#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ikm h PRO 60 N 0.00 0.23 -0.07 0.00 0.13 -2.04 0.15 132.00 130.40 3ikm h PRO 60 Ca 0.00 -0.10 -0.17 0.00 -0.87 0.00 0.00 66.00 64.86 3ikm h PRO 60 Cb 0.00 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 3ikm h PRO 60 CO 0.00 0.58 -0.70 0.78 -0.23 0.00 0.00 178.00 178.43 3ikm h GLY 61 N 1.17 0.35 1.11 1.56 0.00 -2.04 -1.66 103.07 103.57 3ikm h GLY 61 Ca 0.02 -0.49 -0.14 0.00 0.00 0.00 0.00 47.33 46.72 3ikm h GLY 61 CO 0.06 0.44 -0.30 1.48 0.00 0.00 0.00 176.54 178.22 3ikm h SER 62 N 0.22 1.01 -0.74 0.19 4.64 -1.75 -2.05 113.55 115.07 3ikm h SER 62 Ca -0.02 -0.43 -0.01 0.00 -0.47 0.00 0.00 61.79 60.86 3ikm h SER 62 Cb 1.26 -0.28 -0.04 0.00 -0.31 0.00 0.00 62.40 63.03 3ikm h SER 62 CO 0.11 1.22 0.42 1.23 -0.87 0.00 0.00 176.83 178.95 3ikm h GLY 63 N 0.80 1.09 1.41 -0.77 0.00 -0.55 -1.64 103.07 103.41 3ikm h GLY 63 Ca 0.09 -0.48 -0.07 0.00 0.00 0.00 0.00 47.33 46.87 3ikm h GLY 63 CO 0.08 0.46 -0.00 1.05 0.00 0.00 0.00 176.54 178.13 3ikm h GLU 64 N 1.02 0.72 -0.53 4.80 4.11 -1.22 -1.72 114.58 121.75 3ikm h GLU 64 Ca 0.26 -0.19 -0.07 0.00 0.07 0.00 0.00 59.36 59.44 3ikm h GLU 64 Cb 0.01 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 3ikm h GLU 64 CO -0.05 0.74 0.06 0.78 0.07 0.00 0.00 179.01 180.61 3ikm h GLY 65 N 0.95 0.98 0.97 1.06 0.00 -0.84 -1.93 103.07 104.25 3ikm h GLY 65 Ca 0.14 -0.68 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 3ikm h GLY 65 CO 0.02 0.62 0.19 0.23 0.00 0.00 0.00 176.54 177.60 3ikm h SER 66 N 0.79 0.41 -0.34 0.19 0.87 -0.81 0.54 113.55 115.20 3ikm h SER 66 Ca 0.16 -0.08 0.02 0.00 -1.23 0.00 0.00 61.79 60.67 3ikm h SER 66 Cb 0.45 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.28 3ikm h SER 66 CO 0.02 0.37 0.16 -0.33 -0.53 0.00 0.00 176.83 176.52 3ikm h GLU 67 N 0.42 0.33 0.04 2.24 5.08 -1.28 0.76 114.58 122.17 3ikm h GLU 67 Ca 0.12 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.49 3ikm h GLU 67 Cb 0.05 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.17 3ikm h GLU 67 CO -0.02 0.22 -0.36 0.00 -1.00 0.00 0.00 179.01 177.85 3ikm h ALA 68 N 1.18 -0.57 0.00 3.43 0.00 -0.88 1.81 119.26 124.23 3ikm h ALA 68 Ca 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3ikm h ALA 68 Cb 0.06 0.62 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3ikm h ALA 68 CO -0.10 -0.89 0.00 -0.11 0.00 0.00 0.00 179.25 178.15 3ikm n LEU 69 N -5.43 0.57 -0.11 0.00 7.94 0.14 -2.32 117.00 117.78 3ikm n LEU 69 Ca -0.06 0.59 -0.19 0.00 -1.11 0.00 0.00 56.01 55.25 3ikm n LEU 69 Cb 0.35 -0.46 -0.06 0.00 0.53 0.00 0.00 43.42 43.77 3ikm n LEU 69 CO 0.19 -0.31 -0.97 -0.11 -1.11 0.00 0.00 177.39 175.07 3ikm n LEU 70 N -2.08 1.93 -0.26 -1.96 -0.00 0.26 -3.95 117.00 110.95 3ikm n LEU 70 Ca 0.04 0.37 -0.04 0.00 -0.00 0.00 0.00 56.01 56.38 3ikm n LEU 70 Cb 0.31 -0.80 0.02 0.00 -0.00 0.00 0.00 43.42 42.95 3ikm n LEU 70 CO 0.24 0.11 0.62 -0.08 -0.00 0.00 0.00 177.39 178.28 3ikm h GLU 71 N -1.00 -0.10 -0.67 1.96 4.22 0.27 1.78 114.58 121.03 3ikm h GLU 71 Ca -0.33 0.01 0.19 0.00 0.08 0.00 0.00 59.36 59.31 3ikm h GLU 71 Cb 1.25 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 3ikm h GLU 71 CO -0.20 -0.07 0.54 0.82 -2.18 0.00 0.00 179.01 177.92 3ikm h ILE 72 N -0.11 0.53 0.06 2.32 1.08 -1.57 0.34 117.51 120.16 3ikm h ILE 72 Ca 0.27 0.00 -0.24 0.00 -0.39 0.00 0.00 64.86 64.50 3ikm h ILE 72 Cb 0.57 0.61 -0.00 0.00 -3.07 0.00 0.00 36.82 34.92 3ikm h ILE 72 CO -0.78 0.00 -1.08 0.00 -0.69 0.00 0.00 178.15 175.60 3ikm h GLN 74 N 0.10 -0.55 -7.37 0.00 3.07 0.11 0.70 115.11 111.18 3ikm h GLN 74 Ca -0.09 0.04 -0.44 0.00 0.09 0.00 0.00 58.65 58.25 3ikm h GLN 74 Cb 1.78 0.12 0.17 0.00 0.08 0.00 0.00 27.48 29.63 3ikm h GLN 74 CO 0.17 -0.25 0.17 0.50 0.09 0.00 0.00 178.83 179.51 3ikm s ARG 75 N -4.09 -0.17 -0.89 0.06 3.52 0.83 -2.75 118.95 115.46 3ikm s ARG 75 Ca -0.12 0.31 0.00 0.00 -0.13 0.00 0.00 55.73 55.79 3ikm s ARG 75 Cb 0.01 -1.69 0.00 0.00 -1.56 0.00 0.00 34.95 31.72 3ikm s ARG 75 CO 0.41 -3.09 0.00 0.54 -0.81 0.00 0.00 175.30 172.35 3ikm n ARG 76 N -4.39 -1.46 -3.90 5.12 1.74 -1.24 -3.94 116.66 108.59 3ikm n ARG 76 Ca 0.07 0.57 -0.34 0.00 -0.77 0.00 0.00 57.85 57.38 3ikm n ARG 76 Cb 0.58 -4.62 0.01 0.00 -1.02 0.00 0.00 32.46 27.41 3ikm n ARG 76 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3ikm n HIS 77 N -1.58 -1.49 -0.03 -1.55 8.25 -1.11 -4.89 115.22 112.82 3ikm n HIS 77 Ca -0.08 0.35 0.00 0.00 -0.26 0.00 0.00 57.72 57.73 3ikm n HIS 77 Cb 0.35 -2.48 -0.08 0.00 1.12 0.00 0.00 29.99 28.90 3ikm n HIS 77 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3ikm n PHE 78 N -3.73 0.00 -3.96 4.41 7.35 0.22 -2.78 117.46 118.97 3ikm n PHE 78 Ca -0.19 0.00 -0.30 0.00 -0.76 0.00 0.00 57.45 56.20 3ikm n PHE 78 Cb 0.56 -0.36 -0.14 0.00 0.35 0.00 0.00 39.48 39.88 3ikm n PHE 78 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 3ikm s LEU 79 N -4.24 4.34 0.22 -2.13 2.01 0.23 0.15 118.68 119.27 3ikm s LEU 79 Ca -0.04 -2.55 -0.08 0.00 0.01 0.00 0.00 54.13 51.46 3ikm s LEU 79 Cb 0.05 -1.57 0.33 0.00 0.01 0.00 0.00 46.19 45.01 3ikm s LEU 79 CO 0.42 -0.31 1.27 -1.20 1.01 0.00 0.00 176.35 177.54 3ikm n SER 80 N 3.72 -0.35 -4.89 2.29 7.64 -0.59 -4.59 113.62 116.85 3ikm n SER 80 Ca 0.04 1.40 -0.30 0.00 1.01 0.00 0.00 58.87 61.03 3ikm n SER 80 Cb 0.37 -0.40 -0.04 0.00 -1.01 0.00 0.00 64.21 63.14 3ikm n SER 80 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3ikm s GLY 81 N -4.04 2.00 0.29 0.23 0.00 -1.24 -4.81 107.32 99.74 3ikm s GLY 81 Ca -0.12 -0.37 0.11 0.00 0.00 0.00 0.00 44.72 44.35 3ikm s GLY 81 CO 0.62 -0.22 -0.17 -0.45 0.00 0.00 0.00 173.10 172.88 3ikm s SER 82 N -2.93 3.51 0.00 1.64 0.15 -1.26 -4.68 113.70 110.12 3ikm s SER 82 Ca 0.47 -1.07 0.00 0.00 0.70 0.00 0.00 55.95 56.06 3ikm s SER 82 Cb -0.11 -0.29 0.00 0.00 -1.71 0.00 0.00 66.02 63.91 3ikm s SER 82 CO 0.28 -0.04 0.00 0.29 1.20 0.00 0.00 173.24 174.97 3ikm n LYS 83 N -0.63 0.00 0.05 5.44 5.02 -1.26 -4.74 118.16 122.04 3ikm n LYS 83 Ca -0.05 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.12 3ikm n LYS 83 Cb 0.61 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.60 3ikm n LYS 83 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 3ikm h GLN 84 N 0.00 0.43 0.00 1.97 5.75 -1.98 -2.93 115.11 118.35 3ikm h GLN 84 Ca 0.00 -0.41 0.00 0.00 -0.15 0.00 0.00 58.65 58.09 3ikm h GLN 84 Cb 0.00 0.10 0.00 0.00 1.07 0.00 0.00 27.48 28.65 3ikm h GLN 84 CO 0.00 1.06 0.04 1.04 -2.65 0.00 0.00 178.83 178.32 3ikm n GLN 85 N -3.80 0.00 -0.12 1.69 1.13 -1.26 -1.05 117.38 113.97 3ikm n GLN 85 Ca -0.06 0.36 -0.17 0.00 -1.94 0.00 0.00 57.00 55.20 3ikm n GLN 85 Cb 0.78 -1.54 -0.13 0.00 0.11 0.00 0.00 30.24 29.46 3ikm n GLN 85 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3ikm n LEU 86 N -1.35 2.53 -2.71 1.08 4.32 -1.11 -2.85 117.00 116.91 3ikm n LEU 86 Ca 0.00 -0.11 -0.34 0.00 -0.02 0.00 0.00 56.01 55.54 3ikm n LEU 86 Cb 0.04 -0.70 -0.04 0.00 -1.62 0.00 0.00 43.42 41.10 3ikm n LEU 86 CO 0.00 0.87 0.24 -1.20 -1.22 0.00 0.00 177.39 176.08 3ikm n SER 87 N -3.19 -0.24 0.00 -1.43 7.64 -0.22 -2.32 113.62 113.86 3ikm n SER 87 Ca -0.44 0.70 0.00 0.00 1.01 0.00 0.00 58.87 60.14 3ikm n SER 87 Cb 1.02 -0.56 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 3ikm n SER 87 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 3ikm n ARG 88 N 0.82 0.00 -0.09 1.43 0.63 -1.26 0.19 116.66 118.37 3ikm n ARG 88 Ca 0.12 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.99 3ikm n ARG 88 Cb 0.08 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.00 3ikm n ARG 88 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3ikm h ASP 89 N 0.00 -0.15 -0.31 6.15 5.19 -1.95 -0.61 116.42 124.75 3ikm h ASP 89 Ca 0.00 0.08 -0.11 0.00 -0.62 0.00 0.00 57.03 56.38 3ikm h ASP 89 Cb 0.00 0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.64 3ikm h ASP 89 CO 0.00 -0.04 -0.23 0.77 -3.12 0.00 0.00 179.24 176.62 3ikm h SER 90 N 0.08 0.74 -0.56 6.45 4.64 0.18 -2.41 113.55 122.67 3ikm h SER 90 Ca 0.16 -0.44 0.11 0.00 -0.47 0.00 0.00 61.79 61.14 3ikm h SER 90 Cb 0.21 -0.21 -0.09 0.00 -0.31 0.00 0.00 62.40 62.01 3ikm h SER 90 CO -0.27 1.02 0.01 0.25 -0.87 0.00 0.00 176.83 176.98 3ikm h LEU 91 N 0.46 -0.22 -1.44 5.97 5.85 -0.12 0.83 115.31 126.64 3ikm h LEU 91 Ca 0.06 0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 3ikm h LEU 91 Cb 0.78 0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.04 3ikm h LEU 91 CO 0.06 -0.08 -0.16 -0.07 -0.34 0.00 0.00 178.44 177.85 3ikm h LEU 92 N 0.13 0.00 0.12 2.25 3.38 -1.01 -2.89 115.31 117.30 3ikm h LEU 92 Ca 0.29 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 58.03 3ikm h LEU 92 Cb 0.45 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.20 3ikm h LEU 92 CO -0.46 0.16 -1.13 0.77 0.09 0.00 0.00 178.44 177.87 3ikm h SER 93 N 0.00 0.39 0.00 -0.43 4.64 -0.48 -3.49 113.55 114.18 3ikm h SER 93 Ca -0.00 -0.88 0.00 0.00 -0.47 0.00 0.00 61.79 60.43 3ikm h SER 93 Cb 0.58 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 3ikm h SER 93 CO 0.02 1.51 0.00 0.61 -0.87 0.00 0.00 176.83 178.10 3ikm n GLY 94 N 1.70 1.54 1.94 -0.77 0.00 0.27 -4.17 105.19 105.70 3ikm n GLY 94 Ca -0.20 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.62 3ikm n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ikm s HIS 96 N -2.14 3.48 0.04 0.00 -0.00 -1.13 -4.48 115.29 111.06 3ikm s HIS 96 Ca 0.36 0.22 0.19 0.00 -0.00 0.00 0.00 55.06 55.84 3ikm s HIS 96 Cb 0.29 -1.76 0.55 0.00 -0.00 0.00 0.00 32.58 31.66 3ikm s HIS 96 CO 0.00 0.44 1.67 -1.35 -0.00 0.00 0.00 174.74 175.50 3ikm h PRO 97 N 2.03 0.00 0.00 -0.38 0.11 -1.86 -3.48 132.00 128.42 3ikm h PRO 97 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3ikm h PRO 97 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3ikm h PRO 97 CO 0.68 0.36 0.00 0.41 -0.21 0.00 0.00 178.00 179.24 3ikm n GLY 98 N 0.55 0.33 3.19 -0.55 0.00 -1.26 -4.51 105.19 102.94 3ikm n GLY 98 Ca 0.01 -1.33 -0.15 0.00 0.00 0.00 0.00 46.02 44.55 3ikm n GLY 98 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ikm s PHE 99 N -3.99 1.14 1.31 1.61 0.08 -1.26 -1.55 117.98 115.32 3ikm s PHE 99 Ca 0.00 -0.61 -0.21 0.00 0.12 0.00 0.00 56.93 56.23 3ikm s PHE 99 Cb 0.00 -0.62 0.33 0.00 -0.57 0.00 0.00 43.02 42.16 3ikm s PHE 99 CO 0.00 0.04 1.04 0.20 -0.10 0.00 0.00 175.22 176.39 3ikm s GLY 100 N -2.38 1.52 0.30 4.36 0.00 0.41 -3.60 107.32 107.92 3ikm s GLY 100 Ca 0.05 -0.93 -0.02 0.00 0.00 0.00 0.00 44.72 43.82 3ikm s GLY 100 CO 0.01 0.02 1.97 -2.55 0.00 0.00 0.00 173.10 172.55 3ikm h PRO 101 N -2.97 1.10 -0.76 2.90 0.11 -1.88 1.29 132.00 131.79 3ikm h PRO 101 Ca -0.44 -0.07 0.13 0.00 0.11 0.00 0.00 66.00 65.74 3ikm h PRO 101 Cb 1.31 -0.25 -0.09 0.00 0.11 0.00 0.00 31.00 32.08 3ikm h PRO 101 CO 0.30 0.73 0.35 1.25 -0.21 0.00 0.00 178.00 180.41 3ikm h LEU 102 N 1.13 0.39 -0.33 2.35 6.46 -1.89 0.12 115.31 123.54 3ikm h LEU 102 Ca 0.31 0.09 0.07 0.00 -0.12 0.00 0.00 57.88 58.23 3ikm h LEU 102 Cb -0.12 0.04 -0.08 0.00 -0.73 0.00 0.00 40.66 39.77 3ikm h LEU 102 CO -0.07 0.18 -0.19 1.23 -0.62 0.00 0.00 178.44 178.97 3ikm h GLY 103 N 0.53 0.04 0.90 3.75 0.00 0.15 -2.19 103.07 106.25 3ikm h GLY 103 Ca 0.40 0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.96 3ikm h GLY 103 CO -0.35 -0.18 0.08 -2.08 0.00 0.00 0.00 176.54 174.01 3ikm h VAL 104 N -0.14 1.15 -0.81 4.60 2.07 0.09 -2.45 116.25 120.76 3ikm h VAL 104 Ca 0.17 -0.45 0.08 0.00 0.82 0.00 0.00 66.70 67.32 3ikm h VAL 104 Cb 0.40 1.10 -0.07 0.00 -1.52 0.00 0.00 31.29 31.20 3ikm h VAL 104 CO -0.42 0.15 0.47 -0.33 0.02 0.00 0.00 177.57 177.46 3ikm h GLU 105 N 0.17 0.79 0.49 1.57 4.39 -0.67 0.57 114.58 121.89 3ikm h GLU 105 Ca 0.07 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 3ikm h GLU 105 Cb 0.16 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 3ikm h GLU 105 CO -0.01 0.52 -0.24 1.25 -1.16 0.00 0.00 179.01 179.38 3ikm h LEU 106 N 0.81 -0.56 -1.49 1.33 5.85 -1.36 0.23 115.31 120.13 3ikm h LEU 106 Ca 0.38 0.02 0.21 0.00 0.84 0.00 0.00 57.88 59.33 3ikm h LEU 106 Cb 0.31 0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.41 3ikm h LEU 106 CO -0.23 -0.24 0.61 -0.09 -0.34 0.00 0.00 178.44 178.15 3ikm h ARG 107 N -0.98 0.40 0.27 1.25 2.43 -1.28 0.54 114.38 117.00 3ikm h ARG 107 Ca -0.07 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 3ikm h ARG 107 Cb 0.51 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3ikm h ARG 107 CO 0.11 0.26 -0.13 -0.22 -1.51 0.00 0.00 179.97 178.49 3ikm h LYS 108 N 0.41 -0.34 -0.69 0.20 3.64 0.20 0.10 116.57 120.09 3ikm h LYS 108 Ca 0.49 0.02 0.13 0.00 -1.27 0.00 0.00 60.65 60.02 3ikm h LYS 108 Cb 1.21 0.08 -0.13 0.00 -0.41 0.00 0.00 32.23 32.98 3ikm h LYS 108 CO -0.19 -0.01 -0.25 -0.91 -2.27 0.00 0.00 179.45 175.82 3ikm h ASN 109 N -0.73 -0.89 0.00 4.20 2.35 0.25 0.21 115.58 120.97 3ikm h ASN 109 Ca -0.04 0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 3ikm h ASN 109 Cb 0.49 0.51 0.00 0.00 0.05 0.00 0.00 38.32 39.37 3ikm h ASN 109 CO 0.06 -0.27 0.00 -0.11 -1.65 0.00 0.00 177.43 175.46 3ikm n LEU 110 N -5.47 0.00 -0.32 1.61 7.94 0.16 0.38 117.00 121.30 3ikm n LEU 110 Ca 0.08 0.82 -0.08 0.00 -1.11 0.00 0.00 56.01 55.72 3ikm n LEU 110 Cb 0.37 -0.32 -0.06 0.00 0.53 0.00 0.00 43.42 43.93 3ikm n LEU 110 CO -0.00 -0.32 0.38 0.00 -1.11 0.00 0.00 177.39 176.34 3ikm n ALA 111 N -1.75 -0.45 -0.01 1.96 0.00 0.00 0.23 120.51 120.50 3ikm n ALA 111 Ca 0.00 0.67 -0.11 0.00 0.00 0.00 0.00 53.44 54.00 3ikm n ALA 111 Cb 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 19.45 19.26 3ikm n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ikm h ALA 112 N 0.47 -0.48 -0.49 0.00 0.00 -0.10 2.22 119.26 120.87 3ikm h ALA 112 Ca 0.14 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3ikm h ALA 112 Cb 0.33 0.72 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 3ikm h ALA 112 CO -0.73 -0.87 0.27 1.49 0.00 0.00 0.00 179.25 179.41 3ikm h GLU 113 N -0.44 0.69 -0.44 0.00 4.57 1.69 -0.69 114.58 119.96 3ikm h GLU 113 Ca 0.09 -0.08 -0.07 0.00 -1.18 0.00 0.00 59.36 58.12 3ikm h GLU 113 Cb 0.59 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.03 3ikm h GLU 113 CO -0.39 0.54 -0.00 2.35 -1.18 0.00 0.00 179.01 180.33 3ikm h TRP 114 N 0.65 0.85 -0.50 0.92 7.01 0.34 -3.04 115.95 122.19 3ikm h TRP 114 Ca 0.17 -0.15 0.09 0.00 2.11 0.00 0.00 58.89 61.11 3ikm h TRP 114 Cb 0.06 -0.22 -0.07 0.00 -2.10 0.00 0.00 29.16 26.83 3ikm h TRP 114 CO -0.02 0.83 0.09 2.35 -2.79 0.00 0.00 178.44 178.90 3ikm h TRP 115 N 0.62 0.14 -0.49 2.65 2.91 0.42 -2.68 115.95 119.53 3ikm h TRP 115 Ca 0.12 0.03 0.10 0.00 1.13 0.00 0.00 58.89 60.27 3ikm h TRP 115 Cb 0.49 0.01 -0.10 0.00 -0.51 0.00 0.00 29.16 29.06 3ikm h TRP 115 CO 0.04 -0.02 -0.15 0.00 -1.03 0.00 0.00 178.44 177.28 3ikm h THR 116 N 0.22 0.46 -0.15 2.65 1.03 -1.02 -1.26 112.91 114.84 3ikm h THR 116 Ca 0.25 0.00 0.05 0.00 -0.01 0.00 0.00 66.41 66.70 3ikm h THR 116 Cb 0.34 0.46 -0.06 0.00 -1.07 0.00 0.00 68.15 67.81 3ikm h THR 116 CO -0.34 0.00 -0.26 0.28 -0.01 0.00 0.00 175.52 175.19 3ikm h SER 117 N -0.04 -0.82 -0.72 0.00 0.02 -1.55 -2.25 113.55 108.19 3ikm h SER 117 Ca 0.23 0.13 0.14 0.00 -0.84 0.00 0.00 61.79 61.45 3ikm h SER 117 Cb 0.40 0.36 -0.09 0.00 0.14 0.00 0.00 62.40 63.21 3ikm h SER 117 CO -0.52 -0.31 0.25 1.62 -1.14 0.00 0.00 176.83 176.73 3ikm h VAL 118 N -0.32 0.64 -0.44 2.27 3.04 -1.10 -2.74 116.25 117.61 3ikm h VAL 118 Ca 0.11 -0.13 -0.07 0.00 -1.01 0.00 0.00 66.70 65.59 3ikm h VAL 118 Cb 0.48 0.22 -0.02 0.00 -2.01 0.00 0.00 31.29 29.96 3ikm h VAL 118 CO -0.33 0.07 -0.03 0.58 -1.01 0.00 0.00 177.57 176.85 3ikm h VAL 119 N 0.39 1.24 0.00 1.51 2.07 -0.72 -3.40 116.25 117.33 3ikm h VAL 119 Ca 0.39 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.90 3ikm h VAL 119 Cb 0.60 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 3ikm h VAL 119 CO -0.41 0.35 0.00 1.33 0.02 0.00 0.00 177.57 178.86 3ikm n VAL 120 N -4.21 0.00 -1.23 2.57 0.24 -0.95 -4.66 118.33 110.08 3ikm n VAL 120 Ca 0.02 1.49 -0.36 0.00 -2.04 0.00 0.00 64.34 63.45 3ikm n VAL 120 Cb 0.31 -2.15 0.08 0.00 -1.47 0.00 0.00 33.84 30.60 3ikm n VAL 120 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 3ikm n PHE 121 N -2.61 -0.52 0.13 6.34 -0.00 -1.26 -4.66 117.46 114.88 3ikm n PHE 121 Ca 0.00 0.35 0.03 0.00 -0.00 0.00 0.00 57.45 57.83 3ikm n PHE 121 Cb 0.00 -1.94 0.04 0.00 -0.00 0.00 0.00 39.48 37.58 3ikm n PHE 121 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3ikm n ARG 122 N -1.11 0.02 -4.88 -4.13 1.74 -1.26 -3.98 116.66 103.05 3ikm n ARG 122 Ca 0.10 0.53 -0.27 0.00 -0.77 0.00 0.00 57.85 57.45 3ikm n ARG 122 Cb 0.50 -1.42 -0.15 0.00 -1.02 0.00 0.00 32.46 30.37 3ikm n ARG 122 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3ikm s GLU 123 N -2.78 1.61 0.00 5.56 2.02 -1.26 -5.11 118.70 118.74 3ikm s GLU 123 Ca -0.00 -0.86 0.00 0.00 0.02 0.00 0.00 54.97 54.13 3ikm s GLU 123 Cb 0.01 -1.63 0.00 0.00 0.10 0.00 0.00 34.13 32.61 3ikm s GLU 123 CO 0.04 0.43 0.00 0.00 0.02 0.00 0.00 175.26 175.76 3ikm n GLN 124 N 2.22 0.00 -0.92 1.61 0.00 -1.26 -4.79 117.38 114.24 3ikm n GLN 124 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 57.00 56.84 3ikm n GLN 124 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.77 3ikm n GLN 124 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.06 178.39 3ikm n VAL 125 N 0.00 0.00 -4.21 -0.39 0.24 -0.85 -4.96 118.33 108.17 3ikm n VAL 125 Ca 0.00 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.13 3ikm n VAL 125 Cb 0.00 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.26 3ikm n VAL 125 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 3ikm s PHE 126 N -6.55 1.27 -1.09 6.34 0.08 -1.10 0.97 117.98 117.90 3ikm s PHE 126 Ca 0.00 -0.55 0.10 0.00 0.12 0.00 0.00 56.93 56.60 3ikm s PHE 126 Cb 0.00 -0.68 0.45 0.00 -0.57 0.00 0.00 43.02 42.22 3ikm s PHE 126 CO 0.00 0.09 1.30 -0.35 -0.10 0.00 0.00 175.22 176.16 3ikm n PRO 127 N 0.73 0.03 0.00 0.24 -0.04 -1.22 -4.03 135.00 130.72 3ikm n PRO 127 Ca -0.17 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 3ikm n PRO 127 Cb 0.56 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 3ikm n PRO 127 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 3ikm n VAL 128 N -1.46 0.00 -0.11 0.52 3.14 -1.26 -4.54 118.33 114.63 3ikm n VAL 128 Ca 0.03 0.00 -0.16 0.00 -2.96 0.00 0.00 64.34 61.25 3ikm n VAL 128 Cb 0.11 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 32.83 3ikm n VAL 128 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 3ikm n ASP 129 N 2.06 1.93 -1.56 6.55 -0.08 -1.26 -5.00 116.55 119.19 3ikm n ASP 129 Ca 0.00 0.37 -0.00 0.00 -1.51 0.00 0.00 54.79 53.65 3ikm n ASP 129 Cb 0.00 -0.79 -0.00 0.00 2.34 0.00 0.00 41.12 42.67 3ikm n ASP 129 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3ikm n ALA 130 N -4.24 -3.03 -3.86 -1.67 0.00 -1.26 -5.01 120.51 101.44 3ikm n ALA 130 Ca -0.28 0.05 -0.30 0.00 0.00 0.00 0.00 53.44 52.91 3ikm n ALA 130 Cb 0.63 -0.10 -0.15 0.00 0.00 0.00 0.00 19.45 19.82 3ikm n ALA 130 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ikm s LEU 131 N -0.06 2.58 0.08 0.00 1.02 -1.26 -5.01 118.68 116.03 3ikm s LEU 131 Ca -0.00 -1.41 -0.16 0.00 0.02 0.00 0.00 54.13 52.58 3ikm s LEU 131 Cb 0.00 -1.06 -0.04 0.00 0.02 0.00 0.00 46.19 45.12 3ikm s LEU 131 CO 0.04 -0.32 0.91 1.41 0.02 0.00 0.00 176.35 178.40 3ikm n HIS 132 N 4.72 -0.22 0.00 0.29 8.25 -1.26 -4.41 115.22 122.58 3ikm n HIS 132 Ca -0.06 0.64 0.00 0.00 -0.26 0.00 0.00 57.72 58.04 3ikm n HIS 132 Cb 0.44 -0.50 0.00 0.00 1.12 0.00 0.00 29.99 31.04 3ikm n HIS 132 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3ikm n HIS 133 N -4.37 0.00 -1.47 4.41 8.25 -1.26 -1.01 115.22 119.77 3ikm n HIS 133 Ca 0.01 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.30 3ikm n HIS 133 Cb 0.13 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.17 3ikm n HIS 133 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 3ikm n LYS 134 N 14.00 -1.45 -1.72 -0.41 4.81 -1.26 -4.57 118.16 127.56 3ikm n LYS 134 Ca 0.00 1.02 -0.41 0.00 -0.87 0.00 0.00 58.31 58.05 3ikm n LYS 134 Cb 0.00 -5.35 0.01 0.00 0.02 0.00 0.00 35.03 29.71 3ikm n LYS 134 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 3ikm n PRO 135 N -1.93 2.13 0.00 1.64 -0.04 -1.26 -4.92 135.00 130.63 3ikm n PRO 135 Ca -0.17 0.75 0.00 0.00 -0.04 0.00 0.00 63.50 64.05 3ikm n PRO 135 Cb 0.58 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.60 3ikm n PRO 135 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ikm n GLY 136 N 0.72 3.38 3.38 0.55 0.00 -1.26 -5.18 105.19 106.79 3ikm n GLY 136 Ca 0.05 -0.81 -0.31 0.00 0.00 0.00 0.00 46.02 44.95 3ikm n GLY 136 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ikm s PRO 137 N -2.09 1.98 7.00 1.61 0.05 -1.26 -5.06 135.00 137.23 3ikm s PRO 137 Ca 0.00 -1.01 0.00 0.00 0.05 0.00 0.00 61.00 60.04 3ikm s PRO 137 Cb 0.00 -2.08 0.00 0.00 0.05 0.00 0.00 34.50 32.47 3ikm s PRO 137 CO 0.00 0.54 0.00 1.28 0.05 0.00 0.00 177.00 178.87 3ikm n LEU 138 N 1.86 0.00 -0.42 -3.56 7.99 -1.26 -4.64 117.00 116.98 3ikm n LEU 138 Ca -0.17 0.00 0.37 0.00 -0.01 0.00 0.00 56.01 56.20 3ikm n LEU 138 Cb 0.52 0.00 0.63 0.00 -0.11 0.00 0.00 43.42 44.46 3ikm n LEU 138 CO 0.24 0.00 1.14 0.18 -1.51 0.00 0.00 177.39 177.44 3ikm n LEU 139 N 0.00 0.24 0.08 2.23 4.77 -1.26 -3.86 117.00 119.20 3ikm n LEU 139 Ca 0.00 1.41 -0.03 0.00 -0.03 0.00 0.00 56.01 57.36 3ikm n LEU 139 Cb 0.00 -0.69 -0.01 0.00 -2.33 0.00 0.00 43.42 40.38 3ikm n LEU 139 CO 0.00 -1.55 0.32 1.55 -1.33 0.00 0.00 177.39 176.37 3ikm h PRO 140 N 0.00 -0.20 -6.40 3.23 0.13 -1.98 -3.45 132.00 123.34 3ikm h PRO 140 Ca 0.84 0.01 -0.67 0.00 -0.87 0.00 0.00 66.00 65.32 3ikm h PRO 140 Cb 2.59 0.04 -0.15 0.00 0.13 0.00 0.00 31.00 33.61 3ikm h PRO 140 CO -0.53 -0.13 -0.71 0.20 -0.23 0.00 0.00 178.00 176.60 3ikm s GLY 141 N -1.67 1.81 -0.29 1.56 0.00 -1.25 -5.09 107.32 102.39 3ikm s GLY 141 Ca -0.03 -1.13 -0.05 0.00 0.00 0.00 0.00 44.72 43.51 3ikm s GLY 141 CO 0.09 -1.06 0.04 0.99 0.00 0.00 0.00 173.10 173.16 3ikm s ASP 142 N -1.93 4.94 0.17 1.64 1.11 -1.26 -4.72 116.67 116.62 3ikm s ASP 142 Ca 0.21 -0.84 -0.32 0.00 0.18 0.00 0.00 52.55 51.78 3ikm s ASP 142 Cb -0.11 -1.81 -0.11 0.00 1.07 0.00 0.00 42.92 41.95 3ikm s ASP 142 CO 0.12 -0.20 1.73 -0.55 1.18 0.00 0.00 175.17 177.45 3ikm s SER 143 N 1.43 6.43 -0.30 0.27 0.15 -1.26 -4.97 113.70 115.44 3ikm s SER 143 Ca 0.01 2.79 -0.03 0.00 0.70 0.00 0.00 55.95 59.42 3ikm s SER 143 Cb -0.18 -2.59 0.11 0.00 -1.71 0.00 0.00 66.02 61.65 3ikm s SER 143 CO 0.01 -0.96 0.14 0.00 1.20 0.00 0.00 173.24 173.63 3ikm s ALA 144 N 1.63 0.67 0.00 5.45 0.00 -1.26 -5.03 121.76 123.23 3ikm s ALA 144 Ca 0.76 -1.21 0.00 0.00 0.00 0.00 0.00 51.96 51.50 3ikm s ALA 144 Cb -0.48 -1.42 0.00 0.00 0.00 0.00 0.00 23.12 21.22 3ikm s ALA 144 CO 0.33 -1.72 0.00 1.19 0.00 0.00 0.00 175.76 175.56 3ikm n PHE 145 N 5.06 0.00 0.00 0.00 3.01 -1.26 -5.07 117.46 119.20 3ikm n PHE 145 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 3ikm n PHE 145 Cb 0.41 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.88 3ikm n PHE 145 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3ikm n ARG 146 N 0.00 0.00 0.00 -1.08 1.74 -1.26 -5.14 116.66 110.92 3ikm n ARG 146 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3ikm n ARG 146 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 3ikm n ARG 146 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3ikm n SER 178 N 0.00 0.00 -3.63 0.55 2.88 -1.26 -5.03 113.62 107.13 3ikm n SER 178 Ca 0.00 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3ikm n SER 178 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 3ikm n SER 178 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3ikm s GLY 179 N 0.00 -0.18 -0.59 0.46 0.00 -1.26 -5.09 107.32 100.65 3ikm s GLY 179 Ca 0.00 0.18 0.05 0.00 0.00 0.00 0.00 44.72 44.96 3ikm s GLY 179 CO 0.00 2.12 0.51 1.17 0.00 0.00 0.00 173.10 176.90 3ikm n LYS 180 N -0.65 1.49 -3.77 2.90 3.00 -1.26 -5.03 118.16 114.84 3ikm n LYS 180 Ca -0.04 -4.10 -0.14 0.00 -0.00 0.00 0.00 58.31 54.03 3ikm n LYS 180 Cb 0.61 -2.03 -0.15 0.00 0.00 0.00 0.00 35.03 33.45 3ikm n LYS 180 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 3ikm s LEU 181 N -1.30 1.02 0.16 3.14 1.43 -1.26 -4.63 118.68 117.24 3ikm s LEU 181 Ca 0.31 0.18 -0.16 0.00 -1.03 0.00 0.00 54.13 53.43 3ikm s LEU 181 Cb 0.04 0.19 -0.10 0.00 0.03 0.00 0.00 46.19 46.35 3ikm s LEU 181 CO -0.14 -0.12 0.25 0.54 0.23 0.00 0.00 176.35 177.11 3ikm n ARG 182 N 3.99 0.00 0.00 1.70 1.74 -0.18 -4.52 116.66 119.39 3ikm n ARG 182 Ca -0.24 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.84 3ikm n ARG 182 Cb 0.52 -0.62 0.00 0.00 -1.02 0.00 0.00 32.46 31.35 3ikm n ARG 182 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3ikm n GLU 183 N 0.68 1.96 -3.51 5.56 -0.58 -1.26 -2.80 120.64 120.69 3ikm n GLU 183 Ca 0.10 -0.11 -0.28 0.00 -0.42 0.00 0.00 57.16 56.44 3ikm n GLU 183 Cb 0.18 -0.48 -0.12 0.00 -0.57 0.00 0.00 31.44 30.46 3ikm n GLU 183 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 3ikm s ASN 184 N -0.31 2.68 0.57 1.62 0.01 -1.26 -4.93 114.94 113.32 3ikm s ASN 184 Ca 0.00 -2.68 0.29 0.00 -0.71 0.00 0.00 52.86 49.75 3ikm s ASN 184 Cb 0.00 -0.61 1.48 0.00 0.41 0.00 0.00 41.25 42.53 3ikm s ASN 184 CO 0.00 -0.24 1.93 -0.07 -1.51 0.00 0.00 177.10 177.21 3ikm h LEU 185 N 6.38 0.00 -0.26 0.60 3.38 -1.97 0.31 115.31 123.75 3ikm h LEU 185 Ca 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 3ikm h LEU 185 Cb 0.93 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 3ikm h LEU 185 CO 0.37 0.00 0.07 0.25 0.09 0.00 0.00 178.44 179.22 3ikm h LEU 186 N 0.00 0.39 -0.65 1.67 6.46 -1.92 -2.92 115.31 118.34 3ikm h LEU 186 Ca 0.25 -0.22 0.06 0.00 -0.12 0.00 0.00 57.88 57.85 3ikm h LEU 186 Cb 1.20 -0.10 -0.09 0.00 -0.73 0.00 0.00 40.66 40.94 3ikm h LEU 186 CO -0.00 0.51 -0.54 -0.74 -0.62 0.00 0.00 178.44 177.05 3ikm h HIS 187 N 0.24 -1.69 -0.26 1.25 2.76 -0.78 0.34 115.15 117.02 3ikm h HIS 187 Ca 0.08 0.10 0.05 0.00 -2.20 0.00 0.00 60.37 58.40 3ikm h HIS 187 Cb 0.27 0.82 -0.05 0.00 1.55 0.00 0.00 27.41 30.00 3ikm h HIS 187 CO 0.01 -0.41 -0.05 0.78 -1.30 0.00 0.00 177.93 176.97 3ikm h GLY 188 N -0.19 0.21 -0.78 5.26 0.00 -1.61 0.91 103.07 106.87 3ikm h GLY 188 Ca 0.11 0.07 0.26 0.00 0.00 0.00 0.00 47.33 47.77 3ikm h GLY 188 CO -0.71 -0.09 1.13 0.00 0.00 0.00 0.00 176.54 176.87 3ikm h ALA 189 N 1.25 2.82 0.01 3.60 0.00 -0.74 0.41 119.26 126.61 3ikm h ALA 189 Ca 0.13 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3ikm h ALA 189 Cb 0.19 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3ikm h ALA 189 CO -0.26 -1.60 -0.00 -0.07 0.00 0.00 0.00 179.25 177.32 3ikm h LEU 190 N 0.00 -0.01 -0.44 0.00 3.38 -0.25 -2.65 115.31 115.34 3ikm h LEU 190 Ca 0.43 -0.80 0.09 0.00 0.09 0.00 0.00 57.88 57.69 3ikm h LEU 190 Cb 2.69 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 43.36 3ikm h LEU 190 CO -0.00 0.82 -0.11 -0.08 0.09 0.00 0.00 178.44 179.16 3ikm h GLU 191 N -0.87 -0.00 0.00 1.13 4.57 -0.94 1.64 114.58 120.10 3ikm h GLU 191 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3ikm h GLU 191 Cb 0.81 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.40 3ikm h GLU 191 CO 0.00 -0.00 0.14 0.45 -1.18 0.00 0.00 179.01 178.42 3ikm h HIS 192 N -0.00 0.00 -0.01 0.92 3.86 -1.58 -3.27 115.15 115.07 3ikm h HIS 192 Ca 0.21 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 3ikm h HIS 192 Cb 0.33 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.79 3ikm h HIS 192 CO -0.39 0.00 -0.02 -0.92 0.86 0.00 0.00 177.93 177.46 3ikm h TYR 193 N 0.00 -0.06 -0.85 2.45 3.20 0.28 0.21 116.97 122.20 3ikm h TYR 193 Ca 0.00 0.00 0.22 0.00 3.14 0.00 0.00 58.73 62.09 3ikm h TYR 193 Cb 0.29 0.03 -0.14 0.00 1.54 0.00 0.00 36.73 38.45 3ikm h TYR 193 CO 0.00 -0.02 0.20 0.28 -1.64 0.00 0.00 178.16 176.98 3ikm h VAL 194 N -0.02 0.34 -0.37 1.81 2.07 -1.68 0.76 116.25 119.16 3ikm h VAL 194 Ca 0.00 -0.07 -0.10 0.00 0.82 0.00 0.00 66.70 67.35 3ikm h VAL 194 Cb 0.02 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 29.90 3ikm h VAL 194 CO -0.02 0.04 -0.19 0.78 0.02 0.00 0.00 177.57 178.20 3ikm h ASN 195 N 0.20 0.71 -0.03 0.57 -0.26 -1.69 0.33 115.58 115.41 3ikm h ASN 195 Ca 0.52 -0.23 0.01 0.00 -0.56 0.00 0.00 56.30 56.03 3ikm h ASN 195 Cb 1.01 -0.19 -0.00 0.00 -1.06 0.00 0.00 38.32 38.08 3ikm h ASN 195 CO -0.64 0.89 0.03 0.00 -1.06 0.00 0.00 177.43 176.65 3ikm h LEU 197 N 0.00 0.28 -1.93 0.00 6.46 0.39 -2.49 115.31 118.02 3ikm h LEU 197 Ca 0.01 -0.59 0.26 0.00 -0.12 0.00 0.00 57.88 57.44 3ikm h LEU 197 Cb 0.07 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 39.88 3ikm h LEU 197 CO -0.00 0.82 0.65 -2.24 -0.62 0.00 0.00 178.44 177.05 3ikm h ASP 198 N -0.24 0.05 -4.00 1.25 3.04 0.82 -1.05 116.42 116.29 3ikm h ASP 198 Ca -0.00 0.01 -0.51 0.00 -3.24 0.00 0.00 57.03 53.29 3ikm h ASP 198 Cb 0.79 -0.00 0.06 0.00 -1.04 0.00 0.00 39.33 39.14 3ikm h ASP 198 CO 0.04 0.02 0.49 -0.22 -2.04 0.00 0.00 179.24 177.53 3ikm s LEU 199 N -8.65 4.02 -0.35 0.15 1.98 -0.66 -2.69 118.68 112.49 3ikm s LEU 199 Ca -0.05 2.32 0.00 0.00 -2.89 0.00 0.00 54.13 53.50 3ikm s LEU 199 Cb 0.22 -4.23 0.00 0.00 0.66 0.00 0.00 46.19 42.84 3ikm s LEU 199 CO 0.78 -0.91 0.00 0.52 -1.89 0.00 0.00 176.35 174.84 3ikm n VAL 200 N -0.46 0.00 -1.66 1.68 0.31 -1.26 -2.68 118.33 114.26 3ikm n VAL 200 Ca 0.07 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.37 3ikm n VAL 200 Cb 0.48 -0.69 -0.01 0.00 -0.91 0.00 0.00 33.84 32.72 3ikm n VAL 200 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3ikm n ASN 201 N -0.06 -2.30 0.00 4.52 4.13 -1.10 -2.07 115.26 118.38 3ikm n ASN 201 Ca -0.03 0.02 0.00 0.00 1.68 0.00 0.00 54.58 56.25 3ikm n ASN 201 Cb 0.24 -1.05 0.00 0.00 -1.54 0.00 0.00 39.78 37.43 3ikm n ASN 201 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 3ikm n LYS 202 N -1.92 0.00 -0.87 3.52 4.81 -0.40 -4.92 118.16 118.37 3ikm n LYS 202 Ca -0.03 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.12 3ikm n LYS 202 Cb 0.35 -1.34 0.20 0.00 0.02 0.00 0.00 35.03 34.26 3ikm n LYS 202 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3ikm s ARG 203 N 0.00 -0.04 0.00 1.64 0.52 -0.88 -3.98 118.95 116.20 3ikm s ARG 203 Ca 0.00 0.76 0.00 0.00 -0.52 0.00 0.00 55.73 55.97 3ikm s ARG 203 Cb 0.00 -1.66 0.00 0.00 0.52 0.00 0.00 34.95 33.81 3ikm s ARG 203 CO 0.00 -3.11 0.00 -0.11 0.02 0.00 0.00 175.30 172.10 3ikm n LEU 204 N -4.48 0.00 -3.69 2.53 7.94 -1.26 -4.58 117.00 113.47 3ikm n LEU 204 Ca 0.05 0.00 -0.29 0.00 -1.11 0.00 0.00 56.01 54.66 3ikm n LEU 204 Cb 0.55 0.00 0.04 0.00 0.53 0.00 0.00 43.42 44.54 3ikm n LEU 204 CO 0.57 0.00 -0.08 -2.65 -1.11 0.00 0.00 177.39 174.11 3ikm n PRO 205 N 0.00 -1.80 -1.15 1.96 -0.02 -1.26 -4.99 135.00 127.74 3ikm n PRO 205 Ca 0.00 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 3ikm n PRO 205 Cb 0.00 -4.35 0.00 0.00 -0.02 0.00 0.00 33.50 29.13 3ikm n PRO 205 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 3ikm n TYR 206 N -4.16 -1.73 -3.90 6.00 -0.00 -1.26 -4.86 117.16 107.26 3ikm n TYR 206 Ca -0.13 0.00 -0.30 0.00 -0.00 0.00 0.00 57.90 57.46 3ikm n TYR 206 Cb 0.61 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.80 3ikm n TYR 206 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.86 177.06 3ikm s GLY 207 N -1.53 1.48 -0.62 -7.48 0.00 -1.25 -2.31 107.32 95.60 3ikm s GLY 207 Ca 0.00 -1.93 -0.25 0.00 0.00 0.00 0.00 44.72 42.53 3ikm s GLY 207 CO 0.00 1.16 1.08 0.48 0.00 0.00 0.00 173.10 175.81 3ikm s LEU 208 N 1.27 3.81 0.29 0.66 0.05 -0.53 -2.00 118.68 122.23 3ikm s LEU 208 Ca 0.06 -0.41 -0.20 0.00 0.05 0.00 0.00 54.13 53.63 3ikm s LEU 208 Cb -0.18 -2.75 0.04 0.00 -2.05 0.00 0.00 46.19 41.24 3ikm s LEU 208 CO -0.13 -1.47 0.79 0.00 -0.55 0.00 0.00 176.35 175.00 3ikm s ALA 209 N 4.59 -1.17 0.16 1.48 0.00 0.27 -2.87 121.76 124.23 3ikm s ALA 209 Ca 0.32 -0.37 -0.10 0.00 0.00 0.00 0.00 51.96 51.81 3ikm s ALA 209 Cb -0.11 0.77 0.04 0.00 0.00 0.00 0.00 23.12 23.81 3ikm s ALA 209 CO 0.18 -1.03 0.49 0.94 0.00 0.00 0.00 175.76 176.34 3ikm n GLN 210 N -0.50 0.49 -5.14 0.00 0.00 -1.23 -2.73 117.38 108.28 3ikm n GLN 210 Ca -0.05 -1.02 -0.30 0.00 -0.00 0.00 0.00 57.00 55.63 3ikm n GLN 210 Cb 0.60 1.31 -0.16 0.00 0.00 0.00 0.00 30.24 31.99 3ikm n GLN 210 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 3ikm s ILE 211 N -2.41 1.86 0.06 1.69 1.01 -1.26 -3.38 121.20 118.76 3ikm s ILE 211 Ca 0.10 -0.97 -0.28 0.00 0.00 0.00 0.00 60.65 59.50 3ikm s ILE 211 Cb -0.02 -1.56 0.09 0.00 0.01 0.00 0.00 42.46 40.98 3ikm s ILE 211 CO 0.05 0.52 1.11 -0.83 0.00 0.00 0.00 174.94 175.79 3ikm s GLY 212 N -0.24 -0.32 0.07 6.18 0.00 -0.61 -5.01 107.32 107.39 3ikm s GLY 212 Ca 0.00 0.45 -0.26 0.00 0.00 0.00 0.00 44.72 44.92 3ikm s GLY 212 CO 0.02 0.08 0.79 0.14 0.00 0.00 0.00 173.10 174.14 3ikm s VAL 213 N -2.88 4.65 0.25 1.40 1.01 -1.26 -0.26 120.40 123.30 3ikm s VAL 213 Ca 0.13 1.70 0.05 0.00 0.00 0.00 0.00 61.98 63.86 3ikm s VAL 213 Cb 0.01 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 3ikm s VAL 213 CO -0.01 0.38 -0.04 0.00 0.00 0.00 0.00 175.10 175.43 3ikm s PHE 215 N -3.18 2.50 -0.05 0.00 0.40 -1.12 -1.83 117.98 114.69 3ikm s PHE 215 Ca 0.28 -0.50 0.05 0.00 -0.60 0.00 0.00 56.93 56.16 3ikm s PHE 215 Cb 0.04 -1.60 -0.02 0.00 0.51 0.00 0.00 43.02 41.95 3ikm s PHE 215 CO 0.10 -0.07 -0.20 -1.01 0.70 0.00 0.00 175.22 174.74 3ikm s HIS 216 N -0.39 2.54 0.13 0.36 3.76 0.28 -4.81 115.29 117.16 3ikm s HIS 216 Ca 0.03 -0.46 0.03 0.00 -0.15 0.00 0.00 55.06 54.52 3ikm s HIS 216 Cb -0.12 -1.61 -0.04 0.00 1.11 0.00 0.00 32.58 31.92 3ikm s HIS 216 CO 0.02 -0.04 0.19 -1.25 -0.85 0.00 0.00 174.74 172.81 3ikm s PRO 217 N -0.41 3.17 -0.28 8.40 0.04 -1.26 0.28 135.00 144.95 3ikm s PRO 217 Ca 0.04 -0.67 0.00 0.00 0.04 0.00 0.00 61.00 60.41 3ikm s PRO 217 Cb -0.12 -2.83 0.05 0.00 0.04 0.00 0.00 34.50 31.64 3ikm s PRO 217 CO 0.02 0.53 -0.06 0.54 0.04 0.00 0.00 177.00 178.07 3ikm s VAL 218 N -1.65 2.62 -0.57 -0.36 0.11 -1.26 -4.85 120.40 114.43 3ikm s VAL 218 Ca 0.33 -1.45 0.04 0.00 -2.93 0.00 0.00 61.98 57.97 3ikm s VAL 218 Cb -0.11 -2.50 0.17 0.00 -1.53 0.00 0.00 36.38 32.41 3ikm s VAL 218 CO 0.26 -0.03 0.42 -0.36 -3.33 0.00 0.00 175.10 172.05 3ikm s PHE 219 N 1.20 2.50 0.00 1.54 0.40 -1.26 -4.86 117.98 117.49 3ikm s PHE 219 Ca -0.06 -2.89 0.00 0.00 -0.60 0.00 0.00 56.93 53.38 3ikm s PHE 219 Cb -0.19 -1.95 0.00 0.00 0.51 0.00 0.00 43.02 41.39 3ikm s PHE 219 CO -0.03 -0.67 0.69 -0.25 0.70 0.00 0.00 175.22 175.66 3ikm n ASP 220 N 2.39 0.00 -3.67 1.36 8.00 -1.26 -4.88 116.55 118.49 3ikm n ASP 220 Ca 0.23 0.69 -0.10 0.00 0.71 0.00 0.00 54.79 56.32 3ikm n ASP 220 Cb 0.40 -0.19 -0.04 0.00 -0.02 0.00 0.00 41.12 41.27 3ikm n ASP 220 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3ikm s THR 221 N -1.76 0.03 0.00 -3.53 2.01 -1.26 -5.18 115.64 105.95 3ikm s THR 221 Ca 0.00 -0.63 0.00 0.00 0.31 0.00 0.00 61.69 61.37 3ikm s THR 221 Cb 0.00 -1.40 0.00 0.00 0.01 0.00 0.00 72.50 71.11 3ikm s THR 221 CO 0.00 -0.16 0.00 2.29 -0.69 0.00 0.00 174.62 176.06 3ikm n LYS 222 N -0.31 1.41 0.00 4.92 2.85 -1.26 -4.92 118.16 120.85 3ikm n LYS 222 Ca -0.12 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.14 3ikm n LYS 222 Cb 0.63 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.01 3ikm n LYS 222 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 3ikm n GLN 223 N -0.72 0.00 -1.71 -1.58 0.00 -1.26 -5.09 117.38 107.02 3ikm n GLN 223 Ca 0.00 0.00 -0.59 0.00 -0.00 0.00 0.00 57.00 56.41 3ikm n GLN 223 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 30.24 30.16 3ikm n GLN 223 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 3ikm n ILE 224 N 0.00 0.26 -1.19 1.69 2.08 -1.26 -4.78 119.36 116.15 3ikm n ILE 224 Ca 0.00 -0.05 0.00 0.00 0.56 0.00 0.00 62.75 63.26 3ikm n ILE 224 Cb 0.00 -1.11 0.00 0.00 -0.75 0.00 0.00 39.64 37.78 3ikm n ILE 224 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 3ikm n ARG 225 N 5.27 0.00 0.00 0.38 1.74 -1.26 -4.24 116.66 118.55 3ikm n ARG 225 Ca 0.28 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.36 3ikm n ARG 225 Cb 0.10 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.54 3ikm n ARG 225 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3ikm n ASN 226 N -1.80 0.00 0.00 0.55 3.02 -1.26 -4.97 115.26 110.80 3ikm n ASN 226 Ca 0.00 0.49 0.00 0.00 -0.03 0.00 0.00 54.58 55.04 3ikm n ASN 226 Cb 0.00 -0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.01 3ikm n ASN 226 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ikm n GLY 227 N -0.91 3.50 3.87 7.41 0.00 -1.26 -5.03 105.19 112.77 3ikm n GLY 227 Ca 0.00 -1.79 -0.28 0.00 0.00 0.00 0.00 46.02 43.95 3ikm n GLY 227 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3ikm n VAL 228 N -1.15 -0.40 -2.57 1.61 0.24 -1.26 -4.94 118.33 109.86 3ikm n VAL 228 Ca 0.00 -0.20 -0.23 0.00 -2.04 0.00 0.00 64.34 61.87 3ikm n VAL 228 Cb 0.00 -0.58 0.09 0.00 -1.47 0.00 0.00 33.84 31.88 3ikm n VAL 228 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 3ikm s LYS 229 N -6.10 1.84 0.00 7.34 1.02 -1.26 -4.66 119.74 117.91 3ikm s LYS 229 Ca 0.31 -1.01 0.00 0.00 0.02 0.00 0.00 55.97 55.29 3ikm s LYS 229 Cb -0.18 -2.34 0.00 0.00 -0.52 0.00 0.00 37.83 34.79 3ikm s LYS 229 CO 0.78 -1.32 0.00 0.43 -0.92 0.00 0.00 175.35 174.32 3ikm n SER 230 N -2.77 0.00 -3.62 2.83 7.64 -1.26 -4.84 113.62 111.60 3ikm n SER 230 Ca 0.13 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.88 3ikm n SER 230 Cb 0.60 0.26 -0.07 0.00 -1.01 0.00 0.00 64.21 63.99 3ikm n SER 230 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 3ikm s ILE 231 N -3.18 0.00 0.16 0.44 1.10 -1.26 -4.61 121.20 113.84 3ikm s ILE 231 Ca 0.00 0.00 0.11 0.00 -0.51 0.00 0.00 60.65 60.25 3ikm s ILE 231 Cb 0.00 -1.00 -0.04 0.00 0.15 0.00 0.00 42.46 41.57 3ikm s ILE 231 CO 0.00 0.00 -0.25 -0.83 -2.11 0.00 0.00 174.94 171.75 3ikm s GLY 232 N 0.16 1.61 0.07 1.50 0.00 0.82 -4.43 107.32 107.05 3ikm s GLY 232 Ca -0.01 -1.54 0.08 0.00 0.00 0.00 0.00 44.72 43.25 3ikm s GLY 232 CO 0.01 -1.54 -0.20 -0.54 0.00 0.00 0.00 173.10 170.82 3ikm s GLU 233 N -2.35 1.24 -0.21 2.90 2.02 -1.24 0.10 118.70 121.16 3ikm s GLU 233 Ca 0.17 -1.03 -0.11 0.00 0.02 0.00 0.00 54.97 54.01 3ikm s GLU 233 Cb -0.09 -1.42 0.07 0.00 0.10 0.00 0.00 34.13 32.80 3ikm s GLU 233 CO 0.08 0.35 0.51 0.15 0.02 0.00 0.00 175.26 176.37 3ikm s LYS 234 N -1.51 0.50 -0.84 1.61 1.02 -0.76 -4.77 119.74 114.99 3ikm s LYS 234 Ca 0.07 0.99 -0.25 0.00 0.02 0.00 0.00 55.97 56.79 3ikm s LYS 234 Cb -0.09 0.10 0.04 0.00 -0.52 0.00 0.00 37.83 37.36 3ikm s LYS 234 CO 0.03 -0.17 1.32 0.99 -0.92 0.00 0.00 175.35 176.60 3ikm s THR 235 N 1.66 3.84 0.46 2.17 2.01 -1.26 -1.56 115.64 122.96 3ikm s THR 235 Ca -0.09 -0.08 0.00 0.00 0.31 0.00 0.00 61.69 61.83 3ikm s THR 235 Cb -0.08 -4.95 -0.00 0.00 0.01 0.00 0.00 72.50 67.48 3ikm s THR 235 CO -0.15 -1.86 0.68 -1.83 -0.69 0.00 0.00 174.62 170.77 3ikm s GLU 236 N 5.32 3.05 -0.22 4.92 -1.05 0.64 -4.11 118.70 127.24 3ikm s GLU 236 Ca 0.38 -0.47 0.01 0.00 -0.15 0.00 0.00 54.97 54.74 3ikm s GLU 236 Cb -0.06 -2.54 0.05 0.00 -0.44 0.00 0.00 34.13 31.14 3ikm s GLU 236 CO 0.06 -0.30 -0.10 0.00 0.95 0.00 0.00 175.26 175.86 3ikm s ALA 237 N -2.58 2.16 -0.09 -0.84 0.00 -1.17 -1.57 121.76 117.67 3ikm s ALA 237 Ca 0.49 -1.38 0.04 0.00 0.00 0.00 0.00 51.96 51.10 3ikm s ALA 237 Cb -0.10 -1.38 0.00 0.00 0.00 0.00 0.00 23.12 21.64 3ikm s ALA 237 CO 0.38 -0.96 -0.21 -1.54 0.00 0.00 0.00 175.76 173.43 3ikm s SER 238 N 1.31 2.75 -0.23 0.00 1.04 -1.22 -4.14 113.70 113.22 3ikm s SER 238 Ca -0.04 -0.49 -0.03 0.00 0.48 0.00 0.00 55.95 55.87 3ikm s SER 238 Cb -0.18 -1.23 0.00 0.00 0.10 0.00 0.00 66.02 64.72 3ikm s SER 238 CO -0.07 0.13 -0.05 -0.22 0.98 0.00 0.00 173.24 174.01 3ikm s LEU 239 N 0.39 2.96 0.44 2.42 2.96 -1.26 -3.50 118.68 123.08 3ikm s LEU 239 Ca -0.17 -0.54 0.08 0.00 -0.22 0.00 0.00 54.13 53.28 3ikm s LEU 239 Cb -0.17 -1.71 0.00 0.00 0.50 0.00 0.00 46.19 44.81 3ikm s LEU 239 CO 0.07 -0.05 0.47 -0.69 -1.32 0.00 0.00 176.35 174.83 3ikm s VAL 240 N 1.43 2.69 -0.27 1.68 1.01 -1.14 -3.63 120.40 122.17 3ikm s VAL 240 Ca 0.04 -1.21 -0.18 0.00 0.00 0.00 0.00 61.98 60.63 3ikm s VAL 240 Cb -0.15 -2.90 0.07 0.00 0.00 0.00 0.00 36.38 33.41 3ikm s VAL 240 CO -0.04 0.00 0.68 0.86 0.00 0.00 0.00 175.10 176.60 3ikm s TRP 241 N -2.46 -0.94 -0.46 5.22 -0.11 -1.25 -1.45 118.94 117.48 3ikm s TRP 241 Ca 0.51 2.00 -0.10 0.00 1.22 0.00 0.00 56.10 59.73 3ikm s TRP 241 Cb -0.06 0.50 0.10 0.00 -1.50 0.00 0.00 33.47 32.51 3ikm s TRP 241 CO 0.30 -0.47 0.33 -0.06 -4.62 0.00 0.00 176.95 172.43 3ikm s PHE 242 N 1.21 3.36 0.04 5.86 0.08 -0.98 -1.83 117.98 125.72 3ikm s PHE 242 Ca -0.07 -1.62 0.02 0.00 0.12 0.00 0.00 56.93 55.38 3ikm s PHE 242 Cb -0.05 -3.28 -0.04 0.00 -0.57 0.00 0.00 43.02 39.08 3ikm s PHE 242 CO -0.13 -0.92 0.05 0.95 -0.10 0.00 0.00 175.22 175.07 3ikm s THR 243 N 1.43 4.43 0.63 0.64 -4.23 -1.02 -4.11 115.64 113.41 3ikm s THR 243 Ca 0.04 -0.66 -0.11 0.00 -1.18 0.00 0.00 61.69 59.79 3ikm s THR 243 Cb -0.25 -3.06 0.16 0.00 1.34 0.00 0.00 72.50 70.69 3ikm s THR 243 CO 0.01 0.25 0.44 -2.65 -0.54 0.00 0.00 174.62 172.13 3ikm n PRO 244 N 0.90 -2.82 0.15 3.99 -0.02 -1.26 0.51 135.00 136.44 3ikm n PRO 244 Ca -0.12 -0.72 0.13 0.00 -2.02 0.00 0.00 63.50 60.78 3ikm n PRO 244 Cb 0.52 -0.82 0.39 0.00 -0.02 0.00 0.00 33.50 33.57 3ikm n PRO 244 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3ikm h PRO 245 N 0.00 0.00 0.05 0.52 0.13 -1.98 -3.21 132.00 127.51 3ikm h PRO 245 Ca -0.18 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.57 3ikm h PRO 245 Cb 0.59 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.68 3ikm h PRO 245 CO 0.11 0.00 -2.26 0.54 -0.23 0.00 0.00 178.00 176.16 3ikm n ARG 246 N -2.50 0.69 -0.26 0.86 3.00 -1.26 -3.81 116.66 113.38 3ikm n ARG 246 Ca 0.04 0.19 0.07 0.00 -0.01 0.00 0.00 57.85 58.14 3ikm n ARG 246 Cb 0.41 -1.60 0.20 0.00 0.00 0.00 0.00 32.46 31.47 3ikm n ARG 246 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.63 179.42 3ikm h THR 247 N 0.03 0.55 0.00 0.55 1.35 -1.92 -3.40 112.91 110.07 3ikm h THR 247 Ca -0.51 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 3ikm h THR 247 Cb 1.98 0.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 3ikm h THR 247 CO -0.01 0.06 0.00 -0.24 -0.25 0.00 0.00 175.52 175.08 3ikm n SER 248 N -5.09 0.00 -0.33 5.36 2.88 -1.21 0.25 113.62 115.47 3ikm n SER 248 Ca 0.15 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.74 3ikm n SER 248 Cb 0.48 0.00 0.22 0.00 -0.75 0.00 0.00 64.21 64.16 3ikm n SER 248 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 3ikm h ASN 249 N 0.00 0.95 -0.41 -3.46 2.35 -1.81 -1.36 115.58 111.84 3ikm h ASN 249 Ca 0.00 0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.74 3ikm h ASN 249 Cb 0.00 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 3ikm h ASN 249 CO 0.00 0.59 0.15 -0.61 -1.65 0.00 0.00 177.43 175.91 3ikm h GLN 250 N 1.06 0.63 -0.21 0.81 5.75 -1.67 0.53 115.11 122.01 3ikm h GLN 250 Ca 0.43 -0.12 -0.12 0.00 -0.15 0.00 0.00 58.65 58.69 3ikm h GLN 250 Cb 0.26 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 3ikm h GLN 250 CO -0.18 0.60 -0.37 -1.49 -2.65 0.00 0.00 178.83 174.75 3ikm h TRP 251 N 0.52 0.53 0.69 3.99 -0.00 0.38 0.91 115.95 122.97 3ikm h TRP 251 Ca 0.14 -0.14 -0.03 0.00 -0.00 0.00 0.00 58.89 58.85 3ikm h TRP 251 Cb 0.22 -0.12 0.01 0.00 -0.00 0.00 0.00 29.16 29.27 3ikm h TRP 251 CO 0.00 0.76 -0.33 1.25 -0.00 0.00 0.00 178.44 180.12 3ikm h LEU 252 N 0.38 -0.78 -1.96 -4.49 6.46 -1.04 -2.61 115.31 111.27 3ikm h LEU 252 Ca 0.04 0.03 0.27 0.00 -0.12 0.00 0.00 57.88 58.10 3ikm h LEU 252 Cb 0.82 0.20 -0.04 0.00 -0.73 0.00 0.00 40.66 40.91 3ikm h LEU 252 CO 0.07 -0.41 0.67 0.44 -0.62 0.00 0.00 178.44 178.59 3ikm h ASP 253 N -1.22 0.03 -0.58 1.25 3.32 0.33 0.35 116.42 119.90 3ikm h ASP 253 Ca -0.09 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 3ikm h ASP 253 Cb 0.71 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 3ikm h ASP 253 CO 0.16 0.01 0.34 0.15 -1.72 0.00 0.00 179.24 178.18 3ikm h PHE 254 N 0.03 0.77 0.09 4.55 3.57 0.11 -2.72 116.94 123.34 3ikm h PHE 254 Ca 0.45 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.94 3ikm h PHE 254 Cb 1.76 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 40.25 3ikm h PHE 254 CO -0.00 0.54 -0.04 -1.49 -2.23 0.00 0.00 178.31 175.09 3ikm h TRP 255 N 0.78 -0.11 -0.30 0.41 4.06 0.06 -2.48 115.95 118.36 3ikm h TRP 255 Ca 0.21 -0.00 0.03 0.00 2.06 0.00 0.00 58.89 61.18 3ikm h TRP 255 Cb -0.00 0.04 -0.04 0.00 -1.00 0.00 0.00 29.16 28.16 3ikm h TRP 255 CO -0.02 -0.06 -0.18 1.28 -3.56 0.00 0.00 178.44 175.90 3ikm n LEU 256 N -5.14 -0.32 0.00 -4.49 7.99 -1.03 -1.02 117.00 112.99 3ikm n LEU 256 Ca -0.08 1.03 0.00 0.00 -0.01 0.00 0.00 56.01 56.95 3ikm n LEU 256 Cb 0.08 -0.32 0.00 0.00 -0.11 0.00 0.00 43.42 43.07 3ikm n LEU 256 CO 0.34 -0.68 0.11 0.54 -1.51 0.00 0.00 177.39 176.18 3ikm n ARG 257 N -3.62 0.00 -0.22 3.23 1.74 -1.02 -2.41 116.66 114.36 3ikm n ARG 257 Ca 0.01 0.21 -0.06 0.00 -0.77 0.00 0.00 57.85 57.24 3ikm n ARG 257 Cb 0.08 -0.66 -0.05 0.00 -1.02 0.00 0.00 32.46 30.80 3ikm n ARG 257 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 3ikm n HIS 258 N -0.44 -0.23 -0.28 -1.55 -0.00 -0.65 -1.30 115.22 110.77 3ikm n HIS 258 Ca 0.00 0.64 -0.01 0.00 0.46 0.00 0.00 57.72 58.81 3ikm n HIS 258 Cb 0.00 -0.50 0.05 0.00 -0.12 0.00 0.00 29.99 29.42 3ikm n HIS 258 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3ikm h ARG 259 N 0.00 -0.06 -0.72 1.57 2.47 -0.93 -0.23 114.38 116.49 3ikm h ARG 259 Ca 0.08 0.00 0.12 0.00 -1.26 0.00 0.00 59.98 58.92 3ikm h ARG 259 Cb 0.21 0.01 -0.08 0.00 -1.65 0.00 0.00 29.97 28.46 3ikm h ARG 259 CO -0.48 -0.04 0.31 -0.07 0.56 0.00 0.00 179.97 180.25 3ikm h LEU 260 N -0.06 0.34 -1.55 3.04 3.38 -0.83 -1.02 115.31 118.61 3ikm h LEU 260 Ca 0.33 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.36 3ikm h LEU 260 Cb 0.58 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 3ikm h LEU 260 CO -0.82 0.17 -0.13 1.56 0.09 0.00 0.00 178.44 179.31 3ikm h GLN 261 N 0.50 0.00 0.16 1.13 7.50 -0.97 -2.54 115.11 120.88 3ikm h GLN 261 Ca 0.37 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.52 3ikm h GLN 261 Cb 0.50 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.03 3ikm h GLN 261 CO -0.34 0.13 -0.08 2.35 -1.50 0.00 0.00 178.83 179.39 3ikm h TRP 262 N 0.00 -0.20 0.22 2.96 7.01 -0.64 -2.16 115.95 123.14 3ikm h TRP 262 Ca -0.00 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 3ikm h TRP 262 Cb 0.53 0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.64 3ikm h TRP 262 CO 0.00 0.17 -0.20 -1.49 -2.79 0.00 0.00 178.44 174.13 3ikm h TRP 263 N -0.60 -0.51 -0.60 2.65 4.06 -1.27 -1.26 115.95 118.41 3ikm h TRP 263 Ca -0.02 0.00 0.12 0.00 2.06 0.00 0.00 58.89 61.05 3ikm h TRP 263 Cb 0.45 0.20 -0.09 0.00 -1.00 0.00 0.00 29.16 28.72 3ikm h TRP 263 CO 0.05 -0.30 0.09 0.00 -3.56 0.00 0.00 178.44 174.72 3ikm h ARG 264 N -0.44 0.20 -0.89 0.49 3.08 -1.57 0.88 114.38 116.14 3ikm h ARG 264 Ca -0.00 -0.01 0.21 0.00 0.07 0.00 0.00 59.98 60.24 3ikm h ARG 264 Cb 0.40 -0.05 -0.12 0.00 0.08 0.00 0.00 29.97 30.28 3ikm h ARG 264 CO -0.03 0.13 0.39 -0.22 -1.07 0.00 0.00 179.97 179.17 3ikm h LYS 265 N 0.21 0.41 -0.64 0.04 3.64 -0.58 0.61 116.57 120.26 3ikm h LYS 265 Ca 0.31 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 3ikm h LYS 265 Cb 0.48 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 3ikm h LYS 265 CO -0.44 0.27 0.00 1.19 -2.27 0.00 0.00 179.45 178.20 3ikm n PHE 266 N -5.03 1.11 -4.32 1.91 3.72 0.12 -4.93 117.46 110.04 3ikm n PHE 266 Ca 0.21 -0.55 -0.35 0.00 -0.05 0.00 0.00 57.45 56.71 3ikm n PHE 266 Cb 0.63 -0.10 -0.10 0.00 -0.94 0.00 0.00 39.48 38.96 3ikm n PHE 266 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ikm s ALA 267 N -1.37 3.26 -0.33 4.37 0.00 0.28 -4.72 121.76 123.25 3ikm s ALA 267 Ca 0.47 -0.80 0.20 0.00 0.00 0.00 0.00 51.96 51.83 3ikm s ALA 267 Cb 0.27 -1.56 0.26 0.00 0.00 0.00 0.00 23.12 22.08 3ikm s ALA 267 CO 0.27 0.47 1.56 0.52 0.00 0.00 0.00 175.76 178.58 3ikm h MET 268 N 5.64 0.00 -0.09 0.00 2.86 -1.88 -3.38 114.93 118.08 3ikm h MET 268 Ca -0.45 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 56.94 3ikm h MET 268 Cb 1.19 0.00 -0.16 0.00 0.06 0.00 0.00 31.60 32.69 3ikm h MET 268 CO 0.58 0.18 -0.46 0.43 1.06 0.00 0.00 176.91 178.70 3ikm n SER 269 N -3.15 -2.09 0.00 1.22 7.64 -1.26 -5.04 113.62 110.94 3ikm n SER 269 Ca 0.03 -3.42 0.00 0.00 1.01 0.00 0.00 58.87 56.49 3ikm n SER 269 Cb 0.60 1.62 0.00 0.00 -1.01 0.00 0.00 64.21 65.43 3ikm n SER 269 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3ikm n PRO 270 N 0.16 0.00 0.01 1.43 -0.04 -1.26 -2.99 135.00 132.31 3ikm n PRO 270 Ca 0.05 0.05 0.05 0.00 -0.04 0.00 0.00 63.50 63.61 3ikm n PRO 270 Cb 0.73 -1.57 0.22 0.00 -0.04 0.00 0.00 33.50 32.85 3ikm n PRO 270 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3ikm n SER 271 N -0.84 0.06 -2.82 3.54 7.64 -1.26 -2.86 113.62 117.08 3ikm n SER 271 Ca 0.00 0.52 -0.39 0.00 1.01 0.00 0.00 58.87 60.01 3ikm n SER 271 Cb 0.07 -0.53 0.04 0.00 -1.01 0.00 0.00 64.21 62.78 3ikm n SER 271 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3ikm n ASN 272 N -1.57 7.50 -2.98 6.43 3.02 -1.16 -4.68 115.26 121.82 3ikm n ASN 272 Ca 0.02 -3.80 -0.13 0.00 -0.03 0.00 0.00 54.58 50.65 3ikm n ASN 272 Cb 0.11 -1.07 -0.02 0.00 -0.61 0.00 0.00 39.78 38.19 3ikm n ASN 272 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3ikm n PHE 273 N -0.51 -2.71 -2.89 3.10 3.72 -1.14 -2.22 117.46 114.81 3ikm n PHE 273 Ca 0.55 -2.12 -0.13 0.00 -0.05 0.00 0.00 57.45 55.70 3ikm n PHE 273 Cb 0.30 1.02 0.05 0.00 -0.94 0.00 0.00 39.48 39.91 3ikm n PHE 273 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3ikm n SER 274 N 2.70 1.19 -3.92 4.37 2.88 -1.23 -4.93 113.62 114.69 3ikm n SER 274 Ca 0.21 -1.89 -0.10 0.00 -1.33 0.00 0.00 58.87 55.76 3ikm n SER 274 Cb 0.54 -0.30 -0.11 0.00 -0.75 0.00 0.00 64.21 63.60 3ikm n SER 274 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3ikm s SER 275 N -3.30 0.12 0.35 -3.46 1.04 -1.26 -2.98 113.70 104.21 3ikm s SER 275 Ca 0.38 -0.31 0.03 0.00 0.48 0.00 0.00 55.95 56.54 3ikm s SER 275 Cb -0.03 0.15 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 3ikm s SER 275 CO 0.25 -0.30 0.11 -0.94 0.98 0.00 0.00 173.24 173.33 3ikm s SER 276 N -1.28 2.27 -0.26 7.02 1.04 -0.73 -4.95 113.70 116.81 3ikm s SER 276 Ca -0.14 -1.53 0.23 0.00 0.48 0.00 0.00 55.95 54.99 3ikm s SER 276 Cb -0.08 0.26 0.51 0.00 0.10 0.00 0.00 66.02 66.81 3ikm s SER 276 CO 0.00 -0.80 1.10 0.47 0.98 0.00 0.00 173.24 175.00 3ikm n ASP 277 N -0.95 1.57 -0.25 7.02 9.92 -1.26 -2.30 116.55 130.31 3ikm n ASP 277 Ca -0.03 -2.06 0.04 0.00 -0.53 0.00 0.00 54.79 52.21 3ikm n ASP 277 Cb 0.66 -0.48 0.13 0.00 -0.64 0.00 0.00 41.12 40.79 3ikm n ASP 277 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3ikm s GLN 279 N -6.15 2.05 0.07 0.00 -1.52 -1.26 -5.00 119.66 107.85 3ikm s GLN 279 Ca -0.14 -1.69 0.00 0.00 -1.95 0.00 0.00 55.36 51.58 3ikm s GLN 279 Cb 0.22 -1.94 0.00 0.00 -0.22 0.00 0.00 33.01 31.06 3ikm s GLN 279 CO 0.75 0.21 0.00 -3.47 -0.25 0.00 0.00 175.29 172.53 3ikm n ASP 280 N -0.88 -3.68 -0.08 5.90 4.64 -1.26 -4.64 116.55 116.55 3ikm n ASP 280 Ca -0.05 0.32 0.04 0.00 -1.38 0.00 0.00 54.79 53.72 3ikm n ASP 280 Cb 0.61 -1.15 0.20 0.00 -1.04 0.00 0.00 41.12 39.74 3ikm n ASP 280 CO 0.00 0.00 0.00 -1.84 -0.82 0.00 0.00 177.20 174.54 3ikm n GLU 281 N 0.08 1.10 -3.66 -0.67 0.00 -1.26 -4.22 120.64 112.01 3ikm n GLU 281 Ca 0.00 -0.15 -0.15 0.00 0.00 0.00 0.00 57.16 56.86 3ikm n GLU 281 Cb 0.00 -1.13 -0.08 0.00 0.00 0.00 0.00 31.44 30.23 3ikm n GLU 281 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.13 175.13 3ikm s GLU 282 N -1.95 0.79 0.00 3.44 2.56 -1.26 -4.84 118.70 117.44 3ikm s GLU 282 Ca 0.12 0.25 0.00 0.00 0.00 0.00 0.00 54.97 55.34 3ikm s GLU 282 Cb 0.06 0.37 0.00 0.00 2.00 0.00 0.00 34.13 36.56 3ikm s GLU 282 CO 0.09 -0.20 0.00 0.41 -0.56 0.00 0.00 175.26 175.00 3ikm n GLY 283 N 1.62 2.64 7.00 -1.50 0.00 -1.26 -4.84 105.19 108.84 3ikm n GLY 283 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3ikm n GLY 283 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ikm n ARG 284 N -1.92 0.00 -1.52 1.61 1.74 -1.26 -4.59 116.66 110.72 3ikm n ARG 284 Ca 0.00 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.78 3ikm n ARG 284 Cb 0.00 0.00 0.09 0.00 -1.02 0.00 0.00 32.46 31.53 3ikm n ARG 284 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3ikm s LYS 285 N 0.00 2.06 0.00 5.56 1.02 -1.26 -4.62 119.74 122.50 3ikm s LYS 285 Ca 0.00 0.68 0.00 0.00 0.02 0.00 0.00 55.97 56.67 3ikm s LYS 285 Cb 0.00 -1.91 0.00 0.00 -0.52 0.00 0.00 37.83 35.40 3ikm s LYS 285 CO 0.00 -1.65 0.00 0.41 -0.92 0.00 0.00 175.35 173.19 3ikm n GLY 286 N -1.99 2.66 3.91 -3.33 0.00 -1.25 -1.78 105.19 103.41 3ikm n GLY 286 Ca 0.07 -0.03 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 3ikm n GLY 286 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ikm s ASN 287 N 0.00 6.39 0.19 1.61 4.22 -1.25 -4.56 114.94 121.55 3ikm s ASN 287 Ca 0.00 0.68 -0.11 0.00 -2.14 0.00 0.00 52.86 51.29 3ikm s ASN 287 Cb 0.00 -2.13 -0.07 0.00 1.28 0.00 0.00 41.25 40.33 3ikm s ASN 287 CO 0.00 -0.26 0.54 -0.54 -2.04 0.00 0.00 177.10 174.80 3ikm s LYS 288 N -3.86 3.85 0.21 3.55 1.02 -0.97 -3.84 119.74 119.71 3ikm s LYS 288 Ca 0.43 0.33 0.07 0.00 0.02 0.00 0.00 55.97 56.83 3ikm s LYS 288 Cb -0.10 -2.76 -0.04 0.00 -0.52 0.00 0.00 37.83 34.41 3ikm s LYS 288 CO 0.33 0.39 0.08 -0.51 -0.92 0.00 0.00 175.35 174.71 3ikm s LEU 289 N -2.49 3.51 0.24 3.17 1.43 -0.68 -1.77 118.68 122.10 3ikm s LEU 289 Ca 0.43 -0.36 -0.17 0.00 -1.03 0.00 0.00 54.13 53.01 3ikm s LEU 289 Cb -0.13 -2.10 0.01 0.00 0.03 0.00 0.00 46.19 44.01 3ikm s LEU 289 CO 0.20 0.04 0.56 -0.31 0.23 0.00 0.00 176.35 177.07 3ikm s TYR 290 N -1.95 0.05 0.12 0.29 2.02 -1.16 -2.99 117.35 113.73 3ikm s TYR 290 Ca 0.30 -0.44 0.08 0.00 -0.37 0.00 0.00 57.07 56.65 3ikm s TYR 290 Cb -0.08 0.40 -0.04 0.00 -0.40 0.00 0.00 41.96 41.84 3ikm s TYR 290 CO 0.21 -1.04 -0.19 -0.47 -1.57 0.00 0.00 175.55 172.49 3ikm s TYR 291 N -3.94 1.72 -1.16 2.71 5.04 -0.77 -3.51 117.35 117.44 3ikm s TYR 291 Ca 0.15 -0.44 -0.12 0.00 -2.44 0.00 0.00 57.07 54.22 3ikm s TYR 291 Cb -0.02 -0.92 0.22 0.00 0.35 0.00 0.00 41.96 41.59 3ikm s TYR 291 CO 0.05 0.22 1.28 -0.80 -1.34 0.00 0.00 175.55 174.95 3ikm s ASN 292 N -2.11 7.19 1.17 4.32 0.01 -0.94 -2.19 114.94 122.38 3ikm s ASN 292 Ca 0.08 -3.27 -0.16 0.00 -0.71 0.00 0.00 52.86 48.81 3ikm s ASN 292 Cb -0.09 -2.31 0.27 0.00 0.41 0.00 0.00 41.25 39.53 3ikm s ASN 292 CO 0.05 -0.53 1.05 -0.36 -1.51 0.00 0.00 177.10 175.79 3ikm s PHE 293 N 0.26 1.12 -1.72 2.20 0.08 -0.15 -4.81 117.98 114.96 3ikm s PHE 293 Ca 0.37 0.86 0.02 0.00 0.12 0.00 0.00 56.93 58.30 3ikm s PHE 293 Cb -0.06 -3.19 0.10 0.00 -0.57 0.00 0.00 43.02 39.30 3ikm s PHE 293 CO -0.04 -3.76 0.73 -2.30 -0.10 0.00 0.00 175.22 169.75 3ikm n PRO 294 N -4.78 0.04 -2.53 0.24 -0.02 -1.26 -2.22 135.00 124.47 3ikm n PRO 294 Ca 0.07 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 3ikm n PRO 294 Cb 0.57 -1.50 0.05 0.00 -0.02 0.00 0.00 33.50 32.60 3ikm n PRO 294 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 3ikm n TRP 295 N -1.14 0.75 0.00 6.00 2.14 -1.26 -4.98 117.44 118.94 3ikm n TRP 295 Ca 0.01 -1.76 0.00 0.00 2.07 0.00 0.00 57.50 57.82 3ikm n TRP 295 Cb 0.01 -0.07 0.00 0.00 -0.81 0.00 0.00 31.31 30.44 3ikm n TRP 295 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 3ikm n GLY 296 N -0.44 -2.22 3.81 -1.67 0.00 -0.94 -5.06 105.19 98.67 3ikm n GLY 296 Ca 0.04 -2.19 -0.31 0.00 0.00 0.00 0.00 46.02 43.57 3ikm n GLY 296 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ikm s LYS 297 N -0.80 2.82 -0.14 1.61 1.02 -1.26 -0.97 119.74 122.03 3ikm s LYS 297 Ca 0.00 0.97 -0.07 0.00 0.02 0.00 0.00 55.97 56.90 3ikm s LYS 297 Cb 0.00 -1.98 0.06 0.00 -0.52 0.00 0.00 37.83 35.39 3ikm s LYS 297 CO 0.00 -1.19 0.32 -1.21 -0.92 0.00 0.00 175.35 172.35 3ikm s GLU 298 N -5.03 0.26 0.22 1.68 0.41 -0.93 -4.88 118.70 110.44 3ikm s GLU 298 Ca 0.59 0.71 0.05 0.00 -0.41 0.00 0.00 54.97 55.91 3ikm s GLU 298 Cb -0.14 -0.02 0.29 0.00 -1.78 0.00 0.00 34.13 32.48 3ikm s GLU 298 CO 0.55 -0.20 0.95 1.28 -0.49 0.00 0.00 175.26 177.36 3ikm n LEU 299 N 4.60 0.14 0.00 1.80 4.77 -1.25 -1.84 117.00 125.21 3ikm n LEU 299 Ca -0.19 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 3ikm n LEU 299 Cb 0.53 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3ikm n LEU 299 CO 0.08 -0.40 0.00 -0.38 -1.33 0.00 0.00 177.39 175.36 3ikm n ILE 300 N -1.69 0.00 -1.22 -0.08 5.41 -1.16 -3.95 119.36 116.67 3ikm n ILE 300 Ca -0.00 0.00 -0.29 0.00 1.00 0.00 0.00 62.75 63.46 3ikm n ILE 300 Cb 0.44 0.00 0.17 0.00 -0.71 0.00 0.00 39.64 39.53 3ikm n ILE 300 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 3ikm s GLU 301 N 0.00 0.64 0.00 0.38 2.02 -1.26 -4.52 118.70 115.96 3ikm s GLU 301 Ca 0.00 0.54 0.00 0.00 0.02 0.00 0.00 54.97 55.53 3ikm s GLU 301 Cb 0.00 -1.76 0.00 0.00 0.10 0.00 0.00 34.13 32.47 3ikm s GLU 301 CO 0.00 -2.59 0.00 0.25 0.02 0.00 0.00 175.26 172.94 3ikm n THR 302 N -4.08 0.00 -2.43 3.63 -2.24 -1.26 -1.69 114.28 106.21 3ikm n THR 302 Ca 0.06 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.77 3ikm n THR 302 Cb 0.57 -0.78 0.01 0.00 -2.10 0.00 0.00 70.33 68.03 3ikm n THR 302 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3ikm n LEU 303 N -2.52 -1.78 -4.83 3.22 4.32 -1.25 -3.48 117.00 110.68 3ikm n LEU 303 Ca 0.00 -0.07 -0.31 0.00 -0.02 0.00 0.00 56.01 55.60 3ikm n LEU 303 Cb 0.29 -1.25 0.02 0.00 -1.62 0.00 0.00 43.42 40.86 3ikm n LEU 303 CO 0.00 0.05 0.71 0.26 -1.22 0.00 0.00 177.39 177.19 3ikm s TRP 304 N -2.65 3.27 -0.54 -1.77 0.52 -1.26 -3.96 118.94 112.55 3ikm s TRP 304 Ca 0.08 1.41 0.02 0.00 0.02 0.00 0.00 56.10 57.63 3ikm s TRP 304 Cb -0.03 -2.85 0.14 0.00 -1.15 0.00 0.00 33.47 29.57 3ikm s TRP 304 CO 0.10 -0.96 0.30 1.21 0.02 0.00 0.00 176.95 177.61 3ikm s ASN 305 N -3.62 4.60 -0.61 2.95 2.47 -0.73 -1.55 114.94 118.45 3ikm s ASN 305 Ca 0.58 -2.92 0.02 0.00 0.42 0.00 0.00 52.86 50.97 3ikm s ASN 305 Cb -0.13 -1.70 0.39 0.00 -1.45 0.00 0.00 41.25 38.36 3ikm s ASN 305 CO 0.48 -0.28 1.44 0.00 -3.72 0.00 0.00 177.10 175.03 3ikm n LEU 306 N 3.29 5.76 -4.44 3.21 -0.00 -1.26 -4.55 117.00 119.01 3ikm n LEU 306 Ca 0.06 -5.12 -0.61 0.00 -0.00 0.00 0.00 56.01 50.34 3ikm n LEU 306 Cb 0.34 -0.70 -0.11 0.00 -0.00 0.00 0.00 43.42 42.96 3ikm n LEU 306 CO 0.33 2.07 1.55 0.61 -0.00 0.00 0.00 177.39 181.95 3ikm n GLY 307 N -0.48 0.08 3.76 1.47 0.00 -1.26 -3.53 105.19 105.23 3ikm n GLY 307 Ca 0.44 1.06 -0.27 0.00 0.00 0.00 0.00 46.02 47.25 3ikm n GLY 307 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ikm n ASP 308 N 6.60 -4.91 0.00 1.61 10.43 -1.21 -4.72 116.55 124.34 3ikm n ASP 308 Ca 0.45 -0.85 0.00 0.00 2.57 0.00 0.00 54.79 56.96 3ikm n ASP 308 Cb -0.01 -1.62 0.00 0.00 1.84 0.00 0.00 41.12 41.33 3ikm n ASP 308 CO 0.00 0.00 0.00 1.57 -1.07 0.00 0.00 177.20 177.70 3ikm n HIS 309 N -2.25 0.00 0.02 1.24 -0.00 -1.23 -4.83 115.22 108.16 3ikm n HIS 309 Ca -0.29 0.00 -0.00 0.00 0.46 0.00 0.00 57.72 57.89 3ikm n HIS 309 Cb 0.70 0.00 -0.10 0.00 -0.12 0.00 0.00 29.99 30.47 3ikm n HIS 309 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 3ikm n GLU 310 N -0.40 0.63 -0.12 1.57 4.71 -1.26 -3.46 120.64 122.31 3ikm n GLU 310 Ca 0.00 0.18 -0.10 0.00 -0.01 0.00 0.00 57.16 57.23 3ikm n GLU 310 Cb 0.03 -1.76 0.03 0.00 -1.01 0.00 0.00 31.44 28.73 3ikm n GLU 310 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 3ikm h LEU 311 N 0.00 0.91 -1.44 -4.62 -0.00 -1.95 0.48 115.31 108.69 3ikm h LEU 311 Ca -0.19 -0.36 -0.01 0.00 -0.00 0.00 0.00 57.88 57.32 3ikm h LEU 311 Cb 1.61 -0.25 -0.02 0.00 -0.00 0.00 0.00 40.66 42.00 3ikm h LEU 311 CO 0.04 1.12 0.21 -0.07 -0.00 0.00 0.00 178.44 179.74 3ikm h LEU 312 N 0.75 0.52 0.32 1.67 3.38 -1.85 0.94 115.31 121.03 3ikm h LEU 312 Ca 0.09 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3ikm h LEU 312 Cb 0.82 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3ikm h LEU 312 CO 0.07 0.44 -0.15 -0.74 0.09 0.00 0.00 178.44 178.15 3ikm h HIS 313 N 0.59 -0.40 0.75 1.13 2.76 -1.21 -3.29 115.15 115.48 3ikm h HIS 313 Ca 0.15 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.27 3ikm h HIS 313 Cb 0.06 0.13 0.01 0.00 1.55 0.00 0.00 27.41 29.16 3ikm h HIS 313 CO 0.00 -0.15 -0.36 0.52 -1.30 0.00 0.00 177.93 176.65 3ikm h MET 314 N -0.59 -0.97 -3.17 5.26 2.86 0.15 -3.39 114.93 115.08 3ikm h MET 314 Ca -0.04 0.07 -0.69 0.00 -2.06 0.00 0.00 59.70 56.97 3ikm h MET 314 Cb 0.43 0.22 -0.37 0.00 0.06 0.00 0.00 31.60 31.94 3ikm h MET 314 CO 0.07 -0.63 -0.16 0.66 1.06 0.00 0.00 176.91 177.91 3ikm n TYR 315 N -5.48 3.95 -1.10 -0.22 4.01 0.31 -5.08 117.16 113.54 3ikm n TYR 315 Ca -0.14 -4.10 -0.36 0.00 -0.16 0.00 0.00 57.90 53.14 3ikm n TYR 315 Cb 0.41 -1.02 0.06 0.00 -0.31 0.00 0.00 39.34 38.48 3ikm n TYR 315 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 3ikm n PRO 316 N 2.08 0.06 -3.04 -0.72 -0.02 -1.24 -4.74 135.00 127.38 3ikm n PRO 316 Ca 0.22 0.04 -0.09 0.00 -2.02 0.00 0.00 63.50 61.65 3ikm n PRO 316 Cb 0.37 -1.44 -0.03 0.00 -0.02 0.00 0.00 33.50 32.37 3ikm n PRO 316 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ikm n GLY 317 N 2.30 2.93 0.29 -1.23 0.00 -1.26 -4.53 105.19 103.68 3ikm n GLY 317 Ca 0.06 -1.63 0.11 0.00 0.00 0.00 0.00 46.02 44.56 3ikm n GLY 317 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3ikm n ASN 318 N -2.03 0.87 0.00 1.61 5.15 -1.26 -4.22 115.26 115.38 3ikm n ASN 318 Ca 0.02 -1.52 0.00 0.00 -0.60 0.00 0.00 54.58 52.48 3ikm n ASN 318 Cb 0.33 -0.05 0.00 0.00 -0.53 0.00 0.00 39.78 39.53 3ikm n ASN 318 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 3ikm n VAL 319 N -0.23 0.00 -0.07 3.44 0.31 -1.26 -5.11 118.33 115.41 3ikm n VAL 319 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.49 3ikm n VAL 319 Cb 0.21 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.14 3ikm n VAL 319 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3ikm n SER 320 N 0.00 -0.02 0.00 4.52 7.64 -1.26 -5.05 113.62 119.44 3ikm n SER 320 Ca 0.00 -0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.81 3ikm n SER 320 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 3ikm n SER 320 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3ikm n LYS 321 N -0.09 0.00 -3.51 1.43 5.02 -1.26 -4.65 118.16 115.09 3ikm n LYS 321 Ca 0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.93 3ikm n LYS 321 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 34.95 3ikm n LYS 321 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 3ikm s LEU 322 N 0.00 4.38 -0.16 -0.35 -0.00 -1.26 -4.99 118.68 116.30 3ikm s LEU 322 Ca 0.00 0.90 -0.17 0.00 -0.00 0.00 0.00 54.13 54.85 3ikm s LEU 322 Cb 0.00 -2.92 -0.14 0.00 -0.00 0.00 0.00 46.19 43.13 3ikm s LEU 322 CO 0.00 0.20 0.23 0.45 -0.00 0.00 0.00 176.35 177.23 3ikm h HIS 323 N 3.97 0.00 0.00 3.48 3.86 -1.83 -3.48 115.15 121.15 3ikm h HIS 323 Ca -0.50 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.71 3ikm h HIS 323 Cb 1.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.67 3ikm h HIS 323 CO 0.67 0.80 0.00 0.41 0.86 0.00 0.00 177.93 180.68 3ikm n GLY 324 N 1.57 3.76 3.85 2.45 0.00 -0.59 -3.40 105.19 112.84 3ikm n GLY 324 Ca -0.16 -1.59 -0.33 0.00 0.00 0.00 0.00 46.02 43.94 3ikm n GLY 324 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3ikm s ARG 325 N -4.07 4.01 -0.23 1.61 1.70 -1.26 -1.35 118.95 119.36 3ikm s ARG 325 Ca 0.00 0.62 0.04 0.00 -0.47 0.00 0.00 55.73 55.91 3ikm s ARG 325 Cb 0.00 -2.58 -0.17 0.00 -0.57 0.00 0.00 34.95 31.63 3ikm s ARG 325 CO 0.00 0.25 -0.18 -0.40 -1.08 0.00 0.00 175.30 173.89 3ikm n ASP 326 N -0.05 1.91 0.00 -2.89 3.85 -1.25 -4.72 116.55 113.40 3ikm n ASP 326 Ca 0.01 -0.11 0.00 0.00 -0.71 0.00 0.00 54.79 53.98 3ikm n ASP 326 Cb 0.53 -0.21 0.00 0.00 -1.35 0.00 0.00 41.12 40.09 3ikm n ASP 326 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3ikm n GLY 327 N 2.29 0.30 0.02 6.12 0.00 -1.26 -4.90 105.19 107.75 3ikm n GLY 327 Ca -0.41 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.09 3ikm n GLY 327 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3ikm n ARG 328 N 0.00 0.00 -1.72 1.61 1.85 -1.26 -5.07 116.66 112.06 3ikm n ARG 328 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 3ikm n ARG 328 Cb 0.00 -0.02 0.00 0.00 -1.05 0.00 0.00 32.46 31.39 3ikm n ARG 328 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 3ikm n LYS 329 N -2.01 0.28 -3.80 2.89 4.76 -1.26 -5.18 118.16 113.84 3ikm n LYS 329 Ca 0.00 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.31 3ikm n LYS 329 Cb 0.00 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.04 3ikm n LYS 329 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3ikm s ASN 330 N -0.72 -0.02 0.04 4.39 2.20 -1.26 -3.85 114.94 115.72 3ikm s ASN 330 Ca 0.00 0.11 -0.10 0.00 -0.94 0.00 0.00 52.86 51.93 3ikm s ASN 330 Cb 0.00 0.05 0.01 0.00 -2.00 0.00 0.00 41.25 39.31 3ikm s ASN 330 CO 0.00 -0.09 0.22 -0.69 -2.94 0.00 0.00 177.10 173.60 3ikm s VAL 331 N 0.65 0.10 -0.31 3.54 1.01 -0.46 -4.96 120.40 119.98 3ikm s VAL 331 Ca -0.05 -0.85 -0.16 0.00 0.00 0.00 0.00 61.98 60.92 3ikm s VAL 331 Cb -0.07 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.37 3ikm s VAL 331 CO -0.02 -0.47 0.42 -0.69 0.00 0.00 0.00 175.10 174.33 3ikm s VAL 332 N -2.56 5.12 0.46 2.92 1.01 -1.25 -1.54 120.40 124.57 3ikm s VAL 332 Ca -0.05 0.36 -0.21 0.00 0.00 0.00 0.00 61.98 62.08 3ikm s VAL 332 Cb -0.01 -3.82 -0.11 0.00 0.00 0.00 0.00 36.38 32.44 3ikm s VAL 332 CO -0.04 -0.03 0.61 -0.81 0.00 0.00 0.00 175.10 174.84 3ikm n PRO 333 N 5.47 0.67 -1.44 2.72 -0.04 -1.22 -4.78 135.00 136.38 3ikm n PRO 333 Ca -0.07 0.25 -0.08 0.00 -0.04 0.00 0.00 63.50 63.55 3ikm n PRO 333 Cb 0.50 -1.64 0.04 0.00 -0.04 0.00 0.00 33.50 32.35 3ikm n PRO 333 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ikm s VAL 335 N -0.82 4.45 -0.09 0.00 0.11 -1.23 -2.43 120.40 120.39 3ikm s VAL 335 Ca 0.24 1.38 -0.00 0.00 -2.93 0.00 0.00 61.98 60.67 3ikm s VAL 335 Cb -0.01 -3.61 0.02 0.00 -1.53 0.00 0.00 36.38 31.25 3ikm s VAL 335 CO 0.16 -0.33 -0.06 -0.22 -3.33 0.00 0.00 175.10 171.32 3ikm s LEU 336 N -3.22 1.13 0.02 2.54 0.20 -0.76 -4.49 118.68 114.09 3ikm s LEU 336 Ca 0.61 -0.22 -0.30 0.00 0.69 0.00 0.00 54.13 54.90 3ikm s LEU 336 Cb -0.09 -0.68 -0.06 0.00 -0.43 0.00 0.00 46.19 44.92 3ikm s LEU 336 CO 0.15 -0.10 1.49 -0.55 -0.29 0.00 0.00 176.35 177.05 3ikm s SER 337 N 1.50 6.77 -0.39 3.68 0.15 -0.60 -4.41 113.70 120.39 3ikm s SER 337 Ca -0.00 2.23 -0.04 0.00 0.70 0.00 0.00 55.95 58.84 3ikm s SER 337 Cb -0.13 -2.56 0.09 0.00 -1.71 0.00 0.00 66.02 61.71 3ikm s SER 337 CO -0.04 -0.78 0.18 0.68 1.20 0.00 0.00 173.24 174.48 3ikm s VAL 338 N 2.53 3.41 0.24 4.45 -7.23 -1.24 -4.63 120.40 117.94 3ikm s VAL 338 Ca 0.67 -1.83 -0.29 0.00 -1.81 0.00 0.00 61.98 58.72 3ikm s VAL 338 Cb -0.34 -3.23 -0.15 0.00 0.56 0.00 0.00 36.38 33.22 3ikm s VAL 338 CO 0.28 -0.56 0.92 0.59 -0.31 0.00 0.00 175.10 176.02 3ikm n ASN 339 N 4.66 0.67 0.00 4.85 3.02 -1.26 -4.34 115.26 122.85 3ikm n ASN 339 Ca -0.05 1.16 0.00 0.00 -0.03 0.00 0.00 54.58 55.66 3ikm n ASN 339 Cb 0.42 -1.19 0.00 0.00 -0.61 0.00 0.00 39.78 38.40 3ikm n ASN 339 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ikm n GLY 340 N 1.55 -2.00 0.00 7.41 0.00 -1.26 -4.28 105.19 106.62 3ikm n GLY 340 Ca 0.13 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3ikm n GLY 340 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3ikm n ASP 341 N 0.00 1.33 0.00 1.61 5.68 -1.26 -3.07 116.55 120.84 3ikm n ASP 341 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 3ikm n ASP 341 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 3ikm n ASP 341 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3ikm n LEU 342 N 0.00 0.00 0.13 -2.12 -0.00 -1.26 -4.52 117.00 109.24 3ikm n LEU 342 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 56.01 56.09 3ikm n LEU 342 Cb 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 43.46 3ikm n LEU 342 CO 0.00 0.00 0.29 0.44 -0.00 0.00 0.00 177.39 178.12 3ikm h ASP 343 N 0.00 0.00 -0.69 1.45 5.19 -1.93 -3.37 116.42 117.07 3ikm h ASP 343 Ca 0.00 0.00 0.25 0.00 -0.62 0.00 0.00 57.03 56.66 3ikm h ASP 343 Cb 0.00 0.00 -0.13 0.00 0.18 0.00 0.00 39.33 39.38 3ikm h ASP 343 CO 0.00 0.20 0.22 0.54 -3.12 0.00 0.00 179.24 177.08 3ikm n ARG 344 N -2.95 -0.05 -0.23 3.56 1.74 -1.26 -0.23 116.66 117.25 3ikm n ARG 344 Ca -0.00 0.99 0.03 0.00 -0.77 0.00 0.00 57.85 58.10 3ikm n ARG 344 Cb 0.63 -1.68 0.15 0.00 -1.02 0.00 0.00 32.46 30.54 3ikm n ARG 344 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3ikm h GLY 345 N 0.00 0.94 0.90 -0.13 0.00 -1.89 1.59 103.07 104.48 3ikm h GLY 345 Ca 0.51 -0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.77 3ikm h GLY 345 CO -0.58 -0.14 -0.13 1.98 0.00 0.00 0.00 176.54 177.67 3ikm h MET 346 N 0.31 -0.36 -1.17 4.80 1.85 -0.90 -2.22 114.93 117.23 3ikm h MET 346 Ca 0.37 0.02 0.34 0.00 -0.61 0.00 0.00 59.70 59.82 3ikm h MET 346 Cb 0.58 0.08 -0.05 0.00 0.43 0.00 0.00 31.60 32.64 3ikm h MET 346 CO -0.44 -0.17 0.96 -0.07 -0.40 0.00 0.00 176.91 176.80 3ikm h LEU 347 N -0.48 0.00 0.00 3.39 4.07 0.21 0.71 115.31 123.22 3ikm h LEU 347 Ca -0.04 0.00 -0.27 0.00 0.08 0.00 0.00 57.88 57.65 3ikm h LEU 347 Cb 0.36 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.05 3ikm h LEU 347 CO 0.06 0.00 -1.58 0.00 -1.08 0.00 0.00 178.44 175.85 3ikm h ALA 348 N 1.17 0.70 0.78 1.53 0.00 0.20 -3.28 119.26 120.35 3ikm h ALA 348 Ca 0.55 -1.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.07 3ikm h ALA 348 Cb 2.48 0.37 0.01 0.00 0.00 0.00 0.00 17.79 20.65 3ikm h ALA 348 CO -0.01 1.52 -0.37 1.88 0.00 0.00 0.00 179.25 182.27 3ikm h TYR 349 N 0.00 -0.97 -0.65 0.00 0.05 0.10 1.60 116.97 117.11 3ikm h TYR 349 Ca -0.23 -0.02 0.19 0.00 0.05 0.00 0.00 58.73 58.71 3ikm h TYR 349 Cb 1.96 0.32 -0.03 0.00 1.01 0.00 0.00 36.73 40.00 3ikm h TYR 349 CO 0.00 -0.59 0.53 1.37 -1.05 0.00 0.00 178.16 178.43 3ikm h LEU 350 N -1.21 0.00 0.00 3.88 8.10 -1.69 0.31 115.31 124.70 3ikm h LEU 350 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.88 3ikm h LEU 350 Cb 0.81 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.03 3ikm h LEU 350 CO 0.17 0.00 0.00 -1.22 -4.11 0.00 0.00 178.44 173.28 3ikm n TYR 351 N -4.05 0.00 0.00 0.17 4.01 -0.26 -2.52 117.16 114.51 3ikm n TYR 351 Ca 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.87 3ikm n TYR 351 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.81 3ikm n TYR 351 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3ikm n ASP 352 N 0.00 0.00 0.00 7.72 -0.08 0.53 0.48 116.55 125.20 3ikm n ASP 352 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 3ikm n ASP 352 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 3ikm n ASP 352 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 3ikm n SER 353 N -0.67 0.00 0.11 1.67 3.41 0.93 -2.06 113.62 117.01 3ikm n SER 353 Ca 0.00 0.08 0.12 0.00 -0.26 0.00 0.00 58.87 58.81 3ikm n SER 353 Cb 0.00 0.00 0.19 0.00 -0.26 0.00 0.00 64.21 64.14 3ikm n SER 353 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3ikm h PHE 354 N 0.00 0.00 -0.69 7.33 3.57 -0.58 -3.23 116.94 123.34 3ikm h PHE 354 Ca 0.00 0.00 0.16 0.00 3.53 0.00 0.00 57.97 61.66 3ikm h PHE 354 Cb 0.00 0.00 -0.13 0.00 2.79 0.00 0.00 35.95 38.61 3ikm h PHE 354 CO 0.00 0.00 -0.08 0.94 -2.23 0.00 0.00 178.31 176.94 3ikm n GLN 355 N -2.45 -0.06 -1.09 1.11 0.00 1.73 -2.83 117.38 113.79 3ikm n GLN 355 Ca 0.03 1.05 -0.02 0.00 -0.00 0.00 0.00 57.00 58.06 3ikm n GLN 355 Cb 0.48 -1.62 -0.02 0.00 0.00 0.00 0.00 30.24 29.08 3ikm n GLN 355 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3ikm n LEU 356 N -5.02 -1.46 -4.88 1.69 4.77 -0.87 -4.69 117.00 106.54 3ikm n LEU 356 Ca 0.14 -1.57 -0.23 0.00 -0.03 0.00 0.00 56.01 54.32 3ikm n LEU 356 Cb 0.44 -0.77 -0.02 0.00 -2.33 0.00 0.00 43.42 40.73 3ikm n LEU 356 CO -0.07 -1.93 0.02 -0.89 -1.33 0.00 0.00 177.39 173.19 3ikm s THR 357 N 2.81 2.30 0.00 -5.08 2.01 -1.13 -4.24 115.64 112.32 3ikm s THR 357 Ca 0.13 -1.41 0.00 0.00 0.31 0.00 0.00 61.69 60.72 3ikm s THR 357 Cb -0.01 -2.71 0.00 0.00 0.01 0.00 0.00 72.50 69.79 3ikm s THR 357 CO 0.03 0.00 0.00 -1.84 -0.69 0.00 0.00 174.62 172.12 3ikm n GLU 358 N -1.61 0.00 -1.54 4.92 0.28 -1.26 -4.82 120.64 116.61 3ikm n GLU 358 Ca 0.02 0.00 -0.48 0.00 -0.16 0.00 0.00 57.16 56.54 3ikm n GLU 358 Cb 0.63 -0.35 -0.06 0.00 1.43 0.00 0.00 31.44 33.09 3ikm n GLU 358 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 3ikm n ASN 359 N 1.03 2.68 -1.17 -1.84 4.13 -1.26 0.24 115.26 119.06 3ikm n ASN 359 Ca 0.00 0.47 -0.10 0.00 1.68 0.00 0.00 54.58 56.63 3ikm n ASN 359 Cb 0.00 -1.36 -0.00 0.00 -1.54 0.00 0.00 39.78 36.88 3ikm n ASN 359 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3ikm n SER 360 N 9.69 -3.39 0.03 6.41 7.64 -1.26 -4.86 113.62 127.89 3ikm n SER 360 Ca 0.34 -0.02 0.11 0.00 1.01 0.00 0.00 58.87 60.32 3ikm n SER 360 Cb 0.30 -2.63 -0.04 0.00 -1.01 0.00 0.00 64.21 60.83 3ikm n SER 360 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 3ikm n PHE 361 N -4.00 0.35 -2.89 1.43 7.35 0.65 -4.54 117.46 115.81 3ikm n PHE 361 Ca -0.12 0.10 -0.12 0.00 -0.76 0.00 0.00 57.45 56.55 3ikm n PHE 361 Cb 0.59 -0.56 0.04 0.00 0.35 0.00 0.00 39.48 39.90 3ikm n PHE 361 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 3ikm n THR 362 N -2.20 -0.08 0.00 -2.13 -2.24 -1.25 -5.03 114.28 101.36 3ikm n THR 362 Ca -0.00 -2.56 0.00 0.00 -2.27 0.00 0.00 64.05 59.22 3ikm n THR 362 Cb 0.50 0.82 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 3ikm n THR 362 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3ikm n ARG 363 N 0.46 0.00 -3.83 -0.78 5.12 -1.26 -5.16 116.66 111.21 3ikm n ARG 363 Ca 0.13 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.81 3ikm n ARG 363 Cb 0.68 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.95 3ikm n ARG 363 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 3ikm s LYS 364 N 0.00 2.34 0.70 5.56 0.00 -1.26 -5.10 119.74 121.98 3ikm s LYS 364 Ca 0.00 -1.83 -0.17 0.00 0.00 0.00 0.00 55.97 53.97 3ikm s LYS 364 Cb 0.00 -2.17 -0.08 0.00 0.00 0.00 0.00 37.83 35.58 3ikm s LYS 364 CO 0.00 -0.38 0.20 1.17 0.00 0.00 0.00 175.35 176.34 3ikm n LYS 365 N -1.59 0.19 -2.83 1.78 3.00 -1.26 -4.83 118.16 112.61 3ikm n LYS 365 Ca 0.00 0.09 -0.43 0.00 -0.00 0.00 0.00 58.31 57.97 3ikm n LYS 365 Cb 0.63 -1.52 -0.03 0.00 0.00 0.00 0.00 35.03 34.11 3ikm n LYS 365 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 3ikm s ASN 366 N -1.29 6.51 0.00 3.14 0.01 -1.26 -4.35 114.94 117.69 3ikm s ASN 366 Ca 0.60 -1.69 0.15 0.00 -0.71 0.00 0.00 52.86 51.21 3ikm s ASN 366 Cb -0.36 -2.44 0.25 0.00 0.41 0.00 0.00 41.25 39.10 3ikm s ASN 366 CO 0.63 -1.24 1.08 0.00 -1.51 0.00 0.00 177.10 176.06 3ikm n LEU 367 N 7.29 0.53 -3.39 0.60 -0.00 -1.26 -5.00 117.00 115.76 3ikm n LEU 367 Ca 0.20 -1.62 -0.33 0.00 -0.00 0.00 0.00 56.01 54.26 3ikm n LEU 367 Cb 0.49 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.84 3ikm n LEU 367 CO 0.56 0.47 1.68 1.57 -0.00 0.00 0.00 177.39 181.68 3ikm n HIS 368 N 0.29 0.70 0.08 1.47 -0.00 -1.26 -4.48 115.22 112.01 3ikm n HIS 368 Ca 0.02 -1.06 -0.08 0.00 0.46 0.00 0.00 57.72 57.06 3ikm n HIS 368 Cb 0.95 -1.11 -0.08 0.00 -0.12 0.00 0.00 29.99 29.63 3ikm n HIS 368 CO 0.00 0.00 0.00 0.07 0.46 0.00 0.00 176.34 176.87 3ikm h ARG 369 N 8.54 0.06 0.00 1.57 -0.00 -1.98 -3.49 114.38 119.07 3ikm h ARG 369 Ca 0.29 -0.08 0.31 0.00 -0.00 0.00 0.00 59.98 60.49 3ikm h ARG 369 Cb 0.48 0.03 -0.08 0.00 -0.00 0.00 0.00 29.97 30.41 3ikm h ARG 369 CO 1.74 0.99 -0.41 1.63 -0.00 0.00 0.00 179.97 183.92 3ikm n LYS 370 N -3.45 -2.29 -3.46 0.08 5.02 -1.26 -5.00 118.16 107.81 3ikm n LYS 370 Ca -0.02 1.51 -0.12 0.00 -2.02 0.00 0.00 58.31 57.66 3ikm n LYS 370 Cb 0.91 -2.79 -0.03 0.00 -0.02 0.00 0.00 35.03 33.10 3ikm n LYS 370 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3ikm s VAL 371 N -1.81 0.00 0.70 -0.18 0.11 -1.26 -4.70 120.40 113.26 3ikm s VAL 371 Ca 0.00 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.02 3ikm s VAL 371 Cb 0.00 -1.00 0.10 0.00 -1.53 0.00 0.00 36.38 33.95 3ikm s VAL 371 CO 0.00 0.00 0.97 -1.48 -3.33 0.00 0.00 175.10 171.26 3ikm s LEU 372 N -2.40 2.99 -0.17 2.54 0.05 -1.05 -4.55 118.68 116.09 3ikm s LEU 372 Ca -0.00 -0.03 -0.05 0.00 0.05 0.00 0.00 54.13 54.09 3ikm s LEU 372 Cb -0.01 -2.49 0.08 0.00 -2.05 0.00 0.00 46.19 41.72 3ikm s LEU 372 CO -0.08 -1.71 0.34 -0.54 -0.55 0.00 0.00 176.35 173.81 3ikm s LYS 373 N -5.14 0.24 0.05 1.48 1.02 -1.26 -4.66 119.74 111.46 3ikm s LYS 373 Ca 0.63 0.84 0.07 0.00 0.02 0.00 0.00 55.97 57.53 3ikm s LYS 373 Cb -0.08 0.06 -0.03 0.00 -0.52 0.00 0.00 37.83 37.26 3ikm s LYS 373 CO 0.44 -0.31 -0.17 -0.51 -0.92 0.00 0.00 175.35 173.88 3ikm s LEU 374 N 2.51 2.67 0.60 3.17 1.43 -1.26 -4.14 118.68 123.66 3ikm s LEU 374 Ca 0.01 -0.41 -0.19 0.00 -1.03 0.00 0.00 54.13 52.51 3ikm s LEU 374 Cb -0.12 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 3ikm s LEU 374 CO -0.11 0.25 1.05 1.57 0.23 0.00 0.00 176.35 179.34 3ikm n HIS 375 N 1.47 1.13 -0.29 0.29 -0.00 -1.26 -4.51 115.22 112.05 3ikm n HIS 375 Ca -0.16 0.44 -0.04 0.00 -0.00 0.00 0.00 57.72 57.96 3ikm n HIS 375 Cb 0.52 -2.18 0.02 0.00 -0.00 0.00 0.00 29.99 28.35 3ikm n HIS 375 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3ikm h PRO 376 N 0.60 -0.09 -0.64 1.57 0.13 -1.96 0.77 132.00 132.38 3ikm h PRO 376 Ca -0.49 0.01 0.13 0.00 -0.87 0.00 0.00 66.00 64.77 3ikm h PRO 376 Cb 1.35 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.47 3ikm h PRO 376 CO 0.52 -0.06 0.43 0.00 -0.23 0.00 0.00 178.00 178.66 3ikm h LEU 378 N 0.33 -0.36 -7.26 0.00 4.07 0.25 -3.45 115.31 108.89 3ikm h LEU 378 Ca 0.31 0.03 -0.56 0.00 0.08 0.00 0.00 57.88 57.73 3ikm h LEU 378 Cb 0.74 0.11 0.08 0.00 1.08 0.00 0.00 40.66 42.68 3ikm h LEU 378 CO -0.08 -0.19 -0.34 0.00 -1.08 0.00 0.00 178.44 176.74 3ikm n ALA 379 N -2.35 -2.61 -0.08 1.53 0.00 -0.86 -4.74 120.51 111.41 3ikm n ALA 379 Ca -0.04 0.38 -0.13 0.00 0.00 0.00 0.00 53.44 53.65 3ikm n ALA 379 Cb 0.13 -1.32 -0.05 0.00 0.00 0.00 0.00 19.45 18.21 3ikm n ALA 379 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3ikm h PRO 380 N 1.09 0.58 -5.79 0.00 0.13 -1.87 -3.44 132.00 122.70 3ikm h PRO 380 Ca -0.26 -0.30 -0.67 0.00 -0.87 0.00 0.00 66.00 63.91 3ikm h PRO 380 Cb 1.16 0.01 -0.22 0.00 0.13 0.00 0.00 31.00 32.08 3ikm h PRO 380 CO 0.47 0.89 -0.71 0.42 -0.23 0.00 0.00 178.00 178.84 3ikm s ILE 381 N -4.39 3.54 -0.04 -3.56 1.09 -1.26 -4.84 121.20 111.75 3ikm s ILE 381 Ca -0.13 -0.52 -0.06 0.00 -1.10 0.00 0.00 60.65 58.85 3ikm s ILE 381 Cb 0.08 -2.48 -0.29 0.00 -1.06 0.00 0.00 42.46 38.71 3ikm s ILE 381 CO 0.80 0.56 0.70 0.50 -0.10 0.00 0.00 174.94 177.40 3ikm h LYS 382 N 5.90 0.30 -2.50 2.79 3.64 -1.81 -3.35 116.57 121.54 3ikm h LYS 382 Ca -0.39 -0.51 -0.01 0.00 -1.27 0.00 0.00 60.65 58.46 3ikm h LYS 382 Cb 1.18 0.19 -0.15 0.00 -0.41 0.00 0.00 32.23 33.04 3ikm h LYS 382 CO 0.55 1.18 0.25 0.54 -2.27 0.00 0.00 179.45 179.70 3ikm s VAL 383 N -2.59 0.00 -0.36 2.00 0.11 -1.23 -1.61 120.40 116.72 3ikm s VAL 383 Ca -0.13 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 58.86 3ikm s VAL 383 Cb 0.06 -1.00 0.06 0.00 -1.53 0.00 0.00 36.38 33.97 3ikm s VAL 383 CO 0.84 0.00 0.13 0.00 -3.33 0.00 0.00 175.10 172.74 3ikm s ALA 384 N -2.66 3.06 0.58 1.54 0.00 -1.13 -1.84 121.76 121.32 3ikm s ALA 384 Ca -0.03 -1.95 -0.20 0.00 0.00 0.00 0.00 51.96 49.79 3ikm s ALA 384 Cb -0.01 -2.30 -0.04 0.00 0.00 0.00 0.00 23.12 20.78 3ikm s ALA 384 CO -0.04 -1.45 1.27 -0.51 0.00 0.00 0.00 175.76 175.02 3ikm s LEU 385 N 1.34 3.72 0.08 0.00 1.43 -1.26 -3.04 118.68 120.95 3ikm s LEU 385 Ca 0.00 2.55 0.01 0.00 -1.03 0.00 0.00 54.13 55.66 3ikm s LEU 385 Cb -0.21 -4.48 -0.04 0.00 0.03 0.00 0.00 46.19 41.49 3ikm s LEU 385 CO 0.01 -1.64 -0.06 -1.81 0.23 0.00 0.00 176.35 173.08 3ikm s ASP 386 N -1.35 0.99 -0.28 2.29 1.01 0.54 0.50 116.67 120.38 3ikm s ASP 386 Ca 0.76 -0.94 -0.14 0.00 0.71 0.00 0.00 52.55 52.94 3ikm s ASP 386 Cb -0.35 0.10 0.09 0.00 1.01 0.00 0.00 42.92 43.77 3ikm s ASP 386 CO 0.39 -0.45 0.66 0.68 0.21 0.00 0.00 175.17 176.66 3ikm s VAL 387 N -3.33 -0.22 -0.04 -1.27 -7.23 -1.24 -0.15 120.40 106.93 3ikm s VAL 387 Ca 0.08 0.01 -0.11 0.00 -1.81 0.00 0.00 61.98 60.14 3ikm s VAL 387 Cb 0.03 -0.97 0.02 0.00 0.56 0.00 0.00 36.38 36.02 3ikm s VAL 387 CO -0.05 0.00 0.25 -0.83 -0.31 0.00 0.00 175.10 174.17 3ikm s GLY 388 N 1.90 -0.12 0.00 2.32 0.00 1.20 -4.52 107.32 108.10 3ikm s GLY 388 Ca -0.09 0.34 0.00 0.00 0.00 0.00 0.00 44.72 44.97 3ikm s GLY 388 CO -0.19 0.19 0.00 -2.13 0.00 0.00 0.00 173.10 170.96 3ikm n ARG 389 N 1.84 0.00 -4.17 2.90 3.00 -1.26 -2.75 116.66 116.22 3ikm n ARG 389 Ca -0.19 0.00 -0.25 0.00 -0.00 0.00 0.00 57.85 57.41 3ikm n ARG 389 Cb 0.57 0.00 -0.08 0.00 0.00 0.00 0.00 32.46 32.95 3ikm n ARG 389 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 3ikm s GLY 390 N -1.22 2.35 0.24 5.14 0.00 -1.26 -2.15 107.32 110.42 3ikm s GLY 390 Ca 0.00 -2.13 -0.30 0.00 0.00 0.00 0.00 44.72 42.29 3ikm s GLY 390 CO 0.00 -1.93 1.44 -4.14 0.00 0.00 0.00 173.10 168.47 3ikm s PRO 391 N -3.89 4.27 0.17 2.90 0.02 -1.26 -4.87 135.00 132.34 3ikm s PRO 391 Ca 0.41 2.28 0.06 0.00 0.02 0.00 0.00 61.00 63.77 3ikm s PRO 391 Cb 0.04 -3.12 0.53 0.00 0.02 0.00 0.00 34.50 31.97 3ikm s PRO 391 CO 0.22 -0.42 0.77 2.41 -0.33 0.00 0.00 177.00 179.65 3ikm n THR 392 N 2.48 -0.20 -0.04 0.99 -1.04 -0.91 -0.61 114.28 114.94 3ikm n THR 392 Ca 0.07 1.03 -0.12 0.00 -2.04 0.00 0.00 64.05 62.99 3ikm n THR 392 Cb 0.40 -1.59 -0.10 0.00 -1.82 0.00 0.00 70.33 67.22 3ikm n THR 392 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3ikm h LEU 393 N 0.00 -0.03 -1.30 -4.42 3.38 -1.96 -0.90 115.31 110.08 3ikm h LEU 393 Ca 0.36 -0.71 0.32 0.00 0.09 0.00 0.00 57.88 57.94 3ikm h LEU 393 Cb 0.88 0.01 -0.11 0.00 0.09 0.00 0.00 40.66 41.52 3ikm h LEU 393 CO -0.41 0.76 0.70 -0.33 0.09 0.00 0.00 178.44 179.25 3ikm h GLU 394 N -0.88 0.30 0.19 1.13 3.07 -1.17 5.83 114.58 123.05 3ikm h GLU 394 Ca -0.00 -0.02 -0.29 0.00 -0.50 0.00 0.00 59.36 58.55 3ikm h GLU 394 Cb 0.74 -0.07 0.02 0.00 -0.84 0.00 0.00 28.75 28.60 3ikm h GLU 394 CO 0.01 0.20 -1.35 1.25 -1.40 0.00 0.00 179.01 177.71 3ikm h LEU 395 N 0.31 0.64 -1.92 1.33 6.46 -1.55 -2.85 115.31 117.73 3ikm h LEU 395 Ca 0.68 -0.92 0.01 0.00 -0.12 0.00 0.00 57.88 57.53 3ikm h LEU 395 Cb 1.81 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 41.52 3ikm h LEU 395 CO -0.39 1.63 0.08 0.08 -0.62 0.00 0.00 178.44 179.23 3ikm h ARG 396 N -0.06 0.10 -7.38 1.25 -0.00 0.15 -3.17 114.38 105.27 3ikm h ARG 396 Ca -0.25 -0.01 -0.49 0.00 -0.00 0.00 0.00 59.98 59.23 3ikm h ARG 396 Cb 1.96 -0.02 0.12 0.00 -0.00 0.00 0.00 29.97 32.03 3ikm h ARG 396 CO 0.19 0.07 0.32 -1.14 -0.00 0.00 0.00 179.97 179.41 3ikm s GLN 397 N -5.15 2.05 0.00 0.08 0.74 1.84 -1.12 119.66 118.11 3ikm s GLN 397 Ca -0.06 0.76 0.00 0.00 0.05 0.00 0.00 55.36 56.12 3ikm s GLN 397 Cb 0.17 -1.90 0.00 0.00 1.10 0.00 0.00 33.01 32.38 3ikm s GLN 397 CO 0.69 -1.67 0.00 1.33 -0.55 0.00 0.00 175.29 175.08 3ikm n VAL 398 N -3.49 0.00 -0.03 1.34 0.24 -1.25 -3.79 118.33 111.35 3ikm n VAL 398 Ca 0.07 0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 62.18 3ikm n VAL 398 Cb 0.55 0.00 -0.13 0.00 -1.47 0.00 0.00 33.84 32.79 3ikm n VAL 398 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ikm h GLN 400 N -0.63 -0.02 -0.48 0.00 -0.00 -1.22 0.81 115.11 113.58 3ikm h GLN 400 Ca -0.20 0.00 0.09 0.00 -0.00 0.00 0.00 58.65 58.54 3ikm h GLN 400 Cb 1.46 0.01 -0.08 0.00 0.00 0.00 0.00 27.48 28.87 3ikm h GLN 400 CO 0.01 -0.01 0.02 0.78 0.00 0.00 0.00 178.83 179.63 3ikm h GLY 401 N -0.02 0.51 0.71 2.39 0.00 -1.35 -2.95 103.07 102.36 3ikm h GLY 401 Ca 0.32 0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.66 3ikm h GLY 401 CO -0.72 -0.12 -0.34 1.41 0.00 0.00 0.00 176.54 176.77 3ikm h LEU 402 N 0.14 -0.81 -0.02 3.11 4.07 1.03 -3.19 115.31 119.64 3ikm h LEU 402 Ca 0.24 0.03 0.00 0.00 0.08 0.00 0.00 57.88 58.23 3ikm h LEU 402 Cb 0.35 0.21 -0.00 0.00 1.08 0.00 0.00 40.66 42.30 3ikm h LEU 402 CO -0.38 -0.47 -0.01 0.33 -1.08 0.00 0.00 178.44 176.83 3ikm n PHE 403 N -5.16 -0.01 -0.03 1.13 -0.00 0.62 0.58 117.46 114.60 3ikm n PHE 403 Ca -0.12 0.02 -0.06 0.00 -0.00 0.00 0.00 57.45 57.29 3ikm n PHE 403 Cb 0.38 -0.25 -0.04 0.00 -0.00 0.00 0.00 39.48 39.56 3ikm n PHE 403 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 176.76 175.85 3ikm h ASN 404 N 0.00 -0.78 -0.94 -2.13 4.21 -1.64 5.62 115.58 119.92 3ikm h ASN 404 Ca 0.00 0.10 0.17 0.00 1.21 0.00 0.00 56.30 57.78 3ikm h ASN 404 Cb 0.01 0.31 -0.17 0.00 -1.12 0.00 0.00 38.32 37.35 3ikm h ASN 404 CO -0.02 -0.20 -0.29 1.21 -1.29 0.00 0.00 177.43 176.85 3ikm n GLU 405 N -3.83 -0.14 0.09 0.81 0.00 -0.20 0.16 120.64 117.53 3ikm n GLU 405 Ca -0.02 1.45 -0.04 0.00 0.00 0.00 0.00 57.16 58.55 3ikm n GLU 405 Cb 0.16 -2.16 -0.02 0.00 0.00 0.00 0.00 31.44 29.41 3ikm n GLU 405 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 3ikm h LEU 406 N 0.00 -0.21 -0.47 4.31 4.07 0.34 -1.78 115.31 121.57 3ikm h LEU 406 Ca 0.40 0.01 0.05 0.00 0.08 0.00 0.00 57.88 58.41 3ikm h LEU 406 Cb 0.63 0.05 -0.06 0.00 1.08 0.00 0.00 40.66 42.36 3ikm h LEU 406 CO -0.95 -0.13 -0.26 -0.11 -1.08 0.00 0.00 178.44 175.91 3ikm n LEU 407 N -2.73 -0.46 0.01 1.67 0.00 1.80 0.31 117.00 117.59 3ikm n LEU 407 Ca -0.03 0.84 -0.11 0.00 0.00 0.00 0.00 56.01 56.71 3ikm n LEU 407 Cb 0.10 -0.13 -0.07 0.00 0.00 0.00 0.00 43.42 43.32 3ikm n LEU 407 CO 0.07 -0.70 0.50 -0.33 0.00 0.00 0.00 177.39 176.94 3ikm h GLU 408 N 0.00 -0.41 -0.67 1.96 3.07 0.16 -3.09 114.58 115.60 3ikm h GLU 408 Ca 0.09 0.03 0.14 0.00 -0.50 0.00 0.00 59.36 59.12 3ikm h GLU 408 Cb 0.21 0.09 -0.13 0.00 -0.84 0.00 0.00 28.75 28.09 3ikm h GLU 408 CO -0.45 -0.27 -0.16 0.09 -1.40 0.00 0.00 179.01 176.82 3ikm n ASN 409 N -4.54 -0.23 0.00 1.42 3.02 0.15 -4.66 115.26 110.41 3ikm n ASN 409 Ca -0.04 1.15 0.00 0.00 -0.03 0.00 0.00 54.58 55.66 3ikm n ASN 409 Cb 0.26 -0.35 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 3ikm n ASN 409 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ikm n GLY 410 N -1.42 0.90 3.29 7.41 0.00 -1.17 -5.13 105.19 109.08 3ikm n GLY 410 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 3ikm n GLY 410 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3ikm s ILE 411 N -1.04 2.37 0.25 -0.61 2.07 -1.25 -5.11 121.20 117.87 3ikm s ILE 411 Ca 0.00 -0.93 -0.30 0.00 -1.41 0.00 0.00 60.65 58.01 3ikm s ILE 411 Cb 0.00 -1.91 -0.09 0.00 0.13 0.00 0.00 42.46 40.59 3ikm s ILE 411 CO 0.00 0.56 1.04 -0.94 -1.91 0.00 0.00 174.94 173.69 3ikm s SER 412 N 0.05 7.41 0.07 4.50 1.04 -1.26 -4.29 113.70 121.22 3ikm s SER 412 Ca -0.09 2.12 -0.05 0.00 0.48 0.00 0.00 55.95 58.41 3ikm s SER 412 Cb -0.15 -2.62 -0.02 0.00 0.10 0.00 0.00 66.02 63.33 3ikm s SER 412 CO 0.06 -0.04 0.08 -0.69 0.98 0.00 0.00 173.24 173.62 3ikm s VAL 413 N -1.00 0.18 -0.83 5.02 1.01 -1.26 -2.93 120.40 120.59 3ikm s VAL 413 Ca 0.44 -1.48 0.11 0.00 0.00 0.00 0.00 61.98 61.04 3ikm s VAL 413 Cb -0.29 -1.42 0.31 0.00 0.00 0.00 0.00 36.38 34.99 3ikm s VAL 413 CO 0.37 -0.82 1.26 1.87 0.00 0.00 0.00 175.10 177.78 3ikm n TRP 414 N 0.04 0.49 -2.10 5.22 -0.00 -0.76 -5.00 117.44 115.33 3ikm n TRP 414 Ca -0.15 -0.53 0.00 0.00 -0.00 0.00 0.00 57.50 56.82 3ikm n TRP 414 Cb 0.62 -0.05 0.00 0.00 -0.00 0.00 0.00 31.31 31.87 3ikm n TRP 414 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 3ikm n PRO 415 N 0.39 -0.61 -0.70 5.87 -0.01 -1.26 -4.73 135.00 133.96 3ikm n PRO 415 Ca 0.12 0.58 0.08 0.00 -0.01 0.00 0.00 63.50 64.27 3ikm n PRO 415 Cb 0.46 -0.55 0.36 0.00 -0.01 0.00 0.00 33.50 33.76 3ikm n PRO 415 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3ikm n GLY 416 N 2.09 2.71 0.16 -1.23 0.00 0.18 -4.23 105.19 104.87 3ikm n GLY 416 Ca 0.00 -0.84 -0.13 0.00 0.00 0.00 0.00 46.02 45.05 3ikm n GLY 416 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3ikm h TYR 417 N 3.89 0.53 0.62 1.61 0.99 -1.89 -2.10 116.97 120.62 3ikm h TYR 417 Ca 0.00 -0.15 -0.02 0.00 2.00 0.00 0.00 58.73 60.55 3ikm h TYR 417 Cb 1.60 -0.11 -0.01 0.00 1.00 0.00 0.00 36.73 39.21 3ikm h TYR 417 CO 0.86 0.79 -0.44 1.25 -0.00 0.00 0.00 178.16 180.63 3ikm h LEU 418 N 0.12 -1.13 -0.56 3.88 5.85 -1.94 -3.09 115.31 118.44 3ikm h LEU 418 Ca 0.03 0.07 0.23 0.00 0.84 0.00 0.00 57.88 59.06 3ikm h LEU 418 Cb 0.69 0.35 -0.10 0.00 0.37 0.00 0.00 40.66 41.97 3ikm h LEU 418 CO 0.04 -0.65 0.31 1.21 -0.34 0.00 0.00 178.44 179.01 3ikm n GLU 419 N -5.56 -0.03 0.28 1.25 0.00 -0.86 -0.87 120.64 114.85 3ikm n GLU 419 Ca -0.13 0.76 0.12 0.00 0.00 0.00 0.00 57.16 57.91 3ikm n GLU 419 Cb 0.44 -1.37 0.79 0.00 0.00 0.00 0.00 31.44 31.30 3ikm n GLU 419 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.13 178.28 3ikm h THR 420 N 0.00 0.74 0.27 6.31 2.02 -1.31 -3.22 112.91 117.72 3ikm h THR 420 Ca 0.47 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.63 3ikm h THR 420 Cb 1.26 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 68.68 3ikm h THR 420 CO -0.42 0.00 -0.13 0.00 0.37 0.00 0.00 175.52 175.34 3ikm h MET 421 N 0.00 -0.35 -6.78 6.66 -0.00 -1.19 -3.45 114.93 109.81 3ikm h MET 421 Ca -0.00 0.02 -0.50 0.00 -0.00 0.00 0.00 59.70 59.22 3ikm h MET 421 Cb 0.01 0.08 0.01 0.00 -0.00 0.00 0.00 31.60 31.70 3ikm h MET 421 CO 0.00 -0.24 0.45 -1.14 -0.00 0.00 0.00 176.91 175.98 3ikm s GLN 422 N -3.80 4.68 3.11 -0.10 0.74 -1.22 -4.93 119.66 118.14 3ikm s GLN 422 Ca -0.05 1.73 0.00 0.00 0.05 0.00 0.00 55.36 57.09 3ikm s GLN 422 Cb 0.01 -3.21 0.00 0.00 1.10 0.00 0.00 33.01 30.90 3ikm s GLN 422 CO 0.16 0.27 0.00 -1.13 -0.55 0.00 0.00 175.29 174.04 3ikm n SER 423 N 1.34 0.00 -3.70 6.67 3.41 -1.26 -4.93 113.62 115.15 3ikm n SER 423 Ca -0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.47 3ikm n SER 423 Cb 0.45 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.31 3ikm n SER 423 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3ikm s SER 424 N -4.00 -0.52 0.00 4.04 0.15 -1.26 -5.10 113.70 107.01 3ikm s SER 424 Ca 0.00 1.01 -0.00 0.00 0.70 0.00 0.00 55.95 57.66 3ikm s SER 424 Cb 0.00 1.03 -0.00 0.00 -1.71 0.00 0.00 66.02 65.34 3ikm s SER 424 CO 0.00 -0.18 0.01 -0.11 1.20 0.00 0.00 173.24 174.16 3ikm n LEU 425 N 2.81 -0.00 -0.28 3.45 7.94 -1.26 -2.07 117.00 127.58 3ikm n LEU 425 Ca -0.13 0.01 -0.10 0.00 -1.11 0.00 0.00 56.01 54.68 3ikm n LEU 425 Cb 0.57 -0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.45 3ikm n LEU 425 CO 0.10 -0.01 0.53 -0.08 -1.11 0.00 0.00 177.39 176.82 3ikm h GLU 426 N 0.00 -0.17 0.00 1.96 4.57 -2.00 0.45 114.58 119.39 3ikm h GLU 426 Ca 0.00 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3ikm h GLU 426 Cb 0.00 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.63 3ikm h GLU 426 CO -0.00 -0.11 0.00 1.96 -1.18 0.00 0.00 179.01 179.68 3ikm h GLN 427 N -0.17 0.00 0.65 1.92 7.50 -1.85 0.71 115.11 123.86 3ikm h GLN 427 Ca 0.17 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.28 3ikm h GLN 427 Cb 0.53 0.00 0.01 0.00 0.05 0.00 0.00 27.48 28.06 3ikm h GLN 427 CO -0.78 0.00 -0.31 -0.07 -1.50 0.00 0.00 178.83 176.17 3ikm h LEU 428 N 0.00 -0.73 -0.26 1.46 3.38 -0.10 0.11 115.31 119.17 3ikm h LEU 428 Ca 0.00 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.02 3ikm h LEU 428 Cb 0.11 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 3ikm h LEU 428 CO 0.00 -0.40 -0.15 -1.22 0.09 0.00 0.00 178.44 176.76 3ikm n TYR 429 N -5.04 -0.11 -0.28 1.13 0.53 0.13 -1.20 117.16 112.32 3ikm n TYR 429 Ca -0.11 0.32 -0.01 0.00 -1.02 0.00 0.00 57.90 57.08 3ikm n TYR 429 Cb 0.34 -0.49 0.05 0.00 -1.03 0.00 0.00 39.34 38.21 3ikm n TYR 429 CO 0.00 0.00 0.00 0.66 -1.02 0.00 0.00 176.86 176.50 3ikm h SER 430 N 0.00 -1.09 0.24 7.72 4.64 -1.15 0.14 113.55 124.05 3ikm h SER 430 Ca 0.04 0.25 -0.00 0.00 -0.47 0.00 0.00 61.79 61.62 3ikm h SER 430 Cb 0.11 0.60 -0.03 0.00 -0.31 0.00 0.00 62.40 62.77 3ikm h SER 430 CO -0.24 -0.29 -0.40 0.50 -0.87 0.00 0.00 176.83 175.53 3ikm h LYS 431 N -0.07 -0.65 -0.77 4.77 3.11 0.55 0.77 116.57 124.28 3ikm h LYS 431 Ca 0.32 0.04 0.17 0.00 -2.81 0.00 0.00 60.65 58.37 3ikm h LYS 431 Cb 0.58 0.15 -0.14 0.00 -1.00 0.00 0.00 32.23 31.82 3ikm h LYS 431 CO -0.81 -0.44 -0.06 1.88 -2.81 0.00 0.00 179.45 177.20 3ikm h TYR 432 N -0.68 -0.18 -0.43 1.91 0.99 -0.12 2.21 116.97 120.68 3ikm h TYR 432 Ca -0.03 0.06 -0.07 0.00 2.00 0.00 0.00 58.73 60.69 3ikm h TYR 432 Cb 0.63 0.20 -0.02 0.00 1.00 0.00 0.00 36.73 38.55 3ikm h TYR 432 CO -0.32 -0.29 -0.01 -0.44 -0.00 0.00 0.00 178.16 177.11 3ikm h ASP 433 N 0.06 0.74 0.28 3.88 3.32 -0.52 1.80 116.42 125.98 3ikm h ASP 433 Ca 0.41 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3ikm h ASP 433 Cb 0.70 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3ikm h ASP 433 CO -0.73 0.87 0.00 -0.62 -1.72 0.00 0.00 179.24 177.05 3ikm n GLU 434 N -4.40 0.08 -0.05 3.56 1.02 0.28 -2.25 120.64 118.87 3ikm n GLU 434 Ca -0.00 0.25 -0.02 0.00 -0.02 0.00 0.00 57.16 57.37 3ikm n GLU 434 Cb 0.30 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.10 3ikm n GLU 434 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 3ikm n MET 435 N -1.40 1.19 0.00 3.49 1.56 0.68 -4.69 117.12 117.96 3ikm n MET 435 Ca 0.04 -0.06 0.00 0.00 -0.27 0.00 0.00 57.70 57.41 3ikm n MET 435 Cb 0.11 -1.38 0.00 0.00 2.15 0.00 0.00 33.22 34.09 3ikm n MET 435 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 3ikm n SER 436 N -2.38 0.00 -4.63 6.12 2.88 0.56 -4.88 113.62 111.29 3ikm n SER 436 Ca -0.17 0.00 -0.51 0.00 -1.33 0.00 0.00 58.87 56.86 3ikm n SER 436 Cb 0.79 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.19 3ikm n SER 436 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 3ikm n ILE 437 N -2.00 0.41 0.00 2.46 -5.35 -0.98 -4.84 119.36 109.06 3ikm n ILE 437 Ca 0.00 -0.14 0.00 0.00 -0.27 0.00 0.00 62.75 62.34 3ikm n ILE 437 Cb 0.00 -1.68 0.00 0.00 -1.74 0.00 0.00 39.64 36.22 3ikm n ILE 437 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3ikm n LEU 438 N 7.29 0.00 -4.73 7.28 7.99 -0.63 -4.67 117.00 129.53 3ikm n LEU 438 Ca 0.28 0.12 -0.26 0.00 -0.01 0.00 0.00 56.01 56.14 3ikm n LEU 438 Cb 0.24 0.00 -0.08 0.00 -0.11 0.00 0.00 43.42 43.48 3ikm n LEU 438 CO 0.76 0.00 -0.18 -0.36 -1.51 0.00 0.00 177.39 176.10 3ikm s PHE 439 N -0.27 2.42 -0.04 -1.77 0.08 -1.24 -4.49 117.98 112.68 3ikm s PHE 439 Ca 0.00 -0.67 -0.02 0.00 0.12 0.00 0.00 56.93 56.36 3ikm s PHE 439 Cb 0.00 -1.88 0.02 0.00 -0.57 0.00 0.00 43.02 40.59 3ikm s PHE 439 CO 0.00 0.19 0.08 0.95 -0.10 0.00 0.00 175.22 176.34 3ikm s THR 440 N -2.67 -0.02 -0.26 0.64 -4.23 -0.91 -2.83 115.64 105.35 3ikm s THR 440 Ca 0.35 0.09 0.02 0.00 -1.18 0.00 0.00 61.69 60.96 3ikm s THR 440 Cb 0.04 -0.14 0.07 0.00 1.34 0.00 0.00 72.50 73.81 3ikm s THR 440 CO 0.19 0.04 -0.05 0.68 -0.54 0.00 0.00 174.62 174.94 3ikm s VAL 441 N 0.52 1.76 -0.96 2.29 -7.23 -1.17 -2.66 120.40 112.95 3ikm s VAL 441 Ca -0.04 -1.47 -0.22 0.00 -1.81 0.00 0.00 61.98 58.45 3ikm s VAL 441 Cb -0.06 -2.02 0.08 0.00 0.56 0.00 0.00 36.38 34.94 3ikm s VAL 441 CO -0.02 -0.16 1.30 -0.76 -0.31 0.00 0.00 175.10 175.15 3ikm s LEU 442 N 1.27 4.09 -0.43 1.32 1.43 -1.24 -0.34 118.68 124.78 3ikm s LEU 442 Ca -0.04 -1.59 -0.27 0.00 -1.03 0.00 0.00 54.13 51.19 3ikm s LEU 442 Cb -0.19 -2.50 -0.03 0.00 0.03 0.00 0.00 46.19 43.50 3ikm s LEU 442 CO -0.07 -1.36 1.93 -0.69 0.23 0.00 0.00 176.35 176.39 3ikm s VAL 443 N 4.14 3.34 0.21 -1.59 1.01 0.79 -4.70 120.40 123.60 3ikm s VAL 443 Ca 0.40 0.29 0.03 0.00 0.00 0.00 0.00 61.98 62.70 3ikm s VAL 443 Cb -0.03 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 3ikm s VAL 443 CO -0.08 -0.48 0.10 0.35 0.00 0.00 0.00 175.10 175.00 3ikm n THR 444 N 7.46 0.00 -0.07 3.92 -2.24 -1.22 0.37 114.28 122.51 3ikm n THR 444 Ca 0.25 -1.30 0.05 0.00 -2.27 0.00 0.00 64.05 60.78 3ikm n THR 444 Cb 0.49 0.51 0.09 0.00 -2.10 0.00 0.00 70.33 69.32 3ikm n THR 444 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3ikm n GLU 445 N -0.46 -0.01 0.12 -0.78 4.07 -1.11 0.57 120.64 123.04 3ikm n GLU 445 Ca -0.01 0.30 0.05 0.00 -0.06 0.00 0.00 57.16 57.43 3ikm n GLU 445 Cb 0.33 -0.50 0.48 0.00 -0.06 0.00 0.00 31.44 31.69 3ikm n GLU 445 CO 0.00 0.00 0.00 1.79 -0.06 0.00 0.00 177.13 178.86 3ikm h THR 446 N 0.00 1.10 -3.69 6.31 1.35 -1.89 -2.98 112.91 113.11 3ikm h THR 446 Ca 0.15 -0.34 -0.46 0.00 -0.55 0.00 0.00 66.41 65.21 3ikm h THR 446 Cb 0.35 0.90 0.18 0.00 -1.73 0.00 0.00 68.15 67.85 3ikm h THR 446 CO -0.18 0.12 0.13 0.42 -0.25 0.00 0.00 175.52 175.76 3ikm s THR 447 N -5.10 2.17 -0.00 6.82 -4.23 2.35 -2.62 115.64 115.04 3ikm s THR 447 Ca -0.06 0.06 -0.00 0.00 -1.18 0.00 0.00 61.69 60.50 3ikm s THR 447 Cb 0.17 -2.31 -0.00 0.00 1.34 0.00 0.00 72.50 71.69 3ikm s THR 447 CO 0.71 -0.07 0.01 0.00 -0.54 0.00 0.00 174.62 174.73 3ikm n LEU 448 N -4.45 0.00 0.00 4.79 -0.00 -1.25 -2.69 117.00 113.41 3ikm n LEU 448 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.06 3ikm n LEU 448 Cb 0.55 -0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.97 3ikm n LEU 448 CO 0.56 -0.00 0.00 -0.62 -0.00 0.00 0.00 177.39 177.33 3ikm n GLU 449 N 0.02 0.00 -2.16 1.47 1.02 -1.25 -4.65 120.64 115.10 3ikm n GLU 449 Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.15 3ikm n GLU 449 Cb -0.00 0.00 0.04 0.00 -0.02 0.00 0.00 31.44 31.46 3ikm n GLU 449 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3ikm n ASN 450 N 0.00 0.76 0.00 1.62 4.05 -1.08 -4.84 115.26 115.77 3ikm n ASN 450 Ca 0.00 -2.03 0.00 0.00 0.45 0.00 0.00 54.58 53.00 3ikm n ASN 450 Cb 0.00 -0.20 0.00 0.00 1.23 0.00 0.00 39.78 40.81 3ikm n ASN 450 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3ikm n GLY 451 N -0.26 0.00 0.00 8.20 0.00 -1.24 -4.33 105.19 107.56 3ikm n GLY 451 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3ikm n GLY 451 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3ikm n LEU 452 N 0.00 0.00 -0.13 0.99 -0.00 -1.26 -4.83 117.00 111.77 3ikm n LEU 452 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 3ikm n LEU 452 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 3ikm n LEU 452 CO 0.00 0.00 -0.04 -0.38 -0.00 0.00 0.00 177.39 176.97 3ikm n ILE 453 N 0.00 -1.36 -4.08 1.47 5.41 -1.26 -3.84 119.36 115.70 3ikm n ILE 453 Ca 0.00 0.20 -0.33 0.00 1.00 0.00 0.00 62.75 63.62 3ikm n ILE 453 Cb 0.00 -0.46 -0.15 0.00 -0.71 0.00 0.00 39.64 38.32 3ikm n ILE 453 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 3ikm s HIS 454 N -1.91 3.00 -0.52 1.39 5.65 4.63 -4.09 115.29 123.45 3ikm s HIS 454 Ca 0.00 -1.91 -0.25 0.00 0.25 0.00 0.00 55.06 53.15 3ikm s HIS 454 Cb 0.00 -1.94 0.04 0.00 -1.18 0.00 0.00 32.58 29.50 3ikm s HIS 454 CO 0.00 -0.83 0.95 -0.51 -0.65 0.00 0.00 174.74 173.70 3ikm s LEU 455 N 1.22 4.04 0.00 8.88 1.02 -1.26 0.26 118.68 132.84 3ikm s LEU 455 Ca -0.01 -0.17 0.00 0.00 0.02 0.00 0.00 54.13 53.97 3ikm s LEU 455 Cb -0.16 -2.97 0.00 0.00 0.02 0.00 0.00 46.19 43.08 3ikm s LEU 455 CO -0.09 -1.18 0.00 -2.11 0.02 0.00 0.00 176.35 172.99 3ikm n ARG 456 N 7.41 0.00 -1.28 1.70 0.00 -1.11 -3.70 116.66 119.68 3ikm n ARG 456 Ca 0.04 0.00 -0.48 0.00 -0.00 0.00 0.00 57.85 57.40 3ikm n ARG 456 Cb 0.48 0.00 -0.06 0.00 -0.00 0.00 0.00 32.46 32.88 3ikm n ARG 456 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 3ikm n SER 457 N 0.00 -0.35 0.00 2.89 3.41 -1.09 -4.04 113.62 114.45 3ikm n SER 457 Ca 0.00 1.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 3ikm n SER 457 Cb 0.00 -0.81 0.00 0.00 -0.26 0.00 0.00 64.21 63.14 3ikm n SER 457 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3ikm n ARG 458 N 1.17 0.00 -2.02 4.33 0.00 -1.24 -2.15 116.66 116.76 3ikm n ARG 458 Ca 0.17 0.00 -0.28 0.00 -0.00 0.00 0.00 57.85 57.73 3ikm n ARG 458 Cb 0.12 0.00 0.13 0.00 0.00 0.00 0.00 32.46 32.71 3ikm n ARG 458 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 3ikm s ASP 459 N 0.00 3.87 0.00 6.15 1.01 -1.26 0.87 116.67 127.31 3ikm s ASP 459 Ca 0.00 0.39 0.00 0.00 0.71 0.00 0.00 52.55 53.65 3ikm s ASP 459 Cb 0.00 -0.68 0.00 0.00 1.01 0.00 0.00 42.92 43.25 3ikm s ASP 459 CO 0.00 -2.25 0.00 0.35 0.21 0.00 0.00 175.17 173.48 3ikm n THR 460 N -3.43 0.00 -3.74 -1.27 -2.24 -1.26 -4.23 114.28 98.11 3ikm n THR 460 Ca 0.12 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.67 3ikm n THR 460 Cb 0.60 -0.02 0.03 0.00 -2.10 0.00 0.00 70.33 68.85 3ikm n THR 460 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3ikm n THR 461 N -1.60 -3.90 -3.09 4.28 -2.24 -1.21 -4.91 114.28 101.62 3ikm n THR 461 Ca 0.00 -0.37 -0.45 0.00 -2.27 0.00 0.00 64.05 60.96 3ikm n THR 461 Cb 0.01 -3.59 -0.02 0.00 -2.10 0.00 0.00 70.33 64.62 3ikm n THR 461 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3ikm s MET 462 N -6.13 3.57 -0.23 -0.78 -1.94 0.25 -4.80 119.30 109.25 3ikm s MET 462 Ca 0.17 -1.99 0.06 0.00 -1.71 0.00 0.00 55.69 52.21 3ikm s MET 462 Cb -0.08 -4.69 0.48 0.00 2.01 0.00 0.00 34.83 32.55 3ikm s MET 462 CO 0.81 -1.58 1.47 1.63 -0.01 0.00 0.00 175.02 177.34 3ikm n LYS 463 N 5.59 2.62 -1.71 2.03 5.02 -1.26 -3.61 118.16 126.84 3ikm n LYS 463 Ca 0.18 -2.01 -0.43 0.00 -2.02 0.00 0.00 58.31 54.03 3ikm n LYS 463 Cb 0.48 -1.88 -0.01 0.00 -0.02 0.00 0.00 35.03 33.60 3ikm n LYS 463 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 3ikm n GLU 464 N -0.12 2.24 -2.11 1.97 -0.00 -1.26 -3.89 120.64 117.48 3ikm n GLU 464 Ca 0.30 0.79 -0.40 0.00 -0.00 0.00 0.00 57.16 57.84 3ikm n GLU 464 Cb 1.09 -2.42 -0.02 0.00 -0.00 0.00 0.00 31.44 30.10 3ikm n GLU 464 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.13 175.49 3ikm s MET 465 N -1.64 4.29 -0.14 3.44 -1.94 -1.26 -2.75 119.30 119.31 3ikm s MET 465 Ca 0.57 2.20 0.00 0.00 -1.71 0.00 0.00 55.69 56.76 3ikm s MET 465 Cb -0.56 -3.01 0.02 0.00 2.01 0.00 0.00 34.83 33.29 3ikm s MET 465 CO 0.60 -0.24 -0.13 -1.64 -0.01 0.00 0.00 175.02 173.60 3ikm s MET 466 N -1.87 2.18 0.24 2.03 -1.94 0.74 -4.83 119.30 115.85 3ikm s MET 466 Ca 0.50 -0.51 -0.31 0.00 -1.71 0.00 0.00 55.69 53.66 3ikm s MET 466 Cb -0.39 -2.01 -0.13 0.00 2.01 0.00 0.00 34.83 34.31 3ikm s MET 466 CO 0.52 -0.22 1.45 1.58 -0.01 0.00 0.00 175.02 178.34 3ikm n HIS 467 N 4.73 2.28 -0.28 -0.03 -0.00 -1.26 0.83 115.22 121.48 3ikm n HIS 467 Ca -0.17 0.39 0.10 0.00 -0.00 0.00 0.00 57.72 58.05 3ikm n HIS 467 Cb 0.50 -2.49 0.25 0.00 -0.00 0.00 0.00 29.99 28.26 3ikm n HIS 467 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.34 177.31 3ikm h ILE 468 N 3.14 0.44 0.00 3.57 6.09 -1.89 -3.38 117.51 125.49 3ikm h ILE 468 Ca -0.45 -0.10 0.00 0.00 -1.37 0.00 0.00 64.86 62.94 3ikm h ILE 468 Cb 1.27 0.12 0.00 0.00 0.47 0.00 0.00 36.82 38.68 3ikm h ILE 468 CO 0.77 0.05 0.00 -1.54 -3.07 0.00 0.00 178.15 174.37 3ikm n SER 469 N -5.14 0.00 -0.27 2.19 3.41 -1.26 -1.98 113.62 110.57 3ikm n SER 469 Ca 0.19 0.92 -0.07 0.00 -0.26 0.00 0.00 58.87 59.65 3ikm n SER 469 Cb 0.59 -0.48 -0.06 0.00 -0.26 0.00 0.00 64.21 64.00 3ikm n SER 469 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3ikm n LYS 470 N -1.93 -0.28 0.06 4.33 5.02 -1.26 0.10 118.16 124.21 3ikm n LYS 470 Ca 0.00 1.00 -0.11 0.00 -2.02 0.00 0.00 58.31 57.18 3ikm n LYS 470 Cb 0.00 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 33.49 3ikm n LYS 470 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3ikm h LEU 471 N 0.00 -0.78 -0.47 -0.35 4.07 -1.76 1.60 115.31 117.62 3ikm h LEU 471 Ca 0.10 0.11 0.10 0.00 0.08 0.00 0.00 57.88 58.26 3ikm h LEU 471 Cb 0.26 0.32 -0.10 0.00 1.08 0.00 0.00 40.66 42.22 3ikm h LEU 471 CO -0.59 -0.33 -0.24 0.11 -1.08 0.00 0.00 178.44 176.30 3ikm h LYS 472 N -0.40 -0.14 -0.02 1.13 1.79 0.39 3.52 116.57 122.84 3ikm h LYS 472 Ca 0.06 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 3ikm h LYS 472 Cb 0.49 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 3ikm h LYS 472 CO -0.23 -0.09 0.00 -0.25 -1.08 0.00 0.00 179.45 177.80 3ikm n ASP 473 N -5.41 0.10 -0.06 0.86 9.92 0.29 -1.83 116.55 120.41 3ikm n ASP 473 Ca 0.03 -1.99 -0.14 0.00 -0.53 0.00 0.00 54.79 52.17 3ikm n ASP 473 Cb 0.32 -0.01 -0.14 0.00 -0.64 0.00 0.00 41.12 40.65 3ikm n ASP 473 CO 0.00 0.00 0.00 2.22 0.13 0.00 0.00 177.20 179.55 3ikm n PHE 474 N -0.45 0.54 -0.18 1.24 1.16 1.08 -3.61 117.46 117.24 3ikm n PHE 474 Ca 0.01 0.15 -0.10 0.00 -1.87 0.00 0.00 57.45 55.64 3ikm n PHE 474 Cb 0.02 -1.09 0.01 0.00 -1.61 0.00 0.00 39.48 36.81 3ikm n PHE 474 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 3ikm h LEU 475 N 0.02 0.90 -1.04 5.98 3.38 0.20 0.94 115.31 125.69 3ikm h LEU 475 Ca -0.46 -0.32 0.12 0.00 0.09 0.00 0.00 57.88 57.32 3ikm h LEU 475 Cb 2.06 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 42.48 3ikm h LEU 475 CO 0.03 1.00 0.63 0.16 0.09 0.00 0.00 178.44 180.34 3ikm h ILE 476 N 0.78 0.92 0.76 1.22 -2.65 -1.60 0.16 117.51 117.10 3ikm h ILE 476 Ca 0.14 -0.33 -0.04 0.00 1.03 0.00 0.00 64.86 65.66 3ikm h ILE 476 Cb 0.55 -0.14 0.01 0.00 -2.05 0.00 0.00 36.82 35.19 3ikm h ILE 476 CO 0.03 0.18 -0.36 0.11 0.03 0.00 0.00 178.15 178.13 3ikm h LYS 477 N 0.97 -0.98 -0.03 0.16 1.57 -1.26 -3.18 116.57 113.82 3ikm h LYS 477 Ca 0.49 0.07 0.00 0.00 -1.87 0.00 0.00 60.65 59.34 3ikm h LYS 477 Cb 0.50 0.22 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 3ikm h LYS 477 CO -0.26 -0.65 -0.02 0.98 -0.57 0.00 0.00 179.45 178.93 3ikm n TYR 478 N -5.34 -0.01 -0.15 -1.35 4.19 0.31 0.98 117.16 115.79 3ikm n TYR 478 Ca -0.13 0.03 -0.11 0.00 3.31 0.00 0.00 57.90 61.01 3ikm n TYR 478 Cb 0.40 -0.15 -0.08 0.00 0.49 0.00 0.00 39.34 40.00 3ikm n TYR 478 CO 0.00 0.00 0.00 0.82 0.91 0.00 0.00 176.86 178.59 3ikm h ILE 479 N 0.00 0.00 -0.48 2.97 2.04 -1.28 -0.20 117.51 120.57 3ikm h ILE 479 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 3ikm h ILE 479 Cb 0.01 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.03 3ikm h ILE 479 CO -0.02 0.00 -0.35 0.77 0.00 0.00 0.00 178.15 178.54 3ikm h SER 480 N -0.27 -1.25 0.00 1.72 4.64 0.64 0.84 113.55 119.87 3ikm h SER 480 Ca 0.07 0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3ikm h SER 480 Cb 0.47 0.54 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 3ikm h SER 480 CO -0.54 -0.18 -0.00 0.77 -0.87 0.00 0.00 176.83 176.01 3ikm h SER 481 N -0.09 -0.00 -0.22 4.97 4.64 -1.26 -1.69 113.55 119.90 3ikm h SER 481 Ca 0.08 -0.01 0.04 0.00 -0.47 0.00 0.00 61.79 61.42 3ikm h SER 481 Cb 0.29 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.31 3ikm h SER 481 CO -0.49 0.01 -0.53 0.00 -0.87 0.00 0.00 176.83 174.95 3ikm h ALA 482 N 0.98 -0.84 -0.48 5.18 0.00 -0.39 -2.25 119.26 121.47 3ikm h ALA 482 Ca -0.00 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.92 3ikm h ALA 482 Cb 0.01 1.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.76 3ikm h ALA 482 CO 0.00 -1.05 -0.52 -0.22 0.00 0.00 0.00 179.25 177.46 3ikm h LYS 483 N -0.50 -0.29 0.00 0.00 1.63 0.91 -3.32 116.57 115.00 3ikm h LYS 483 Ca 0.04 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 3ikm h LYS 483 Cb 0.62 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.32 3ikm h LYS 483 CO -0.47 -0.19 0.00 0.09 -3.45 0.00 0.00 179.45 175.43 3ikm n ASN 484 N -5.13 0.00 0.00 4.20 3.02 -0.65 -5.06 115.26 111.63 3ikm n ASN 484 Ca -0.02 0.58 0.00 0.00 -0.03 0.00 0.00 54.58 55.11 3ikm n ASN 484 Cb 0.30 -0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.31 3ikm n ASN 484 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19