#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ikm h ALA 68 N 0.00 -0.02 -0.22 4.31 0.00 -2.03 0.17 119.26 121.47 3ikm h ALA 68 Ca 0.00 0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 3ikm h ALA 68 Cb 0.00 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3ikm h ALA 68 CO 0.00 -0.60 -0.59 1.37 0.00 0.00 0.00 179.25 179.43 3ikm h LEU 69 N -0.18 0.82 -0.94 0.00 8.10 -1.99 -3.27 115.31 117.85 3ikm h LEU 69 Ca 0.13 -0.46 0.16 0.00 0.11 0.00 0.00 57.88 57.82 3ikm h LEU 69 Cb 0.38 -0.24 -0.16 0.00 -0.44 0.00 0.00 40.66 40.20 3ikm h LEU 69 CO -0.34 1.23 -0.35 -0.07 -4.11 0.00 0.00 178.44 174.80 3ikm h LEU 70 N 0.55 -1.30 -0.56 0.17 4.07 -1.42 2.01 115.31 118.82 3ikm h LEU 70 Ca -0.00 0.30 -0.06 0.00 0.08 0.00 0.00 57.88 58.19 3ikm h LEU 70 Cb 1.18 0.70 -0.02 0.00 1.08 0.00 0.00 40.66 43.60 3ikm h LEU 70 CO 0.12 -0.30 0.11 -0.33 -1.08 0.00 0.00 178.44 176.97 3ikm h GLU 71 N -0.02 0.91 -0.25 1.13 5.08 -1.39 -2.83 114.58 117.21 3ikm h GLU 71 Ca 0.35 -0.24 -0.13 0.00 -1.00 0.00 0.00 59.36 58.35 3ikm h GLU 71 Cb 0.61 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 3ikm h GLU 71 CO -0.95 0.87 -0.36 -0.84 -1.00 0.00 0.00 179.01 176.73 3ikm h ILE 72 N 0.81 1.31 -0.98 3.13 3.07 -0.97 -3.26 117.51 120.62 3ikm h ILE 72 Ca 0.17 -1.55 0.33 0.00 1.55 0.00 0.00 64.86 65.36 3ikm h ILE 72 Cb 0.39 1.69 -0.16 0.00 -0.27 0.00 0.00 36.82 38.47 3ikm h ILE 72 CO 0.01 0.49 0.41 0.00 -1.05 0.00 0.00 178.15 178.01 3ikm h GLN 74 N 0.14 0.55 0.00 0.00 3.07 -1.59 -3.29 115.11 113.99 3ikm h GLN 74 Ca 0.72 -0.33 0.00 0.00 0.09 0.00 0.00 58.65 59.13 3ikm h GLN 74 Cb 1.70 0.03 0.00 0.00 0.08 0.00 0.00 27.48 29.30 3ikm h GLN 74 CO -0.72 0.93 0.00 0.54 0.09 0.00 0.00 178.83 179.67 3ikm n ARG 75 N -4.34 0.00 -3.16 0.06 1.74 -0.53 0.41 116.66 110.83 3ikm n ARG 75 Ca -0.06 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.81 3ikm n ARG 75 Cb 0.47 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 31.96 3ikm n ARG 75 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3ikm n ARG 76 N 0.00 -5.55 -1.35 5.56 5.12 -1.26 -4.12 116.66 115.07 3ikm n ARG 76 Ca 0.00 0.80 0.00 0.00 -1.93 0.00 0.00 57.85 56.72 3ikm n ARG 76 Cb 0.00 -5.54 0.00 0.00 -1.16 0.00 0.00 32.46 25.76 3ikm n ARG 76 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 3ikm n HIS 77 N -4.55 0.00 -2.06 -1.55 8.25 1.39 -4.84 115.22 111.85 3ikm n HIS 77 Ca -0.06 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.12 3ikm n HIS 77 Cb 0.59 -0.64 0.02 0.00 1.12 0.00 0.00 29.99 31.08 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 1.74 3.06 0.00 4.41 -0.00 0.11 -4.06 117.46 122.72 3ikm n PHE 78 Ca 0.00 -2.64 0.00 0.00 -0.00 0.00 0.00 57.45 54.81 3ikm n PHE 78 Cb 0.00 -0.50 0.00 0.00 -0.00 0.00 0.00 39.48 38.98 3ikm n PHE 78 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 3ikm n LEU 79 N -0.64 0.00 -4.64 -2.13 0.00 -1.26 -4.27 117.00 104.06 3ikm n LEU 79 Ca 0.46 0.00 -0.42 0.00 0.00 0.00 0.00 56.01 56.05 3ikm n LEU 79 Cb 0.74 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 44.12 3ikm n LEU 79 CO 0.44 0.00 0.69 -0.94 0.00 0.00 0.00 177.39 177.59 3ikm s SER 80 N 0.00 6.84 0.00 1.96 1.04 -1.21 -4.48 113.70 117.85 3ikm s SER 80 Ca 0.00 1.00 0.00 0.00 0.48 0.00 0.00 55.95 57.43 3ikm s SER 80 Cb 0.00 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.67 3ikm s SER 80 CO 0.00 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.25 3ikm n GLY 81 N 3.81 3.91 0.00 7.32 0.00 -1.26 -3.58 105.19 115.39 3ikm n GLY 81 Ca 0.06 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.75 3ikm n GLY 81 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ikm n SER 82 N 0.00 -0.55 0.00 1.61 2.88 -1.26 -4.81 113.62 111.49 3ikm n SER 82 Ca 0.00 -0.59 0.00 0.00 -1.33 0.00 0.00 58.87 56.95 3ikm n SER 82 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 3ikm n SER 82 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3ikm n LYS 83 N -1.14 0.00 0.27 -1.46 4.01 -1.26 -3.22 118.16 115.36 3ikm n LYS 83 Ca 0.00 0.45 0.15 0.00 -0.51 0.00 0.00 58.31 58.40 3ikm n LYS 83 Cb 0.00 -1.45 0.71 0.00 -0.51 0.00 0.00 35.03 33.78 3ikm n LYS 83 CO 0.00 0.00 0.00 -0.56 -1.11 0.00 0.00 177.40 175.73 3ikm h GLN 84 N 0.00 0.00 -0.05 1.97 -0.00 -2.04 -3.14 115.11 111.84 3ikm h GLN 84 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 58.65 58.69 3ikm h GLN 84 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 27.48 27.43 3ikm h GLN 84 CO 0.00 0.09 -0.25 1.96 -0.00 0.00 0.00 178.83 180.63 3ikm h GLN 85 N 0.00 -0.35 -4.78 0.06 1.08 -1.92 -3.38 115.11 105.82 3ikm h GLN 85 Ca -0.00 0.02 -0.68 0.00 -1.45 0.00 0.00 58.65 56.54 3ikm h GLN 85 Cb 0.45 0.08 -0.19 0.00 -0.05 0.00 0.00 27.48 27.77 3ikm h GLN 85 CO 0.01 -0.23 -0.38 -0.51 -0.95 0.00 0.00 178.83 176.77 3ikm s LEU 86 N -10.39 4.61 0.13 1.46 1.43 -1.19 -4.36 118.68 110.38 3ikm s LEU 86 Ca -0.15 -0.45 0.10 0.00 -1.03 0.00 0.00 54.13 52.60 3ikm s LEU 86 Cb 0.10 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 3ikm s LEU 86 CO 0.66 -0.33 -0.23 -0.55 0.23 0.00 0.00 176.35 176.13 3ikm s SER 87 N 1.73 3.57 0.00 2.29 0.15 -1.26 -4.90 113.70 115.27 3ikm s SER 87 Ca 0.08 -0.68 0.00 0.00 0.70 0.00 0.00 55.95 56.05 3ikm s SER 87 Cb -0.17 -0.36 0.00 0.00 -1.71 0.00 0.00 66.02 63.78 3ikm s SER 87 CO 0.11 0.17 0.00 0.54 1.20 0.00 0.00 173.24 175.26 3ikm n ARG 88 N 0.79 0.00 0.00 5.44 1.74 -1.26 0.80 116.66 124.16 3ikm n ARG 88 Ca -0.16 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.92 3ikm n ARG 88 Cb 0.53 -0.98 0.00 0.00 -1.02 0.00 0.00 32.46 30.99 3ikm n ARG 88 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3ikm n ASP 89 N -0.09 2.38 0.12 0.55 9.92 -1.26 -4.28 116.55 123.89 3ikm n ASP 89 Ca 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.25 3ikm n ASP 89 Cb 0.00 0.15 0.03 0.00 -0.64 0.00 0.00 41.12 40.66 3ikm n ASP 89 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 3ikm h SER 90 N 0.00 0.00 0.49 -2.24 0.87 -0.99 0.70 113.55 112.39 3ikm h SER 90 Ca 0.00 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.41 3ikm h SER 90 Cb 0.52 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.46 3ikm h SER 90 CO 0.00 0.67 -0.64 -0.07 -0.53 0.00 0.00 176.83 176.26 3ikm h LEU 91 N 0.00 0.16 -0.74 2.23 3.38 0.13 1.12 115.31 121.59 3ikm h LEU 91 Ca -0.01 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3ikm h LEU 91 Cb 1.43 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3ikm h LEU 91 CO 0.09 0.76 0.00 -0.11 0.09 0.00 0.00 178.44 179.27 3ikm n LEU 92 N -3.82 1.13 -0.03 1.67 7.94 -0.89 -3.00 117.00 120.00 3ikm n LEU 92 Ca -0.02 -0.43 0.01 0.00 -1.11 0.00 0.00 56.01 54.46 3ikm n LEU 92 Cb 0.64 -0.04 0.00 0.00 0.53 0.00 0.00 43.42 44.55 3ikm n LEU 92 CO 0.44 0.22 0.16 -1.54 -1.11 0.00 0.00 177.39 175.55 3ikm n SER 93 N -0.07 0.67 0.00 1.96 3.41 0.19 -4.94 113.62 114.84 3ikm n SER 93 Ca 0.18 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.95 3ikm n SER 93 Cb 0.27 0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.63 3ikm n SER 93 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ikm n GLY 94 N 0.47 0.00 0.21 5.00 0.00 0.36 -4.32 105.19 106.91 3ikm n GLY 94 Ca 0.01 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 3ikm n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ikm n HIS 96 N -2.77 -3.41 0.29 0.00 1.44 -0.99 -4.62 115.22 105.15 3ikm n HIS 96 Ca 0.02 0.21 0.04 0.00 -2.01 0.00 0.00 57.72 55.98 3ikm n HIS 96 Cb 0.33 -1.63 0.23 0.00 0.12 0.00 0.00 29.99 29.05 3ikm n HIS 96 CO 0.00 0.00 0.00 -1.00 -2.81 0.00 0.00 176.34 172.53 3ikm h PRO 97 N -0.61 0.00 0.00 -1.40 0.13 -1.78 -3.45 132.00 124.90 3ikm h PRO 97 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3ikm h PRO 97 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 3ikm h PRO 97 CO 0.33 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.51 3ikm n GLY 98 N -1.37 2.78 3.79 1.56 0.00 -1.23 -4.97 105.19 105.74 3ikm n GLY 98 Ca -0.01 -1.74 -0.39 0.00 0.00 0.00 0.00 46.02 43.88 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 -1.83 3.86 0.57 1.61 0.08 -1.26 -3.35 117.98 117.66 3ikm s PHE 99 Ca 0.00 1.48 0.08 0.00 0.12 0.00 0.00 56.93 58.61 3ikm s PHE 99 Cb 0.00 -2.66 0.07 0.00 -0.57 0.00 0.00 43.02 39.86 3ikm s PHE 99 CO 0.00 0.53 0.65 0.20 -0.10 0.00 0.00 175.22 176.50 3ikm s GLY 100 N -1.07 1.97 0.00 4.36 0.00 -1.26 -3.99 107.32 107.33 3ikm s GLY 100 Ca 0.33 -1.80 0.00 0.00 0.00 0.00 0.00 44.72 43.25 3ikm s GLY 100 CO 0.23 -1.79 0.00 -1.05 0.00 0.00 0.00 173.10 170.49 3ikm n PRO 101 N -2.08 0.00 0.19 2.90 -0.02 -1.26 -2.25 135.00 132.48 3ikm n PRO 101 Ca 0.09 0.00 0.17 0.00 -2.02 0.00 0.00 63.50 61.74 3ikm n PRO 101 Cb 0.63 -0.09 0.68 0.00 -0.02 0.00 0.00 33.50 34.70 3ikm n PRO 101 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3ikm h LEU 102 N 0.00 0.00 0.11 2.45 4.07 -1.85 -2.49 115.31 117.60 3ikm h LEU 102 Ca 0.00 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.97 3ikm h LEU 102 Cb 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 3ikm h LEU 102 CO 0.00 0.00 -0.12 1.23 -1.08 0.00 0.00 178.44 178.47 3ikm h GLY 103 N 0.00 -0.24 -0.19 0.83 0.00 -1.63 -3.11 103.07 98.74 3ikm h GLY 103 Ca 0.12 0.13 0.05 0.00 0.00 0.00 0.00 47.33 47.64 3ikm h GLY 103 CO -0.00 -0.12 -0.48 -2.08 0.00 0.00 0.00 176.54 173.86 3ikm h VAL 104 N -0.26 0.07 -0.85 4.60 2.07 -1.41 0.52 116.25 120.99 3ikm h VAL 104 Ca 0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.61 3ikm h VAL 104 Cb 0.25 0.07 -0.11 0.00 -1.52 0.00 0.00 31.29 29.98 3ikm h VAL 104 CO -0.04 0.00 -0.57 -0.08 0.02 0.00 0.00 177.57 176.90 3ikm h GLU 105 N -0.46 -0.10 -0.38 1.57 4.22 -1.71 1.93 114.58 119.66 3ikm h GLU 105 Ca 0.08 0.01 0.07 0.00 0.08 0.00 0.00 59.36 59.59 3ikm h GLU 105 Cb 0.63 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.81 3ikm h GLU 105 CO -0.49 -0.07 -0.43 1.25 -2.18 0.00 0.00 179.01 177.09 3ikm h LEU 106 N -0.10 -1.44 0.30 1.64 5.85 -1.02 1.28 115.31 121.82 3ikm h LEU 106 Ca 0.15 0.22 0.00 0.00 0.84 0.00 0.00 57.88 59.08 3ikm h LEU 106 Cb 0.46 0.62 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 3ikm h LEU 106 CO -0.85 -0.38 -0.46 -0.09 -0.34 0.00 0.00 178.44 176.32 3ikm h ARG 107 N -0.35 -0.79 -0.78 1.25 2.43 0.60 3.79 114.38 120.53 3ikm h ARG 107 Ca 0.13 0.05 0.16 0.00 -0.81 0.00 0.00 59.98 59.51 3ikm h ARG 107 Cb 0.59 0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.26 3ikm h ARG 107 CO -0.56 -0.53 0.52 -0.22 -1.51 0.00 0.00 179.97 177.68 3ikm h LYS 108 N -0.82 0.41 -0.17 0.20 3.64 0.30 0.11 116.57 120.23 3ikm h LYS 108 Ca -0.02 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 3ikm h LYS 108 Cb 0.77 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.49 3ikm h LYS 108 CO -0.16 0.27 -0.09 -0.97 -2.27 0.00 0.00 179.45 176.23 3ikm h ASN 109 N 0.42 0.37 0.00 4.20 -1.24 0.54 -2.77 115.58 117.10 3ikm h ASN 109 Ca 0.39 -0.42 0.00 0.00 0.71 0.00 0.00 56.30 56.98 3ikm h ASN 109 Cb 0.91 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 39.85 3ikm h ASN 109 CO -0.13 0.71 0.00 -0.11 -1.29 0.00 0.00 177.43 176.61 3ikm n LEU 110 N -4.60 0.05 -0.31 0.34 7.94 1.22 -2.14 117.00 119.50 3ikm n LEU 110 Ca -0.05 0.80 -0.07 0.00 -1.11 0.00 0.00 56.01 55.57 3ikm n LEU 110 Cb 0.31 -0.32 -0.06 0.00 0.53 0.00 0.00 43.42 43.88 3ikm n LEU 110 CO 0.38 -0.32 0.36 0.00 -1.11 0.00 0.00 177.39 176.70 3ikm n ALA 111 N -1.46 -0.44 -0.28 1.96 0.00 -0.12 0.37 120.51 120.54 3ikm n ALA 111 Ca 0.00 0.63 -0.05 0.00 0.00 0.00 0.00 53.44 54.02 3ikm n ALA 111 Cb 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 19.45 19.33 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 0.42 -0.09 -0.04 0.00 0.00 -1.51 0.85 119.26 118.89 3ikm h ALA 112 Ca 0.13 0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.23 3ikm h ALA 112 Cb 0.31 0.95 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 3ikm h ALA 112 CO -0.69 -0.72 0.10 1.49 0.00 0.00 0.00 179.25 179.42 3ikm h GLU 113 N -0.12 0.00 -0.01 0.00 4.57 0.45 0.47 114.58 119.94 3ikm h GLU 113 Ca 0.25 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 58.23 3ikm h GLU 113 Cb 0.56 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 29.17 3ikm h GLU 113 CO -0.80 0.00 -0.76 2.35 -1.18 0.00 0.00 179.01 178.62 3ikm h TRP 114 N 0.00 0.79 -1.43 0.92 7.01 0.11 0.45 115.95 123.80 3ikm h TRP 114 Ca 0.02 -0.42 0.42 0.00 2.11 0.00 0.00 58.89 61.01 3ikm h TRP 114 Cb 0.21 -0.09 -0.06 0.00 -2.10 0.00 0.00 29.16 27.11 3ikm h TRP 114 CO 0.00 1.25 1.03 2.35 -2.79 0.00 0.00 178.44 180.27 3ikm h TRP 115 N 0.12 0.03 0.00 2.65 2.91 0.21 0.92 115.95 122.80 3ikm h TRP 115 Ca -0.09 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.93 3ikm h TRP 115 Cb 1.45 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 30.09 3ikm h TRP 115 CO 0.13 -0.00 -0.17 1.15 -1.03 0.00 0.00 178.44 178.51 3ikm h THR 116 N 0.01 0.00 0.00 2.65 2.02 -0.81 0.61 112.91 117.39 3ikm h THR 116 Ca 0.69 -0.78 0.00 0.00 0.77 0.00 0.00 66.41 67.09 3ikm h THR 116 Cb 2.73 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 69.14 3ikm h THR 116 CO -0.03 0.00 0.00 -0.24 0.37 0.00 0.00 175.52 175.62 3ikm n SER 117 N -4.15 0.00 -0.02 4.18 2.88 0.31 0.32 113.62 117.15 3ikm n SER 117 Ca -0.02 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.49 3ikm n SER 117 Cb 0.09 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.53 3ikm n SER 117 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 3ikm n VAL 118 N -2.06 0.21 0.03 2.46 3.14 -0.83 -4.61 118.33 116.68 3ikm n VAL 118 Ca 0.00 -0.08 -0.12 0.00 -2.96 0.00 0.00 64.34 61.18 3ikm n VAL 118 Cb 0.00 -0.77 -0.07 0.00 -1.06 0.00 0.00 33.84 31.94 3ikm n VAL 118 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 3ikm h VAL 119 N -0.02 1.03 -0.07 1.55 2.07 -1.28 -3.29 116.25 116.24 3ikm h VAL 119 Ca -0.09 -0.09 -0.15 0.00 0.82 0.00 0.00 66.70 67.20 3ikm h VAL 119 Cb 1.12 1.06 0.01 0.00 -1.52 0.00 0.00 31.29 31.96 3ikm h VAL 119 CO -0.02 0.03 -0.53 0.58 0.02 0.00 0.00 177.57 177.64 3ikm h VAL 120 N -0.01 1.39 -0.92 2.57 2.07 0.49 -3.41 116.25 118.44 3ikm h VAL 120 Ca 0.01 -1.91 0.20 0.00 0.82 0.00 0.00 66.70 65.82 3ikm h VAL 120 Cb 0.03 2.33 -0.17 0.00 -1.52 0.00 0.00 31.29 31.96 3ikm h VAL 120 CO -0.00 0.57 -0.14 -0.26 0.02 0.00 0.00 177.57 177.75 3ikm h PHE 121 N 0.04 -0.34 -2.28 1.57 0.04 -1.55 -3.34 116.94 111.08 3ikm h PHE 121 Ca -0.05 0.08 -0.50 0.00 2.80 0.00 0.00 57.97 60.30 3ikm h PHE 121 Cb 1.20 0.30 -0.35 0.00 2.20 0.00 0.00 35.95 39.29 3ikm h PHE 121 CO 0.12 -0.39 -0.81 -0.98 -0.60 0.00 0.00 178.31 175.66 3ikm s ARG 122 N -6.18 0.66 0.00 1.51 1.70 -1.26 -5.01 118.95 110.37 3ikm s ARG 122 Ca -0.14 -1.30 0.00 0.00 -0.47 0.00 0.00 55.73 53.82 3ikm s ARG 122 Cb 0.26 -1.08 0.00 0.00 -0.57 0.00 0.00 34.95 33.56 3ikm s ARG 122 CO 0.77 -1.24 0.17 -1.91 -1.08 0.00 0.00 175.30 172.01 3ikm n GLU 123 N 3.86 0.00 0.05 3.89 0.00 -1.26 -3.56 120.64 123.62 3ikm n GLU 123 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.42 3ikm n GLU 123 Cb 0.42 -1.03 -0.05 0.00 0.00 0.00 0.00 31.44 30.78 3ikm n GLU 123 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 3ikm n GLN 124 N 2.01 0.55 -4.02 5.31 6.02 -1.26 -4.93 117.38 121.05 3ikm n GLN 124 Ca 0.00 -0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.75 3ikm n GLN 124 Cb 0.00 -1.68 -0.06 0.00 1.02 0.00 0.00 30.24 29.52 3ikm n GLN 124 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3ikm s VAL 125 N -3.37 2.53 0.10 5.09 1.01 -1.23 -4.53 120.40 119.98 3ikm s VAL 125 Ca -0.02 -1.64 -0.08 0.00 0.00 0.00 0.00 61.98 60.25 3ikm s VAL 125 Cb 0.12 -2.99 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 3ikm s VAL 125 CO 0.83 -0.04 0.18 -0.36 0.00 0.00 0.00 175.10 175.71 3ikm s PHE 126 N -2.54 0.23 -0.34 5.22 0.40 -1.25 -5.01 117.98 114.69 3ikm s PHE 126 Ca 0.42 -0.66 -0.29 0.00 -0.60 0.00 0.00 56.93 55.80 3ikm s PHE 126 Cb 0.01 -0.09 -0.01 0.00 0.51 0.00 0.00 43.02 43.44 3ikm s PHE 126 CO 0.23 -0.56 1.53 -1.25 0.70 0.00 0.00 175.22 175.88 3ikm s PRO 127 N -3.88 3.61 0.11 0.24 0.04 -1.26 -2.59 135.00 131.25 3ikm s PRO 127 Ca 0.07 1.25 -0.05 0.00 0.04 0.00 0.00 61.00 62.31 3ikm s PRO 127 Cb 0.05 -4.05 -0.05 0.00 0.04 0.00 0.00 34.50 30.49 3ikm s PRO 127 CO -0.09 -1.52 0.34 0.54 0.04 0.00 0.00 177.00 176.30 3ikm s VAL 128 N 5.60 5.21 -0.49 -0.36 0.11 -0.40 -4.97 120.40 125.11 3ikm s VAL 128 Ca 0.67 0.03 0.02 0.00 -2.93 0.00 0.00 61.98 59.77 3ikm s VAL 128 Cb -0.18 -3.62 0.13 0.00 -1.53 0.00 0.00 36.38 31.17 3ikm s VAL 128 CO 0.31 0.12 0.24 -0.62 -3.33 0.00 0.00 175.10 171.82 3ikm s ASP 129 N -2.28 4.65 0.24 3.54 2.15 -1.26 -4.47 116.67 119.24 3ikm s ASP 129 Ca 0.37 -2.72 -0.06 0.00 0.43 0.00 0.00 52.55 50.58 3ikm s ASP 129 Cb -0.13 -1.69 -0.06 0.00 -0.30 0.00 0.00 42.92 40.75 3ikm s ASP 129 CO 0.23 -0.31 0.50 0.00 -0.17 0.00 0.00 175.17 175.42 3ikm s ALA 130 N 0.13 3.66 0.95 3.66 0.00 -1.26 -5.09 121.76 123.81 3ikm s ALA 130 Ca 0.15 -0.51 -0.12 0.00 0.00 0.00 0.00 51.96 51.48 3ikm s ALA 130 Cb -0.23 -2.28 0.16 0.00 0.00 0.00 0.00 23.12 20.77 3ikm s ALA 130 CO -0.03 0.41 1.09 -0.51 0.00 0.00 0.00 175.76 176.73 3ikm s LEU 131 N -3.16 1.94 -0.15 0.00 1.43 -1.26 -5.01 118.68 112.48 3ikm s LEU 131 Ca 0.44 1.40 0.15 0.00 -1.03 0.00 0.00 54.13 55.09 3ikm s LEU 131 Cb -0.11 -3.70 -0.21 0.00 0.03 0.00 0.00 46.19 42.20 3ikm s LEU 131 CO 0.26 -2.94 0.08 1.41 0.23 0.00 0.00 176.35 175.40 3ikm n HIS 132 N -4.07 0.00 -4.41 0.29 8.25 -1.26 -4.95 115.22 109.07 3ikm n HIS 132 Ca 0.06 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.24 3ikm n HIS 132 Cb 0.56 -0.77 -0.08 0.00 1.12 0.00 0.00 29.99 30.82 3ikm n HIS 132 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 3ikm s HIS 133 N -2.46 2.29 -0.16 4.41 -3.43 -1.26 -3.97 115.29 110.70 3ikm s HIS 133 Ca -0.08 -0.73 -0.06 0.00 -0.80 0.00 0.00 55.06 53.39 3ikm s HIS 133 Cb 0.05 -1.81 0.08 0.00 -1.43 0.00 0.00 32.58 29.47 3ikm s HIS 133 CO 0.67 0.21 0.33 0.21 -2.00 0.00 0.00 174.74 174.16 3ikm s LYS 134 N -3.88 0.23 0.00 -0.38 2.47 -1.25 -5.04 119.74 111.89 3ikm s LYS 134 Ca 0.29 0.88 0.00 0.00 -1.56 0.00 0.00 55.97 55.58 3ikm s LYS 134 Cb 0.05 0.13 0.00 0.00 -1.46 0.00 0.00 37.83 36.55 3ikm s LYS 134 CO 0.16 -0.27 0.00 -2.30 0.16 0.00 0.00 175.35 173.10 3ikm n PRO 135 N 5.35 0.01 0.00 4.03 -0.02 -1.26 -2.97 135.00 140.14 3ikm n PRO 135 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 3ikm n PRO 135 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.98 3ikm n PRO 135 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ikm n GLY 136 N 4.86 1.41 0.06 -1.23 0.00 -1.26 -3.22 105.19 105.81 3ikm n GLY 136 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3ikm n GLY 136 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3ikm n PRO 137 N 0.00 0.23 -2.41 1.61 -0.02 -1.26 -4.90 135.00 128.25 3ikm n PRO 137 Ca 0.00 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.27 3ikm n PRO 137 Cb 0.00 -1.01 0.02 0.00 -0.02 0.00 0.00 33.50 32.49 3ikm n PRO 137 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ikm n GLY 179 N -0.19 0.10 3.62 -1.23 0.00 -1.20 -4.99 105.19 101.31 3ikm n GLY 179 Ca 0.00 0.60 -0.28 0.00 0.00 0.00 0.00 46.02 46.34 3ikm n GLY 179 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ikm s LYS 180 N -1.32 1.97 0.29 1.61 2.47 -1.16 -5.04 119.74 118.55 3ikm s LYS 180 Ca 0.20 -2.13 0.04 0.00 -1.56 0.00 0.00 55.97 52.53 3ikm s LYS 180 Cb -0.02 -1.59 -0.03 0.00 -1.46 0.00 0.00 37.83 34.73 3ikm s LYS 180 CO 0.45 -0.08 0.44 -0.51 0.16 0.00 0.00 175.35 175.80 3ikm s LEU 181 N -3.71 4.16 -1.07 5.43 1.43 -1.26 -3.93 118.68 119.72 3ikm s LEU 181 Ca 0.33 0.11 -0.22 0.00 -1.03 0.00 0.00 54.13 53.32 3ikm s LEU 181 Cb 0.09 -2.95 0.06 0.00 0.03 0.00 0.00 46.19 43.42 3ikm s LEU 181 CO 0.17 -0.22 1.49 -0.60 0.23 0.00 0.00 176.35 177.42 3ikm s ARG 182 N -4.12 3.67 -0.19 1.70 3.52 -1.25 -4.75 118.95 117.53 3ikm s ARG 182 Ca 0.38 -1.32 -0.10 0.00 -0.13 0.00 0.00 55.73 54.55 3ikm s ARG 182 Cb -0.09 -5.37 -0.08 0.00 -1.56 0.00 0.00 34.95 27.84 3ikm s ARG 182 CO 0.31 -2.20 -0.26 -0.85 -0.81 0.00 0.00 175.30 171.50 3ikm n GLU 183 N 8.67 0.42 -3.06 5.12 0.28 -1.26 0.22 120.64 131.03 3ikm n GLU 183 Ca 0.36 0.18 -0.44 0.00 -0.16 0.00 0.00 57.16 57.10 3ikm n GLU 183 Cb 0.50 -1.20 0.00 0.00 1.43 0.00 0.00 31.44 32.17 3ikm n GLU 183 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 3ikm n ASN 184 N -3.93 5.49 0.28 -1.84 2.85 -1.26 -4.37 115.26 112.49 3ikm n ASN 184 Ca -0.36 -3.07 0.14 0.00 -0.11 0.00 0.00 54.58 51.18 3ikm n ASN 184 Cb 0.74 -1.45 0.74 0.00 1.24 0.00 0.00 39.78 41.05 3ikm n ASN 184 CO 0.00 0.00 0.00 0.17 -2.11 0.00 0.00 177.26 175.32 3ikm h LEU 185 N 7.72 0.00 -2.07 1.20 -0.00 -1.95 1.23 115.31 121.43 3ikm h LEU 185 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.13 3ikm h LEU 185 Cb 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.48 3ikm h LEU 185 CO 1.20 0.00 0.06 0.25 -0.00 0.00 0.00 178.44 179.95 3ikm h LEU 186 N 0.00 0.00 0.10 0.17 6.46 -1.97 -3.00 115.31 117.07 3ikm h LEU 186 Ca 0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 3ikm h LEU 186 Cb 0.53 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.46 3ikm h LEU 186 CO 0.00 0.00 -0.05 -0.74 -0.62 0.00 0.00 178.44 177.03 3ikm h HIS 187 N 0.00 -0.13 -1.14 1.25 2.76 0.12 -3.34 115.15 114.66 3ikm h HIS 187 Ca 0.00 -0.00 0.44 0.00 -2.20 0.00 0.00 60.37 58.60 3ikm h HIS 187 Cb 0.12 0.04 -0.16 0.00 1.55 0.00 0.00 27.41 28.97 3ikm h HIS 187 CO 0.00 0.36 0.68 0.41 -1.30 0.00 0.00 177.93 178.08 3ikm n GLY 188 N 1.00 -0.77 0.24 5.26 0.00 -1.13 0.44 105.19 110.23 3ikm n GLY 188 Ca -0.07 0.77 -0.15 0.00 0.00 0.00 0.00 46.02 46.57 3ikm n GLY 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ikm h ALA 189 N 1.78 -0.55 -0.60 4.61 0.00 -1.74 -3.05 119.26 119.73 3ikm h ALA 189 Ca 0.85 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.71 3ikm h ALA 189 Cb 2.46 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 20.39 3ikm h ALA 189 CO -0.62 -0.81 -0.29 1.28 0.00 0.00 0.00 179.25 178.80 3ikm n LEU 190 N -5.33 -0.52 -0.24 0.00 7.99 0.17 0.17 117.00 119.25 3ikm n LEU 190 Ca -0.11 1.05 0.06 0.00 -0.01 0.00 0.00 56.01 57.00 3ikm n LEU 190 Cb 0.24 -0.18 0.31 0.00 -0.11 0.00 0.00 43.42 43.67 3ikm n LEU 190 CO 0.36 -0.90 1.23 -0.33 -1.51 0.00 0.00 177.39 176.24 3ikm h GLU 191 N 0.00 0.84 0.00 3.23 5.08 -1.55 -2.54 114.58 119.64 3ikm h GLU 191 Ca 0.15 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3ikm h GLU 191 Cb 0.30 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3ikm h GLU 191 CO -0.57 0.56 -0.44 0.72 -1.00 0.00 0.00 179.01 178.27 3ikm n HIS 192 N -4.49 0.38 -0.25 4.33 8.25 0.13 -4.16 115.22 119.40 3ikm n HIS 192 Ca 0.13 0.11 -0.04 0.00 -0.26 0.00 0.00 57.72 57.66 3ikm n HIS 192 Cb 0.24 -0.56 0.02 0.00 1.12 0.00 0.00 29.99 30.81 3ikm n HIS 192 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 3ikm h TYR 193 N 0.00 -0.97 -0.36 4.41 3.20 -0.90 1.16 116.97 123.51 3ikm h TYR 193 Ca 0.00 0.08 0.03 0.00 3.14 0.00 0.00 58.73 61.98 3ikm h TYR 193 Cb 0.65 0.53 -0.03 0.00 1.54 0.00 0.00 36.73 39.41 3ikm h TYR 193 CO 0.00 -0.39 0.17 -0.24 -1.64 0.00 0.00 178.16 176.06 3ikm h VAL 194 N -0.12 0.97 -0.37 1.81 3.04 -1.76 1.28 116.25 121.09 3ikm h VAL 194 Ca 0.26 -0.12 0.08 0.00 -1.01 0.00 0.00 66.70 65.91 3ikm h VAL 194 Cb 0.56 0.59 -0.08 0.00 -2.01 0.00 0.00 31.29 30.35 3ikm h VAL 194 CO -0.76 0.06 -0.14 -1.13 -1.01 0.00 0.00 177.57 174.59 3ikm h ASN 195 N 0.35 -0.50 1.20 3.17 -1.24 0.51 -2.60 115.58 116.46 3ikm h ASN 195 Ca 0.15 0.13 -0.06 0.00 0.71 0.00 0.00 56.30 57.24 3ikm h ASN 195 Cb 0.07 0.29 -0.01 0.00 0.73 0.00 0.00 38.32 39.41 3ikm h ASN 195 CO -0.11 -0.18 -0.83 0.00 -1.29 0.00 0.00 177.43 175.01 3ikm h LEU 197 N 0.00 -2.07 -1.42 0.00 5.85 0.20 2.08 115.31 119.96 3ikm h LEU 197 Ca -0.04 0.31 0.36 0.00 0.84 0.00 0.00 57.88 59.35 3ikm h LEU 197 Cb 1.20 0.90 -0.05 0.00 0.37 0.00 0.00 40.66 43.08 3ikm h LEU 197 CO 0.02 -0.28 1.20 -0.78 -0.34 0.00 0.00 178.44 178.26 3ikm h ASP 198 N -0.11 0.00 0.00 1.25 1.82 -1.72 -2.77 116.42 114.89 3ikm h ASP 198 Ca 0.14 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.78 3ikm h ASP 198 Cb 0.47 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.48 3ikm h ASP 198 CO -0.85 0.00 0.00 -0.11 -1.61 0.00 0.00 179.24 176.67 3ikm n LEU 199 N -3.51 0.00 -3.99 2.28 -0.00 0.70 -3.44 117.00 109.05 3ikm n LEU 199 Ca 0.28 0.68 -0.43 0.00 -0.00 0.00 0.00 56.01 56.54 3ikm n LEU 199 Cb 1.58 -0.18 0.00 0.00 -0.00 0.00 0.00 43.42 44.82 3ikm n LEU 199 CO 0.30 -0.18 2.03 1.33 -0.00 0.00 0.00 177.39 180.87 3ikm n VAL 200 N -1.43 4.10 0.00 1.96 0.24 -1.05 -4.90 118.33 117.25 3ikm n VAL 200 Ca 0.00 -4.12 0.00 0.00 -2.04 0.00 0.00 64.34 58.18 3ikm n VAL 200 Cb 0.00 -2.43 0.00 0.00 -1.47 0.00 0.00 33.84 29.94 3ikm n VAL 200 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3ikm n ASN 201 N 5.01 0.00 -0.12 -1.34 2.85 -1.22 -0.57 115.26 119.87 3ikm n ASN 201 Ca 0.43 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.90 3ikm n ASN 201 Cb 0.39 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.41 3ikm n ASN 201 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 3ikm n LYS 202 N 0.00 0.00 -0.56 1.20 4.76 -1.26 -4.39 118.16 117.91 3ikm n LYS 202 Ca 0.00 -0.26 -0.29 0.00 -2.87 0.00 0.00 58.31 54.89 3ikm n LYS 202 Cb 0.00 -0.21 0.20 0.00 -1.84 0.00 0.00 35.03 33.17 3ikm n LYS 202 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 3ikm n ARG 203 N 0.00 -2.27 -3.75 1.97 1.85 0.26 -4.52 116.66 110.20 3ikm n ARG 203 Ca 0.00 -0.65 -0.12 0.00 -1.00 0.00 0.00 57.85 56.07 3ikm n ARG 203 Cb 0.52 -1.75 -0.11 0.00 -1.05 0.00 0.00 32.46 30.07 3ikm n ARG 203 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3ikm s LEU 204 N -2.69 0.65 0.00 2.89 1.43 -1.26 -4.74 118.68 114.96 3ikm s LEU 204 Ca 0.56 0.63 0.00 0.00 -1.03 0.00 0.00 54.13 54.29 3ikm s LEU 204 Cb -0.13 1.03 0.00 0.00 0.03 0.00 0.00 46.19 47.12 3ikm s LEU 204 CO 0.59 -0.13 0.00 -0.81 0.23 0.00 0.00 176.35 176.23 3ikm n PRO 205 N 3.30 1.47 -3.31 1.29 -0.04 -1.26 -4.96 135.00 131.49 3ikm n PRO 205 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 3ikm n PRO 205 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 3ikm n PRO 205 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3ikm n TYR 206 N 0.00 0.00 -2.79 0.54 0.18 -1.26 -4.97 117.16 108.86 3ikm n TYR 206 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 3ikm n TYR 206 Cb 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 38.96 3ikm n TYR 206 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3ikm n GLY 207 N -0.18 6.40 2.90 -7.48 0.00 -1.26 -2.30 105.19 103.28 3ikm n GLY 207 Ca 0.00 -1.72 -0.06 0.00 0.00 0.00 0.00 46.02 44.25 3ikm n GLY 207 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3ikm s LEU 208 N 0.00 -1.06 0.47 0.99 2.34 -1.16 -3.90 118.68 116.36 3ikm s LEU 208 Ca 0.00 -1.45 -0.23 0.00 0.06 0.00 0.00 54.13 52.51 3ikm s LEU 208 Cb 0.00 1.55 -0.07 0.00 -0.56 0.00 0.00 46.19 47.11 3ikm s LEU 208 CO 0.00 -0.14 1.18 0.00 -1.06 0.00 0.00 176.35 176.33 3ikm s ALA 209 N 1.26 2.95 -0.30 1.48 0.00 -1.07 -4.15 121.76 121.94 3ikm s ALA 209 Ca 0.23 0.96 -0.03 0.00 0.00 0.00 0.00 51.96 53.12 3ikm s ALA 209 Cb -0.03 -3.40 0.19 0.00 0.00 0.00 0.00 23.12 19.88 3ikm s ALA 209 CO -0.07 -0.72 0.67 -1.14 0.00 0.00 0.00 175.76 174.51 3ikm s GLN 210 N -2.74 0.51 -0.99 0.00 -0.44 -0.19 -1.27 119.66 114.53 3ikm s GLN 210 Ca 0.65 0.91 -0.22 0.00 -2.50 0.00 0.00 55.36 54.19 3ikm s GLN 210 Cb -0.29 0.50 0.07 0.00 -1.64 0.00 0.00 33.01 31.65 3ikm s GLN 210 CO 0.35 -0.55 1.37 0.42 0.50 0.00 0.00 175.29 177.39 3ikm s ILE 211 N 2.87 4.10 -0.15 -2.34 1.01 -1.26 -1.16 121.20 124.27 3ikm s ILE 211 Ca 0.17 -0.92 -0.04 0.00 0.00 0.00 0.00 60.65 59.87 3ikm s ILE 211 Cb -0.14 -4.99 -0.03 0.00 0.01 0.00 0.00 42.46 37.31 3ikm s ILE 211 CO -0.19 -1.84 -0.04 -0.83 0.00 0.00 0.00 174.94 172.04 3ikm s GLY 212 N 4.64 1.72 -0.90 6.18 0.00 -1.12 -4.82 107.32 113.03 3ikm s GLY 212 Ca 0.43 -0.82 -0.25 0.00 0.00 0.00 0.00 44.72 44.08 3ikm s GLY 212 CO -0.09 -0.10 2.14 0.54 0.00 0.00 0.00 173.10 175.59 3ikm s VAL 213 N 0.30 3.26 0.00 1.40 0.11 0.64 -4.17 120.40 121.94 3ikm s VAL 213 Ca -0.03 -0.25 0.00 0.00 -2.93 0.00 0.00 61.98 58.76 3ikm s VAL 213 Cb -0.14 -3.67 0.00 0.00 -1.53 0.00 0.00 36.38 31.04 3ikm s VAL 213 CO 0.03 -0.53 0.00 0.00 -3.33 0.00 0.00 175.10 171.27 3ikm s PHE 215 N 0.00 1.43 0.00 0.00 0.40 0.61 -3.21 117.98 117.20 3ikm s PHE 215 Ca 0.00 -1.49 0.00 0.00 -0.60 0.00 0.00 56.93 54.84 3ikm s PHE 215 Cb 0.00 -0.53 0.00 0.00 0.51 0.00 0.00 43.02 43.00 3ikm s PHE 215 CO 0.00 -0.86 0.00 1.58 0.70 0.00 0.00 175.22 176.64 3ikm n HIS 216 N -0.51 0.00 -3.55 0.36 -0.00 -1.26 -4.68 115.22 105.58 3ikm n HIS 216 Ca 0.05 0.00 -0.27 0.00 0.46 0.00 0.00 57.72 57.96 3ikm n HIS 216 Cb 0.63 0.00 -0.10 0.00 -0.12 0.00 0.00 29.99 30.40 3ikm n HIS 216 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 3ikm n PRO 217 N 0.00 1.46 -2.22 1.57 -0.05 -1.24 -3.98 135.00 130.55 3ikm n PRO 217 Ca 0.00 -4.04 -0.40 0.00 -0.05 0.00 0.00 63.50 59.01 3ikm n PRO 217 Cb 0.00 -1.97 -0.03 0.00 -0.05 0.00 0.00 33.50 31.46 3ikm n PRO 217 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 175.50 175.59 3ikm s VAL 218 N -1.34 2.95 0.96 0.52 -7.23 -1.26 -2.77 120.40 112.22 3ikm s VAL 218 Ca 0.32 0.94 -0.11 0.00 -1.81 0.00 0.00 61.98 61.32 3ikm s VAL 218 Cb 0.06 -3.59 0.17 0.00 0.56 0.00 0.00 36.38 33.58 3ikm s VAL 218 CO -0.13 0.21 1.09 -0.54 -0.31 0.00 0.00 175.10 175.43 3ikm s LYS 229 N -1.75 0.68 0.05 4.82 3.01 -1.26 -3.90 119.74 121.40 3ikm s LYS 229 Ca 0.48 1.07 -0.10 0.00 -1.01 0.00 0.00 55.97 56.41 3ikm s LYS 229 Cb -0.37 -1.72 0.03 0.00 -1.01 0.00 0.00 37.83 34.76 3ikm s LYS 229 CO 0.49 -2.71 0.45 -1.13 0.51 0.00 0.00 175.35 172.96 3ikm n SER 230 N -4.24 -0.66 -3.72 2.83 3.41 -1.26 -5.20 113.62 104.78 3ikm n SER 230 Ca 0.07 -1.30 -0.11 0.00 -0.26 0.00 0.00 58.87 57.27 3ikm n SER 230 Cb 0.54 1.06 -0.06 0.00 -0.26 0.00 0.00 64.21 65.49 3ikm n SER 230 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3ikm s ILE 231 N -2.29 0.08 0.21 -1.33 -0.00 -1.12 -4.76 121.20 112.00 3ikm s ILE 231 Ca 0.10 -0.68 -0.22 0.00 -0.00 0.00 0.00 60.65 59.85 3ikm s ILE 231 Cb -0.01 -1.06 0.05 0.00 -0.00 0.00 0.00 42.46 41.43 3ikm s ILE 231 CO 0.02 -0.37 0.65 -0.83 -0.00 0.00 0.00 174.94 174.41 3ikm s GLY 232 N -2.37 -0.38 -0.12 6.27 0.00 -1.26 -4.40 107.32 105.06 3ikm s GLY 232 Ca -0.01 0.13 0.03 0.00 0.00 0.00 0.00 44.72 44.87 3ikm s GLY 232 CO -0.07 0.05 -0.22 -0.54 0.00 0.00 0.00 173.10 172.32 3ikm s GLU 233 N -3.83 2.93 -0.47 2.90 2.02 -1.25 -3.59 118.70 117.42 3ikm s GLU 233 Ca 0.05 -0.83 -0.14 0.00 0.02 0.00 0.00 54.97 54.07 3ikm s GLU 233 Cb -0.03 -2.31 0.08 0.00 0.10 0.00 0.00 34.13 31.97 3ikm s GLU 233 CO -0.04 0.06 0.38 0.15 0.02 0.00 0.00 175.26 175.83 3ikm s LYS 234 N 0.63 2.91 0.02 1.61 3.01 -1.20 -4.77 119.74 121.96 3ikm s LYS 234 Ca -0.12 -1.41 -0.05 0.00 -1.01 0.00 0.00 55.97 53.38 3ikm s LYS 234 Cb -0.16 -4.09 -0.02 0.00 -1.01 0.00 0.00 37.83 32.55 3ikm s LYS 234 CO 0.03 -1.05 1.08 1.79 0.51 0.00 0.00 175.35 177.71 3ikm h THR 235 N 5.83 0.00 -3.48 2.17 1.35 -1.86 0.31 112.91 117.23 3ikm h THR 235 Ca -0.28 0.00 0.37 0.00 -0.55 0.00 0.00 66.41 65.96 3ikm h THR 235 Cb 1.10 0.00 -0.16 0.00 -1.73 0.00 0.00 68.15 67.36 3ikm h THR 235 CO 0.88 0.00 -1.03 -0.62 -0.25 0.00 0.00 175.52 174.50 3ikm n GLU 236 N -3.07 -3.26 -3.81 4.72 1.02 -1.26 -0.26 120.64 114.73 3ikm n GLU 236 Ca -0.01 2.50 -0.12 0.00 -0.02 0.00 0.00 57.16 59.51 3ikm n GLU 236 Cb 0.05 -3.87 -0.09 0.00 -0.02 0.00 0.00 31.44 27.52 3ikm n GLU 236 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3ikm s ALA 237 N -3.56 -0.56 0.01 0.62 0.00 -1.26 -2.78 121.76 114.22 3ikm s ALA 237 Ca 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 51.96 51.97 3ikm s ALA 237 Cb 0.00 0.17 -0.01 0.00 0.00 0.00 0.00 23.12 23.28 3ikm s ALA 237 CO 0.00 -0.29 0.02 0.45 0.00 0.00 0.00 175.76 175.94 3ikm s SER 238 N -1.63 0.14 -0.04 0.00 0.15 -0.31 -4.57 113.70 107.44 3ikm s SER 238 Ca -0.11 -0.32 0.04 0.00 0.70 0.00 0.00 55.95 56.26 3ikm s SER 238 Cb -0.04 0.12 -0.00 0.00 -1.71 0.00 0.00 66.02 64.39 3ikm s SER 238 CO 0.01 -0.26 -0.14 -0.22 1.20 0.00 0.00 173.24 173.83 3ikm s LEU 239 N -1.14 1.86 -0.41 3.45 2.96 -1.23 -1.02 118.68 123.13 3ikm s LEU 239 Ca -0.12 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 53.51 3ikm s LEU 239 Cb -0.08 -0.82 0.13 0.00 0.50 0.00 0.00 46.19 45.92 3ikm s LEU 239 CO -0.00 0.12 0.22 -0.69 -1.32 0.00 0.00 176.35 174.67 3ikm s VAL 240 N 0.13 1.19 0.30 1.68 1.01 -1.26 -2.91 120.40 120.54 3ikm s VAL 240 Ca -0.04 -2.31 -0.02 0.00 0.00 0.00 0.00 61.98 59.61 3ikm s VAL 240 Cb -0.11 -1.84 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 3ikm s VAL 240 CO 0.02 -0.88 0.53 0.86 0.00 0.00 0.00 175.10 175.63 3ikm s TRP 241 N 0.60 3.49 -0.33 5.22 -0.11 -1.26 -2.99 118.94 123.56 3ikm s TRP 241 Ca 0.17 0.47 -0.01 0.00 1.22 0.00 0.00 56.10 57.95 3ikm s TRP 241 Cb -0.24 -1.98 0.11 0.00 -1.50 0.00 0.00 33.47 29.87 3ikm s TRP 241 CO -0.02 0.17 0.14 -0.59 -4.62 0.00 0.00 176.95 172.03 3ikm s PHE 242 N -2.16 1.40 0.17 5.86 -0.12 -0.97 -3.40 117.98 118.76 3ikm s PHE 242 Ca 0.41 -1.69 -0.02 0.00 -0.05 0.00 0.00 56.93 55.58 3ikm s PHE 242 Cb -0.10 -1.51 -0.05 0.00 -0.63 0.00 0.00 43.02 40.73 3ikm s PHE 242 CO 0.33 -0.85 0.38 -0.08 -0.05 0.00 0.00 175.22 174.95 3ikm s THR 243 N 1.42 5.20 0.59 -4.49 -1.32 -1.25 -4.48 115.64 111.32 3ikm s THR 243 Ca 0.12 -0.20 -0.11 0.00 -1.21 0.00 0.00 61.69 60.29 3ikm s THR 243 Cb -0.19 -3.68 -0.04 0.00 -1.51 0.00 0.00 72.50 67.07 3ikm s THR 243 CO -0.20 -0.08 1.00 -2.16 -2.21 0.00 0.00 174.62 170.98 3ikm s PRO 244 N -3.03 3.64 0.05 7.08 0.04 -1.26 0.43 135.00 141.95 3ikm s PRO 244 Ca 0.39 0.72 -0.14 0.00 0.04 0.00 0.00 61.00 62.01 3ikm s PRO 244 Cb -0.12 -2.12 -0.05 0.00 0.04 0.00 0.00 34.50 32.26 3ikm s PRO 244 CO 0.27 -0.50 1.24 -1.00 0.04 0.00 0.00 177.00 177.05 3ikm h PRO 245 N -0.12 -0.20 0.00 0.56 0.13 -1.94 -1.21 132.00 129.22 3ikm h PRO 245 Ca -0.45 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3ikm h PRO 245 Cb 1.19 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3ikm h PRO 245 CO 0.62 -0.13 0.00 -2.13 -0.23 0.00 0.00 178.00 176.13 3ikm n ARG 246 N -3.84 0.00 0.00 0.86 0.00 -1.26 -1.12 116.66 111.29 3ikm n ARG 246 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.83 3ikm n ARG 246 Cb 0.15 -0.28 0.00 0.00 0.00 0.00 0.00 32.46 32.33 3ikm n ARG 246 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 3ikm n THR 247 N 0.00 0.23 0.04 5.15 -1.04 -1.26 -3.12 114.28 114.28 3ikm n THR 247 Ca 0.00 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 61.94 3ikm n THR 247 Cb 0.00 -0.51 -0.05 0.00 -1.82 0.00 0.00 70.33 67.95 3ikm n THR 247 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 3ikm h SER 248 N 1.11 -0.17 0.06 8.00 0.87 0.17 -1.25 113.55 122.34 3ikm h SER 248 Ca 0.00 -0.23 0.02 0.00 -1.23 0.00 0.00 61.79 60.35 3ikm h SER 248 Cb 0.28 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.25 3ikm h SER 248 CO 0.00 0.39 -0.23 -1.13 -0.53 0.00 0.00 176.83 175.33 3ikm h ASN 249 N -0.99 -0.65 0.05 6.23 -1.24 -1.61 -1.50 115.58 115.86 3ikm h ASN 249 Ca -0.02 0.08 0.01 0.00 0.71 0.00 0.00 56.30 57.08 3ikm h ASN 249 Cb 0.40 0.26 -0.03 0.00 0.73 0.00 0.00 38.32 39.67 3ikm h ASN 249 CO 0.03 -0.31 -0.34 -0.61 -1.29 0.00 0.00 177.43 174.92 3ikm h GLN 250 N -0.40 -0.45 -3.02 6.67 5.75 -1.77 0.36 115.11 122.26 3ikm h GLN 250 Ca 0.04 0.03 -0.26 0.00 -0.15 0.00 0.00 58.65 58.32 3ikm h GLN 250 Cb 0.44 0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.09 3ikm h GLN 250 CO -0.16 -0.30 1.48 0.91 -2.65 0.00 0.00 178.83 178.11 3ikm n TRP 251 N -4.38 0.76 0.00 3.99 5.03 -0.47 -3.25 117.44 119.12 3ikm n TRP 251 Ca -0.05 -1.46 0.00 0.00 3.03 0.00 0.00 57.50 59.02 3ikm n TRP 251 Cb 0.26 -1.40 0.00 0.00 -1.03 0.00 0.00 31.31 29.14 3ikm n TRP 251 CO 0.00 0.00 0.00 -0.11 -0.03 0.00 0.00 177.69 177.55 3ikm n LEU 252 N 3.57 0.00 -0.35 -0.99 7.94 0.11 -4.72 117.00 122.57 3ikm n LEU 252 Ca 0.35 0.00 0.06 0.00 -1.11 0.00 0.00 56.01 55.31 3ikm n LEU 252 Cb 0.29 0.27 0.22 0.00 0.53 0.00 0.00 43.42 44.73 3ikm n LEU 252 CO 0.48 -0.41 1.22 0.44 -1.11 0.00 0.00 177.39 178.01 3ikm h ASP 253 N 0.00 0.89 -0.67 1.96 3.45 -1.10 -0.34 116.42 120.61 3ikm h ASP 253 Ca 0.00 0.05 0.04 0.00 0.43 0.00 0.00 57.03 57.54 3ikm h ASP 253 Cb 0.00 -0.13 -0.05 0.00 -0.56 0.00 0.00 39.33 38.59 3ikm h ASP 253 CO 0.00 0.48 0.41 0.15 -1.57 0.00 0.00 179.24 178.71 3ikm h PHE 254 N 0.97 0.76 -0.94 4.55 3.57 -1.79 -2.57 116.94 121.49 3ikm h PHE 254 Ca 0.47 0.02 0.26 0.00 3.53 0.00 0.00 57.97 62.26 3ikm h PHE 254 Cb 0.44 -0.25 -0.17 0.00 2.79 0.00 0.00 35.95 38.77 3ikm h PHE 254 CO -0.02 0.42 0.11 -1.49 -2.23 0.00 0.00 178.31 175.10 3ikm h TRP 255 N 0.79 0.10 -0.45 0.41 4.06 -1.31 1.75 115.95 121.29 3ikm h TRP 255 Ca 0.28 0.06 0.07 0.00 2.06 0.00 0.00 58.89 61.36 3ikm h TRP 255 Cb 0.06 0.11 -0.09 0.00 -1.00 0.00 0.00 29.16 28.24 3ikm h TRP 255 CO -0.05 -0.37 -0.44 1.25 -3.56 0.00 0.00 178.44 175.27 3ikm h LEU 256 N 0.06 -1.47 -0.67 -4.49 7.12 -1.51 0.39 115.31 114.74 3ikm h LEU 256 Ca 0.59 0.23 0.06 0.00 0.13 0.00 0.00 57.88 58.89 3ikm h LEU 256 Cb 1.23 0.65 -0.08 0.00 -0.53 0.00 0.00 40.66 41.93 3ikm h LEU 256 CO -0.83 -0.36 -0.39 -1.14 -0.13 0.00 0.00 178.44 175.58 3ikm n ARG 257 N -5.41 -0.29 0.00 1.25 0.63 0.59 0.13 116.66 113.56 3ikm n ARG 257 Ca -0.00 1.26 0.00 0.00 -0.92 0.00 0.00 57.85 58.19 3ikm n ARG 257 Cb 0.35 -1.86 0.00 0.00 0.45 0.00 0.00 32.46 31.40 3ikm n ARG 257 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 3ikm n HIS 258 N -4.54 0.00 0.63 -0.14 -0.00 0.13 0.77 115.22 112.07 3ikm n HIS 258 Ca 0.01 0.00 0.06 0.00 0.46 0.00 0.00 57.72 58.25 3ikm n HIS 258 Cb 0.17 0.00 0.32 0.00 -0.12 0.00 0.00 29.99 30.36 3ikm n HIS 258 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 3ikm n ARG 259 N 0.00 0.25 -0.33 1.57 1.74 -1.22 -0.94 116.66 117.73 3ikm n ARG 259 Ca 0.00 0.11 0.08 0.00 -0.77 0.00 0.00 57.85 57.27 3ikm n ARG 259 Cb 0.00 -1.50 0.17 0.00 -1.02 0.00 0.00 32.46 30.11 3ikm n ARG 259 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3ikm n LEU 260 N -1.18 -0.27 0.03 0.55 7.94 0.34 0.37 117.00 124.78 3ikm n LEU 260 Ca 0.07 1.59 0.08 0.00 -1.11 0.00 0.00 56.01 56.64 3ikm n LEU 260 Cb 0.07 -0.51 0.35 0.00 0.53 0.00 0.00 43.42 43.86 3ikm n LEU 260 CO 0.08 -1.55 0.76 1.67 -1.11 0.00 0.00 177.39 177.24 3ikm n GLN 261 N -5.47 0.04 0.00 1.96 7.27 -0.11 -3.93 117.38 117.14 3ikm n GLN 261 Ca 0.17 0.29 0.00 0.00 0.07 0.00 0.00 57.00 57.53 3ikm n GLN 261 Cb 0.54 -1.59 0.00 0.00 2.41 0.00 0.00 30.24 31.60 3ikm n GLN 261 CO 0.00 0.00 0.00 1.87 0.07 0.00 0.00 177.06 179.00 3ikm n TRP 262 N -1.67 0.00 -0.24 3.69 -0.00 1.17 0.41 117.44 120.80 3ikm n TRP 262 Ca 0.03 0.00 -0.09 0.00 -0.00 0.00 0.00 57.50 57.44 3ikm n TRP 262 Cb 0.18 0.00 -0.08 0.00 -0.00 0.00 0.00 31.31 31.42 3ikm n TRP 262 CO 0.00 0.00 0.00 -1.49 -0.00 0.00 0.00 177.69 176.20 3ikm h TRP 263 N 0.00 -1.41 -0.99 5.87 6.55 -1.75 2.65 115.95 126.88 3ikm h TRP 263 Ca 0.00 0.09 0.35 0.00 0.95 0.00 0.00 58.89 60.28 3ikm h TRP 263 Cb 0.00 0.69 -0.17 0.00 -0.86 0.00 0.00 29.16 28.83 3ikm h TRP 263 CO 0.00 -0.32 0.48 0.00 -1.05 0.00 0.00 178.44 177.56 3ikm h ARG 264 N -0.11 0.14 -5.36 0.49 3.08 -1.67 -3.43 114.38 107.52 3ikm h ARG 264 Ca 0.10 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.14 3ikm h ARG 264 Cb 0.37 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.38 3ikm h ARG 264 CO -0.63 0.09 0.00 0.36 -1.07 0.00 0.00 179.97 178.73 3ikm n LYS 265 N -5.20 -0.96 -2.60 0.04 2.85 1.34 0.15 118.16 113.79 3ikm n LYS 265 Ca 0.33 -0.14 -0.09 0.00 -1.05 0.00 0.00 58.31 57.36 3ikm n LYS 265 Cb 1.08 0.25 0.04 0.00 -0.65 0.00 0.00 35.03 35.75 3ikm n LYS 265 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 3ikm n PHE 266 N -0.93 -1.43 -0.80 5.58 3.72 -1.26 -5.00 117.46 117.34 3ikm n PHE 266 Ca 0.00 0.52 -0.35 0.00 -0.05 0.00 0.00 57.45 57.57 3ikm n PHE 266 Cb 0.00 -3.54 0.12 0.00 -0.94 0.00 0.00 39.48 35.12 3ikm n PHE 266 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ikm n ALA 267 N -2.59 -4.75 0.02 4.37 0.00 0.40 -4.93 120.51 113.03 3ikm n ALA 267 Ca -0.07 -1.28 0.00 0.00 0.00 0.00 0.00 53.44 52.09 3ikm n ALA 267 Cb 0.58 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.77 3ikm n ALA 267 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 3ikm n MET 268 N -0.28 0.00 -0.00 0.00 1.56 -1.26 -4.84 117.12 112.29 3ikm n MET 268 Ca -0.00 0.00 0.05 0.00 -0.27 0.00 0.00 57.70 57.47 3ikm n MET 268 Cb 0.67 -0.13 -0.06 0.00 2.15 0.00 0.00 33.22 35.85 3ikm n MET 268 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 3ikm n SER 269 N -2.80 0.70 -1.79 6.12 7.64 -1.26 -4.69 113.62 117.54 3ikm n SER 269 Ca 0.00 -0.65 0.00 0.00 1.01 0.00 0.00 58.87 59.23 3ikm n SER 269 Cb 0.00 1.05 0.00 0.00 -1.01 0.00 0.00 64.21 64.25 3ikm n SER 269 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3ikm n PRO 270 N -1.29 0.01 -0.40 1.43 -0.02 -1.26 -2.05 135.00 131.41 3ikm n PRO 270 Ca 0.01 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.58 3ikm n PRO 270 Cb 0.16 -1.49 0.27 0.00 -0.02 0.00 0.00 33.50 32.42 3ikm n PRO 270 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3ikm n SER 271 N 1.78 3.50 -3.17 2.55 7.64 -1.26 -4.26 113.62 120.40 3ikm n SER 271 Ca 0.00 -2.20 -0.19 0.00 1.01 0.00 0.00 58.87 57.49 3ikm n SER 271 Cb 0.01 -0.45 -0.03 0.00 -1.01 0.00 0.00 64.21 62.72 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 0.98 1.20 -4.02 6.43 3.02 -0.87 -5.04 115.26 116.97 3ikm n ASN 272 Ca 0.20 -3.06 -0.31 0.00 -0.03 0.00 0.00 54.58 51.37 3ikm n ASN 272 Cb 0.62 -0.62 -0.15 0.00 -0.61 0.00 0.00 39.78 39.02 3ikm n ASN 272 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3ikm s PHE 273 N -2.45 3.29 0.39 3.10 0.08 -1.26 -2.50 117.98 118.64 3ikm s PHE 273 Ca 0.41 -2.51 -0.07 0.00 0.12 0.00 0.00 56.93 54.88 3ikm s PHE 273 Cb 0.33 -2.29 -0.05 0.00 -0.57 0.00 0.00 43.02 40.44 3ikm s PHE 273 CO -0.09 -0.90 0.71 0.45 -0.10 0.00 0.00 175.22 175.29 3ikm s SER 274 N 1.08 6.42 -0.06 1.36 0.15 -0.33 -4.95 113.70 117.36 3ikm s SER 274 Ca 0.01 0.93 -0.02 0.00 0.70 0.00 0.00 55.95 57.56 3ikm s SER 274 Cb -0.19 -2.24 0.04 0.00 -1.71 0.00 0.00 66.02 61.92 3ikm s SER 274 CO -0.07 -0.39 0.13 -0.94 1.20 0.00 0.00 173.24 173.16 3ikm s SER 275 N -3.48 0.04 0.21 5.45 1.04 -1.26 -0.49 113.70 115.21 3ikm s SER 275 Ca 0.48 0.26 0.10 0.00 0.48 0.00 0.00 55.95 57.27 3ikm s SER 275 Cb -0.10 0.16 -0.04 0.00 0.10 0.00 0.00 66.02 66.13 3ikm s SER 275 CO 0.35 -0.16 -0.13 -0.55 0.98 0.00 0.00 173.24 173.73 3ikm s SER 276 N 1.32 4.03 -0.13 7.02 0.15 -1.23 -5.02 113.70 119.84 3ikm s SER 276 Ca -0.07 -0.70 -0.03 0.00 0.70 0.00 0.00 55.95 55.84 3ikm s SER 276 Cb -0.12 -0.58 -0.03 0.00 -1.71 0.00 0.00 66.02 63.58 3ikm s SER 276 CO -0.05 0.09 -0.01 -1.81 1.20 0.00 0.00 173.24 172.65 3ikm s ASP 277 N -2.98 5.03 -0.08 5.45 1.11 -1.26 -2.57 116.67 121.36 3ikm s ASP 277 Ca 0.25 -0.01 0.04 0.00 0.18 0.00 0.00 52.55 53.01 3ikm s ASP 277 Cb -0.08 -1.67 0.00 0.00 1.07 0.00 0.00 42.92 42.25 3ikm s ASP 277 CO 0.15 0.25 -0.19 0.00 1.18 0.00 0.00 175.17 176.55 3ikm s GLN 279 N 0.40 4.26 0.65 0.00 1.11 -1.26 -4.73 119.66 120.09 3ikm s GLN 279 Ca -0.15 2.22 0.00 0.00 0.01 0.00 0.00 55.36 57.44 3ikm s GLN 279 Cb -0.16 -3.25 0.00 0.00 -1.01 0.00 0.00 33.01 28.58 3ikm s GLN 279 CO 0.06 -0.55 0.00 -0.25 0.01 0.00 0.00 175.29 174.56 3ikm n ASP 280 N 4.18 0.00 -1.33 5.90 9.92 -1.26 -5.04 116.55 128.93 3ikm n ASP 280 Ca 0.13 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.39 3ikm n ASP 280 Cb 0.40 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.88 3ikm n ASP 280 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 3ikm n GLU 281 N 0.00 0.00 -2.90 -1.24 4.07 -1.26 -2.03 120.64 117.28 3ikm n GLU 281 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 3ikm n GLU 281 Cb 0.00 -0.44 0.00 0.00 -0.06 0.00 0.00 31.44 30.94 3ikm n GLU 281 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 3ikm n GLU 282 N 1.24 -1.02 0.00 5.31 -0.58 -1.26 -4.04 120.64 120.29 3ikm n GLU 282 Ca 0.00 -0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.57 3ikm n GLU 282 Cb 0.00 0.31 0.00 0.00 -0.57 0.00 0.00 31.44 31.18 3ikm n GLU 282 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ikm n GLY 283 N -0.97 -0.21 0.00 0.62 0.00 -1.26 -4.99 105.19 98.38 3ikm n GLY 283 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 3ikm n GLY 283 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3ikm n ARG 284 N -1.88 0.00 0.00 1.61 3.00 -1.11 -2.76 116.66 115.52 3ikm n ARG 284 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 3ikm n ARG 284 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 3ikm n ARG 284 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 3ikm n LYS 285 N -0.21 0.00 0.00 -0.14 4.81 -0.86 -4.79 118.16 116.97 3ikm n LYS 285 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3ikm n LYS 285 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 3ikm n LYS 285 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ikm n GLY 286 N 0.00 3.81 3.88 3.14 0.00 -1.26 0.19 105.19 114.95 3ikm n GLY 286 Ca 0.00 -1.75 -0.22 0.00 0.00 0.00 0.00 46.02 44.05 3ikm n GLY 286 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ikm s ASN 287 N 0.00 4.95 0.50 1.61 -0.87 -1.09 -4.50 114.94 115.53 3ikm s ASN 287 Ca 0.00 -0.85 0.08 0.00 -1.57 0.00 0.00 52.86 50.52 3ikm s ASN 287 Cb 0.00 -0.37 0.03 0.00 -0.02 0.00 0.00 41.25 40.89 3ikm s ASN 287 CO 0.00 -0.75 0.55 -0.54 -2.57 0.00 0.00 177.10 173.79 3ikm s LYS 288 N -4.17 2.46 0.08 -0.60 1.02 -1.06 -1.77 119.74 115.70 3ikm s LYS 288 Ca 0.46 -1.62 0.08 0.00 0.02 0.00 0.00 55.97 54.92 3ikm s LYS 288 Cb -0.03 -2.48 -0.03 0.00 -0.52 0.00 0.00 37.83 34.78 3ikm s LYS 288 CO 0.27 -0.51 -0.22 -0.51 -0.92 0.00 0.00 175.35 173.46 3ikm s LEU 289 N -4.38 2.24 0.12 3.17 2.01 0.56 -3.47 118.68 118.93 3ikm s LEU 289 Ca 0.51 -0.62 -0.07 0.00 0.01 0.00 0.00 54.13 53.95 3ikm s LEU 289 Cb -0.05 -0.99 -0.01 0.00 0.01 0.00 0.00 46.19 45.15 3ikm s LEU 289 CO 0.31 0.13 0.18 -0.31 1.01 0.00 0.00 176.35 177.67 3ikm s TYR 290 N -0.98 0.37 0.06 0.29 2.02 0.36 0.65 117.35 120.12 3ikm s TYR 290 Ca 0.08 -0.78 0.06 0.00 -0.37 0.00 0.00 57.07 56.06 3ikm s TYR 290 Cb -0.10 -0.15 -0.03 0.00 -0.40 0.00 0.00 41.96 41.29 3ikm s TYR 290 CO 0.03 -0.59 -0.17 -0.47 -1.57 0.00 0.00 175.55 172.78 3ikm s TYR 291 N -3.93 1.49 -1.10 2.71 5.04 -0.83 -1.19 117.35 119.55 3ikm s TYR 291 Ca 0.12 -0.40 -0.23 0.00 -2.44 0.00 0.00 57.07 54.13 3ikm s TYR 291 Cb 0.05 -0.86 -0.05 0.00 0.35 0.00 0.00 41.96 41.45 3ikm s TYR 291 CO -0.05 0.09 1.89 1.21 -1.34 0.00 0.00 175.55 177.35 3ikm s ASN 292 N -1.46 5.34 -0.39 4.32 3.84 -1.04 -3.27 114.94 122.28 3ikm s ASN 292 Ca 0.03 -1.42 -0.19 0.00 0.21 0.00 0.00 52.86 51.49 3ikm s ASN 292 Cb -0.09 -2.58 0.01 0.00 -0.55 0.00 0.00 41.25 38.04 3ikm s ASN 292 CO 0.02 -2.68 0.53 -0.36 -2.79 0.00 0.00 177.10 171.82 3ikm s PHE 293 N 9.65 3.15 0.09 0.43 0.08 -1.26 -4.96 117.98 125.15 3ikm s PHE 293 Ca 0.66 -0.00 -0.27 0.00 0.12 0.00 0.00 56.93 57.44 3ikm s PHE 293 Cb -0.02 -3.02 -0.11 0.00 -0.57 0.00 0.00 43.02 39.30 3ikm s PHE 293 CO 0.07 -0.65 1.43 -1.00 -0.10 0.00 0.00 175.22 174.97 3ikm h PRO 294 N 8.62 -0.51 -0.77 0.24 0.13 -1.99 -1.09 132.00 136.63 3ikm h PRO 294 Ca -0.27 0.03 0.18 0.00 -0.87 0.00 0.00 66.00 65.07 3ikm h PRO 294 Cb 1.11 0.12 -0.13 0.00 0.13 0.00 0.00 31.00 32.23 3ikm h PRO 294 CO 0.81 -0.34 0.07 2.35 -0.23 0.00 0.00 178.00 180.66 3ikm h TRP 295 N -0.53 0.07 0.00 1.56 2.91 -2.02 -3.41 115.95 114.53 3ikm h TRP 295 Ca 0.01 0.05 0.00 0.00 1.13 0.00 0.00 58.89 60.08 3ikm h TRP 295 Cb 0.57 0.09 0.00 0.00 -0.51 0.00 0.00 29.16 29.31 3ikm h TRP 295 CO -0.49 -0.21 0.00 0.41 -1.03 0.00 0.00 178.44 177.12 3ikm n GLY 296 N -1.40 -0.39 3.19 2.65 0.00 -0.48 -5.16 105.19 103.60 3ikm n GLY 296 Ca 0.15 0.82 -0.37 0.00 0.00 0.00 0.00 46.02 46.62 3ikm n GLY 296 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ikm n LYS 297 N 0.00 0.02 -3.91 1.61 5.02 -0.79 -4.62 118.16 115.49 3ikm n LYS 297 Ca 0.00 0.02 -0.10 0.00 -2.02 0.00 0.00 58.31 56.20 3ikm n LYS 297 Cb 0.00 -1.22 -0.11 0.00 -0.02 0.00 0.00 35.03 33.68 3ikm n LYS 297 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3ikm s GLU 298 N -2.02 0.31 -0.05 1.97 2.56 -1.20 -4.89 118.70 115.38 3ikm s GLU 298 Ca 0.50 -0.37 -0.30 0.00 0.00 0.00 0.00 54.97 54.80 3ikm s GLU 298 Cb -0.30 0.12 -0.04 0.00 2.00 0.00 0.00 34.13 35.92 3ikm s GLU 298 CO 0.73 -0.06 1.29 -1.17 -0.56 0.00 0.00 175.26 175.49 3ikm s LEU 299 N -1.08 4.28 -0.27 2.70 0.20 -1.26 -1.96 118.68 121.29 3ikm s LEU 299 Ca -0.12 1.91 -0.07 0.00 0.69 0.00 0.00 54.13 56.54 3ikm s LEU 299 Cb -0.07 -3.56 -0.14 0.00 -0.43 0.00 0.00 46.19 41.99 3ikm s LEU 299 CO 0.00 -0.66 -0.30 2.30 -0.29 0.00 0.00 176.35 177.40 3ikm n ILE 300 N 4.75 1.51 -3.91 6.68 -5.35 0.21 -4.93 119.36 118.32 3ikm n ILE 300 Ca 0.12 -0.47 -0.10 0.00 -0.27 0.00 0.00 62.75 62.04 3ikm n ILE 300 Cb 0.45 -1.69 -0.10 0.00 -1.74 0.00 0.00 39.64 36.57 3ikm n ILE 300 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 3ikm s GLU 301 N -2.51 0.52 -0.26 6.28 2.12 -1.24 -3.27 118.70 120.34 3ikm s GLU 301 Ca -0.37 -0.60 -0.02 0.00 0.36 0.00 0.00 54.97 54.34 3ikm s GLU 301 Cb 0.12 0.21 0.08 0.00 0.26 0.00 0.00 34.13 34.81 3ikm s GLU 301 CO 0.54 -0.12 0.07 0.95 -0.54 0.00 0.00 175.26 176.16 3ikm s THR 302 N -2.01 0.64 -0.07 -1.70 -4.23 0.31 0.21 115.64 108.79 3ikm s THR 302 Ca -0.10 -1.00 -0.16 0.00 -1.18 0.00 0.00 61.69 59.25 3ikm s THR 302 Cb -0.05 -1.35 -0.05 0.00 1.34 0.00 0.00 72.50 72.39 3ikm s THR 302 CO -0.02 -0.50 0.41 -0.76 -0.54 0.00 0.00 174.62 173.22 3ikm s LEU 303 N 1.76 4.36 0.00 4.79 1.02 -0.73 -3.74 118.68 126.15 3ikm s LEU 303 Ca 0.05 0.83 0.00 0.00 0.02 0.00 0.00 54.13 55.03 3ikm s LEU 303 Cb -0.17 -2.59 0.00 0.00 0.02 0.00 0.00 46.19 43.45 3ikm s LEU 303 CO -0.20 0.17 0.00 0.79 0.02 0.00 0.00 176.35 177.13 3ikm n TRP 304 N 2.80 -0.15 -2.74 0.29 5.03 -0.53 -2.68 117.44 119.47 3ikm n TRP 304 Ca -0.11 0.00 -0.08 0.00 3.03 0.00 0.00 57.50 60.34 3ikm n TRP 304 Cb 0.52 0.00 0.07 0.00 -1.03 0.00 0.00 31.31 30.87 3ikm n TRP 304 CO 0.00 0.00 0.00 0.09 -0.03 0.00 0.00 177.69 177.75 3ikm n ASN 305 N -0.16 -2.60 -2.15 -0.99 3.02 0.51 -4.35 115.26 108.54 3ikm n ASN 305 Ca 0.00 -3.38 -0.11 0.00 -0.03 0.00 0.00 54.58 51.06 3ikm n ASN 305 Cb 0.00 1.83 -0.13 0.00 -0.61 0.00 0.00 39.78 40.86 3ikm n ASN 305 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3ikm n LEU 306 N 1.12 4.45 0.18 3.41 4.77 -0.24 -2.75 117.00 127.93 3ikm n LEU 306 Ca 0.07 -2.75 0.03 0.00 -0.03 0.00 0.00 56.01 53.33 3ikm n LEU 306 Cb 0.66 -1.18 0.18 0.00 -2.33 0.00 0.00 43.42 40.75 3ikm n LEU 306 CO 0.03 1.32 0.79 1.23 -1.33 0.00 0.00 177.39 179.43 3ikm h GLY 307 N 5.30 0.00 -2.36 -0.72 0.00 -1.43 -1.66 103.07 102.20 3ikm h GLY 307 Ca 0.18 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.93 3ikm h GLY 307 CO 0.35 0.00 -0.68 0.99 0.00 0.00 0.00 176.54 177.20 3ikm s ASP 308 N -2.96 4.15 -0.12 0.19 1.01 -1.25 -4.27 116.67 113.42 3ikm s ASP 308 Ca -0.01 -0.84 -0.02 0.00 0.71 0.00 0.00 52.55 52.39 3ikm s ASP 308 Cb 0.02 -0.60 -0.03 0.00 1.01 0.00 0.00 42.92 43.31 3ikm s ASP 308 CO 0.06 -0.03 0.29 0.00 0.21 0.00 0.00 175.17 175.70 3ikm n HIS 309 N -0.81 0.03 -1.78 4.23 1.44 -1.26 -4.55 115.22 112.52 3ikm n HIS 309 Ca -0.06 0.02 0.06 0.00 -2.01 0.00 0.00 57.72 55.73 3ikm n HIS 309 Cb 0.60 -0.16 0.14 0.00 0.12 0.00 0.00 29.99 30.68 3ikm n HIS 309 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 3ikm n GLU 310 N 0.82 1.02 0.00 -1.40 -0.58 -1.26 -4.79 120.64 114.45 3ikm n GLU 310 Ca 0.08 -2.69 0.00 0.00 -0.42 0.00 0.00 57.16 54.13 3ikm n GLU 310 Cb 0.01 -1.10 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 3ikm n GLU 310 CO 0.00 0.00 0.00 1.47 -0.48 0.00 0.00 177.13 178.12 3ikm n LEU 311 N -0.67 0.00 0.00 -4.62 -0.00 -1.26 -4.74 117.00 105.71 3ikm n LEU 311 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.15 3ikm n LEU 311 Cb 0.80 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.22 3ikm n LEU 311 CO -0.03 0.00 0.00 0.18 -0.00 0.00 0.00 177.39 177.54 3ikm n LEU 312 N 0.00 0.00 0.38 1.47 4.32 -1.24 -0.06 117.00 121.86 3ikm n LEU 312 Ca 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 56.01 55.81 3ikm n LEU 312 Cb 0.00 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 41.71 3ikm n LEU 312 CO 0.00 0.00 0.59 1.12 -1.22 0.00 0.00 177.39 177.88 3ikm h HIS 313 N 0.00 -1.12 -1.16 -1.77 2.07 -1.93 1.17 115.15 112.41 3ikm h HIS 313 Ca 0.00 -0.01 0.37 0.00 -2.85 0.00 0.00 60.37 57.88 3ikm h HIS 313 Cb 0.00 0.40 -0.13 0.00 2.57 0.00 0.00 27.41 30.25 3ikm h HIS 313 CO 0.00 -0.63 0.72 1.98 -3.07 0.00 0.00 177.93 176.93 3ikm h MET 314 N -1.04 0.20 -2.48 5.12 1.85 -0.76 -2.19 114.93 115.63 3ikm h MET 314 Ca -0.09 -0.01 -0.59 0.00 -0.61 0.00 0.00 59.70 58.40 3ikm h MET 314 Cb 0.84 -0.04 -0.39 0.00 0.43 0.00 0.00 31.60 32.43 3ikm h MET 314 CO 0.08 0.13 -0.90 0.66 -0.40 0.00 0.00 176.91 176.49 3ikm n TYR 315 N -4.80 0.04 -1.33 1.39 4.01 -0.61 -5.04 117.16 110.82 3ikm n TYR 315 Ca 0.33 -3.54 0.00 0.00 -0.16 0.00 0.00 57.90 54.53 3ikm n TYR 315 Cb 1.20 0.03 0.00 0.00 -0.31 0.00 0.00 39.34 40.26 3ikm n TYR 315 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 3ikm n PRO 316 N 2.52 3.23 0.00 -0.72 -0.04 0.39 -3.74 135.00 136.65 3ikm n PRO 316 Ca 0.27 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 3ikm n PRO 316 Cb 0.46 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.92 3ikm n PRO 316 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ikm n GLY 317 N 5.00 1.78 3.08 0.55 0.00 -1.26 -4.31 105.19 110.03 3ikm n GLY 317 Ca 0.00 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 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 8.14 6.04 -0.48 1.61 4.05 -1.26 -4.89 115.26 128.47 3ikm n ASN 318 Ca 0.00 -3.28 0.40 0.00 0.45 0.00 0.00 54.58 52.15 3ikm n ASN 318 Cb 0.00 -1.33 0.73 0.00 1.23 0.00 0.00 39.78 40.41 3ikm n ASN 318 CO 0.00 0.00 0.00 1.62 -3.05 0.00 0.00 177.26 175.83 3ikm h VAL 319 N 3.56 0.21 0.00 3.44 3.04 -1.88 0.11 116.25 124.73 3ikm h VAL 319 Ca 0.22 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.89 3ikm h VAL 319 Cb 0.68 0.15 0.00 0.00 -2.01 0.00 0.00 31.29 30.11 3ikm h VAL 319 CO 1.30 0.01 0.00 -1.20 -1.01 0.00 0.00 177.57 176.67 3ikm n SER 320 N -4.28 0.00 0.12 3.17 7.64 -1.26 -1.39 113.62 117.63 3ikm n SER 320 Ca 0.35 0.40 -0.00 0.00 1.01 0.00 0.00 58.87 60.63 3ikm n SER 320 Cb 1.51 -0.40 0.01 0.00 -1.01 0.00 0.00 64.21 64.32 3ikm n SER 320 CO 0.00 0.00 0.00 0.07 -3.01 0.00 0.00 175.04 172.10 3ikm h LYS 321 N 0.00 0.00 0.00 1.43 2.10 -1.18 -3.44 116.57 115.49 3ikm h LYS 321 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3ikm h LYS 321 Cb 0.01 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.34 3ikm h LYS 321 CO 0.00 0.65 0.00 1.28 -2.00 0.00 0.00 179.45 179.38 3ikm n LEU 322 N -3.30 0.00 -0.80 7.07 4.77 -0.48 -5.06 117.00 119.19 3ikm n LEU 322 Ca 0.01 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.05 3ikm n LEU 322 Cb 0.78 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.84 3ikm n LEU 322 CO 0.42 0.00 -0.17 0.00 -1.33 0.00 0.00 177.39 176.31 3ikm n HIS 323 N 0.00 -1.21 0.00 -1.77 1.44 -1.26 -4.89 115.22 107.53 3ikm n HIS 323 Ca 0.00 0.65 0.00 0.00 -2.01 0.00 0.00 57.72 56.36 3ikm n HIS 323 Cb 0.00 -1.10 0.00 0.00 0.12 0.00 0.00 29.99 29.01 3ikm n HIS 323 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3ikm n GLY 324 N -3.06 3.11 3.39 -1.39 0.00 6.45 -4.75 105.19 108.93 3ikm n GLY 324 Ca -0.02 -0.35 -0.15 0.00 0.00 0.00 0.00 46.02 45.50 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 4.15 0.96 -0.12 1.61 3.03 -1.25 0.25 118.95 127.57 3ikm s ARG 325 Ca 0.00 -0.13 -0.21 0.00 2.03 0.00 0.00 55.73 57.41 3ikm s ARG 325 Cb 0.00 0.44 -0.26 0.00 -1.03 0.00 0.00 34.95 34.10 3ikm s ARG 325 CO 0.00 -0.32 0.61 0.22 -1.13 0.00 0.00 175.30 174.68 3ikm h ASP 326 N 3.04 0.23 0.00 -2.89 1.82 -1.81 -3.41 116.42 113.41 3ikm h ASP 326 Ca -0.30 -0.84 0.00 0.00 -0.39 0.00 0.00 57.03 55.50 3ikm h ASP 326 Cb 1.19 -0.08 0.00 0.00 0.68 0.00 0.00 39.33 41.12 3ikm h ASP 326 CO 0.41 1.40 0.00 0.61 -1.61 0.00 0.00 179.24 180.05 3ikm n GLY 327 N 1.64 0.06 0.00 -0.78 0.00 -1.26 -4.93 105.19 99.92 3ikm n GLY 327 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3ikm n GLY 327 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ikm n ARG 328 N 0.00 4.98 -4.62 1.61 1.74 -1.26 -5.09 116.66 114.01 3ikm n ARG 328 Ca 0.00 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.75 3ikm n ARG 328 Cb 0.00 -0.41 -0.14 0.00 -1.02 0.00 0.00 32.46 30.88 3ikm n ARG 328 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3ikm s LYS 329 N 0.00 3.40 0.36 5.56 1.02 -1.26 -5.09 119.74 123.73 3ikm s LYS 329 Ca 0.00 -0.66 -0.28 0.00 0.02 0.00 0.00 55.97 55.04 3ikm s LYS 329 Cb 0.00 -2.70 -0.11 0.00 -0.52 0.00 0.00 37.83 34.50 3ikm s LYS 329 CO 0.00 0.16 1.52 0.54 -0.92 0.00 0.00 175.35 176.65 3ikm s ASN 330 N 0.50 6.33 0.05 2.83 4.22 -1.26 -2.25 114.94 125.36 3ikm s ASN 330 Ca -0.08 3.04 -0.27 0.00 -2.14 0.00 0.00 52.86 53.42 3ikm s ASN 330 Cb -0.15 -2.66 0.09 0.00 1.28 0.00 0.00 41.25 39.80 3ikm s ASN 330 CO 0.04 -0.90 0.76 0.68 -2.04 0.00 0.00 177.10 175.64 3ikm s VAL 331 N -0.87 0.00 -0.31 3.54 -7.23 0.14 -4.90 120.40 110.77 3ikm s VAL 331 Ca 0.55 0.00 -0.15 0.00 -1.81 0.00 0.00 61.98 60.58 3ikm s VAL 331 Cb -0.47 -1.00 -0.03 0.00 0.56 0.00 0.00 36.38 35.44 3ikm s VAL 331 CO 0.60 0.00 0.35 0.54 -0.31 0.00 0.00 175.10 176.28 3ikm s VAL 332 N -3.01 5.19 1.40 1.32 0.11 -1.26 0.98 120.40 125.13 3ikm s VAL 332 Ca 0.01 0.25 -0.22 0.00 -2.93 0.00 0.00 61.98 59.08 3ikm s VAL 332 Cb -0.01 -3.74 0.36 0.00 -1.53 0.00 0.00 36.38 31.46 3ikm s VAL 332 CO -0.08 0.04 0.95 -2.16 -3.33 0.00 0.00 175.10 170.51 3ikm s PRO 333 N 2.01 -2.78 0.59 1.54 0.04 -1.26 -4.72 135.00 130.42 3ikm s PRO 333 Ca 0.12 0.14 0.01 0.00 0.04 0.00 0.00 61.00 61.30 3ikm s PRO 333 Cb -0.16 -1.40 0.05 0.00 0.04 0.00 0.00 34.50 33.03 3ikm s PRO 333 CO 0.11 -4.78 0.82 0.00 0.04 0.00 0.00 177.00 173.20 3ikm s VAL 335 N -2.85 3.48 0.11 0.00 1.01 -0.62 -3.76 120.40 117.77 3ikm s VAL 335 Ca 0.59 -0.69 -0.00 0.00 0.00 0.00 0.00 61.98 61.88 3ikm s VAL 335 Cb -0.10 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 3ikm s VAL 335 CO 0.40 0.50 0.00 -0.22 0.00 0.00 0.00 175.10 175.78 3ikm s LEU 336 N -1.07 2.15 -0.04 3.92 0.20 -1.22 -1.08 118.68 121.55 3ikm s LEU 336 Ca 0.14 -1.11 -0.01 0.00 0.69 0.00 0.00 54.13 53.84 3ikm s LEU 336 Cb -0.11 0.14 0.03 0.00 -0.43 0.00 0.00 46.19 45.82 3ikm s LEU 336 CO 0.04 -0.62 0.04 -0.55 -0.29 0.00 0.00 176.35 174.96 3ikm s SER 337 N -3.04 0.89 -0.50 3.68 0.15 -1.26 -4.56 113.70 109.06 3ikm s SER 337 Ca 0.17 0.04 0.07 0.00 0.70 0.00 0.00 55.95 56.93 3ikm s SER 337 Cb 0.07 -0.18 0.28 0.00 -1.71 0.00 0.00 66.02 64.48 3ikm s SER 337 CO -0.02 -0.20 0.70 0.52 1.20 0.00 0.00 173.24 175.44 3ikm n VAL 338 N 4.90 1.03 -4.18 4.45 0.31 -1.15 -1.45 118.33 122.24 3ikm n VAL 338 Ca -0.12 -4.77 -0.16 0.00 -0.01 0.00 0.00 64.34 59.28 3ikm n VAL 338 Cb 0.50 -1.64 -0.11 0.00 -0.91 0.00 0.00 33.84 31.68 3ikm n VAL 338 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3ikm s ASN 339 N -2.19 1.60 -0.13 4.52 0.02 -1.25 -3.56 114.94 113.95 3ikm s ASN 339 Ca 0.40 -0.74 -0.31 0.00 -1.02 0.00 0.00 52.86 51.19 3ikm s ASN 339 Cb 0.21 -0.02 0.13 0.00 0.02 0.00 0.00 41.25 41.58 3ikm s ASN 339 CO -0.08 -0.18 1.04 -0.83 0.02 0.00 0.00 177.10 177.07 3ikm s GLY 340 N -2.19 -0.30 -0.16 0.66 0.00 -1.26 0.11 107.32 104.18 3ikm s GLY 340 Ca 0.03 1.72 -0.06 0.00 0.00 0.00 0.00 44.72 46.41 3ikm s GLY 340 CO 0.01 0.74 0.04 0.51 0.00 0.00 0.00 173.10 174.40 3ikm s ASP 341 N -1.71 5.47 0.19 1.64 -4.77 -1.20 -4.43 116.67 111.85 3ikm s ASP 341 Ca 0.03 0.08 -0.13 0.00 -3.30 0.00 0.00 52.55 49.23 3ikm s ASP 341 Cb -0.01 -1.87 0.18 0.00 -1.09 0.00 0.00 42.92 40.14 3ikm s ASP 341 CO -0.03 0.22 1.74 0.25 0.70 0.00 0.00 175.17 178.04 3ikm h LEU 342 N 6.36 0.12 -0.18 2.11 7.12 -1.88 -3.26 115.31 125.70 3ikm h LEU 342 Ca -0.39 0.07 0.06 0.00 0.13 0.00 0.00 57.88 57.75 3ikm h LEU 342 Cb 1.18 0.07 -0.03 0.00 -0.53 0.00 0.00 40.66 41.35 3ikm h LEU 342 CO 0.66 0.09 0.04 -0.67 -0.13 0.00 0.00 178.44 178.44 3ikm n ASP 343 N -5.04 0.02 -0.38 1.25 2.03 -1.26 0.52 116.55 113.69 3ikm n ASP 343 Ca 0.05 0.30 0.07 0.00 0.52 0.00 0.00 54.79 55.73 3ikm n ASP 343 Cb 0.22 -0.13 0.02 0.00 -0.72 0.00 0.00 41.12 40.51 3ikm n ASP 343 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 3ikm n ARG 344 N -3.73 1.58 0.29 -0.67 0.00 -1.23 -4.43 116.66 108.48 3ikm n ARG 344 Ca 0.05 -0.90 0.17 0.00 -0.00 0.00 0.00 57.85 57.17 3ikm n ARG 344 Cb 0.18 -1.21 0.89 0.00 -0.00 0.00 0.00 32.46 32.32 3ikm n ARG 344 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 3ikm h GLY 345 N 2.82 0.00 0.65 2.89 0.00 1.29 0.87 103.07 111.59 3ikm h GLY 345 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.04 3ikm h GLY 345 CO 0.00 0.00 -1.88 1.15 0.00 0.00 0.00 176.54 175.81 3ikm n MET 346 N -2.78 0.65 -0.21 4.80 0.00 -1.21 -3.76 117.12 114.61 3ikm n MET 346 Ca -0.02 0.18 0.01 0.00 0.00 0.00 0.00 57.70 57.87 3ikm n MET 346 Cb 0.20 -1.71 0.12 0.00 0.00 0.00 0.00 33.22 31.84 3ikm n MET 346 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 3ikm h LEU 347 N 0.00 0.06 0.19 3.17 7.12 0.50 0.29 115.31 126.64 3ikm h LEU 347 Ca -0.34 0.11 -0.01 0.00 0.13 0.00 0.00 57.88 57.77 3ikm h LEU 347 Cb 1.99 0.14 0.00 0.00 -0.53 0.00 0.00 40.66 42.26 3ikm h LEU 347 CO 0.06 0.03 -0.09 0.00 -0.13 0.00 0.00 178.44 178.31 3ikm h ALA 348 N 1.49 -0.83 -0.48 1.25 0.00 -1.56 -2.50 119.26 116.62 3ikm h ALA 348 Ca 0.33 -0.06 0.14 0.00 0.00 0.00 0.00 54.91 55.32 3ikm h ALA 348 Cb 0.49 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3ikm h ALA 348 CO -0.40 -0.81 0.99 -0.92 0.00 0.00 0.00 179.25 178.11 3ikm h TYR 349 N -0.32 0.00 0.00 0.00 5.03 -1.60 2.91 116.97 122.99 3ikm h TYR 349 Ca -0.03 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.28 3ikm h TYR 349 Cb 0.20 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.48 3ikm h TYR 349 CO 0.13 0.00 0.00 -0.11 -1.32 0.00 0.00 178.16 176.86 3ikm n LEU 350 N -2.95 0.00 -0.04 2.82 -0.00 1.00 -3.49 117.00 114.33 3ikm n LEU 350 Ca 0.10 0.19 -0.05 0.00 -0.00 0.00 0.00 56.01 56.26 3ikm n LEU 350 Cb 1.14 -0.19 -0.07 0.00 -0.00 0.00 0.00 43.42 44.30 3ikm n LEU 350 CO 0.13 -0.09 -0.80 -1.22 -0.00 0.00 0.00 177.39 175.42 3ikm n TYR 351 N -1.19 0.00 -0.02 1.96 4.02 0.97 -4.47 117.16 118.43 3ikm n TYR 351 Ca 0.09 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 58.12 3ikm n TYR 351 Cb 0.11 -0.44 0.56 0.00 -0.02 0.00 0.00 39.34 39.55 3ikm n TYR 351 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 176.86 176.07 3ikm h ASP 352 N 0.00 0.24 0.00 7.72 3.58 -1.64 -3.22 116.42 123.09 3ikm h ASP 352 Ca -0.24 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.21 3ikm h ASP 352 Cb 1.54 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 42.55 3ikm h ASP 352 CO 0.01 0.14 0.00 -1.54 -2.88 0.00 0.00 179.24 174.97 3ikm n SER 353 N -4.46 0.00 -4.06 2.28 3.41 -1.26 -4.78 113.62 104.76 3ikm n SER 353 Ca 0.08 0.31 -0.32 0.00 -0.26 0.00 0.00 58.87 58.68 3ikm n SER 353 Cb 0.38 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.43 3ikm n SER 353 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3ikm n PHE 354 N -0.52 -1.43 0.00 7.33 7.35 -1.22 -4.72 117.46 124.26 3ikm n PHE 354 Ca 0.00 0.40 0.00 0.00 -0.76 0.00 0.00 57.45 57.09 3ikm n PHE 354 Cb 0.00 -1.45 0.00 0.00 0.35 0.00 0.00 39.48 38.38 3ikm n PHE 354 CO 0.00 0.00 0.00 0.94 -0.76 0.00 0.00 176.76 176.94 3ikm n GLN 355 N 0.28 0.00 -1.52 -4.13 0.00 -1.26 -5.07 117.38 105.68 3ikm n GLN 355 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 3ikm n GLN 355 Cb 0.63 -0.12 0.00 0.00 0.00 0.00 0.00 30.24 30.75 3ikm n GLN 355 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 3ikm n ARG 369 N -1.73 -1.04 -3.66 3.69 0.63 -1.26 -5.11 116.66 108.18 3ikm n ARG 369 Ca 0.00 0.76 -0.09 0.00 -0.92 0.00 0.00 57.85 57.59 3ikm n ARG 369 Cb 0.00 -1.24 -0.10 0.00 0.45 0.00 0.00 32.46 31.57 3ikm n ARG 369 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 3ikm s LYS 370 N -1.49 0.29 -0.07 -0.14 -0.14 -1.26 -5.17 119.74 111.77 3ikm s LYS 370 Ca 0.00 0.98 -0.06 0.00 -1.36 0.00 0.00 55.97 55.53 3ikm s LYS 370 Cb 0.00 0.26 0.02 0.00 -1.68 0.00 0.00 37.83 36.43 3ikm s LYS 370 CO 0.00 -0.26 0.18 0.54 -0.76 0.00 0.00 175.35 175.05 3ikm s VAL 371 N 2.56 -0.00 -0.25 3.17 0.11 -1.26 -4.23 120.40 120.49 3ikm s VAL 371 Ca -0.01 0.01 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 3ikm s VAL 371 Cb -0.12 -0.26 0.07 0.00 -1.53 0.00 0.00 36.38 34.54 3ikm s VAL 371 CO -0.12 0.00 -0.00 -0.76 -3.33 0.00 0.00 175.10 170.89 3ikm s LEU 372 N 0.15 2.55 0.39 2.54 1.02 -0.76 -4.87 118.68 119.70 3ikm s LEU 372 Ca -0.00 -1.31 -0.10 0.00 0.02 0.00 0.00 54.13 52.74 3ikm s LEU 372 Cb -0.02 -1.09 -0.06 0.00 0.02 0.00 0.00 46.19 45.04 3ikm s LEU 372 CO -0.00 -0.29 0.74 -0.54 0.02 0.00 0.00 176.35 176.28 3ikm s LYS 373 N 1.45 3.77 0.02 1.70 1.02 -1.26 -3.78 119.74 122.66 3ikm s LYS 373 Ca -0.01 0.42 -0.12 0.00 0.02 0.00 0.00 55.97 56.29 3ikm s LYS 373 Cb -0.18 -2.42 0.01 0.00 -0.52 0.00 0.00 37.83 34.72 3ikm s LYS 373 CO -0.10 0.01 0.25 -0.51 -0.92 0.00 0.00 175.35 174.08 3ikm s LEU 374 N -3.76 1.10 -0.41 3.17 1.43 -1.26 -4.64 118.68 114.31 3ikm s LEU 374 Ca 0.50 -0.15 -0.27 0.00 -1.03 0.00 0.00 54.13 53.18 3ikm s LEU 374 Cb -0.10 1.12 -0.04 0.00 0.03 0.00 0.00 46.19 47.20 3ikm s LEU 374 CO 0.30 -0.51 2.03 -2.28 0.23 0.00 0.00 176.35 176.13 3ikm s HIS 375 N -1.98 1.48 0.00 0.29 5.65 -1.26 -4.85 115.29 114.62 3ikm s HIS 375 Ca -0.09 0.86 0.00 0.00 0.25 0.00 0.00 55.06 56.08 3ikm s HIS 375 Cb -0.03 -3.96 0.00 0.00 -1.18 0.00 0.00 32.58 27.41 3ikm s HIS 375 CO -0.00 -2.91 0.00 -0.35 -0.65 0.00 0.00 174.74 170.83 3ikm n PRO 376 N 8.81 0.00 -0.41 2.88 -0.04 -1.26 -0.19 135.00 144.78 3ikm n PRO 376 Ca 0.27 0.00 0.31 0.00 -0.04 0.00 0.00 63.50 64.04 3ikm n PRO 376 Cb 0.50 -0.08 0.48 0.00 -0.04 0.00 0.00 33.50 34.35 3ikm n PRO 376 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ikm h LEU 378 N 0.00 0.00 -1.14 0.00 4.07 -0.96 -3.46 115.31 113.82 3ikm h LEU 378 Ca 0.55 -0.48 -0.09 0.00 0.08 0.00 0.00 57.88 57.93 3ikm h LEU 378 Cb 2.19 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.92 3ikm h LEU 378 CO -0.01 0.82 0.22 0.00 -1.08 0.00 0.00 178.44 178.39 3ikm n ALA 379 N -2.82 0.04 -0.12 1.53 0.00 0.12 -4.63 120.51 114.62 3ikm n ALA 379 Ca -0.08 -0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.33 3ikm n ALA 379 Cb 0.29 -0.31 -0.03 0.00 0.00 0.00 0.00 19.45 19.40 3ikm n ALA 379 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3ikm n PRO 380 N 1.13 -0.13 -3.24 0.00 -0.02 -1.26 -4.21 135.00 127.27 3ikm n PRO 380 Ca 0.09 0.60 -0.21 0.00 -2.02 0.00 0.00 63.50 61.95 3ikm n PRO 380 Cb -0.00 -0.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 3ikm n PRO 380 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 3ikm s ILE 381 N -4.40 4.13 -0.18 4.25 -5.25 -1.26 -4.77 121.20 113.72 3ikm s ILE 381 Ca -0.03 -0.72 -0.00 0.00 -0.99 0.00 0.00 60.65 58.90 3ikm s ILE 381 Cb 0.03 -3.48 -0.11 0.00 2.95 0.00 0.00 42.46 41.85 3ikm s ILE 381 CO 0.18 -0.27 -0.17 0.29 -1.79 0.00 0.00 174.94 173.18 3ikm n LYS 382 N -1.86 0.44 -3.98 0.37 4.01 -1.23 -4.80 118.16 111.11 3ikm n LYS 382 Ca 0.00 0.11 -0.11 0.00 -0.51 0.00 0.00 58.31 57.80 3ikm n LYS 382 Cb 0.58 -1.34 -0.03 0.00 -0.51 0.00 0.00 35.03 33.74 3ikm n LYS 382 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 3ikm s VAL 383 N -2.36 0.00 0.32 -0.18 0.11 -1.14 -4.02 120.40 113.12 3ikm s VAL 383 Ca -0.25 -1.36 -0.11 0.00 -2.93 0.00 0.00 61.98 57.33 3ikm s VAL 383 Cb 0.07 -2.57 0.02 0.00 -1.53 0.00 0.00 36.38 32.36 3ikm s VAL 383 CO 0.41 0.00 0.58 0.00 -3.33 0.00 0.00 175.10 172.76 3ikm s ALA 384 N -3.12 -0.17 -0.04 1.54 0.00 -1.26 -0.55 121.76 118.16 3ikm s ALA 384 Ca 0.24 -0.98 -0.31 0.00 0.00 0.00 0.00 51.96 50.91 3ikm s ALA 384 Cb -0.02 0.97 0.12 0.00 0.00 0.00 0.00 23.12 24.19 3ikm s ALA 384 CO 0.15 -0.89 1.33 -0.48 0.00 0.00 0.00 175.76 175.86 3ikm s LEU 385 N -3.09 -0.03 0.00 0.00 2.34 0.50 -2.42 118.68 115.99 3ikm s LEU 385 Ca 0.22 -0.11 0.00 0.00 0.06 0.00 0.00 54.13 54.29 3ikm s LEU 385 Cb -0.02 1.26 0.00 0.00 -0.56 0.00 0.00 46.19 46.87 3ikm s LEU 385 CO 0.13 -0.21 0.00 -0.67 -1.06 0.00 0.00 176.35 174.53 3ikm n ASP 386 N -0.65 0.00 -4.67 1.48 -0.08 -1.26 -0.59 116.55 110.78 3ikm n ASP 386 Ca -0.05 -0.91 -0.24 0.00 -1.51 0.00 0.00 54.79 52.08 3ikm n ASP 386 Cb 0.62 0.00 0.11 0.00 2.34 0.00 0.00 41.12 44.19 3ikm n ASP 386 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 3ikm s VAL 387 N -2.89 2.10 0.00 5.18 -7.23 -1.26 -3.81 120.40 112.50 3ikm s VAL 387 Ca 0.00 -0.61 0.00 0.00 -1.81 0.00 0.00 61.98 59.56 3ikm s VAL 387 Cb 0.00 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.44 3ikm s VAL 387 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 3ikm n GLY 388 N -2.84 2.92 4.79 2.32 0.00 -1.12 -4.80 105.19 106.46 3ikm n GLY 388 Ca 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3ikm n GLY 388 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ikm n ARG 389 N -0.64 0.00 0.00 1.61 5.12 -1.26 -3.18 116.66 118.31 3ikm n ARG 389 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 3ikm n ARG 389 Cb 0.00 -0.63 0.00 0.00 -1.16 0.00 0.00 32.46 30.67 3ikm n ARG 389 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3ikm n GLY 390 N 0.00 -3.11 0.89 -0.13 0.00 -1.26 -4.59 105.19 96.98 3ikm n GLY 390 Ca 0.00 0.50 -0.02 0.00 0.00 0.00 0.00 46.02 46.50 3ikm n GLY 390 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ikm n PRO 391 N -2.37 0.04 -0.87 1.61 -0.04 -1.26 -4.94 135.00 127.16 3ikm n PRO 391 Ca 0.00 0.02 -0.33 0.00 -0.04 0.00 0.00 63.50 63.15 3ikm n PRO 391 Cb 0.00 -0.59 0.14 0.00 -0.04 0.00 0.00 33.50 33.01 3ikm n PRO 391 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3ikm n THR 392 N -3.05 0.73 0.00 0.52 -1.04 -1.26 -4.30 114.28 105.88 3ikm n THR 392 Ca -0.04 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 3ikm n THR 392 Cb 0.53 -0.95 0.00 0.00 -1.82 0.00 0.00 70.33 68.08 3ikm n THR 392 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3ikm n LEU 393 N -3.01 0.00 -0.32 -4.42 4.77 -1.26 -4.34 117.00 108.42 3ikm n LEU 393 Ca 0.11 0.00 0.20 0.00 -0.03 0.00 0.00 56.01 56.29 3ikm n LEU 393 Cb 0.52 0.00 0.41 0.00 -2.33 0.00 0.00 43.42 42.02 3ikm n LEU 393 CO 0.49 0.00 1.07 -0.08 -1.33 0.00 0.00 177.39 177.54 3ikm h GLU 394 N 0.00 0.31 -0.34 3.23 4.81 -1.99 -2.21 114.58 118.39 3ikm h GLU 394 Ca 0.00 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 3ikm h GLU 394 Cb 0.00 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 3ikm h GLU 394 CO 0.00 0.20 0.18 1.25 -0.73 0.00 0.00 179.01 179.91 3ikm h LEU 395 N 0.31 0.42 -0.57 1.64 5.85 -1.80 0.12 115.31 121.28 3ikm h LEU 395 Ca 0.67 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 59.32 3ikm h LEU 395 Cb 1.46 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 42.35 3ikm h LEU 395 CO -0.61 0.39 0.35 -0.09 -0.34 0.00 0.00 178.44 178.15 3ikm h ARG 396 N 0.42 0.68 -0.50 1.25 2.43 -1.63 -1.17 114.38 115.86 3ikm h ARG 396 Ca 0.12 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 3ikm h ARG 396 Cb 0.07 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 3ikm h ARG 396 CO -0.02 0.45 0.10 1.96 -1.51 0.00 0.00 179.97 180.96 3ikm h GLN 397 N 0.71 0.77 -0.50 0.20 4.20 -0.82 -2.66 115.11 117.00 3ikm h GLN 397 Ca 0.23 -0.16 -0.11 0.00 0.06 0.00 0.00 58.65 58.66 3ikm h GLN 397 Cb -0.00 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 3ikm h GLN 397 CO -0.09 0.72 -0.13 0.28 -0.67 0.00 0.00 178.83 178.94 3ikm h VAL 398 N 0.75 1.27 -0.88 -0.54 2.07 -0.29 -2.31 116.25 116.32 3ikm h VAL 398 Ca 0.16 -1.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.39 3ikm h VAL 398 Cb 0.31 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 3ikm h VAL 398 CO 0.00 0.44 0.49 0.00 0.02 0.00 0.00 177.57 178.53 3ikm h GLN 400 N 1.23 0.73 -0.65 0.00 7.50 -1.36 0.20 115.11 122.76 3ikm h GLN 400 Ca 0.31 -0.25 -0.01 0.00 0.50 0.00 0.00 58.65 59.20 3ikm h GLN 400 Cb 0.02 -0.06 -0.03 0.00 0.05 0.00 0.00 27.48 27.46 3ikm h GLN 400 CO -0.05 0.83 0.35 0.78 -1.50 0.00 0.00 178.83 179.24 3ikm h GLY 401 N 0.55 0.97 0.79 3.46 0.00 -1.15 0.20 103.07 107.90 3ikm h GLY 401 Ca 0.11 -0.45 0.03 0.00 0.00 0.00 0.00 47.33 47.02 3ikm h GLY 401 CO 0.03 0.43 0.19 1.41 0.00 0.00 0.00 176.54 178.59 3ikm h LEU 402 N 0.89 0.27 -0.49 3.11 3.38 -0.56 -0.24 115.31 121.66 3ikm h LEU 402 Ca 0.23 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.32 3ikm h LEU 402 Cb 0.06 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 40.69 3ikm h LEU 402 CO -0.03 0.20 -0.13 0.15 0.09 0.00 0.00 178.44 178.71 3ikm h PHE 403 N 0.38 -0.28 -0.79 1.13 3.57 0.15 -1.14 116.94 119.95 3ikm h PHE 403 Ca 0.17 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.72 3ikm h PHE 403 Cb 0.08 0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 3ikm h PHE 403 CO -0.11 -0.22 0.51 -0.91 -2.23 0.00 0.00 178.31 175.36 3ikm h ASN 404 N -0.01 0.92 -0.37 0.41 4.21 0.27 -1.67 115.58 119.34 3ikm h ASN 404 Ca 0.24 -0.04 -0.01 0.00 1.21 0.00 0.00 56.30 57.70 3ikm h ASN 404 Cb 0.37 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 37.32 3ikm h ASN 404 CO -0.51 0.68 0.21 -0.08 -1.29 0.00 0.00 177.43 176.44 3ikm h GLU 405 N 1.08 0.52 -0.36 0.81 4.57 0.05 -1.91 114.58 119.34 3ikm h GLU 405 Ca 0.29 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.40 3ikm h GLU 405 Cb -0.10 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.37 3ikm h GLU 405 CO -0.06 0.43 0.18 -0.07 -1.18 0.00 0.00 179.01 178.30 3ikm h LEU 406 N 0.48 0.43 -0.55 1.64 -0.00 -0.88 -2.79 115.31 113.64 3ikm h LEU 406 Ca 0.13 -0.03 -0.15 0.00 -0.00 0.00 0.00 57.88 57.83 3ikm h LEU 406 Cb 0.06 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 40.60 3ikm h LEU 406 CO -0.02 0.37 -0.45 0.25 -0.00 0.00 0.00 178.44 178.58 3ikm h LEU 407 N 0.50 0.70 -0.65 1.67 5.85 -0.58 -3.05 115.31 119.74 3ikm h LEU 407 Ca 0.13 -0.34 0.12 0.00 0.84 0.00 0.00 57.88 58.63 3ikm h LEU 407 Cb 0.04 -0.20 -0.09 0.00 0.37 0.00 0.00 40.66 40.79 3ikm h LEU 407 CO -0.02 1.05 0.20 -0.33 -0.34 0.00 0.00 178.44 179.00 3ikm h GLU 408 N 0.52 0.33 0.23 1.25 5.08 -1.09 -2.93 114.58 117.98 3ikm h GLU 408 Ca 0.03 -0.02 -0.32 0.00 -1.00 0.00 0.00 59.36 58.06 3ikm h GLU 408 Cb 0.99 -0.07 0.03 0.00 0.50 0.00 0.00 28.75 30.20 3ikm h GLU 408 CO 0.09 0.22 -1.42 -0.91 -1.00 0.00 0.00 179.01 175.99 3ikm h ASN 409 N 0.34 0.76 0.00 1.42 2.35 -1.69 -3.48 115.58 115.28 3ikm h ASN 409 Ca 0.35 -0.93 0.00 0.00 -0.55 0.00 0.00 56.30 55.17 3ikm h ASN 409 Cb 0.51 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.63 3ikm h ASN 409 CO -0.39 1.68 0.00 0.61 -1.65 0.00 0.00 177.43 177.67 3ikm n GLY 410 N 1.73 -0.75 3.05 2.83 0.00 -1.10 -5.16 105.19 105.79 3ikm n GLY 410 Ca -0.18 0.10 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 3ikm n GLY 410 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ikm s ILE 411 N 0.00 -0.54 0.82 -0.61 1.09 -1.16 -5.04 121.20 115.77 3ikm s ILE 411 Ca 0.00 0.12 -0.11 0.00 -1.10 0.00 0.00 60.65 59.56 3ikm s ILE 411 Cb 0.00 -0.63 0.09 0.00 -1.06 0.00 0.00 42.46 40.86 3ikm s ILE 411 CO 0.00 0.01 1.14 -0.94 -0.10 0.00 0.00 174.94 175.05 3ikm s SER 412 N 2.51 3.75 0.18 3.58 1.04 -1.26 -4.02 113.70 119.48 3ikm s SER 412 Ca 0.03 2.10 -0.12 0.00 0.48 0.00 0.00 55.95 58.44 3ikm s SER 412 Cb -0.13 -2.56 0.04 0.00 0.10 0.00 0.00 66.02 63.48 3ikm s SER 412 CO -0.12 -2.55 0.58 0.52 0.98 0.00 0.00 173.24 172.66 3ikm n VAL 413 N -3.65 0.00 -3.55 5.02 0.31 -1.25 -2.91 118.33 112.30 3ikm n VAL 413 Ca 0.11 -0.48 -0.04 0.00 -0.01 0.00 0.00 64.34 63.93 3ikm n VAL 413 Cb 0.52 0.55 -0.06 0.00 -0.91 0.00 0.00 33.84 33.94 3ikm n VAL 413 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 3ikm s TRP 414 N -4.05 -1.14 0.45 3.52 -0.11 0.29 -4.86 118.94 113.04 3ikm s TRP 414 Ca 0.12 1.82 0.08 0.00 1.22 0.00 0.00 56.10 59.34 3ikm s TRP 414 Cb -0.02 0.52 0.02 0.00 -1.50 0.00 0.00 33.47 32.49 3ikm s TRP 414 CO 0.05 -0.64 0.57 -1.25 -4.62 0.00 0.00 176.95 171.06 3ikm s PRO 415 N 2.76 2.65 -0.24 5.86 0.04 -1.25 0.19 135.00 145.01 3ikm s PRO 415 Ca 0.01 -1.41 0.22 0.00 0.04 0.00 0.00 61.00 59.86 3ikm s PRO 415 Cb -0.13 -2.64 0.50 0.00 0.04 0.00 0.00 34.50 32.27 3ikm s PRO 415 CO -0.17 -0.38 1.12 0.41 0.04 0.00 0.00 177.00 178.02 3ikm n GLY 416 N -1.87 2.11 3.93 0.56 0.00 0.24 -4.82 105.19 105.34 3ikm n GLY 416 Ca 0.08 -1.17 -0.27 0.00 0.00 0.00 0.00 46.02 44.66 3ikm n GLY 416 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ikm s TYR 417 N -3.49 2.42 0.00 1.61 1.13 -1.26 -3.91 117.35 113.85 3ikm s TYR 417 Ca 0.30 0.40 0.00 0.00 -1.41 0.00 0.00 57.07 56.35 3ikm s TYR 417 Cb 0.33 -3.49 0.00 0.00 -1.10 0.00 0.00 41.96 37.71 3ikm s TYR 417 CO -0.04 -1.86 0.00 -0.11 -2.51 0.00 0.00 175.55 171.03 3ikm n LEU 418 N -3.23 0.00 -4.69 -3.49 0.00 -1.26 -4.78 117.00 99.56 3ikm n LEU 418 Ca 0.11 0.00 -0.63 0.00 0.00 0.00 0.00 56.01 55.48 3ikm n LEU 418 Cb 0.60 0.00 -0.09 0.00 0.00 0.00 0.00 43.42 43.94 3ikm n LEU 418 CO 0.50 0.00 1.08 1.21 0.00 0.00 0.00 177.39 180.19 3ikm n GLU 419 N 0.00 0.33 -0.05 1.96 2.13 -1.25 -4.78 120.64 118.98 3ikm n GLU 419 Ca 0.00 0.12 0.01 0.00 0.66 0.00 0.00 57.16 57.95 3ikm n GLU 419 Cb 0.00 -1.67 0.03 0.00 0.27 0.00 0.00 31.44 30.06 3ikm n GLU 419 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 3ikm n THR 420 N 3.65 0.16 -3.85 6.31 5.66 -1.26 -4.90 114.28 120.05 3ikm n THR 420 Ca 0.27 -0.09 -0.12 0.00 -3.05 0.00 0.00 64.05 61.07 3ikm n THR 420 Cb 0.02 -0.32 -0.10 0.00 -1.55 0.00 0.00 70.33 68.38 3ikm n THR 420 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3ikm s MET 421 N -1.38 0.52 0.54 1.09 0.00 -1.26 -5.01 119.30 113.79 3ikm s MET 421 Ca 0.04 -0.36 0.32 0.00 0.00 0.00 0.00 55.69 55.69 3ikm s MET 421 Cb 0.03 0.22 1.23 0.00 0.00 0.00 0.00 34.83 36.31 3ikm s MET 421 CO 0.02 -0.13 1.94 0.37 0.00 0.00 0.00 175.02 177.21 3ikm h GLN 422 N 4.20 0.00 -2.27 3.16 4.15 -1.99 -3.46 115.11 118.91 3ikm h GLN 422 Ca -0.31 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 58.91 3ikm h GLN 422 Cb 1.19 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.82 3ikm h GLN 422 CO 0.40 0.00 -0.21 -1.13 -1.93 0.00 0.00 178.83 175.97 3ikm n SER 423 N -3.09 -2.85 0.00 -0.69 3.41 -1.26 -4.49 113.62 104.65 3ikm n SER 423 Ca 0.01 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 3ikm n SER 423 Cb 0.34 -2.68 0.00 0.00 -0.26 0.00 0.00 64.21 61.61 3ikm n SER 423 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3ikm n SER 424 N -0.62 -1.25 0.00 4.04 2.88 -1.26 -3.63 113.62 113.79 3ikm n SER 424 Ca -0.11 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.43 3ikm n SER 424 Cb 0.41 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.87 3ikm n SER 424 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3ikm n LEU 425 N 0.00 0.00 -0.23 2.46 0.00 -1.26 -4.68 117.00 113.28 3ikm n LEU 425 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 56.01 56.04 3ikm n LEU 425 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 43.42 43.44 3ikm n LEU 425 CO 0.00 0.00 0.33 -0.62 0.00 0.00 0.00 177.39 177.10 3ikm n GLU 426 N -0.04 0.18 -0.00 1.96 4.71 -1.26 -2.57 120.64 123.61 3ikm n GLU 426 Ca 0.00 -0.82 0.08 0.00 -0.01 0.00 0.00 57.16 56.41 3ikm n GLU 426 Cb 0.00 -1.10 -0.10 0.00 -1.01 0.00 0.00 31.44 29.23 3ikm n GLU 426 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 3ikm n GLN 427 N 0.26 1.33 -0.06 3.49 7.27 -1.26 -3.68 117.38 124.73 3ikm n GLN 427 Ca 0.03 -0.05 -0.04 0.00 0.07 0.00 0.00 57.00 57.01 3ikm n GLN 427 Cb 0.15 -1.29 -0.14 0.00 2.41 0.00 0.00 30.24 31.37 3ikm n GLN 427 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 3ikm n LEU 428 N -1.62 0.00 0.15 1.69 7.94 -1.24 -4.38 117.00 119.53 3ikm n LEU 428 Ca 0.01 0.00 0.03 0.00 -1.11 0.00 0.00 56.01 54.94 3ikm n LEU 428 Cb 0.31 0.31 0.08 0.00 0.53 0.00 0.00 43.42 44.65 3ikm n LEU 428 CO 0.33 0.31 0.50 1.88 -1.11 0.00 0.00 177.39 179.30 3ikm h TYR 429 N 0.00 0.00 0.00 1.96 0.99 -1.67 -3.08 116.97 115.17 3ikm h TYR 429 Ca -0.34 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.33 3ikm h TYR 429 Cb 1.73 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 39.45 3ikm h TYR 429 CO 0.00 0.50 -0.30 1.03 -0.00 0.00 0.00 178.16 179.38 3ikm h SER 430 N 0.00 0.00 0.61 3.88 0.87 -1.76 -1.90 113.55 115.25 3ikm h SER 430 Ca -0.00 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.43 3ikm h SER 430 Cb 1.31 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.25 3ikm h SER 430 CO 0.06 0.30 -0.61 0.50 -0.53 0.00 0.00 176.83 176.56 3ikm h LYS 431 N 0.00 0.00 -0.58 2.24 3.11 -1.75 0.25 116.57 119.84 3ikm h LYS 431 Ca -0.00 0.00 -0.08 0.00 -2.81 0.00 0.00 60.65 57.76 3ikm h LYS 431 Cb 0.72 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.92 3ikm h LYS 431 CO 0.04 0.61 0.06 1.88 -2.81 0.00 0.00 179.45 179.23 3ikm h TYR 432 N 0.00 1.05 0.37 1.91 -1.99 -1.41 3.62 116.97 120.52 3ikm h TYR 432 Ca -0.01 -0.16 -0.02 0.00 2.00 0.00 0.00 58.73 60.55 3ikm h TYR 432 Cb 1.07 -0.28 0.00 0.00 2.00 0.00 0.00 36.73 39.52 3ikm h TYR 432 CO 0.00 0.93 -0.20 -0.44 -0.00 0.00 0.00 178.16 178.45 3ikm h ASP 433 N 0.88 -0.48 -0.71 3.88 5.19 -1.07 0.29 116.42 124.40 3ikm h ASP 433 Ca 0.17 0.02 0.17 0.00 -0.62 0.00 0.00 57.03 56.77 3ikm h ASP 433 Cb 0.46 0.13 -0.04 0.00 0.18 0.00 0.00 39.33 40.06 3ikm h ASP 433 CO 0.02 -0.32 0.49 -0.33 -3.12 0.00 0.00 179.24 175.98 3ikm h GLU 434 N -0.52 0.23 -0.86 3.56 5.08 -0.24 1.37 114.58 123.21 3ikm h GLU 434 Ca -0.05 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.21 3ikm h GLU 434 Cb 0.40 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.55 3ikm h GLU 434 CO 0.07 0.15 0.11 -1.33 -1.00 0.00 0.00 179.01 177.02 3ikm n MET 435 N -4.43 2.54 -2.99 2.33 2.81 1.20 -4.87 117.12 113.71 3ikm n MET 435 Ca 0.14 -1.58 0.00 0.00 -1.81 0.00 0.00 57.70 54.45 3ikm n MET 435 Cb 0.61 -1.79 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 3ikm n MET 435 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3ikm n SER 436 N 0.10 0.00 -0.69 7.83 2.88 0.46 -4.84 113.62 119.37 3ikm n SER 436 Ca 0.20 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.74 3ikm n SER 436 Cb 0.86 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.32 3ikm n SER 436 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 3ikm n ILE 437 N -0.95 0.00 0.00 2.46 5.41 0.79 -4.63 119.36 122.44 3ikm n ILE 437 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 3ikm n ILE 437 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 3ikm n ILE 437 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3ikm n LEU 438 N 0.00 0.00 0.00 1.39 4.77 -1.26 -4.59 117.00 117.31 3ikm n LEU 438 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3ikm n LEU 438 Cb 0.00 0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3ikm n LEU 438 CO 0.00 -0.29 0.00 0.49 -1.33 0.00 0.00 177.39 176.26 3ikm n PHE 439 N -2.08 0.00 0.00 -1.77 3.72 -1.26 0.87 117.46 116.94 3ikm n PHE 439 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3ikm n PHE 439 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 3ikm n PHE 439 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 3ikm n THR 440 N 0.00 0.00 -2.86 4.37 -1.04 -1.25 -4.46 114.28 109.04 3ikm n THR 440 Ca 0.00 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.99 3ikm n THR 440 Cb 0.00 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 68.52 3ikm n THR 440 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 3ikm s VAL 441 N -2.00 -0.79 -0.85 12.58 -7.23 -1.02 -4.03 120.40 117.06 3ikm s VAL 441 Ca 0.00 -0.52 -0.25 0.00 -1.81 0.00 0.00 61.98 59.40 3ikm s VAL 441 Cb 0.00 0.00 -0.08 0.00 0.56 0.00 0.00 36.38 36.86 3ikm s VAL 441 CO 0.00 0.00 2.11 -0.76 -0.31 0.00 0.00 175.10 176.14 3ikm s LEU 442 N 1.23 3.07 0.10 1.32 1.43 -0.69 -4.39 118.68 120.75 3ikm s LEU 442 Ca 0.24 -0.35 -0.31 0.00 -1.03 0.00 0.00 54.13 52.68 3ikm s LEU 442 Cb 0.01 -2.55 -0.07 0.00 0.03 0.00 0.00 46.19 43.61 3ikm s LEU 442 CO -0.07 -3.13 1.34 -0.69 0.23 0.00 0.00 176.35 174.03 3ikm s VAL 443 N 11.74 3.48 0.25 -1.59 1.01 -1.25 -3.73 120.40 130.31 3ikm s VAL 443 Ca 0.78 1.06 0.04 0.00 0.00 0.00 0.00 61.98 63.87 3ikm s VAL 443 Cb -0.09 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 3ikm s VAL 443 CO 0.04 0.08 0.14 0.35 0.00 0.00 0.00 175.10 175.71 3ikm n THR 444 N 3.94 0.00 0.15 3.92 -2.24 -1.25 -2.79 114.28 116.02 3ikm n THR 444 Ca 0.11 -1.62 0.07 0.00 -2.27 0.00 0.00 64.05 60.34 3ikm n THR 444 Cb 0.43 0.69 0.06 0.00 -2.10 0.00 0.00 70.33 69.42 3ikm n THR 444 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3ikm h GLU 445 N 0.00 0.00 -2.05 -0.78 4.81 -1.80 -3.24 114.58 111.52 3ikm h GLU 445 Ca -0.19 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.99 3ikm h GLU 445 Cb 0.81 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 3ikm h GLU 445 CO 0.29 0.25 -0.09 -2.37 -0.73 0.00 0.00 179.01 176.36 3ikm n THR 446 N -3.09 1.99 0.00 0.32 5.66 -1.26 -1.73 114.28 116.16 3ikm n THR 446 Ca 0.01 -0.72 0.00 0.00 -3.05 0.00 0.00 64.05 60.30 3ikm n THR 446 Cb 0.65 -1.60 0.00 0.00 -1.55 0.00 0.00 70.33 67.84 3ikm n THR 446 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 3ikm n THR 447 N 1.92 0.00 0.28 1.09 -1.04 -1.22 -4.34 114.28 110.97 3ikm n THR 447 Ca 0.13 0.00 0.17 0.00 -2.04 0.00 0.00 64.05 62.31 3ikm n THR 447 Cb 0.55 0.00 0.86 0.00 -1.82 0.00 0.00 70.33 69.92 3ikm n THR 447 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3ikm h LEU 448 N 0.00 0.00 -0.76 -4.42 6.46 -1.45 2.03 115.31 117.17 3ikm h LEU 448 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 3ikm h LEU 448 Cb 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.93 3ikm h LEU 448 CO 0.00 0.00 0.00 -1.84 -0.62 0.00 0.00 178.44 175.98 3ikm n GLU 449 N -2.73 -0.36 0.00 1.25 0.28 -1.26 -4.80 120.64 113.02 3ikm n GLU 449 Ca -0.01 -0.38 0.00 0.00 -0.16 0.00 0.00 57.16 56.61 3ikm n GLU 449 Cb 0.11 -0.87 0.00 0.00 1.43 0.00 0.00 31.44 32.11 3ikm n GLU 449 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 3ikm n ASN 450 N -0.06 0.81 -0.13 -1.84 6.94 -0.85 -5.07 115.26 115.05 3ikm n ASN 450 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 3ikm n ASN 450 Cb 0.04 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.46 3ikm n ASN 450 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3ikm n GLY 451 N 2.57 1.10 2.98 4.83 0.00 0.68 -5.01 105.19 112.34 3ikm n GLY 451 Ca 0.00 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.43 3ikm n GLY 451 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ikm s LEU 452 N -0.27 2.01 0.12 0.99 2.01 -1.26 -2.70 118.68 119.59 3ikm s LEU 452 Ca 0.00 -0.76 0.01 0.00 0.01 0.00 0.00 54.13 53.39 3ikm s LEU 452 Cb 0.00 -1.15 -0.04 0.00 0.01 0.00 0.00 46.19 45.01 3ikm s LEU 452 CO 0.00 -0.14 0.28 0.27 1.01 0.00 0.00 176.35 177.77 3ikm s ILE 453 N 1.47 5.32 -0.28 -0.59 -0.00 -1.00 -4.45 121.20 121.67 3ikm s ILE 453 Ca 0.00 -0.47 -0.10 0.00 -0.00 0.00 0.00 60.65 60.08 3ikm s ILE 453 Cb -0.15 -3.69 -0.04 0.00 -0.00 0.00 0.00 42.46 38.58 3ikm s ILE 453 CO -0.09 -0.01 0.16 -1.38 -0.00 0.00 0.00 174.94 173.62 3ikm s HIS 454 N -1.67 3.18 0.32 1.37 -3.43 -1.24 -1.81 115.29 112.01 3ikm s HIS 454 Ca 0.36 -0.12 0.07 0.00 -0.80 0.00 0.00 55.06 54.57 3ikm s HIS 454 Cb -0.12 -2.34 -0.06 0.00 -1.43 0.00 0.00 32.58 28.62 3ikm s HIS 454 CO 0.28 -0.26 -0.04 -0.48 -2.00 0.00 0.00 174.74 172.24 3ikm s LEU 455 N 1.70 2.57 0.00 5.38 2.34 -0.80 -1.71 118.68 128.17 3ikm s LEU 455 Ca 0.07 -1.25 0.00 0.00 0.06 0.00 0.00 54.13 53.01 3ikm s LEU 455 Cb -0.16 -0.74 0.00 0.00 -0.56 0.00 0.00 46.19 44.73 3ikm s LEU 455 CO 0.08 -0.36 0.00 0.54 -1.06 0.00 0.00 176.35 175.55 3ikm n ARG 456 N -0.71 1.56 -3.98 1.48 1.74 -1.26 -1.01 116.66 114.48 3ikm n ARG 456 Ca -0.05 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.94 3ikm n ARG 456 Cb 0.64 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 32.01 3ikm n ARG 456 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3ikm s SER 457 N 1.00 0.15 -0.75 0.55 0.15 -1.26 -3.80 113.70 109.73 3ikm s SER 457 Ca 0.00 -0.88 0.00 0.00 0.70 0.00 0.00 55.95 55.77 3ikm s SER 457 Cb 0.00 0.36 0.36 0.00 -1.71 0.00 0.00 66.02 65.04 3ikm s SER 457 CO 0.00 -0.79 1.74 -1.14 1.20 0.00 0.00 173.24 174.25 3ikm n ARG 458 N -0.12 3.20 0.02 5.44 0.63 0.25 -4.59 116.66 121.48 3ikm n ARG 458 Ca -0.10 -3.93 0.00 0.00 -0.92 0.00 0.00 57.85 52.90 3ikm n ARG 458 Cb 0.63 -2.28 0.00 0.00 0.45 0.00 0.00 32.46 31.25 3ikm n ARG 458 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3ikm n ASP 459 N -0.47 -0.06 -4.29 6.15 8.00 -1.26 -4.47 116.55 120.14 3ikm n ASP 459 Ca 0.49 0.06 -0.31 0.00 0.71 0.00 0.00 54.79 55.74 3ikm n ASP 459 Cb 0.35 0.12 -0.16 0.00 -0.02 0.00 0.00 41.12 41.40 3ikm n ASP 459 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3ikm s THR 460 N -1.12 2.13 -0.29 -3.53 -1.32 -1.26 -5.08 115.64 105.17 3ikm s THR 460 Ca 0.00 -1.05 -0.14 0.00 -1.21 0.00 0.00 61.69 59.29 3ikm s THR 460 Cb 0.00 -1.77 -0.03 0.00 -1.51 0.00 0.00 72.50 69.19 3ikm s THR 460 CO 0.00 0.57 0.33 0.28 -2.21 0.00 0.00 174.62 173.60 3ikm s THR 461 N -0.30 5.20 -0.41 5.08 -1.32 -1.26 -4.48 115.64 118.15 3ikm s THR 461 Ca 0.01 0.37 0.06 0.00 -1.21 0.00 0.00 61.69 60.92 3ikm s THR 461 Cb -0.13 -3.69 0.20 0.00 -1.51 0.00 0.00 72.50 67.38 3ikm s THR 461 CO 0.02 0.12 0.44 0.23 -2.21 0.00 0.00 174.62 173.22 3ikm n MET 462 N 5.29 0.41 -1.59 7.08 2.81 -1.26 -5.09 117.12 124.77 3ikm n MET 462 Ca -0.10 -3.12 -0.55 0.00 -1.81 0.00 0.00 57.70 52.12 3ikm n MET 462 Cb 0.51 -1.48 -0.07 0.00 -0.71 0.00 0.00 33.22 31.46 3ikm n MET 462 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3ikm n LYS 463 N 2.25 1.08 -3.35 0.03 4.01 -1.26 -4.87 118.16 116.05 3ikm n LYS 463 Ca 0.26 0.36 -0.20 0.00 -0.51 0.00 0.00 58.31 58.22 3ikm n LYS 463 Cb 0.51 -2.18 -0.01 0.00 -0.51 0.00 0.00 35.03 32.83 3ikm n LYS 463 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 3ikm s GLU 464 N 4.60 2.60 0.17 1.97 2.02 -0.18 -4.98 118.70 124.90 3ikm s GLU 464 Ca 1.03 -1.47 0.10 0.00 0.02 0.00 0.00 54.97 54.65 3ikm s GLU 464 Cb -1.03 -2.51 -0.04 0.00 0.10 0.00 0.00 34.13 30.64 3ikm s GLU 464 CO 0.60 -0.30 -0.15 -1.64 0.02 0.00 0.00 175.26 173.80 3ikm s MET 465 N -4.26 1.86 -0.04 1.61 -1.94 -1.26 -1.90 119.30 113.38 3ikm s MET 465 Ca 0.51 -1.32 -0.29 0.00 -1.71 0.00 0.00 55.69 52.88 3ikm s MET 465 Cb -0.06 -2.07 0.10 0.00 2.01 0.00 0.00 34.83 34.81 3ikm s MET 465 CO 0.30 0.43 0.84 1.41 -0.01 0.00 0.00 175.02 177.99 3ikm s MET 466 N -2.64 0.87 -0.82 2.03 1.75 -0.75 -4.91 119.30 114.83 3ikm s MET 466 Ca 0.22 -0.07 -0.25 0.00 -1.25 0.00 0.00 55.69 54.35 3ikm s MET 466 Cb -0.09 0.40 0.00 0.00 2.84 0.00 0.00 34.83 37.99 3ikm s MET 466 CO 0.13 -0.33 1.64 -1.01 -0.65 0.00 0.00 175.02 174.80 3ikm s HIS 467 N -2.17 2.06 -1.01 4.11 3.76 -1.26 -2.36 115.29 118.41 3ikm s HIS 467 Ca -0.01 0.15 -0.24 0.00 -0.15 0.00 0.00 55.06 54.81 3ikm s HIS 467 Cb -0.01 -4.36 -0.07 0.00 1.11 0.00 0.00 32.58 29.25 3ikm s HIS 467 CO -0.02 -2.02 1.97 -1.50 -0.85 0.00 0.00 174.74 172.32 3ikm s ILE 468 N 7.54 3.44 0.00 0.60 2.07 -1.10 -3.42 121.20 130.34 3ikm s ILE 468 Ca 0.55 -0.54 0.00 0.00 -1.41 0.00 0.00 60.65 59.25 3ikm s ILE 468 Cb -0.07 -4.16 0.00 0.00 0.13 0.00 0.00 42.46 38.36 3ikm s ILE 468 CO 0.06 -0.88 0.00 -1.54 -1.91 0.00 0.00 174.94 170.68 3ikm n SER 469 N 14.63 -0.00 0.00 4.50 3.41 -1.26 -4.84 113.62 130.06 3ikm n SER 469 Ca 0.42 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 3ikm n SER 469 Cb 0.47 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 3ikm n SER 469 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3ikm n LYS 470 N -1.55 0.00 0.00 4.33 4.81 -1.22 -1.19 118.16 123.34 3ikm n LYS 470 Ca 0.00 0.20 0.00 0.00 -0.87 0.00 0.00 58.31 57.64 3ikm n LYS 470 Cb 0.00 -1.58 0.00 0.00 0.02 0.00 0.00 35.03 33.47 3ikm n LYS 470 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 3ikm n LEU 471 N -1.14 0.00 0.03 3.14 7.94 -1.25 -1.91 117.00 123.80 3ikm n LEU 471 Ca 0.00 0.32 -0.01 0.00 -1.11 0.00 0.00 56.01 55.21 3ikm n LEU 471 Cb 0.08 -0.32 -0.01 0.00 0.53 0.00 0.00 43.42 43.70 3ikm n LEU 471 CO 0.00 -0.32 0.16 0.50 -1.11 0.00 0.00 177.39 176.61 3ikm h LYS 472 N 0.00 -0.09 0.00 1.96 1.63 -1.53 -3.22 116.57 115.32 3ikm h LYS 472 Ca 0.00 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 3ikm h LYS 472 Cb 0.26 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.91 3ikm h LYS 472 CO 0.00 -0.06 0.00 -0.25 -3.45 0.00 0.00 179.45 175.69 3ikm n ASP 473 N -2.68 0.00 -4.91 4.20 8.00 -0.80 -4.48 116.55 115.87 3ikm n ASP 473 Ca -0.01 -0.22 -0.27 0.00 0.71 0.00 0.00 54.79 54.99 3ikm n ASP 473 Cb 0.04 -0.12 0.07 0.00 -0.02 0.00 0.00 41.12 41.09 3ikm n ASP 473 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3ikm s PHE 474 N -2.23 3.03 0.00 1.24 5.36 -0.81 -3.95 117.98 120.63 3ikm s PHE 474 Ca 0.18 0.64 0.00 0.00 -0.96 0.00 0.00 56.93 56.78 3ikm s PHE 474 Cb 0.09 -3.19 0.00 0.00 -0.34 0.00 0.00 43.02 39.58 3ikm s PHE 474 CO 0.18 -1.39 0.00 1.28 -1.46 0.00 0.00 175.22 173.83 3ikm n LEU 475 N -2.99 0.00 -0.28 6.12 4.77 -1.26 -4.42 117.00 118.94 3ikm n LEU 475 Ca 0.07 0.00 0.27 0.00 -0.03 0.00 0.00 56.01 56.32 3ikm n LEU 475 Cb 0.60 0.00 0.49 0.00 -2.33 0.00 0.00 43.42 42.18 3ikm n LEU 475 CO 0.54 0.00 0.90 -0.38 -1.33 0.00 0.00 177.39 177.12 3ikm n ILE 476 N 0.00 -0.36 0.11 -0.08 2.08 -1.26 0.55 119.36 120.40 3ikm n ILE 476 Ca 0.00 1.76 -0.04 0.00 0.56 0.00 0.00 62.75 65.03 3ikm n ILE 476 Cb 0.00 -2.84 -0.02 0.00 -0.75 0.00 0.00 39.64 36.02 3ikm n ILE 476 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 3ikm h LYS 477 N 0.00 -0.27 -0.40 0.38 1.79 -1.77 2.93 116.57 119.22 3ikm h LYS 477 Ca 0.72 0.02 0.12 0.00 -2.18 0.00 0.00 60.65 59.33 3ikm h LYS 477 Cb 1.89 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 32.59 3ikm h LYS 477 CO -0.67 -0.18 0.43 -0.92 -1.08 0.00 0.00 179.45 177.02 3ikm h TYR 478 N -0.37 0.00 0.00 -1.35 5.03 0.74 0.52 116.97 121.54 3ikm h TYR 478 Ca -0.03 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.28 3ikm h TYR 478 Cb 0.22 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.50 3ikm h TYR 478 CO 0.12 0.00 0.00 -0.89 -1.32 0.00 0.00 178.16 176.07 3ikm n ILE 479 N -3.74 0.00 -0.34 1.81 -0.00 2.18 -2.42 119.36 116.84 3ikm n ILE 479 Ca 0.07 0.31 0.13 0.00 -0.00 0.00 0.00 62.75 63.26 3ikm n ILE 479 Cb 0.61 -0.95 0.34 0.00 -0.00 0.00 0.00 39.64 39.64 3ikm n ILE 479 CO 0.00 0.00 0.00 -1.28 -0.00 0.00 0.00 176.55 175.27 3ikm h SER 480 N 0.00 0.75 0.48 4.38 0.87 0.54 0.56 113.55 121.13 3ikm h SER 480 Ca 0.00 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 3ikm h SER 480 Cb 0.00 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 3ikm h SER 480 CO 0.00 0.28 -0.06 -0.24 -0.53 0.00 0.00 176.83 176.28 3ikm n SER 481 N -4.71 0.22 0.06 6.23 2.88 0.18 -3.05 113.62 115.43 3ikm n SER 481 Ca 0.22 -0.33 0.13 0.00 -1.33 0.00 0.00 58.87 57.57 3ikm n SER 481 Cb 0.57 -0.18 0.46 0.00 -0.75 0.00 0.00 64.21 64.31 3ikm n SER 481 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ikm n ALA 482 N -1.15 2.37 1.57 -1.46 0.00 0.19 -2.16 120.51 119.87 3ikm n ALA 482 Ca 0.14 -0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.65 3ikm n ALA 482 Cb 0.26 -1.44 0.60 0.00 0.00 0.00 0.00 19.45 18.86 3ikm n ALA 482 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3ikm n LYS 483 N -1.98 1.44 0.00 0.00 4.81 -1.17 -4.64 118.16 116.63 3ikm n LYS 483 Ca 0.06 -0.72 0.00 0.00 -0.87 0.00 0.00 58.31 56.78 3ikm n LYS 483 Cb 0.40 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 33.96 3ikm n LYS 483 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3ikm n ASN 484 N -0.15 0.00 0.00 3.14 4.13 -0.92 -5.00 115.26 116.46 3ikm n ASN 484 Ca 0.19 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.45 3ikm n ASN 484 Cb 0.31 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.55 3ikm n ASN 484 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06