09 0.06 1.71 -2.30 -0.01 0.00 0.00 175.02 174.57 3k4b n PRO 498 N -1.33 2.53 -2.17 2.03 -0.02 -1.26 -0.39 135.00 134.39 3k4b n PRO 498 Ca -0.02 0.91 -0.42 0.00 -2.02 0.00 0.00 63.50 61.96 3k4b n PRO 498 Cb 0.60 -2.75 -0.03 0.00 -0.02 0.00 0.00 33.50 31.31 3k4b n PRO 498 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3k4b s GLN 499 N 1.64 4.28 0.32 -0.52 2.00 0.55 -4.64 119.66 123.29 3k4b s GLN 499 Ca 0.79 2.04 -0.29 0.00 -2.00 0.00 0.00 55.36 55.90 3k4b s GLN 499 Cb -0.57 -3.52 -0.10 0.00 0.80 0.00 0.00 33.01 29.61 3k4b s GLN 499 CO 0.37 -0.58 1.28 -1.25 -0.50 0.00 0.00 175.29 174.61 3k4b s PRO 500 N 2.22 4.39 -0.01 1.67 0.04 -1.26 -1.71 135.00 140.33 3k4b s PRO 500 Ca 0.65 2.16 0.00 0.00 0.04 0.00 0.00 61.00 63.85 3k4b s PRO 500 Cb -0.34 -3.09 0.02 0.00 0.04 0.00 0.00 34.50 31.13 3k4b s PRO 500 CO 0.28 -0.14 0.01 0.99 0.04 0.00 0.00 177.00 178.18 3k4b s THR 501 N -1.07 0.03 -0.07 1.26 2.01 0.42 -4.57 115.64 113.65 3k4b s THR 501 Ca 0.49 0.10 -0.04 0.00 0.31 0.00 0.00 61.69 62.55 3k4b s THR 501 Cb -0.39 -0.11 -0.04 0.00 0.01 0.00 0.00 72.50 71.98 3k4b s THR 501 CO 0.51 0.07 0.14 -0.36 -0.69 0.00 0.00 174.62 174.29 3k4b s PHE 502 N 0.67 3.53 -0.35 4.92 0.08 -1.26 -0.52 117.98 125.04 3k4b s PHE 502 Ca -0.06 0.42 0.01 0.00 0.12 0.00 0.00 56.93 57.41 3k4b s PHE 502 Cb -0.09 -1.87 0.11 0.00 -0.57 0.00 0.00 43.02 40.60 3k4b s PHE 502 CO -0.02 0.67 0.13 0.34 -0.10 0.00 0.00 175.22 176.24 3k4b s ASP 503 N -1.43 4.06 -0.01 1.36 -1.08 -0.58 -4.60 116.67 114.39 3k4b s ASP 503 Ca 0.20 -1.99 -0.00 0.00 -0.52 0.00 0.00 52.55 50.24 3k4b s ASP 503 Cb -0.12 -1.04 0.01 0.00 -1.46 0.00 0.00 42.92 40.31 3k4b s ASP 503 CO 0.10 -0.37 0.01 0.12 0.52 0.00 0.00 175.17 175.56 3k4b s PHE 504 N 1.16 0.00 -0.01 -5.34 2.19 -0.39 -1.61 117.98 113.98 3k4b s PHE 504 Ca 0.12 0.05 -0.02 0.00 0.33 0.00 0.00 56.93 57.41 3k4b s PHE 504 Cb -0.19 -0.06 -0.00 0.00 -1.31 0.00 0.00 43.02 41.45 3k4b s PHE 504 CO -0.16 -0.03 0.04 1.03 1.83 0.00 0.00 175.22 177.94 3k4b s ARG 505 N 0.29 0.19 -0.03 10.12 1.81 -1.26 -4.03 118.95 126.03 3k4b s ARG 505 Ca -0.02 -0.18 -0.34 0.00 -1.72 0.00 0.00 55.73 53.47 3k4b s ARG 505 Cb -0.03 0.08 -0.12 0.00 -0.45 0.00 0.00 34.95 34.42 3k4b s ARG 505 CO -0.01 -0.03 1.85 1.19 -0.68 0.00 0.00 175.30 177.62 3k4b n PHE 506 N 2.44 2.35 -1.61 -0.53 3.72 -1.26 -4.87 117.46 117.70 3k4b n PHE 506 Ca -0.17 -0.01 -0.47 0.00 -0.05 0.00 0.00 57.45 56.74 3k4b n PHE 506 Cb 0.58 -2.67 -0.04 0.00 -0.94 0.00 0.00 39.48 36.42 3k4b n PHE 506 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 3k4b n PRO 507 N 6.26 1.46 -0.77 -1.08 -0.02 -1.26 -4.85 135.00 134.73 3k4b n PRO 507 Ca 0.21 0.52 -0.32 0.00 -2.02 0.00 0.00 63.50 61.89 3k4b n PRO 507 Cb 0.31 -2.07 0.15 0.00 -0.02 0.00 0.00 33.50 31.88 3k4b n PRO 507 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k4b n ALA 508 N 1.61 -1.00 0.00 3.55 0.00 -1.26 -2.61 120.51 120.79 3k4b n ALA 508 Ca 0.14 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 53.05 3k4b n ALA 508 Cb 0.27 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.58 3k4b n ALA 508 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k4b n GLY 509 N 0.54 0.44 0.22 0.00 0.00 -1.26 -4.49 105.19 100.63 3k4b n GLY 509 Ca 0.11 -1.76 -0.01 0.00 0.00 0.00 0.00 46.02 44.36 3k4b n GLY 509 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3k4b h ARG 510 N 0.00 0.28 -0.63 1.61 2.43 -1.99 -1.80 114.38 114.27 3k4b h ARG 510 Ca 0.00 -0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.28 3k4b h ARG 510 Cb 0.00 -0.06 -0.09 0.00 -0.42 0.00 0.00 29.97 29.39 3k4b h ARG 510 CO 0.00 0.18 0.10 1.15 -1.51 0.00 0.00 179.97 179.90 3k4b h THR 511 N 0.28 0.58 -0.23 0.20 2.02 -1.79 0.18 112.91 114.16 3k4b h THR 511 Ca 0.28 -0.08 -0.10 0.00 0.77 0.00 0.00 66.41 67.28 3k4b h THR 511 Cb 0.38 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 3k4b h THR 511 CO -0.34 0.04 -0.26 0.28 0.37 0.00 0.00 175.52 175.61 3k4b h SER 512 N 0.22 0.62 -0.73 4.18 0.02 -1.10 -1.80 113.55 114.97 3k4b h SER 512 Ca 0.33 -0.49 -0.05 0.00 -0.84 0.00 0.00 61.79 60.74 3k4b h SER 512 Cb 0.53 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 3k4b h SER 512 CO -0.45 0.98 0.24 0.50 -1.14 0.00 0.00 176.83 176.96 3k4b h LYS 513 N 0.27 1.12 -0.16 3.45 3.64 -1.11 -2.60 116.57 121.18 3k4b h LYS 513 Ca 0.03 -0.23 -0.12 0.00 -1.27 0.00 0.00 60.65 59.06 3k4b h LYS 513 Cb 0.82 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 3k4b h LYS 513 CO 0.06 0.95 -0.43 0.93 -2.27 0.00 0.00 179.45 178.69 3k4b h GLU 514 N 1.07 0.37 -0.26 1.90 5.08 -0.50 -1.26 114.58 120.97 3k4b h GLU 514 Ca 0.24 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 3k4b h GLU 514 Cb 0.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 3k4b h GLU 514 CO -0.01 0.73 0.00 0.00 -1.00 0.00 0.00 179.01 178.74 3k4b h ALA 515 N 1.24 0.35 -0.46 3.43 0.00 -1.01 0.15 119.26 122.96 3k4b h ALA 515 Ca 0.02 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 3k4b h ALA 515 Cb 0.88 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3k4b h ALA 515 CO 0.07 0.08 0.06 1.49 0.00 0.00 0.00 179.25 180.95 3k4b h GLU 516 N 0.24 0.77 0.00 0.00 4.57 -1.41 -0.59 114.58 118.17 3k4b h GLU 516 Ca 0.07 -0.22 -0.03 0.00 -1.18 0.00 0.00 59.36 58.01 3k4b h GLU 516 Cb 0.41 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.91 3k4b h GLU 516 CO 0.01 0.80 -0.13 -0.44 -1.18 0.00 0.00 179.01 178.07 3k4b h ASP 517 N 0.64 0.00 0.34 1.04 3.32 -0.96 -1.86 116.42 118.93 3k4b h ASP 517 Ca 0.14 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 3k4b h ASP 517 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 3k4b h ASP 517 CO 0.01 0.13 -0.16 -0.03 -1.72 0.00 0.00 179.24 177.47 3k4b h MET 518 N 0.00 -0.44 -0.74 3.56 4.05 -0.30 -0.84 114.93 120.23 3k4b h MET 518 Ca -0.00 0.03 0.16 0.00 -0.28 0.00 0.00 59.70 59.61 3k4b h MET 518 Cb 0.29 0.10 -0.13 0.00 -0.80 0.00 0.00 31.60 31.05 3k4b h MET 518 CO 0.02 -0.12 -0.06 1.98 0.23 0.00 0.00 176.91 178.96 3k4b h MET 519 N -0.80 0.06 -0.64 0.39 1.85 -0.78 -0.86 114.93 114.15 3k4b h MET 519 Ca -0.05 -0.00 -0.05 0.00 -0.61 0.00 0.00 59.70 58.99 3k4b h MET 519 Cb 0.52 -0.01 -0.03 0.00 0.43 0.00 0.00 31.60 32.51 3k4b h MET 519 CO 0.08 0.04 0.20 1.15 -0.40 0.00 0.00 176.91 177.97 3k4b h THR 520 N 0.06 1.25 -0.85 -0.77 2.02 -1.26 -1.72 112.91 111.64 3k4b h THR 520 Ca 0.39 -0.86 0.07 0.00 0.77 0.00 0.00 66.41 66.78 3k4b h THR 520 Cb 0.66 0.59 -0.07 0.00 -1.74 0.00 0.00 68.15 67.59 3k4b h THR 520 CO -0.69 0.33 0.52 -0.78 0.37 0.00 0.00 175.52 175.27 3k4b h ASP 521 N 0.93 0.79 -0.40 4.18 3.58 0.03 -0.44 116.42 125.09 3k4b h ASP 521 Ca 0.21 0.03 -0.04 0.00 0.42 0.00 0.00 57.03 57.64 3k4b h ASP 521 Cb 0.30 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.20 3k4b h ASP 521 CO -0.01 0.49 0.08 -0.03 -2.88 0.00 0.00 179.24 176.89 3k4b h MET 522 N 0.92 0.65 -0.61 0.28 4.05 -0.79 0.36 114.93 119.80 3k4b h MET 522 Ca 0.38 -0.17 0.04 0.00 -0.28 0.00 0.00 59.70 59.67 3k4b h MET 522 Cb 0.23 -0.08 -0.04 0.00 -0.80 0.00 0.00 31.60 30.91 3k4b h MET 522 CO -0.20 0.69 0.35 0.00 0.23 0.00 0.00 176.91 177.99 3k4b h VAL 524 N 0.68 1.34 0.03 0.00 2.07 -0.61 -3.01 116.25 116.75 3k4b h VAL 524 Ca 0.26 -1.69 -0.25 0.00 0.82 0.00 0.00 66.70 65.84 3k4b h VAL 524 Cb 0.09 1.98 0.02 0.00 -1.52 0.00 0.00 31.29 31.86 3k4b h VAL 524 CO -0.13 0.52 -0.99 -0.03 0.02 0.00 0.00 177.57 176.96 3k4b h MET 525 N 0.23 0.61 0.00 1.57 -1.53 -0.11 -3.19 114.93 112.50 3k4b h MET 525 Ca -0.01 -0.70 -0.02 0.00 -3.44 0.00 0.00 59.70 55.53 3k4b h MET 525 Cb 1.04 0.21 -0.00 0.00 -0.55 0.00 0.00 31.60 32.30 3k4b h MET 525 CO 0.09 1.29 -0.10 0.66 0.14 0.00 0.00 176.91 179.00 3k4b h SER 526 N 0.23 0.00 0.74 1.39 4.64 -0.91 -1.14 113.55 118.50 3k4b h SER 526 Ca -0.13 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.18 3k4b h SER 526 Cb 1.66 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.75 3k4b h SER 526 CO 0.19 0.10 -0.03 0.00 -0.87 0.00 0.00 176.83 176.22 3k4b h ALA 527 N 1.90 1.03 0.00 5.18 0.00 -1.51 -1.28 119.26 124.57 3k4b h ALA 527 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3k4b h ALA 527 Cb 0.22 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3k4b h ALA 527 CO 0.01 0.03 -0.09 0.87 0.00 0.00 0.00 179.25 180.08 3k4b h LYS 528 N 0.00 0.00 0.00 0.00 1.57 -1.33 -3.30 116.57 113.51 3k4b h LYS 528 Ca -0.00 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 3k4b h LYS 528 Cb 0.40 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.66 3k4b h LYS 528 CO 0.00 0.09 -1.94 -0.89 -0.57 0.00 0.00 179.45 176.14 3k4b n ILE 529 N -3.25 0.95 0.00 1.86 2.08 -0.54 -4.97 119.36 115.48 3k4b n ILE 529 Ca -0.00 -0.55 0.00 0.00 0.56 0.00 0.00 62.75 62.76 3k4b n ILE 529 Cb 0.33 -0.71 0.00 0.00 -0.75 0.00 0.00 39.64 38.50 3k4b n ILE 529 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3k4b n GLY 530 N 2.24 -0.34 3.80 7.39 0.00 -0.86 -0.80 105.19 116.63 3k4b n GLY 530 Ca -0.24 -1.11 -0.33 0.00 0.00 0.00 0.00 46.02 44.35 3k4b n GLY 530 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3k4b s GLY 531 N 0.00 2.08 0.30 -0.02 0.00 -1.18 -4.10 107.32 104.40 3k4b s GLY 531 Ca 0.00 0.39 -0.28 0.00 0.00 0.00 0.00 44.72 44.83 3k4b s GLY 531 CO 0.00 0.72 1.15 0.69 0.00 0.00 0.00 173.10 175.66 3k4b n PHE 532 N -2.25 1.74 -2.63 1.90 3.72 -1.26 0.06 117.46 118.74 3k4b n PHE 532 Ca 0.09 0.63 -0.43 0.00 -0.05 0.00 0.00 57.45 57.69 3k4b n PHE 532 Cb 0.53 -2.33 -0.02 0.00 -0.94 0.00 0.00 39.48 36.71 3k4b n PHE 532 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 3k4b s LEU 533 N -0.17 4.18 0.22 4.37 2.96 0.74 -4.61 118.68 126.38 3k4b s LEU 533 Ca 0.58 1.52 -0.32 0.00 -0.22 0.00 0.00 54.13 55.69 3k4b s LEU 533 Cb -0.65 -3.55 -0.14 0.00 0.50 0.00 0.00 46.19 42.36 3k4b s LEU 533 CO 0.60 -0.58 1.43 -2.65 -1.32 0.00 0.00 176.35 173.83 3k4b n PRO 534 N 5.72 2.01 -0.08 0.98 -0.02 -1.26 -0.28 135.00 142.06 3k4b n PRO 534 Ca 0.11 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 3k4b n PRO 534 Cb 0.47 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 3k4b n PRO 534 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k4b n GLY 535 N 2.37 1.02 2.50 -1.23 0.00 -1.26 -4.90 105.19 103.68 3k4b n GLY 535 Ca 0.13 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.97 3k4b n GLY 535 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3k4b n SER 536 N 0.00 2.12 -4.84 1.61 7.64 0.61 -5.01 113.62 115.74 3k4b n SER 536 Ca 0.00 -3.11 -0.32 0.00 1.01 0.00 0.00 58.87 56.45 3k4b n SER 536 Cb 0.00 -0.56 0.01 0.00 -1.01 0.00 0.00 64.21 62.65 3k4b n SER 536 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3k4b s LEU 537 N -2.97 3.34 0.17 -3.43 1.43 -1.25 -2.22 118.68 113.74 3k4b s LEU 537 Ca 0.38 1.57 -0.34 0.00 -1.03 0.00 0.00 54.13 54.71 3k4b s LEU 537 Cb 0.38 -4.50 -0.13 0.00 0.03 0.00 0.00 46.19 41.97 3k4b s LEU 537 CO -0.06 -1.00 1.61 -0.81 0.23 0.00 0.00 176.35 176.31 3k4b n PRO 538 N -2.47 2.27 -3.55 1.29 -0.04 -1.26 -4.57 135.00 126.67 3k4b n PRO 538 Ca 0.07 0.82 -0.14 0.00 -0.04 0.00 0.00 63.50 64.20 3k4b n PRO 538 Cb 0.54 -2.60 -0.06 0.00 -0.04 0.00 0.00 33.50 31.34 3k4b n PRO 538 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 3k4b s GLN 539 N 0.99 0.83 0.13 0.54 -2.07 -0.77 -5.00 119.66 114.31 3k4b s GLN 539 Ca 0.78 0.21 -0.30 0.00 -1.82 0.00 0.00 55.36 54.23 3k4b s GLN 539 Cb -0.65 0.39 -0.06 0.00 -1.09 0.00 0.00 33.01 31.61 3k4b s GLN 539 CO 0.37 -0.26 0.95 -0.06 -1.32 0.00 0.00 175.29 174.97 3k4b s PHE 540 N -1.14 3.83 0.64 9.60 0.08 -1.26 -1.76 117.98 127.97 3k4b s PHE 540 Ca -0.07 1.80 -0.11 0.00 0.12 0.00 0.00 56.93 58.68 3k4b s PHE 540 Cb -0.00 -3.03 -0.02 0.00 -0.57 0.00 0.00 43.02 39.39 3k4b s PHE 540 CO 0.06 0.25 1.03 -1.64 -0.10 0.00 0.00 175.22 174.82 3k4b s MET 541 N -0.17 3.33 0.34 0.44 -1.94 0.31 -4.97 119.30 116.63 3k4b s MET 541 Ca 0.46 0.60 -0.29 0.00 -1.71 0.00 0.00 55.69 54.75 3k4b s MET 541 Cb -0.24 -2.09 -0.11 0.00 2.01 0.00 0.00 34.83 34.40 3k4b s MET 541 CO 0.30 -0.70 1.49 0.39 -0.01 0.00 0.00 175.02 176.48 3k4b n GLU 542 N -2.80 2.58 -1.65 2.03 4.71 -1.26 -4.77 120.64 119.48 3k4b n GLU 542 Ca 0.06 0.91 -0.49 0.00 -0.01 0.00 0.00 57.16 57.62 3k4b n GLU 542 Cb 0.55 -2.63 -0.05 0.00 -1.01 0.00 0.00 31.44 28.30 3k4b n GLU 542 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 3k4b n PRO 543 N 1.00 1.75 0.00 3.49 -0.02 -1.26 -1.86 135.00 138.11 3k4b n PRO 543 Ca 0.04 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 3k4b n PRO 543 Cb 0.38 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 3k4b n PRO 543 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k4b n GLY 544 N 3.41 1.92 0.35 -1.23 0.00 -1.26 0.95 105.19 109.33 3k4b n GLY 544 Ca 0.19 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.39 3k4b n GLY 544 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3k4b h LEU 545 N 0.00 0.00 -1.06 0.99 5.85 -1.41 -0.30 115.31 119.38 3k4b h LEU 545 Ca 0.00 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 3k4b h LEU 545 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3k4b h LEU 545 CO 0.00 0.00 -0.30 1.62 -0.34 0.00 0.00 178.44 179.42 3k4b h VAL 546 N 0.00 0.74 -4.32 1.05 3.04 -1.86 -3.47 116.25 111.43 3k4b h VAL 546 Ca 0.14 -1.30 -0.27 0.00 -1.01 0.00 0.00 66.70 64.26 3k4b h VAL 546 Cb 0.68 1.82 0.10 0.00 -2.01 0.00 0.00 31.29 31.88 3k4b h VAL 546 CO -0.00 0.29 -0.47 0.18 -1.01 0.00 0.00 177.57 176.57 3k4b n LEU 547 N -3.49 -2.97 -1.40 3.16 4.77 -0.12 -4.93 117.00 112.02 3k4b n LEU 547 Ca -0.00 -0.37 -0.11 0.00 -0.03 0.00 0.00 56.01 55.50 3k4b n LEU 547 Cb 0.46 -2.24 0.12 0.00 -2.33 0.00 0.00 43.42 39.44 3k4b n LEU 547 CO 0.35 0.45 0.44 1.41 -1.33 0.00 0.00 177.39 178.71 3k4b n HIS 548 N -4.22 1.54 -1.75 -1.77 8.25 -1.26 -5.06 115.22 110.96 3k4b n HIS 548 Ca 0.01 -1.91 -0.42 0.00 -0.26 0.00 0.00 57.72 55.14 3k4b n HIS 548 Cb 0.54 -0.42 -0.02 0.00 1.12 0.00 0.00 29.99 31.21 3k4b n HIS 548 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 3k4b n LEU 549 N -0.95 4.40 -4.21 2.41 7.94 -1.26 -4.62 117.00 120.71 3k4b n LEU 549 Ca 0.35 1.14 -0.12 0.00 -1.11 0.00 0.00 56.01 56.27 3k4b n LEU 549 Cb 0.88 -1.60 -0.10 0.00 0.53 0.00 0.00 43.42 43.12 3k4b n LEU 549 CO 0.24 0.19 -0.26 -0.83 -1.11 0.00 0.00 177.39 175.62 3k4b s GLY 550 N 0.56 1.39 0.00 -3.96 0.00 0.06 -4.26 107.32 101.10 3k4b s GLY 550 Ca 0.65 -1.68 0.00 0.00 0.00 0.00 0.00 44.72 43.69 3k4b s GLY 550 CO 0.47 -1.44 0.00 0.61 0.00 0.00 0.00 173.10 172.75 3k4b n GLY 551 N -0.27 0.86 0.19 0.20 0.00 -0.77 -1.30 105.19 104.10 3k4b n GLY 551 Ca -0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 3k4b n GLY 551 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3k4b h THR 552 N 0.00 0.00 -1.03 2.61 1.35 -1.75 -3.25 112.91 110.83 3k4b h THR 552 Ca 0.00 -0.44 -0.36 0.00 -0.55 0.00 0.00 66.41 65.06 3k4b h THR 552 Cb 0.00 1.33 -0.30 0.00 -1.73 0.00 0.00 68.15 67.45 3k4b h THR 552 CO 0.00 0.00 -0.88 0.00 -0.25 0.00 0.00 175.52 174.39 3k4b n HIS 553 N -2.64 -0.92 -2.08 4.73 1.44 -0.38 -1.47 115.22 113.91 3k4b n HIS 553 Ca 0.02 -2.96 -0.37 0.00 -2.01 0.00 0.00 57.72 52.41 3k4b n HIS 553 Cb 0.31 0.44 0.02 0.00 0.12 0.00 0.00 29.99 30.88 3k4b n HIS 553 CO 0.00 0.00 0.00 -0.98 -2.81 0.00 0.00 176.34 172.55 3k4b s ARG 554 N -1.41 3.27 0.21 -1.40 1.70 -1.09 -4.18 118.95 116.05 3k4b s ARG 554 Ca 0.31 1.85 -0.14 0.00 -0.47 0.00 0.00 55.73 57.27 3k4b s ARG 554 Cb 0.35 -2.13 -0.08 0.00 -0.57 0.00 0.00 34.95 32.53 3k4b s ARG 554 CO -0.05 -0.97 0.62 1.41 -1.08 0.00 0.00 175.30 175.22 3k4b s MET 555 N -3.08 4.00 0.13 3.89 -2.45 0.39 0.94 119.30 123.13 3k4b s MET 555 Ca 0.72 0.55 -0.24 0.00 -1.25 0.00 0.00 55.69 55.47 3k4b s MET 555 Cb -0.31 -2.76 0.08 0.00 1.25 0.00 0.00 34.83 33.09 3k4b s MET 555 CO 0.35 0.36 1.07 0.20 1.05 0.00 0.00 175.02 178.06 3k4b s GLY 556 N -1.95 -0.06 0.10 2.11 0.00 0.03 -4.63 107.32 102.91 3k4b s GLY 556 Ca 0.44 -0.06 -0.13 0.00 0.00 0.00 0.00 44.72 44.97 3k4b s GLY 556 CO 0.20 1.83 1.28 0.74 0.00 0.00 0.00 173.10 177.15 3k4b h PHE 557 N 2.00 1.07 -3.37 1.90 0.04 -1.92 -3.33 116.94 113.33 3k4b h PHE 557 Ca -0.27 -0.50 -0.38 0.00 2.80 0.00 0.00 57.97 59.63 3k4b h PHE 557 Cb 1.22 -0.16 -0.37 0.00 2.20 0.00 0.00 35.95 38.84 3k4b h PHE 557 CO 0.99 1.33 -0.75 0.34 -0.60 0.00 0.00 178.31 179.62 3k4b s ASP 558 N -7.15 0.97 0.22 2.17 2.15 -1.26 -4.91 116.67 108.87 3k4b s ASP 558 Ca -0.10 -0.01 -0.09 0.00 0.43 0.00 0.00 52.55 52.78 3k4b s ASP 558 Cb 0.08 -0.26 0.21 0.00 -0.30 0.00 0.00 42.92 42.65 3k4b s ASP 558 CO 0.91 -0.17 1.89 -0.08 -0.17 0.00 0.00 175.17 177.55 3k4b h GLU 559 N 7.91 1.06 0.02 4.34 4.81 -1.88 0.26 114.58 131.10 3k4b h GLU 559 Ca -0.27 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 58.75 3k4b h GLU 559 Cb 1.13 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 30.25 3k4b h GLU 559 CO 0.32 0.70 -0.78 -0.22 -0.73 0.00 0.00 179.01 178.31 3k4b h LYS 560 N 1.10 0.05 -0.65 1.92 3.64 -1.96 -1.76 116.57 118.90 3k4b h LYS 560 Ca 0.31 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.57 3k4b h LYS 560 Cb -0.08 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 3k4b h LYS 560 CO -0.08 1.04 0.22 1.49 -2.27 0.00 0.00 179.45 179.84 3k4b h GLU 561 N -0.88 0.97 -0.44 1.90 4.81 -1.97 -2.94 114.58 116.03 3k4b h GLU 561 Ca -0.20 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 3k4b h GLU 561 Cb 1.26 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.49 3k4b h GLU 561 CO -0.08 0.82 0.00 -0.25 -0.73 0.00 0.00 179.01 178.78 3k4b n ASP 562 N -4.28 3.19 -3.60 1.04 8.00 0.91 -5.00 116.55 116.81 3k4b n ASP 562 Ca 0.05 -1.97 -0.26 0.00 0.71 0.00 0.00 54.79 53.31 3k4b n ASP 562 Cb 0.20 -0.29 0.05 0.00 -0.02 0.00 0.00 41.12 41.06 3k4b n ASP 562 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3k4b n ASN 563 N 0.88 -4.98 -3.59 -2.24 5.03 -0.83 -4.90 115.26 104.63 3k4b n ASN 563 Ca 0.15 -0.93 -0.20 0.00 0.87 0.00 0.00 54.58 54.48 3k4b n ASN 563 Cb 0.48 -3.86 -0.08 0.00 -1.02 0.00 0.00 39.78 35.30 3k4b n ASN 563 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3k4b s VAL 566 N -2.16 0.96 0.60 0.00 -7.23 -1.13 -2.60 120.40 108.85 3k4b s VAL 566 Ca -0.06 -1.75 -0.02 0.00 -1.81 0.00 0.00 61.98 58.35 3k4b s VAL 566 Cb 0.02 -1.48 0.12 0.00 0.56 0.00 0.00 36.38 35.61 3k4b s VAL 566 CO 0.24 -0.62 0.83 -0.46 -0.31 0.00 0.00 175.10 174.77 3k4b n ASN 567 N 0.36 0.95 0.00 4.85 0.23 -0.63 -0.79 115.26 120.22 3k4b n ASN 567 Ca -0.15 -1.84 0.07 0.00 -0.53 0.00 0.00 54.58 52.14 3k4b n ASN 567 Cb 0.59 -0.55 0.35 0.00 -2.08 0.00 0.00 39.78 38.09 3k4b n ASN 567 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3k4b n THR 568 N -2.67 0.67 -0.01 5.53 -2.24 -1.25 -0.71 114.28 113.60 3k4b n THR 568 Ca 0.13 0.17 0.06 0.00 -2.27 0.00 0.00 64.05 62.14 3k4b n THR 568 Cb 0.47 -0.93 0.25 0.00 -2.10 0.00 0.00 70.33 68.02 3k4b n THR 568 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3k4b n ASP 569 N -1.32 3.61 -1.44 3.42 8.00 -1.26 -4.72 116.55 122.84 3k4b n ASP 569 Ca 0.06 -2.38 -0.14 0.00 0.71 0.00 0.00 54.79 53.05 3k4b n ASP 569 Cb 0.12 -0.51 -0.06 0.00 -0.02 0.00 0.00 41.12 40.66 3k4b n ASP 569 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3k4b n SER 570 N 0.65 -3.72 -4.75 -2.24 7.64 0.11 -4.39 113.62 106.93 3k4b n SER 570 Ca 0.18 0.34 -0.40 0.00 1.01 0.00 0.00 58.87 60.00 3k4b n SER 570 Cb 0.71 -3.43 -0.05 0.00 -1.01 0.00 0.00 64.21 60.42 3k4b n SER 570 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 3k4b s ARG 571 N -3.25 4.54 0.01 1.43 3.52 -1.26 -1.23 118.95 122.71 3k4b s ARG 571 Ca 0.00 1.14 -0.30 0.00 -0.13 0.00 0.00 55.73 56.43 3k4b s ARG 571 Cb 0.00 -3.35 -0.06 0.00 -1.56 0.00 0.00 34.95 29.98 3k4b s ARG 571 CO 0.00 0.32 1.57 0.08 -0.81 0.00 0.00 175.30 176.46 3k4b s VAL 572 N -0.24 3.43 0.14 7.11 1.01 -0.48 -1.60 120.40 129.77 3k4b s VAL 572 Ca 0.39 0.76 -0.35 0.00 0.00 0.00 0.00 61.98 62.79 3k4b s VAL 572 Cb -0.21 -3.49 -0.16 0.00 0.00 0.00 0.00 36.38 32.52 3k4b s VAL 572 CO 0.24 -0.02 1.31 0.49 0.00 0.00 0.00 175.10 177.12 3k4b n PHE 573 N 5.98 1.58 0.00 5.22 3.72 -1.07 -1.42 117.46 131.48 3k4b n PHE 573 Ca 0.15 0.59 0.00 0.00 -0.05 0.00 0.00 57.45 58.15 3k4b n PHE 573 Cb 0.42 -2.35 0.00 0.00 -0.94 0.00 0.00 39.48 36.61 3k4b n PHE 573 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3k4b n GLY 574 N 2.42 2.94 3.32 1.37 0.00 -1.26 -5.01 105.19 108.98 3k4b n GLY 574 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 3k4b n GLY 574 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k4b s PHE 575 N -2.27 2.89 0.36 1.61 0.40 -0.50 -4.01 117.98 116.44 3k4b s PHE 575 Ca 0.00 -0.86 0.07 0.00 -0.60 0.00 0.00 56.93 55.54 3k4b s PHE 575 Cb 0.00 -1.98 0.67 0.00 0.51 0.00 0.00 43.02 42.22 3k4b s PHE 575 CO 0.00 -0.42 1.87 0.87 0.70 0.00 0.00 175.22 178.24 3k4b h LYS 576 N 7.49 0.35 0.00 0.44 1.57 -1.52 -3.39 116.57 121.51 3k4b h LYS 576 Ca -0.36 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 58.26 3k4b h LYS 576 Cb 1.18 -0.04 -0.17 0.00 0.08 0.00 0.00 32.23 33.28 3k4b h LYS 576 CO 0.59 0.48 -0.67 0.27 -0.57 0.00 0.00 179.45 179.54 3k4b n ASN 577 N -4.24 1.18 -4.05 0.86 6.94 -1.26 -5.01 115.26 109.68 3k4b n ASN 577 Ca -0.00 -2.67 -0.30 0.00 -0.02 0.00 0.00 54.58 51.59 3k4b n ASN 577 Cb 0.29 -0.36 -0.16 0.00 -2.36 0.00 0.00 39.78 37.18 3k4b n ASN 577 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3k4b s LEU 578 N -1.26 1.77 -0.03 -4.53 2.96 -1.26 -1.30 118.68 115.03 3k4b s LEU 578 Ca 0.29 -0.50 0.06 0.00 -0.22 0.00 0.00 54.13 53.76 3k4b s LEU 578 Cb 0.30 -1.21 -0.01 0.00 0.50 0.00 0.00 46.19 45.78 3k4b s LEU 578 CO -0.09 -0.02 -0.21 -0.36 -1.32 0.00 0.00 176.35 174.35 3k4b s PHE 579 N 1.30 1.94 -0.14 5.38 0.40 -0.23 -1.38 117.98 125.25 3k4b s PHE 579 Ca 0.01 -0.47 -0.04 0.00 -0.60 0.00 0.00 56.93 55.84 3k4b s PHE 579 Cb -0.14 -1.27 -0.03 0.00 0.51 0.00 0.00 43.02 42.09 3k4b s PHE 579 CO -0.08 -0.11 -0.02 -0.51 0.70 0.00 0.00 175.22 175.20 3k4b s LEU 580 N -0.27 3.40 0.01 -0.37 1.43 -0.36 -0.68 118.68 121.83 3k4b s LEU 580 Ca 0.02 -0.03 0.08 0.00 -1.03 0.00 0.00 54.13 53.17 3k4b s LEU 580 Cb -0.10 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 3k4b s LEU 580 CO 0.01 0.23 -0.25 -0.83 0.23 0.00 0.00 176.35 175.73 3k4b s GLY 581 N 0.03 1.28 0.00 -3.19 0.00 -0.33 -4.80 107.32 100.32 3k4b s GLY 581 Ca 0.01 -1.15 0.00 0.00 0.00 0.00 0.00 44.72 43.59 3k4b s GLY 581 CO 0.02 -1.00 0.00 0.61 0.00 0.00 0.00 173.10 172.74 3k4b n GLY 582 N 2.17 0.96 0.23 0.20 0.00 -1.26 -4.39 105.19 103.11 3k4b n GLY 582 Ca -0.16 -2.08 0.06 0.00 0.00 0.00 0.00 46.02 43.84 3k4b n GLY 582 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k4b h GLY 584 N 0.47 0.93 2.00 0.00 0.00 -1.89 0.22 103.07 104.81 3k4b h GLY 584 Ca -0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 47.33 47.19 3k4b h GLY 584 CO 0.02 -0.26 -0.21 3.43 0.00 0.00 0.00 176.54 179.52 3k4b h ASN 585 N 0.09 0.00 -3.01 0.19 2.35 -1.31 -0.92 115.58 112.98 3k4b h ASN 585 Ca 0.79 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.96 3k4b h ASN 585 Cb 2.63 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 40.95 3k4b h ASN 585 CO -0.29 0.21 0.84 -0.63 -1.65 0.00 0.00 177.43 175.91 3k4b s ILE 586 N -4.21 4.51 -2.08 2.81 1.01 0.06 -0.46 121.20 122.84 3k4b s ILE 586 Ca -0.03 1.82 0.24 0.00 0.00 0.00 0.00 60.65 62.69 3k4b s ILE 586 Cb 0.14 -4.18 0.11 0.00 0.01 0.00 0.00 42.46 38.54 3k4b s ILE 586 CO 0.64 -0.16 1.26 -0.81 0.00 0.00 0.00 174.94 175.88 3k4b n PRO 587 N 6.42 1.25 -3.09 2.79 -0.04 -1.26 -1.85 135.00 139.21 3k4b n PRO 587 Ca 0.13 -0.96 -0.17 0.00 -0.04 0.00 0.00 63.50 62.46 3k4b n PRO 587 Cb 0.46 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 3k4b n PRO 587 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3k4b s THR 588 N -2.41 3.02 -0.43 0.52 -4.23 -1.26 -4.81 115.64 106.03 3k4b s THR 588 Ca 0.22 -1.04 -0.21 0.00 -1.18 0.00 0.00 61.69 59.48 3k4b s THR 588 Cb 0.19 -3.02 0.02 0.00 1.34 0.00 0.00 72.50 71.03 3k4b s THR 588 CO 0.52 -0.01 0.66 0.00 -0.54 0.00 0.00 174.62 175.25 3k4b s ALA 589 N -2.35 3.35 0.04 3.99 0.00 -1.26 -4.86 121.76 120.66 3k4b s ALA 589 Ca 0.54 -1.15 0.08 0.00 0.00 0.00 0.00 51.96 51.42 3k4b s ALA 589 Cb -0.09 -3.31 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 3k4b s ALA 589 CO 0.32 -1.76 -0.22 1.52 0.00 0.00 0.00 175.76 175.62 3k4b s TYR 590 N 2.87 1.90 -0.22 0.00 1.13 -1.26 -4.59 117.35 117.18 3k4b s TYR 590 Ca 0.24 -0.38 0.13 0.00 -1.41 0.00 0.00 57.07 55.65 3k4b s TYR 590 Cb -0.14 -1.14 -0.23 0.00 -1.10 0.00 0.00 41.96 39.36 3k4b s TYR 590 CO 0.19 0.09 -0.01 0.41 -2.51 0.00 0.00 175.55 173.72 3k4b n GLY 591 N 1.90 -0.82 3.74 5.49 0.00 -1.26 -4.17 105.19 110.06 3k4b n GLY 591 Ca -0.17 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 3k4b n GLY 591 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k4b s ALA 592 N -2.50 1.85 0.06 4.61 0.00 -1.26 -4.35 121.76 120.17 3k4b s ALA 592 Ca -0.17 0.10 -0.31 0.00 0.00 0.00 0.00 51.96 51.58 3k4b s ALA 592 Cb 0.07 -3.23 -0.07 0.00 0.00 0.00 0.00 23.12 19.88 3k4b s ALA 592 CO 0.77 -2.11 1.51 -0.80 0.00 0.00 0.00 175.76 175.12 3k4b s ASN 593 N -3.39 6.73 0.00 0.00 -0.87 -1.26 -4.91 114.94 111.24 3k4b s ASN 593 Ca 0.62 2.34 0.29 0.00 -1.57 0.00 0.00 52.86 54.54 3k4b s ASN 593 Cb -0.18 -2.57 1.20 0.00 -0.02 0.00 0.00 41.25 39.69 3k4b s ASN 593 CO 0.57 -0.78 1.87 -0.81 -2.57 0.00 0.00 177.10 175.38 3k4b n PRO 594 N 5.05 0.33 -0.11 -0.60 -0.04 -1.26 -4.48 135.00 133.89 3k4b n PRO 594 Ca 0.14 -0.08 -0.11 0.00 -0.04 0.00 0.00 63.50 63.41 3k4b n PRO 594 Cb 0.42 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.35 3k4b n PRO 594 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 3k4b h THR 595 N 0.19 1.27 -0.81 0.52 2.02 -1.91 -1.52 112.91 112.68 3k4b h THR 595 Ca 0.00 -1.05 -0.03 0.00 0.77 0.00 0.00 66.41 66.10 3k4b h THR 595 Cb 0.40 1.32 -0.04 0.00 -1.74 0.00 0.00 68.15 68.09 3k4b h THR 595 CO 0.00 0.34 0.38 0.25 0.37 0.00 0.00 175.52 176.86 3k4b h LEU 596 N 0.37 1.07 -0.38 2.58 5.85 -1.87 0.22 115.31 123.16 3k4b h LEU 596 Ca 0.08 -0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.71 3k4b h LEU 596 Cb 0.51 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 3k4b h LEU 596 CO 0.02 0.91 0.13 0.74 -0.34 0.00 0.00 178.44 179.90 3k4b h THR 597 N 1.15 0.88 -0.66 1.05 2.02 -1.72 -0.89 112.91 114.74 3k4b h THR 597 Ca 0.28 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.33 3k4b h THR 597 Cb 0.13 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 3k4b h THR 597 CO -0.03 0.05 0.29 0.00 0.37 0.00 0.00 175.52 176.20 3k4b h ALA 598 N 1.24 1.28 -0.68 6.16 0.00 -0.89 -1.70 119.26 124.67 3k4b h ALA 598 Ca 0.17 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3k4b h ALA 598 Cb 0.15 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3k4b h ALA 598 CO -0.18 0.55 0.17 1.98 0.00 0.00 0.00 179.25 181.77 3k4b h MET 599 N 0.94 1.09 -0.52 0.00 -1.53 -0.61 -2.25 114.93 112.05 3k4b h MET 599 Ca 0.23 -0.26 -0.07 0.00 -3.44 0.00 0.00 59.70 56.16 3k4b h MET 599 Cb 0.13 -0.14 -0.02 0.00 -0.55 0.00 0.00 31.60 31.02 3k4b h MET 599 CO -0.03 0.97 0.04 0.77 0.14 0.00 0.00 176.91 178.80 3k4b h SER 600 N 1.02 0.80 -0.69 1.39 0.02 -0.43 -1.65 113.55 114.01 3k4b h SER 600 Ca 0.21 -0.18 -0.07 0.00 -0.84 0.00 0.00 61.79 60.91 3k4b h SER 600 Cb 0.36 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 3k4b h SER 600 CO 0.00 0.84 0.16 -0.07 -1.14 0.00 0.00 176.83 176.62 3k4b h LEU 601 N 0.79 1.05 -1.19 5.07 3.38 -1.18 -2.39 115.31 120.84 3k4b h LEU 601 Ca 0.16 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 3k4b h LEU 601 Cb 0.42 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 3k4b h LEU 601 CO 0.01 1.02 0.23 0.00 0.09 0.00 0.00 178.44 179.79 3k4b h ALA 602 N 1.07 1.36 -0.65 1.53 0.00 -0.77 -0.69 119.26 121.12 3k4b h ALA 602 Ca 0.22 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3k4b h ALA 602 Cb 0.38 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 3k4b h ALA 602 CO 0.00 0.48 0.22 0.82 0.00 0.00 0.00 179.25 180.78 3k4b h ILE 603 N 0.79 1.25 -0.00 0.00 2.04 -0.95 0.88 117.51 121.51 3k4b h ILE 603 Ca 0.19 -0.82 -0.12 0.00 1.00 0.00 0.00 64.86 65.11 3k4b h ILE 603 Cb 0.15 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 3k4b h ILE 603 CO -0.02 0.32 -0.56 0.50 0.00 0.00 0.00 178.15 178.38 3k4b h LYS 604 N 0.93 0.00 -0.43 2.37 3.64 -1.15 -1.55 116.57 120.38 3k4b h LYS 604 Ca 0.21 -0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.50 3k4b h LYS 604 Cb 0.27 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3k4b h LYS 604 CO -0.01 0.57 -0.08 1.03 -2.27 0.00 0.00 179.45 178.69 3k4b h SER 605 N 0.00 0.82 0.49 4.20 0.87 -0.35 -2.67 113.55 116.91 3k4b h SER 605 Ca -0.01 -0.35 -0.06 0.00 -1.23 0.00 0.00 61.79 60.15 3k4b h SER 605 Cb 1.00 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.73 3k4b h SER 605 CO 0.07 0.98 -0.27 0.00 -0.53 0.00 0.00 176.83 177.08 3k4b h GLU 607 N 0.00 -0.06 -0.48 0.00 5.08 -0.95 -2.17 114.58 116.00 3k4b h GLU 607 Ca -0.00 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 3k4b h GLU 607 Cb 0.58 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.79 3k4b h GLU 607 CO 0.03 -0.04 0.16 -0.92 -1.00 0.00 0.00 179.01 177.24 3k4b h TYR 608 N -0.06 0.27 -0.29 4.33 5.03 -1.24 -1.54 116.97 123.47 3k4b h TYR 608 Ca 0.02 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.34 3k4b h TYR 608 Cb 0.09 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.30 3k4b h TYR 608 CO -0.11 0.08 0.14 0.82 -1.32 0.00 0.00 178.16 177.76 3k4b h ILE 609 N 0.32 1.15 -0.01 1.81 2.04 -1.31 -1.77 117.51 119.75 3k4b h ILE 609 Ca 0.23 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.65 3k4b h ILE 609 Cb 0.26 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.24 3k4b h ILE 609 CO -0.25 0.16 0.01 0.11 0.00 0.00 0.00 178.15 178.18 3k4b h LYS 610 N 0.34 0.00 -0.02 2.37 1.57 -1.02 -0.16 116.57 119.65 3k4b h LYS 610 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3k4b h LYS 610 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 3k4b h LYS 610 CO -0.01 0.00 -0.04 1.04 -0.57 0.00 0.00 179.45 179.87 3k4b n GLN 611 N -4.26 1.60 0.00 3.15 6.02 -0.61 -4.35 117.38 118.93 3k4b n GLN 611 Ca -0.03 -0.98 0.00 0.00 -0.01 0.00 0.00 57.00 55.98 3k4b n GLN 611 Cb 0.10 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 29.88 3k4b n GLN 611 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3k4b n ASN 612 N 0.16 0.65 -4.16 1.08 3.02 -0.82 -5.05 115.26 110.13 3k4b n ASN 612 Ca 0.17 -0.05 -0.21 0.00 -0.03 0.00 0.00 54.58 54.46 3k4b n ASN 612 Cb 0.38 0.24 -0.14 0.00 -0.61 0.00 0.00 39.78 39.65 3k4b n ASN 612 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3k4b s PHE 613 N -0.37 1.36 -0.22 3.10 0.08 -0.13 -5.06 117.98 116.74 3k4b s PHE 613 Ca 0.00 -0.35 -0.07 0.00 0.12 0.00 0.00 56.93 56.63 3k4b s PHE 613 Cb 0.00 -0.81 -0.03 0.00 -0.57 0.00 0.00 43.02 41.61 3k4b s PHE 613 CO 0.00 0.04 0.05 0.99 -0.10 0.00 0.00 175.22 176.21 3k4b s THR 614 N -0.79 4.39 0.52 0.64 2.01 -1.26 -4.66 115.64 116.49 3k4b s THR 614 Ca 0.03 -0.16 -0.23 0.00 0.31 0.00 0.00 61.69 61.65 3k4b s THR 614 Cb -0.08 -3.02 -0.06 0.00 0.01 0.00 0.00 72.50 69.36 3k4b s THR 614 CO 0.01 0.39 1.37 -2.84 -0.69 0.00 0.00 174.62 172.87 3k4b s PRO 615 N 1.12 3.31 0.80 4.92 0.02 -1.26 -4.98 135.00 138.93 3k4b s PRO 615 Ca 0.04 2.28 -0.12 0.00 0.02 0.00 0.00 61.00 63.22 3k4b s PRO 615 Cb -0.14 -2.38 0.08 0.00 0.02 0.00 0.00 34.50 32.08 3k4b s PRO 615 CO 0.03 -1.07 1.13 -1.54 -0.33 0.00 0.00 177.00 175.22 3k4b s SER 616 N -0.83 3.96 0.57 2.53 1.04 -1.26 -5.01 113.70 114.69 3k4b s SER 616 Ca 0.68 2.06 -0.18 0.00 0.48 0.00 0.00 55.95 59.00 3k4b s SER 616 Cb -0.41 -2.55 -0.05 0.00 0.10 0.00 0.00 66.02 63.11 3k4b s SER 616 CO 0.50 -2.41 1.08 -2.16 0.98 0.00 0.00 173.24 171.23 3k4b s PRO 617 N -4.56 3.37 0.00 4.02 0.04 -1.26 -4.84 135.00 131.77 3k4b s PRO 617 Ca 0.66 1.36 0.27 0.00 0.04 0.00 0.00 61.00 63.33 3k4b s PRO 617 Cb -0.21 -2.03 0.85 0.00 0.04 0.00 0.00 34.50 33.15 3k4b s PRO 617 CO 0.53 -0.79 1.63 0.34 0.04 0.00 0.00 177.00 178.76