#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ksq s PHE 55 N 0.00 3.82 -0.46 1.61 0.40 -1.26 -5.03 117.98 117.06 3ksq s PHE 55 Ca 0.00 1.81 0.02 0.00 -0.60 0.00 0.00 56.93 58.16 3ksq s PHE 55 Cb 0.00 -3.06 0.12 0.00 0.51 0.00 0.00 43.02 40.60 3ksq s PHE 55 CO 0.00 0.20 0.21 -1.17 0.70 0.00 0.00 175.22 175.16 3ksq s LEU 56 N -0.13 4.72 0.37 -0.37 2.96 -1.26 -5.10 118.68 119.87 3ksq s LEU 56 Ca 0.46 -2.58 -0.26 0.00 -0.22 0.00 0.00 54.13 51.54 3ksq s LEU 56 Cb -0.24 -1.69 -0.12 0.00 0.50 0.00 0.00 46.19 44.64 3ksq s LEU 56 CO 0.30 -0.34 0.99 -0.24 -1.32 0.00 0.00 176.35 175.74 3ksq n SER 57 N 3.74 1.19 0.27 3.68 2.88 -1.26 -4.90 113.62 119.21 3ksq n SER 57 Ca 0.04 1.09 0.15 0.00 -1.33 0.00 0.00 58.87 58.82 3ksq n SER 57 Cb 0.37 -1.32 0.74 0.00 -0.75 0.00 0.00 64.21 63.26 3ksq n SER 57 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3ksq h LEU 58 N 1.70 0.00 -1.45 2.46 5.85 -1.98 -2.30 115.31 119.59 3ksq h LEU 58 Ca -0.42 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3ksq h LEU 58 Cb 1.34 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.37 3ksq h LEU 58 CO 0.58 0.09 -0.17 0.47 -0.34 0.00 0.00 178.44 179.06 3ksq n ASP 59 N -3.36 2.37 -4.71 1.25 9.92 -1.26 -4.94 116.55 115.83 3ksq n ASP 59 Ca -0.01 -1.69 -0.43 0.00 -0.53 0.00 0.00 54.79 52.13 3ksq n ASP 59 Cb 0.27 0.20 -0.02 0.00 -0.64 0.00 0.00 41.12 40.93 3ksq n ASP 59 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 3ksq n SER 60 N 0.66 3.25 0.31 -2.24 2.88 -0.87 -4.89 113.62 112.72 3ksq n SER 60 Ca 0.10 1.16 0.18 0.00 -1.33 0.00 0.00 58.87 58.99 3ksq n SER 60 Cb 0.48 -1.51 1.02 0.00 -0.75 0.00 0.00 64.21 63.45 3ksq n SER 60 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3ksq h PRO 61 N 4.10 0.00 -0.57 -1.46 0.13 -1.94 -2.35 132.00 129.90 3ksq h PRO 61 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3ksq h PRO 61 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3ksq h PRO 61 CO 0.74 0.01 0.00 0.25 -0.23 0.00 0.00 178.00 178.78 3ksq n THR 62 N -3.46 2.31 -1.94 1.56 -2.24 -1.26 -4.98 114.28 104.27 3ksq n THR 62 Ca -0.03 -1.37 -0.41 0.00 -2.27 0.00 0.00 64.05 59.98 3ksq n THR 62 Cb 0.10 -0.09 -0.01 0.00 -2.10 0.00 0.00 70.33 68.23 3ksq n THR 62 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3ksq s TYR 63 N -2.37 2.83 0.00 4.78 5.04 -0.89 -5.01 117.35 121.73 3ksq s TYR 63 Ca 0.51 1.20 0.07 0.00 -2.44 0.00 0.00 57.07 56.42 3ksq s TYR 63 Cb 0.37 -3.88 -0.02 0.00 0.35 0.00 0.00 41.96 38.78 3ksq s TYR 63 CO 0.19 -2.60 -0.23 0.08 -1.34 0.00 0.00 175.55 171.65 3ksq s VAL 64 N -0.87 1.80 0.47 3.14 1.01 -1.26 -5.06 120.40 119.63 3ksq s VAL 64 Ca 0.53 -1.07 -0.25 0.00 0.00 0.00 0.00 61.98 61.20 3ksq s VAL 64 Cb -0.44 -1.51 -0.08 0.00 0.00 0.00 0.00 36.38 34.35 3ksq s VAL 64 CO 0.55 0.42 1.44 -0.76 0.00 0.00 0.00 175.10 176.75 3ksq s LEU 65 N -0.76 4.07 0.38 3.92 1.43 -1.26 -4.91 118.68 121.55 3ksq s LEU 65 Ca 0.09 2.94 0.09 0.00 -1.03 0.00 0.00 54.13 56.21 3ksq s LEU 65 Cb -0.09 -3.98 0.83 0.00 0.03 0.00 0.00 46.19 42.98 3ksq s LEU 65 CO 0.00 -1.26 1.93 1.88 0.23 0.00 0.00 176.35 179.13 3ksq h TYR 66 N 2.18 0.71 0.00 0.29 -1.99 -1.96 -0.63 116.97 115.58 3ksq h TYR 66 Ca -0.51 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.24 3ksq h TYR 66 Cb 1.27 -0.23 -0.00 0.00 2.00 0.00 0.00 36.73 39.77 3ksq h TYR 66 CO 0.49 0.33 -0.00 0.07 -0.00 0.00 0.00 178.16 179.05 3ksq h ARG 67 N 0.66 0.00 -0.63 4.88 0.11 -1.91 -1.96 114.38 115.53 3ksq h ARG 67 Ca 0.35 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.43 3ksq h ARG 67 Cb 0.47 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.55 3ksq h ARG 67 CO -0.13 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.70 3ksq n ASP 68 N -3.10 4.05 -4.74 0.08 8.00 -0.25 -4.96 116.55 115.63 3ksq n ASP 68 Ca -0.02 -2.17 -0.35 0.00 0.71 0.00 0.00 54.79 52.96 3ksq n ASP 68 Cb 0.16 -0.48 -0.08 0.00 -0.02 0.00 0.00 41.12 40.70 3ksq n ASP 68 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3ksq s ARG 69 N -1.32 3.91 0.05 -1.24 0.52 -0.74 -4.92 118.95 115.21 3ksq s ARG 69 Ca 0.45 -0.23 -0.24 0.00 -0.52 0.00 0.00 55.73 55.19 3ksq s ARG 69 Cb 0.26 -3.29 -0.17 0.00 0.52 0.00 0.00 34.95 32.27 3ksq s ARG 69 CO 0.27 0.43 1.58 0.00 0.02 0.00 0.00 175.30 177.60 3ksq h ALA 70 N 6.21 -0.03 0.00 2.13 0.00 -1.93 -2.96 119.26 122.68 3ksq h ALA 70 Ca -0.44 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3ksq h ALA 70 Cb 1.17 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3ksq h ALA 70 CO 0.70 -0.44 0.00 -0.85 0.00 0.00 0.00 179.25 178.66 3ksq n GLU 71 N -5.03 0.14 -0.00 0.00 0.00 -1.26 -1.77 120.64 112.72 3ksq n GLU 71 Ca -0.08 0.05 0.00 0.00 0.00 0.00 0.00 57.16 57.14 3ksq n GLU 71 Cb 0.11 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.06 3ksq n GLU 71 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 3ksq n TRP 72 N -1.06 0.01 -0.05 -1.84 7.02 -1.12 -4.81 117.44 115.58 3ksq n TRP 72 Ca 0.04 -0.09 0.09 0.00 -1.02 0.00 0.00 57.50 56.52 3ksq n TRP 72 Cb 0.02 -0.01 0.48 0.00 -2.42 0.00 0.00 31.31 29.38 3ksq n TRP 72 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3ksq h ALA 73 N 0.17 1.92 0.00 6.99 0.00 -1.32 -2.61 119.26 124.41 3ksq h ALA 73 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3ksq h ALA 73 Cb 0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3ksq h ALA 73 CO 0.00 -0.02 -0.27 0.38 0.00 0.00 0.00 179.25 179.34 3ksq h ASP 74 N 0.45 0.00 -3.04 0.00 3.04 -1.87 -3.44 116.42 111.56 3ksq h ASP 74 Ca 0.23 0.00 -0.62 0.00 -3.24 0.00 0.00 57.03 53.40 3ksq h ASP 74 Cb 0.35 0.00 -0.08 0.00 -1.04 0.00 0.00 39.33 38.55 3ksq h ASP 74 CO -0.06 0.27 -0.36 -0.51 -2.04 0.00 0.00 179.24 176.54 3ksq s ILE 75 N -4.19 5.32 -0.18 4.15 1.10 -0.99 -5.08 121.20 121.33 3ksq s ILE 75 Ca -0.03 0.47 -0.20 0.00 -0.51 0.00 0.00 60.65 60.38 3ksq s ILE 75 Cb 0.14 -3.56 -0.03 0.00 0.15 0.00 0.00 42.46 39.16 3ksq s ILE 75 CO 0.68 0.50 0.61 -1.81 -2.11 0.00 0.00 174.94 172.81 3ksq s ASP 76 N -0.32 6.69 0.49 4.50 1.11 -1.26 -5.04 116.67 122.84 3ksq s ASP 76 Ca 0.17 0.84 -0.23 0.00 0.18 0.00 0.00 52.55 53.51 3ksq s ASP 76 Cb -0.13 -2.34 -0.06 0.00 1.07 0.00 0.00 42.92 41.45 3ksq s ASP 76 CO 0.05 -0.22 1.27 -2.16 1.18 0.00 0.00 175.17 175.29 3ksq s PRO 77 N 1.66 3.49 -0.34 8.23 0.04 -1.26 -4.76 135.00 142.06 3ksq s PRO 77 Ca 0.29 2.04 -0.11 0.00 0.04 0.00 0.00 61.00 63.25 3ksq s PRO 77 Cb -0.16 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 32.01 3ksq s PRO 77 CO 0.11 -0.85 0.20 0.08 0.04 0.00 0.00 177.00 176.58 3ksq s VAL 78 N -1.40 4.81 0.66 -0.36 1.01 0.51 -4.95 120.40 120.68 3ksq s VAL 78 Ca 0.66 -0.51 -0.15 0.00 0.00 0.00 0.00 61.98 61.99 3ksq s VAL 78 Cb -0.35 -3.54 -0.00 0.00 0.00 0.00 0.00 36.38 32.49 3ksq s VAL 78 CO 0.43 -0.06 1.11 -2.16 0.00 0.00 0.00 175.10 174.41 3ksq s PRO 79 N 1.63 2.82 0.13 2.72 0.04 -1.26 -4.45 135.00 136.62 3ksq s PRO 79 Ca 0.04 1.39 -0.30 0.00 0.04 0.00 0.00 61.00 62.17 3ksq s PRO 79 Cb -0.18 -1.95 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 3ksq s PRO 79 CO 0.08 -1.24 1.22 -1.14 0.04 0.00 0.00 177.00 175.96 3ksq s GLN 80 N -4.09 4.45 -1.03 4.56 0.74 -1.26 -4.97 119.66 118.05 3ksq s GLN 80 Ca 0.67 1.86 -0.18 0.00 0.05 0.00 0.00 55.36 57.76 3ksq s GLN 80 Cb -0.20 -3.28 0.13 0.00 1.10 0.00 0.00 33.01 30.76 3ksq s GLN 80 CO 0.41 -0.20 1.26 1.21 -0.55 0.00 0.00 175.29 177.43 3ksq s ASN 81 N 0.62 6.76 0.00 6.67 2.47 -1.26 -4.82 114.94 125.37 3ksq s ASN 81 Ca 0.57 -2.29 0.28 0.00 0.42 0.00 0.00 52.86 51.84 3ksq s ASN 81 Cb -0.32 -2.42 1.10 0.00 -1.45 0.00 0.00 41.25 38.16 3ksq s ASN 81 CO 0.33 -1.01 1.78 0.47 -3.72 0.00 0.00 177.10 174.95 3ksq n ASP 82 N 6.54 0.66 0.00 -4.21 8.00 -1.26 -5.06 116.55 121.22 3ksq n ASP 82 Ca 0.29 -0.71 0.00 0.00 0.71 0.00 0.00 54.79 55.08 3ksq n ASP 82 Cb 0.47 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 3ksq n ASP 82 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ksq n GLY 83 N 1.29 -0.56 0.10 0.44 0.00 -1.26 -4.54 105.19 100.66 3ksq n GLY 83 Ca 0.14 -1.74 -0.12 0.00 0.00 0.00 0.00 46.02 44.30 3ksq n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ksq h PRO 84 N 0.00 0.21 -4.25 1.61 0.13 -2.03 -3.39 132.00 124.28 3ksq h PRO 84 Ca 0.00 -0.08 -0.72 0.00 -0.87 0.00 0.00 66.00 64.33 3ksq h PRO 84 Cb 0.00 -0.01 -0.30 0.00 0.13 0.00 0.00 31.00 30.81 3ksq h PRO 84 CO 0.00 0.51 -0.39 -1.12 -0.23 0.00 0.00 178.00 176.76 3ksq s SER 85 N -5.78 5.65 0.48 1.44 0.01 -1.26 -5.09 113.70 109.14 3ksq s SER 85 Ca -0.14 -2.04 -0.19 0.00 1.31 0.00 0.00 55.95 54.88 3ksq s SER 85 Cb 0.05 -1.98 -0.09 0.00 0.21 0.00 0.00 66.02 64.21 3ksq s SER 85 CO 0.71 -0.64 1.00 -2.16 0.41 0.00 0.00 173.24 172.55 3ksq s PRO 86 N 1.17 3.95 0.05 12.44 0.04 -1.26 -5.08 135.00 146.31 3ksq s PRO 86 Ca 0.07 1.18 0.06 0.00 0.04 0.00 0.00 61.00 62.35 3ksq s PRO 86 Cb -0.25 -2.13 -0.02 0.00 0.04 0.00 0.00 34.50 32.14 3ksq s PRO 86 CO -0.02 -0.28 -0.17 0.14 0.04 0.00 0.00 177.00 176.71 3ksq s VAL 87 N -2.22 1.36 -1.71 -0.36 -7.23 -1.26 -4.79 120.40 104.19 3ksq s VAL 87 Ca 0.63 -1.13 -0.15 0.00 -1.81 0.00 0.00 61.98 59.53 3ksq s VAL 87 Cb -0.12 -1.21 0.14 0.00 0.56 0.00 0.00 36.38 35.74 3ksq s VAL 87 CO 0.21 0.06 0.51 1.33 -0.31 0.00 0.00 175.10 176.90 3ksq n VAL 88 N 1.79 -0.84 -2.59 1.32 0.24 -1.26 -4.86 118.33 112.14 3ksq n VAL 88 Ca -0.18 -0.16 -0.43 0.00 -2.04 0.00 0.00 64.34 61.53 3ksq n VAL 88 Cb 0.54 -1.18 -0.02 0.00 -1.47 0.00 0.00 33.84 31.71 3ksq n VAL 88 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3ksq s GLN 89 N -7.11 4.29 -0.09 7.34 0.74 -1.26 -5.02 119.66 118.55 3ksq s GLN 89 Ca 0.55 1.47 -0.21 0.00 0.05 0.00 0.00 55.36 57.21 3ksq s GLN 89 Cb -0.31 -3.64 -0.04 0.00 1.10 0.00 0.00 33.01 30.12 3ksq s GLN 89 CO 0.98 -0.57 0.62 0.42 -0.55 0.00 0.00 175.29 176.18 3ksq s ILE 90 N 2.94 5.10 -1.06 -2.34 1.01 -1.26 -4.98 121.20 120.61 3ksq s ILE 90 Ca 0.49 1.25 -0.19 0.00 0.00 0.00 0.00 60.65 62.20 3ksq s ILE 90 Cb -0.18 -3.95 0.11 0.00 0.01 0.00 0.00 42.46 38.44 3ksq s ILE 90 CO 0.12 0.27 1.36 -0.63 0.00 0.00 0.00 174.94 176.06 3ksq s ILE 91 N 0.80 4.49 0.58 2.92 -1.09 -1.26 -4.98 121.20 122.66 3ksq s ILE 91 Ca 0.33 -1.61 -0.19 0.00 -2.23 0.00 0.00 60.65 56.95 3ksq s ILE 91 Cb -0.17 -4.94 -0.04 0.00 -1.58 0.00 0.00 42.46 35.74 3ksq s ILE 91 CO 0.15 -1.72 1.24 -0.31 -1.23 0.00 0.00 174.94 173.07 3ksq s TYR 92 N 3.30 2.38 0.73 3.97 1.51 -1.26 -5.01 117.35 122.97 3ksq s TYR 92 Ca 0.41 1.49 -0.12 0.00 -1.01 0.00 0.00 57.07 57.84 3ksq s TYR 92 Cb -0.02 -3.55 0.04 0.00 -0.11 0.00 0.00 41.96 38.32 3ksq s TYR 92 CO -0.05 -2.35 1.10 -1.54 -1.11 0.00 0.00 175.55 171.59 3ksq s SER 93 N -1.45 4.72 0.23 2.29 1.04 -1.26 -4.82 113.70 114.45 3ksq s SER 93 Ca 0.76 1.88 -0.07 0.00 0.48 0.00 0.00 55.95 58.99 3ksq s SER 93 Cb -0.33 -2.53 0.28 0.00 0.10 0.00 0.00 66.02 63.55 3ksq s SER 93 CO 0.36 -1.89 1.84 -0.08 0.98 0.00 0.00 173.24 174.45 3ksq h GLU 94 N -0.74 0.87 -0.73 4.02 4.57 -1.99 -1.99 114.58 118.60 3ksq h GLU 94 Ca -0.45 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 57.65 3ksq h GLU 94 Cb 1.24 -0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 29.60 3ksq h GLU 94 CO 0.52 0.57 0.31 0.87 -1.18 0.00 0.00 179.01 180.11 3ksq h LYS 95 N 0.89 1.07 0.22 1.92 1.57 -1.99 -1.34 116.57 118.91 3ksq h LYS 95 Ca 0.34 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3ksq h LYS 95 Cb 0.14 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.27 3ksq h LYS 95 CO -0.16 0.87 -0.11 0.35 -0.57 0.00 0.00 179.45 179.83 3ksq h PHE 96 N 1.03 -0.28 -0.73 -1.35 3.57 -1.88 -2.44 116.94 114.87 3ksq h PHE 96 Ca 0.24 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.83 3ksq h PHE 96 Cb 0.18 0.09 -0.07 0.00 2.79 0.00 0.00 35.95 38.94 3ksq h PHE 96 CO 0.01 0.06 0.37 -0.09 -2.23 0.00 0.00 178.31 176.43 3ksq h ARG 97 N -0.65 0.61 0.09 1.11 2.43 -1.36 -1.25 114.38 115.36 3ksq h ARG 97 Ca -0.03 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3ksq h ARG 97 Cb 0.46 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 3ksq h ARG 97 CO 0.05 0.40 -0.04 0.22 -1.51 0.00 0.00 179.97 179.09 3ksq h ASP 98 N 0.62 -0.10 -0.41 -3.80 3.58 -1.24 0.06 116.42 115.14 3ksq h ASP 98 Ca 0.36 -0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.65 3ksq h ASP 98 Cb 0.37 0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.43 3ksq h ASP 98 CO -0.27 0.09 0.21 0.58 -2.88 0.00 0.00 179.24 176.97 3ksq h VAL 99 N -0.29 1.16 0.00 2.25 2.07 -1.22 -2.72 116.25 117.51 3ksq h VAL 99 Ca -0.01 -0.45 -0.08 0.00 0.82 0.00 0.00 66.70 66.98 3ksq h VAL 99 Cb 0.24 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3ksq h VAL 99 CO 0.02 0.18 -0.37 1.88 0.02 0.00 0.00 177.57 179.30 3ksq h TYR 100 N 0.52 0.00 -0.13 1.57 -1.99 -1.15 0.94 116.97 116.74 3ksq h TYR 100 Ca 0.14 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.69 3ksq h TYR 100 Cb 0.09 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.82 3ksq h TYR 100 CO -0.02 0.37 -0.66 -0.44 -0.00 0.00 0.00 178.16 177.42 3ksq h ASP 101 N 0.00 0.58 0.33 3.88 3.32 -0.92 -1.62 116.42 122.00 3ksq h ASP 101 Ca -0.00 -0.35 -0.20 0.00 0.02 0.00 0.00 57.03 56.49 3ksq h ASP 101 Cb 0.80 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 40.18 3ksq h ASP 101 CO 0.05 1.08 -0.83 1.88 -1.72 0.00 0.00 179.24 179.70 3ksq h TYR 102 N 0.36 0.54 -0.58 4.55 0.05 -1.22 0.15 116.97 120.83 3ksq h TYR 102 Ca -0.02 -0.27 -0.09 0.00 0.05 0.00 0.00 58.73 58.41 3ksq h TYR 102 Cb 1.22 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 38.87 3ksq h TYR 102 CO 0.05 1.06 0.02 0.35 -1.05 0.00 0.00 178.16 178.58 3ksq h PHE 103 N 0.24 1.10 -0.88 4.88 3.57 -0.74 -1.94 116.94 123.17 3ksq h PHE 103 Ca -0.05 -0.18 0.02 0.00 3.53 0.00 0.00 57.97 61.28 3ksq h PHE 103 Cb 1.44 -0.29 -0.05 0.00 2.79 0.00 0.00 35.95 39.84 3ksq h PHE 103 CO 0.05 0.98 0.58 -0.09 -2.23 0.00 0.00 178.31 177.60 3ksq h ARG 104 N 0.91 1.13 -0.11 1.11 2.43 -1.31 -0.16 114.38 118.39 3ksq h ARG 104 Ca 0.17 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 3ksq h ARG 104 Cb 0.53 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 29.82 3ksq h ARG 104 CO 0.03 0.74 -0.04 0.00 -1.51 0.00 0.00 179.97 179.19 3ksq h ALA 105 N 1.46 0.15 -0.13 2.80 0.00 -1.26 -0.58 119.26 121.70 3ksq h ALA 105 Ca 0.34 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 3ksq h ALA 105 Cb -0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3ksq h ALA 105 CO -0.09 -0.10 -0.30 -0.39 0.00 0.00 0.00 179.25 178.38 3ksq h VAL 106 N -0.13 1.26 0.05 0.00 -1.51 -1.04 -2.46 116.25 112.43 3ksq h VAL 106 Ca 0.03 -1.25 -0.00 0.00 -1.23 0.00 0.00 66.70 64.24 3ksq h VAL 106 Cb 0.48 1.50 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 3ksq h VAL 106 CO 0.01 0.38 -0.02 0.25 -1.23 0.00 0.00 177.57 176.96 3ksq h LEU 107 N 0.22 -0.06 -1.13 4.19 5.85 -0.97 0.12 115.31 123.53 3ksq h LEU 107 Ca 0.03 -0.47 0.10 0.00 0.84 0.00 0.00 57.88 58.37 3ksq h LEU 107 Cb 0.65 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.63 3ksq h LEU 107 CO 0.05 0.46 0.60 1.56 -0.34 0.00 0.00 178.44 180.77 3ksq h GLN 108 N -0.59 0.93 -0.01 1.25 4.20 -1.07 -0.43 115.11 119.38 3ksq h GLN 108 Ca -0.01 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.65 3ksq h GLN 108 Cb 0.52 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.09 3ksq h GLN 108 CO 0.01 0.62 -0.19 2.89 -0.67 0.00 0.00 178.83 181.49 3ksq n ARG 109 N -4.54 1.22 -3.73 1.46 1.85 -0.93 -4.97 116.66 107.01 3ksq n ARG 109 Ca 0.16 -0.78 -0.22 0.00 -1.00 0.00 0.00 57.85 56.01 3ksq n ARG 109 Cb 0.29 -1.48 0.03 0.00 -1.05 0.00 0.00 32.46 30.25 3ksq n ARG 109 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 3ksq n ASP 110 N -0.21 -1.59 -4.61 2.89 2.03 -0.10 -4.92 116.55 110.04 3ksq n ASP 110 Ca 0.14 -0.82 -0.43 0.00 0.52 0.00 0.00 54.79 54.20 3ksq n ASP 110 Cb 0.38 -4.02 -0.02 0.00 -0.72 0.00 0.00 41.12 36.74 3ksq n ASP 110 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 3ksq s GLU 111 N -6.07 3.79 -1.08 -0.67 2.12 0.23 -4.94 118.70 112.08 3ksq s GLU 111 Ca 0.08 0.69 -0.05 0.00 0.36 0.00 0.00 54.97 56.05 3ksq s GLU 111 Cb -0.04 -3.88 0.30 0.00 0.26 0.00 0.00 34.13 30.77 3ksq s GLU 111 CO 0.82 -1.29 1.36 0.54 -0.54 0.00 0.00 175.26 176.14 3ksq n ARG 112 N 7.65 4.15 -4.48 4.30 1.74 -1.26 -4.76 116.66 124.00 3ksq n ARG 112 Ca 0.12 -4.53 -0.24 0.00 -0.77 0.00 0.00 57.85 52.43 3ksq n ARG 112 Cb 0.49 -2.52 -0.10 0.00 -1.02 0.00 0.00 32.46 29.31 3ksq n ARG 112 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3ksq s SER 113 N -0.89 3.35 0.32 0.55 1.04 -1.26 -4.89 113.70 111.91 3ksq s SER 113 Ca 0.31 -1.15 0.01 0.00 0.48 0.00 0.00 55.95 55.61 3ksq s SER 113 Cb 0.01 -0.27 0.53 0.00 0.10 0.00 0.00 66.02 66.38 3ksq s SER 113 CO 0.05 -0.19 1.89 -0.08 0.98 0.00 0.00 173.24 175.89 3ksq h GLU 114 N 2.19 0.74 -0.23 4.02 4.57 -1.99 -1.32 114.58 122.55 3ksq h GLU 114 Ca -0.41 -0.12 -0.15 0.00 -1.18 0.00 0.00 59.36 57.50 3ksq h GLU 114 Cb 1.25 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.70 3ksq h GLU 114 CO 0.67 0.63 -0.48 0.07 -1.18 0.00 0.00 179.01 178.72 3ksq h ARG 115 N 0.72 0.62 -0.50 1.92 0.11 -1.97 -2.06 114.38 113.23 3ksq h ARG 115 Ca 0.17 -0.35 -0.08 0.00 0.10 0.00 0.00 59.98 59.82 3ksq h ARG 115 Cb 0.20 0.03 -0.02 0.00 1.11 0.00 0.00 29.97 31.29 3ksq h ARG 115 CO -0.01 0.96 -0.01 0.00 0.10 0.00 0.00 179.97 181.01 3ksq h ALA 116 N 0.98 1.05 -0.13 0.08 0.00 -1.70 -1.44 119.26 118.10 3ksq h ALA 116 Ca 0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3ksq h ALA 116 Cb 1.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3ksq h ALA 116 CO 0.09 0.59 0.06 0.35 0.00 0.00 0.00 179.25 180.35 3ksq h PHE 117 N 0.78 0.19 -0.37 0.00 3.57 -1.06 -1.93 116.94 118.12 3ksq h PHE 117 Ca 0.15 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.57 3ksq h PHE 117 Cb 0.48 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 3ksq h PHE 117 CO 0.03 0.25 -0.05 0.87 -2.23 0.00 0.00 178.31 177.17 3ksq h LYS 118 N 0.07 0.61 -0.84 1.11 1.57 -1.29 -2.47 116.57 115.33 3ksq h LYS 118 Ca 0.04 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.63 3ksq h LYS 118 Cb 0.14 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 3ksq h LYS 118 CO -0.00 0.67 0.39 1.25 -0.57 0.00 0.00 179.45 181.19 3ksq h LEU 119 N 0.57 1.12 -1.65 2.94 5.85 -0.90 -2.33 115.31 120.91 3ksq h LEU 119 Ca 0.11 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 3ksq h LEU 119 Cb 0.44 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 3ksq h LEU 119 CO 0.02 0.95 0.12 0.71 -0.34 0.00 0.00 178.44 179.90 3ksq h THR 120 N 1.21 1.10 -0.77 1.05 1.35 -0.87 -0.65 112.91 115.31 3ksq h THR 120 Ca 0.29 -0.27 -0.02 0.00 -0.55 0.00 0.00 66.41 65.86 3ksq h THR 120 Cb 0.14 0.77 -0.04 0.00 -1.73 0.00 0.00 68.15 67.29 3ksq h THR 120 CO -0.03 0.11 0.40 -0.09 -0.25 0.00 0.00 175.52 175.66 3ksq h ARG 121 N 0.36 1.09 -0.34 4.72 2.43 -1.36 0.10 114.38 121.38 3ksq h ARG 121 Ca 0.09 -0.14 -0.15 0.00 -0.81 0.00 0.00 59.98 58.98 3ksq h ARG 121 Cb 0.05 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.38 3ksq h ARG 121 CO -0.01 0.82 -0.36 -0.44 -1.51 0.00 0.00 179.97 178.47 3ksq h ASP 122 N 1.08 0.91 -0.30 -3.80 3.32 -1.28 -0.62 116.42 115.73 3ksq h ASP 122 Ca 0.27 -0.47 -0.07 0.00 0.02 0.00 0.00 57.03 56.78 3ksq h ASP 122 Cb 0.07 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 3ksq h ASP 122 CO -0.04 1.20 -0.04 0.00 -1.72 0.00 0.00 179.24 178.64 3ksq h ALA 123 N 0.74 1.18 -0.20 3.45 0.00 -0.78 -1.39 119.26 122.25 3ksq h ALA 123 Ca 0.05 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 3ksq h ALA 123 Cb 0.95 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3ksq h ALA 123 CO 0.09 0.53 -0.17 0.82 0.00 0.00 0.00 179.25 180.52 3ksq h ILE 124 N 0.63 1.32 -0.86 0.00 2.04 -0.71 -1.86 117.51 118.07 3ksq h ILE 124 Ca 0.12 -1.30 0.04 0.00 1.00 0.00 0.00 64.86 64.72 3ksq h ILE 124 Cb 0.45 1.73 -0.05 0.00 -0.74 0.00 0.00 36.82 38.21 3ksq h ILE 124 CO 0.02 0.40 0.56 -0.08 0.00 0.00 0.00 178.15 179.05 3ksq h GLU 125 N 0.14 1.01 -0.24 2.37 4.81 -0.86 0.67 114.58 122.48 3ksq h GLU 125 Ca 0.04 -0.06 -0.16 0.00 -0.13 0.00 0.00 59.36 59.04 3ksq h GLU 125 Cb 0.70 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 3ksq h GLU 125 CO 0.04 0.67 -0.51 -0.07 -0.73 0.00 0.00 179.01 178.41 3ksq h LEU 126 N 1.04 0.74 -6.20 1.64 3.38 -1.12 -3.40 115.31 111.38 3ksq h LEU 126 Ca 0.35 -0.38 -0.26 0.00 0.09 0.00 0.00 57.88 57.69 3ksq h LEU 126 Cb 0.09 -0.21 -0.26 0.00 0.09 0.00 0.00 40.66 40.36 3ksq h LEU 126 CO -0.11 1.11 -0.60 0.21 0.09 0.00 0.00 178.44 179.13 3ksq s ASN 127 N -6.91 0.15 0.01 -0.43 2.47 -0.71 -5.02 114.94 104.50 3ksq s ASN 127 Ca -0.08 -1.34 0.12 0.00 0.42 0.00 0.00 52.86 51.98 3ksq s ASN 127 Cb 0.11 1.08 0.52 0.00 -1.45 0.00 0.00 41.25 41.51 3ksq s ASN 127 CO 0.85 -0.22 1.39 0.00 -3.72 0.00 0.00 177.10 175.40 3ksq n ALA 128 N 4.24 1.53 1.49 1.71 0.00 0.18 -1.64 120.51 128.03 3ksq n ALA 128 Ca 0.12 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.65 3ksq n ALA 128 Cb 0.50 -1.20 0.52 0.00 0.00 0.00 0.00 19.45 19.27 3ksq n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ksq n ALA 129 N -1.51 2.57 -2.56 0.00 0.00 -1.26 -4.67 120.51 113.08 3ksq n ALA 129 Ca 0.03 -0.42 -0.41 0.00 0.00 0.00 0.00 53.44 52.63 3ksq n ALA 129 Cb 0.14 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.37 3ksq n ALA 129 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3ksq s ASN 130 N -1.82 6.35 0.44 0.00 3.84 -0.65 -4.84 114.94 118.26 3ksq s ASN 130 Ca 0.36 -1.01 0.16 0.00 0.21 0.00 0.00 52.86 52.58 3ksq s ASN 130 Cb 0.19 -2.57 0.99 0.00 -0.55 0.00 0.00 41.25 39.31 3ksq s ASN 130 CO 0.30 -1.65 1.96 0.10 -2.79 0.00 0.00 177.10 175.02 3ksq h TYR 131 N 9.90 0.00 -0.85 0.43 -0.00 -1.90 -2.51 116.97 122.04 3ksq h TYR 131 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.71 3ksq h TYR 131 Cb 1.03 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.72 3ksq h TYR 131 CO 1.21 0.22 0.50 1.15 -0.00 0.00 0.00 178.16 181.25 3ksq h THR 132 N 0.00 1.24 -0.17 -0.90 2.02 -2.00 -1.08 112.91 112.03 3ksq h THR 132 Ca -0.00 -0.55 -0.02 0.00 0.77 0.00 0.00 66.41 66.61 3ksq h THR 132 Cb 0.41 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 3ksq h THR 132 CO 0.03 0.26 0.01 0.58 0.37 0.00 0.00 175.52 176.76 3ksq h VAL 133 N 1.18 1.24 -0.89 3.16 2.07 -1.87 -2.33 116.25 118.81 3ksq h VAL 133 Ca 0.30 -0.80 0.05 0.00 0.82 0.00 0.00 66.70 67.08 3ksq h VAL 133 Cb -0.03 1.45 -0.06 0.00 -1.52 0.00 0.00 31.29 31.14 3ksq h VAL 133 CO -0.06 0.24 0.58 -0.50 0.02 0.00 0.00 177.57 177.86 3ksq h TRP 134 N 0.05 1.04 -0.21 1.57 4.06 -1.26 0.12 115.95 121.32 3ksq h TRP 134 Ca 0.05 0.03 -0.02 0.00 2.06 0.00 0.00 58.89 61.01 3ksq h TRP 134 Cb 0.35 -0.34 -0.01 0.00 -1.00 0.00 0.00 29.16 28.16 3ksq h TRP 134 CO 0.03 0.57 0.06 1.25 -3.56 0.00 0.00 178.44 176.79 3ksq h HIS 135 N 1.04 0.34 -0.57 0.49 2.76 -0.93 -1.93 115.15 116.36 3ksq h HIS 135 Ca 0.37 -0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 58.45 3ksq h HIS 135 Cb 0.13 -0.10 -0.03 0.00 1.55 0.00 0.00 27.41 28.97 3ksq h HIS 135 CO -0.00 0.42 0.12 0.35 -1.30 0.00 0.00 177.93 177.52 3ksq h PHE 136 N 0.17 0.93 -0.79 5.26 3.57 -1.12 -1.02 116.94 123.95 3ksq h PHE 136 Ca 0.07 -0.10 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 3ksq h PHE 136 Cb 0.24 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 38.67 3ksq h PHE 136 CO 0.00 0.78 0.33 -0.09 -2.23 0.00 0.00 178.31 177.11 3ksq h ARG 137 N 0.86 1.16 -0.24 1.11 2.43 -0.79 -0.30 114.38 118.61 3ksq h ARG 137 Ca 0.18 -0.20 -0.12 0.00 -0.81 0.00 0.00 59.98 59.04 3ksq h ARG 137 Cb 0.34 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3ksq h ARG 137 CO 0.00 0.93 -0.35 0.00 -1.51 0.00 0.00 179.97 179.04 3ksq h ARG 138 N 1.13 0.51 -0.66 0.20 3.08 -0.89 -0.15 114.38 117.61 3ksq h ARG 138 Ca 0.26 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 3ksq h ARG 138 Cb 0.19 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 3ksq h ARG 138 CO -0.03 0.79 0.41 0.28 -1.07 0.00 0.00 179.97 180.35 3ksq h VAL 139 N 0.43 1.19 -0.24 2.04 2.07 -0.62 -2.87 116.25 118.25 3ksq h VAL 139 Ca 0.05 -0.40 -0.13 0.00 0.82 0.00 0.00 66.70 67.03 3ksq h VAL 139 Cb 0.81 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3ksq h VAL 139 CO 0.07 0.19 -0.39 -0.07 0.02 0.00 0.00 177.57 177.39 3ksq h LEU 140 N 0.90 0.58 -1.03 2.57 3.38 -0.63 -0.62 115.31 120.47 3ksq h LEU 140 Ca 0.24 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3ksq h LEU 140 Cb -0.04 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 3ksq h LEU 140 CO -0.05 0.91 0.62 -0.07 0.09 0.00 0.00 178.44 179.94 3ksq h LEU 141 N 0.46 1.12 0.00 1.67 3.38 -0.82 -0.02 115.31 121.10 3ksq h LEU 141 Ca 0.04 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3ksq h LEU 141 Cb 0.88 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 3ksq h LEU 141 CO 0.08 0.82 -0.06 0.03 0.09 0.00 0.00 178.44 179.40 3ksq h ARG 142 N 1.31 0.00 -0.53 1.13 2.47 -1.36 -1.43 114.38 115.96 3ksq h ARG 142 Ca 0.35 -0.01 0.06 0.00 -1.26 0.00 0.00 59.98 59.12 3ksq h ARG 142 Cb -0.12 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.15 3ksq h ARG 142 CO -0.07 1.00 0.25 0.77 0.56 0.00 0.00 179.97 182.48 3ksq h SER 143 N -0.99 0.34 0.57 7.04 0.02 -1.08 -2.35 113.55 117.09 3ksq h SER 143 Ca -0.02 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3ksq h SER 143 Cb 1.02 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.54 3ksq h SER 143 CO -0.01 0.23 -0.11 0.18 -1.14 0.00 0.00 176.83 175.99 3ksq n LEU 144 N -4.91 0.26 -3.55 5.07 4.77 -0.02 -4.95 117.00 113.66 3ksq n LEU 144 Ca 0.05 0.18 -0.21 0.00 -0.03 0.00 0.00 56.01 56.00 3ksq n LEU 144 Cb 0.17 -0.28 0.05 0.00 -2.33 0.00 0.00 43.42 41.03 3ksq n LEU 144 CO 0.27 0.05 -0.02 0.00 -1.33 0.00 0.00 177.39 176.37 3ksq n GLN 145 N -1.22 -3.95 -2.56 3.23 1.13 -0.89 -4.95 117.38 108.18 3ksq n GLN 145 Ca 0.12 0.68 -0.39 0.00 -1.94 0.00 0.00 57.00 55.47 3ksq n GLN 145 Cb 0.29 -5.25 -0.05 0.00 0.11 0.00 0.00 30.24 25.35 3ksq n GLN 145 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 3ksq s LYS 146 N -5.53 4.52 -0.04 -1.09 -0.14 -0.55 -4.97 119.74 111.93 3ksq s LYS 146 Ca 0.18 1.64 -0.29 0.00 -1.36 0.00 0.00 55.97 56.14 3ksq s LYS 146 Cb -0.04 -2.97 -0.08 0.00 -1.68 0.00 0.00 37.83 33.06 3ksq s LYS 146 CO 0.79 0.15 2.02 0.34 -0.76 0.00 0.00 175.35 177.89 3ksq s ASP 147 N -1.19 6.18 0.45 2.83 -1.08 -1.26 -4.87 116.67 117.73 3ksq s ASP 147 Ca 0.49 2.42 0.27 0.00 -0.52 0.00 0.00 52.55 55.20 3ksq s ASP 147 Cb -0.27 -2.52 0.71 0.00 -1.46 0.00 0.00 42.92 39.37 3ksq s ASP 147 CO 0.34 -1.30 1.74 -0.07 0.52 0.00 0.00 175.17 176.40 3ksq h LEU 148 N 11.86 0.00 -0.37 -1.34 3.38 -1.95 -2.65 115.31 124.24 3ksq h LEU 148 Ca -0.47 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.31 3ksq h LEU 148 Cb 1.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.98 3ksq h LEU 148 CO 0.95 0.00 -0.77 -0.61 0.09 0.00 0.00 178.44 178.10 3ksq h GLN 149 N 0.00 0.38 -0.45 1.13 5.75 -1.99 -0.17 115.11 119.76 3ksq h GLN 149 Ca 0.00 -0.33 -0.10 0.00 -0.15 0.00 0.00 58.65 58.06 3ksq h GLN 149 Cb 0.81 0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.42 3ksq h GLN 149 CO 0.00 0.98 -0.14 0.93 -2.65 0.00 0.00 178.83 177.95 3ksq h GLU 150 N 0.25 0.84 -0.27 1.69 4.39 -1.93 -1.78 114.58 117.77 3ksq h GLU 150 Ca -0.04 -0.30 -0.06 0.00 0.34 0.00 0.00 59.36 59.30 3ksq h GLU 150 Cb 1.36 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.93 3ksq h GLU 150 CO 0.13 0.93 -0.08 1.49 -1.16 0.00 0.00 179.01 180.32 3ksq h GLU 151 N 0.75 0.44 -0.63 2.33 4.57 -1.27 -1.72 114.58 119.05 3ksq h GLU 151 Ca 0.12 -0.11 -0.08 0.00 -1.18 0.00 0.00 59.36 58.11 3ksq h GLU 151 Cb 0.65 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.16 3ksq h GLU 151 CO 0.05 0.53 0.07 0.52 -1.18 0.00 0.00 179.01 179.00 3ksq h MET 152 N 0.42 1.07 -0.69 1.92 2.86 -0.49 -0.44 114.93 119.57 3ksq h MET 152 Ca 0.08 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 3ksq h MET 152 Cb 0.40 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 3ksq h MET 152 CO 0.02 1.01 0.45 -0.91 1.06 0.00 0.00 176.91 178.54 3ksq h ASN 153 N 0.98 0.81 0.01 1.22 2.35 -0.76 -1.06 115.58 119.13 3ksq h ASN 153 Ca 0.19 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3ksq h ASN 153 Cb 0.48 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.65 3ksq h ASN 153 CO 0.02 0.60 -0.01 0.22 -1.65 0.00 0.00 177.43 176.61 3ksq h TYR 154 N 0.94 -0.02 -0.57 1.19 3.20 -1.06 -2.65 116.97 118.02 3ksq h TYR 154 Ca 0.25 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.09 3ksq h TYR 154 Cb -0.09 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.16 3ksq h TYR 154 CO -0.02 0.15 0.20 0.97 -1.64 0.00 0.00 178.16 177.82 3ksq h ILE 155 N -0.18 1.21 -0.35 1.81 6.09 -0.85 -1.43 117.51 123.82 3ksq h ILE 155 Ca -0.00 -0.69 0.03 0.00 -1.37 0.00 0.00 64.86 62.82 3ksq h ILE 155 Cb 0.17 0.56 -0.03 0.00 0.47 0.00 0.00 36.82 38.00 3ksq h ILE 155 CO 0.00 0.27 0.16 0.74 -3.07 0.00 0.00 178.15 176.26 3ksq h THR 156 N 0.82 0.97 -0.25 2.19 2.02 -1.17 -0.21 112.91 117.28 3ksq h THR 156 Ca 0.19 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 67.22 3ksq h THR 156 Cb 0.20 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 3ksq h THR 156 CO -0.01 0.06 0.03 0.00 0.37 0.00 0.00 175.52 175.97 3ksq h ALA 157 N 1.19 0.34 -0.54 6.16 0.00 -1.05 -1.67 119.26 123.69 3ksq h ALA 157 Ca 0.15 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 3ksq h ALA 157 Cb 0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3ksq h ALA 157 CO -0.11 0.04 -0.00 0.82 0.00 0.00 0.00 179.25 179.99 3ksq h ILE 158 N 0.23 1.26 -0.46 0.00 1.08 -1.16 -2.56 117.51 115.89 3ksq h ILE 158 Ca 0.08 -1.09 -0.11 0.00 -0.39 0.00 0.00 64.86 63.35 3ksq h ILE 158 Cb 0.36 0.84 -0.01 0.00 -3.07 0.00 0.00 36.82 34.93 3ksq h ILE 158 CO 0.01 0.39 -0.13 0.40 -0.69 0.00 0.00 178.15 178.12 3ksq h ILE 159 N 0.86 1.27 -0.99 -0.67 2.04 -1.00 -1.24 117.51 117.78 3ksq h ILE 159 Ca 0.16 -1.27 0.11 0.00 1.00 0.00 0.00 64.86 64.86 3ksq h ILE 159 Cb 0.51 1.13 -0.08 0.00 -0.74 0.00 0.00 36.82 37.64 3ksq h ILE 159 CO 0.02 0.43 0.63 -0.33 0.00 0.00 0.00 178.15 178.91 3ksq h GLU 160 N 0.75 0.97 -0.16 2.37 4.39 -0.99 -1.45 114.58 120.45 3ksq h GLU 160 Ca 0.11 -0.06 -0.19 0.00 0.34 0.00 0.00 59.36 59.56 3ksq h GLU 160 Cb 0.69 -0.22 0.01 0.00 -0.10 0.00 0.00 28.75 29.13 3ksq h GLU 160 CO 0.05 0.64 -0.66 0.93 -1.16 0.00 0.00 179.01 178.81 3ksq h GLU 161 N 0.99 0.72 -2.16 2.33 5.08 -1.22 -3.39 114.58 116.93 3ksq h GLU 161 Ca 0.48 -0.57 -0.58 0.00 -1.00 0.00 0.00 59.36 57.69 3ksq h GLU 161 Cb 0.45 0.11 -0.40 0.00 0.50 0.00 0.00 28.75 29.41 3ksq h GLU 161 CO -0.24 1.18 -0.92 1.04 -1.00 0.00 0.00 179.01 179.08 3ksq n GLN 162 N -4.05 1.22 0.00 2.33 6.02 -0.49 -4.98 117.38 117.44 3ksq n GLN 162 Ca -0.07 -3.69 0.07 0.00 -0.01 0.00 0.00 57.00 53.29 3ksq n GLN 162 Cb 0.68 -1.62 0.30 0.00 1.02 0.00 0.00 30.24 30.62 3ksq n GLN 162 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 3ksq n PRO 163 N 1.46 0.01 0.00 -1.09 -0.04 -0.57 -2.67 135.00 132.09 3ksq n PRO 163 Ca 0.25 0.27 0.12 0.00 -0.04 0.00 0.00 63.50 64.09 3ksq n PRO 163 Cb 0.48 -1.51 0.10 0.00 -0.04 0.00 0.00 33.50 32.53 3ksq n PRO 163 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3ksq n LYS 164 N -1.53 1.10 -2.33 0.54 5.02 -1.26 -4.77 118.16 114.93 3ksq n LYS 164 Ca 0.03 -0.85 -0.41 0.00 -2.02 0.00 0.00 58.31 55.06 3ksq n LYS 164 Cb 0.16 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.66 3ksq n LYS 164 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3ksq s ASN 165 N -2.49 7.04 0.04 4.39 3.84 -1.09 -4.96 114.94 121.71 3ksq s ASN 165 Ca 0.20 2.30 -0.20 0.00 0.21 0.00 0.00 52.86 55.37 3ksq s ASN 165 Cb 0.18 -2.61 -0.14 0.00 -0.55 0.00 0.00 41.25 38.13 3ksq s ASN 165 CO 0.56 -0.40 1.36 1.88 -2.79 0.00 0.00 177.10 177.70 3ksq h TYR 166 N 5.10 0.43 -0.98 0.43 -1.99 -1.92 -3.34 116.97 114.70 3ksq h TYR 166 Ca -0.45 -0.12 0.02 0.00 2.00 0.00 0.00 58.73 60.18 3ksq h TYR 166 Cb 1.21 -0.09 -0.05 0.00 2.00 0.00 0.00 36.73 39.80 3ksq h TYR 166 CO 0.62 0.74 0.65 1.96 -0.00 0.00 0.00 178.16 182.12 3ksq h GLN 167 N -0.00 1.25 -0.66 4.88 7.50 -1.93 -2.34 115.11 123.82 3ksq h GLN 167 Ca 0.03 -0.08 -0.04 0.00 0.50 0.00 0.00 58.65 59.06 3ksq h GLN 167 Cb 0.66 -0.28 -0.03 0.00 0.05 0.00 0.00 27.48 27.87 3ksq h GLN 167 CO 0.03 0.83 0.26 -0.39 -1.50 0.00 0.00 178.83 178.06 3ksq h VAL 168 N 1.29 1.24 -0.28 -0.54 -1.51 -1.84 -0.98 116.25 113.63 3ksq h VAL 168 Ca 0.37 -0.75 -0.18 0.00 -1.23 0.00 0.00 66.70 64.92 3ksq h VAL 168 Cb -0.08 0.50 0.00 0.00 -2.13 0.00 0.00 31.29 29.58 3ksq h VAL 168 CO -0.10 0.30 -0.52 -0.50 -1.23 0.00 0.00 177.57 175.52 3ksq h TRP 169 N 0.93 1.06 -0.61 5.19 4.06 -1.66 -1.98 115.95 122.94 3ksq h TRP 169 Ca 0.22 -0.38 -0.02 0.00 2.06 0.00 0.00 58.89 60.77 3ksq h TRP 169 Cb 0.21 -0.20 -0.03 0.00 -1.00 0.00 0.00 29.16 28.14 3ksq h TRP 169 CO 0.01 1.20 0.30 1.25 -3.56 0.00 0.00 178.44 177.64 3ksq h HIS 170 N 0.62 0.88 -0.78 0.49 2.76 -1.25 -1.39 115.15 116.49 3ksq h HIS 170 Ca 0.01 -0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.13 3ksq h HIS 170 Cb 1.13 -0.27 -0.04 0.00 1.55 0.00 0.00 27.41 29.78 3ksq h HIS 170 CO 0.08 0.67 0.43 1.25 -1.30 0.00 0.00 177.93 179.05 3ksq h HIS 171 N 0.84 1.06 -0.78 5.26 -0.00 -1.11 -1.23 115.15 119.19 3ksq h HIS 171 Ca 0.21 -0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.52 3ksq h HIS 171 Cb 0.11 -0.34 -0.03 0.00 -0.00 0.00 0.00 27.41 27.15 3ksq h HIS 171 CO -0.00 0.74 0.32 -0.09 -0.00 0.00 0.00 177.93 178.90 3ksq h ARG 172 N 1.07 1.15 -0.32 5.26 2.43 -1.07 -1.27 114.38 121.64 3ksq h ARG 172 Ca 0.27 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 3ksq h ARG 172 Cb 0.03 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.37 3ksq h ARG 172 CO -0.04 0.92 0.16 -0.09 -1.51 0.00 0.00 179.97 179.41 3ksq h ARG 173 N 1.13 0.46 -0.59 0.20 2.43 -0.78 -0.50 114.38 116.73 3ksq h ARG 173 Ca 0.26 -0.06 0.07 0.00 -0.81 0.00 0.00 59.98 59.44 3ksq h ARG 173 Cb 0.19 -0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 29.60 3ksq h ARG 173 CO -0.02 0.41 0.28 0.28 -1.51 0.00 0.00 179.97 179.41 3ksq h VAL 174 N 0.39 0.89 -0.43 0.20 2.07 -0.85 -0.31 116.25 118.21 3ksq h VAL 174 Ca 0.11 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 3ksq h VAL 174 Cb 0.10 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 3ksq h VAL 174 CO -0.02 0.09 0.20 -0.07 0.02 0.00 0.00 177.57 177.80 3ksq h LEU 175 N 0.52 0.56 -0.95 2.57 3.38 -0.97 0.09 115.31 120.51 3ksq h LEU 175 Ca 0.28 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 3ksq h LEU 175 Cb 0.25 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3ksq h LEU 175 CO -0.22 0.54 0.41 0.58 0.09 0.00 0.00 178.44 179.84 3ksq h VAL 176 N 0.55 1.25 0.19 1.22 2.07 -0.59 -0.83 116.25 120.11 3ksq h VAL 176 Ca 0.15 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 3ksq h VAL 176 Cb 0.13 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.08 3ksq h VAL 176 CO -0.02 0.29 -0.09 -0.33 0.02 0.00 0.00 177.57 177.44 3ksq h GLU 177 N 1.15 -0.24 -0.50 1.57 5.08 -0.72 0.15 114.58 121.08 3ksq h GLU 177 Ca 0.28 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.72 3ksq h GLU 177 Cb 0.08 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 3ksq h GLU 177 CO -0.04 -0.05 0.19 -1.49 -1.00 0.00 0.00 179.01 176.62 3ksq h TRP 178 N -0.39 0.34 0.00 4.33 6.55 -0.86 -2.37 115.95 123.54 3ksq h TRP 178 Ca -0.03 0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.84 3ksq h TRP 178 Cb 0.30 -0.08 0.00 0.00 -0.86 0.00 0.00 29.16 28.53 3ksq h TRP 178 CO -0.02 0.12 -0.16 -0.07 -1.05 0.00 0.00 178.44 177.26 3ksq h LEU 179 N 0.38 0.00 -0.04 -4.49 3.38 -1.07 -3.47 115.31 110.00 3ksq h LEU 179 Ca 0.24 -0.02 -0.43 0.00 0.09 0.00 0.00 57.88 57.76 3ksq h LEU 179 Cb 0.23 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3ksq h LEU 179 CO -0.23 0.01 -0.66 0.29 0.09 0.00 0.00 178.44 177.95 3ksq n LYS 180 N -2.71 -4.82 -3.83 1.13 5.02 0.52 -4.95 118.16 108.51 3ksq n LYS 180 Ca 0.04 0.64 -0.30 0.00 -2.02 0.00 0.00 58.31 56.67 3ksq n LYS 180 Cb 0.49 -5.47 -0.15 0.00 -0.02 0.00 0.00 35.03 29.88 3ksq n LYS 180 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3ksq s ASP 181 N -2.98 4.21 0.00 4.39 2.15 -1.10 -4.98 116.67 118.36 3ksq s ASP 181 Ca 0.50 -1.74 0.20 0.00 0.43 0.00 0.00 52.55 51.95 3ksq s ASP 181 Cb -0.25 -1.11 0.53 0.00 -0.30 0.00 0.00 42.92 41.80 3ksq s ASP 181 CO 0.62 -0.39 1.45 -0.81 -0.17 0.00 0.00 175.17 175.87 3ksq n PRO 182 N 4.66 2.37 -0.19 4.34 -0.04 -1.26 -4.64 135.00 140.24 3ksq n PRO 182 Ca -0.01 -2.11 0.13 0.00 -0.04 0.00 0.00 63.50 61.47 3ksq n PRO 182 Cb 0.42 -1.48 0.45 0.00 -0.04 0.00 0.00 33.50 32.85 3ksq n PRO 182 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3ksq h SER 183 N 3.70 0.50 0.84 3.54 4.64 -2.00 -2.39 113.55 122.38 3ksq h SER 183 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3ksq h SER 183 Cb 0.83 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 3ksq h SER 183 CO 0.00 0.27 -0.68 1.56 -0.87 0.00 0.00 176.83 177.11 3ksq h GLN 184 N 0.54 0.00 0.54 4.77 4.20 -2.03 -3.43 115.11 119.69 3ksq h GLN 184 Ca 0.37 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 59.07 3ksq h GLN 184 Cb 0.70 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 3ksq h GLN 184 CO -0.14 0.00 -0.45 0.93 -0.67 0.00 0.00 178.83 178.50 3ksq h GLU 185 N 0.00 -0.94 -0.60 1.46 4.39 -1.76 -1.23 114.58 115.90 3ksq h GLU 185 Ca 0.00 0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 3ksq h GLU 185 Cb 0.76 0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 29.60 3ksq h GLU 185 CO 0.00 -0.63 0.27 -0.07 -1.16 0.00 0.00 179.01 177.42 3ksq h LEU 186 N -0.98 0.77 -0.17 1.33 3.38 -1.83 -0.18 115.31 117.63 3ksq h LEU 186 Ca -0.06 -0.09 -0.23 0.00 0.09 0.00 0.00 57.88 57.59 3ksq h LEU 186 Cb 0.83 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 41.40 3ksq h LEU 186 CO -0.02 0.67 -0.84 -0.08 0.09 0.00 0.00 178.44 178.26 3ksq h GLU 187 N 0.85 0.68 -0.38 1.13 4.81 -1.86 -1.69 114.58 118.13 3ksq h GLU 187 Ca 0.21 -0.61 -0.03 0.00 -0.13 0.00 0.00 59.36 58.80 3ksq h GLU 187 Cb 0.12 0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 3ksq h GLU 187 CO -0.02 1.21 0.12 0.35 -0.73 0.00 0.00 179.01 179.94 3ksq h PHE 188 N 0.44 0.60 -0.58 0.92 3.57 -0.78 -2.41 116.94 118.69 3ksq h PHE 188 Ca -0.07 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.36 3ksq h PHE 188 Cb 1.47 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 40.01 3ksq h PHE 188 CO 0.08 0.56 0.29 0.82 -2.23 0.00 0.00 178.31 177.84 3ksq h ILE 189 N 0.46 1.20 -0.34 1.41 2.04 -1.05 -1.95 117.51 119.28 3ksq h ILE 189 Ca 0.12 -0.56 0.03 0.00 1.00 0.00 0.00 64.86 65.46 3ksq h ILE 189 Cb 0.24 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 3ksq h ILE 189 CO -0.01 0.23 0.23 0.00 0.00 0.00 0.00 178.15 178.60 3ksq h ALA 190 N 1.12 1.90 -0.20 1.87 0.00 -1.21 0.23 119.26 122.97 3ksq h ALA 190 Ca 0.20 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 3ksq h ALA 190 Cb 0.10 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3ksq h ALA 190 CO -0.03 0.05 -0.60 0.22 0.00 0.00 0.00 179.25 178.89 3ksq h ASP 191 N 0.33 0.77 -0.37 0.00 3.58 -0.86 -0.67 116.42 119.20 3ksq h ASP 191 Ca 0.14 -0.44 -0.07 0.00 0.42 0.00 0.00 57.03 57.08 3ksq h ASP 191 Cb 0.15 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.96 3ksq h ASP 191 CO -0.03 1.20 -0.06 0.40 -2.88 0.00 0.00 179.24 177.87 3ksq h ILE 192 N 0.51 1.27 0.00 2.25 1.08 -0.52 -3.00 117.51 119.11 3ksq h ILE 192 Ca -0.00 -1.11 -0.03 0.00 -0.39 0.00 0.00 64.86 63.33 3ksq h ILE 192 Cb 1.19 1.23 -0.00 0.00 -3.07 0.00 0.00 36.82 36.16 3ksq h ILE 192 CO 0.12 0.37 -0.14 -0.07 -0.69 0.00 0.00 178.15 177.74 3ksq h LEU 193 N 0.51 0.00 -1.43 1.44 3.38 -0.55 -1.23 115.31 117.43 3ksq h LEU 193 Ca 0.10 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 3ksq h LEU 193 Cb 0.56 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 3ksq h LEU 193 CO 0.03 0.14 -0.27 -1.13 0.09 0.00 0.00 178.44 177.29 3ksq h ASN 194 N 0.00 0.00 0.25 -0.43 -0.73 -0.97 -2.19 115.58 111.52 3ksq h ASN 194 Ca -0.00 0.00 -0.34 0.00 1.87 0.00 0.00 56.30 57.83 3ksq h ASN 194 Cb 0.50 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 39.05 3ksq h ASN 194 CO 0.02 0.27 -1.95 0.00 -0.37 0.00 0.00 177.43 175.40 3ksq n GLN 195 N -3.85 0.69 -3.38 6.67 6.02 -0.54 -4.78 117.38 118.21 3ksq n GLN 195 Ca -0.02 0.25 -0.17 0.00 -0.01 0.00 0.00 57.00 57.06 3ksq n GLN 195 Cb 0.36 -1.71 -0.09 0.00 1.02 0.00 0.00 30.24 29.82 3ksq n GLN 195 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3ksq s ASP 196 N -6.50 1.48 0.00 1.08 2.15 -0.77 -5.04 116.67 109.08 3ksq s ASP 196 Ca -0.15 -0.91 0.13 0.00 0.43 0.00 0.00 52.55 52.05 3ksq s ASP 196 Cb 0.07 0.56 0.66 0.00 -0.30 0.00 0.00 42.92 43.91 3ksq s ASP 196 CO 0.78 -0.36 1.33 0.00 -0.17 0.00 0.00 175.17 176.76 3ksq n ALA 197 N 5.09 1.76 -0.24 3.66 0.00 -0.83 -2.47 120.51 127.48 3ksq n ALA 197 Ca 0.01 -0.06 0.03 0.00 0.00 0.00 0.00 53.44 53.41 3ksq n ALA 197 Cb 0.46 -1.21 0.05 0.00 0.00 0.00 0.00 19.45 18.75 3ksq n ALA 197 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ksq n LYS 198 N -1.29 2.67 -1.67 0.00 5.02 -1.26 -4.80 118.16 116.84 3ksq n LYS 198 Ca 0.06 -1.80 -0.43 0.00 -2.02 0.00 0.00 58.31 54.13 3ksq n LYS 198 Cb 0.10 -1.15 -0.03 0.00 -0.02 0.00 0.00 35.03 33.94 3ksq n LYS 198 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3ksq s ASN 199 N -1.37 5.57 0.19 4.39 3.84 -1.03 -4.86 114.94 121.67 3ksq s ASN 199 Ca 0.10 1.84 -0.12 0.00 0.21 0.00 0.00 52.86 54.89 3ksq s ASN 199 Cb 0.07 -2.51 0.11 0.00 -0.55 0.00 0.00 41.25 38.37 3ksq s ASN 199 CO 0.03 -1.88 1.83 0.22 -2.79 0.00 0.00 177.10 174.51 3ksq h TYR 200 N 14.51 0.86 -0.50 0.43 3.20 -1.94 -2.09 116.97 131.44 3ksq h TYR 200 Ca -0.40 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.38 3ksq h TYR 200 Cb 1.23 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 39.19 3ksq h TYR 200 CO 0.94 0.59 -0.01 0.45 -1.64 0.00 0.00 178.16 178.49 3ksq h HIS 201 N 0.89 0.91 -0.34 -3.82 3.86 -1.89 -0.71 115.15 114.04 3ksq h HIS 201 Ca 0.23 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 3ksq h HIS 201 Cb -0.02 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.19 3ksq h HIS 201 CO -0.02 0.83 0.16 0.00 0.86 0.00 0.00 177.93 179.77 3ksq h ALA 202 N 1.20 0.44 -0.63 2.45 0.00 -1.79 0.30 119.26 121.23 3ksq h ALA 202 Ca 0.15 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 3ksq h ALA 202 Cb 0.48 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3ksq h ALA 202 CO 0.02 -0.00 0.03 -1.49 0.00 0.00 0.00 179.25 177.81 3ksq h TRP 203 N 0.41 1.18 -0.77 0.00 4.06 -1.19 -0.74 115.95 118.91 3ksq h TRP 203 Ca 0.12 -0.19 -0.04 0.00 2.06 0.00 0.00 58.89 60.84 3ksq h TRP 203 Cb 0.12 -0.31 -0.03 0.00 -1.00 0.00 0.00 29.16 27.93 3ksq h TRP 203 CO -0.02 1.02 0.34 0.37 -3.56 0.00 0.00 178.44 176.59 3ksq h GLN 204 N 1.00 1.13 -0.44 0.49 4.15 -0.88 -0.96 115.11 119.61 3ksq h GLN 204 Ca 0.18 -0.19 -0.14 0.00 0.77 0.00 0.00 58.65 59.28 3ksq h GLN 204 Cb 0.53 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.01 3ksq h GLN 204 CO 0.03 0.90 -0.27 1.25 -1.93 0.00 0.00 178.83 178.81 3ksq h HIS 205 N 1.10 1.11 -0.40 3.99 2.76 -0.77 -1.45 115.15 121.49 3ksq h HIS 205 Ca 0.26 -0.29 0.02 0.00 -2.20 0.00 0.00 60.37 58.17 3ksq h HIS 205 Cb 0.17 -0.25 -0.03 0.00 1.55 0.00 0.00 27.41 28.85 3ksq h HIS 205 CO 0.02 1.11 0.21 -0.09 -1.30 0.00 0.00 177.93 177.87 3ksq h ARG 206 N 0.81 0.42 -0.55 5.26 2.43 -0.83 -0.18 114.38 121.73 3ksq h ARG 206 Ca 0.09 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 3ksq h ARG 206 Cb 0.85 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.28 3ksq h ARG 206 CO 0.08 0.28 0.07 1.96 -1.51 0.00 0.00 179.97 180.84 3ksq h GLN 207 N 0.43 0.93 -0.03 0.20 4.20 -1.05 -1.45 115.11 118.33 3ksq h GLN 207 Ca 0.16 -0.26 0.01 0.00 0.06 0.00 0.00 58.65 58.62 3ksq h GLN 207 Cb 0.05 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 3ksq h GLN 207 CO -0.10 0.91 -0.01 2.35 -0.67 0.00 0.00 178.83 181.31 3ksq h TRP 208 N 0.81 -0.03 0.24 2.96 7.01 -0.92 -1.35 115.95 124.67 3ksq h TRP 208 Ca 0.16 0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.18 3ksq h TRP 208 Cb 0.45 0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.49 3ksq h TRP 208 CO 0.03 -0.02 -0.38 0.28 -2.79 0.00 0.00 178.44 175.56 3ksq h VAL 209 N -0.01 0.22 -0.22 2.65 2.07 -0.90 0.21 116.25 120.27 3ksq h VAL 209 Ca 0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.58 3ksq h VAL 209 Cb 0.04 0.22 -0.04 0.00 -1.52 0.00 0.00 31.29 29.99 3ksq h VAL 209 CO -0.04 0.00 -0.01 0.40 0.02 0.00 0.00 177.57 177.94 3ksq h ILE 210 N -0.70 0.83 -0.23 4.57 2.04 -1.22 -1.43 117.51 121.37 3ksq h ILE 210 Ca -0.00 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 3ksq h ILE 210 Cb 0.67 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 3ksq h ILE 210 CO -0.15 0.01 0.02 -0.61 0.00 0.00 0.00 178.15 177.42 3ksq h GLN 211 N 0.05 0.38 -0.46 2.37 4.15 -1.11 0.14 115.11 120.63 3ksq h GLN 211 Ca 0.10 -0.11 -0.14 0.00 0.77 0.00 0.00 58.65 59.28 3ksq h GLN 211 Cb 0.14 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 3ksq h GLN 211 CO -0.19 0.54 -0.24 1.49 -1.93 0.00 0.00 178.83 178.50 3ksq h GLU 212 N 0.17 0.98 -0.35 1.69 4.57 -0.86 -3.27 114.58 117.51 3ksq h GLU 212 Ca 0.07 -0.43 0.00 0.00 -1.18 0.00 0.00 59.36 57.82 3ksq h GLU 212 Cb 0.35 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 3ksq h GLU 212 CO 0.01 1.10 0.00 1.19 -1.18 0.00 0.00 179.01 180.13 3ksq n PHE 213 N -4.10 0.45 -3.66 0.92 3.01 -0.55 -5.01 117.46 108.53 3ksq n PHE 213 Ca -0.00 -0.33 -0.22 0.00 1.01 0.00 0.00 57.45 57.90 3ksq n PHE 213 Cb 0.47 -0.01 0.05 0.00 -0.01 0.00 0.00 39.48 39.99 3ksq n PHE 213 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3ksq n ARG 214 N 0.97 -6.02 -2.21 -1.08 3.00 -0.08 -4.93 116.66 106.31 3ksq n ARG 214 Ca 0.15 0.71 -0.40 0.00 -0.01 0.00 0.00 57.85 58.30 3ksq n ARG 214 Cb 0.48 -5.54 0.02 0.00 0.00 0.00 0.00 32.46 27.41 3ksq n ARG 214 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 3ksq n LEU 215 N -4.45 7.43 0.09 0.55 4.77 -0.53 -4.71 117.00 120.15 3ksq n LEU 215 Ca -0.17 -5.03 -0.14 0.00 -0.03 0.00 0.00 56.01 50.63 3ksq n LEU 215 Cb 0.62 -1.15 -0.10 0.00 -2.33 0.00 0.00 43.42 40.47 3ksq n LEU 215 CO 0.67 1.91 0.05 -0.50 -1.33 0.00 0.00 177.39 178.19 3ksq h TRP 216 N 3.65 0.49 -0.96 -1.77 4.06 -1.92 -3.42 115.95 116.08 3ksq h TRP 216 Ca 0.55 -0.32 0.29 0.00 2.06 0.00 0.00 58.89 61.47 3ksq h TRP 216 Cb 0.22 -0.03 -0.15 0.00 -1.00 0.00 0.00 29.16 28.20 3ksq h TRP 216 CO 1.30 1.21 0.43 -0.44 -3.56 0.00 0.00 178.44 177.38 3ksq h ASP 217 N 0.11 0.29 -0.31 -3.49 3.45 -1.99 -2.46 116.42 112.02 3ksq h ASP 217 Ca -0.11 0.20 0.00 0.00 0.43 0.00 0.00 57.03 57.55 3ksq h ASP 217 Cb 1.82 0.20 0.00 0.00 -0.56 0.00 0.00 39.33 40.79 3ksq h ASP 217 CO 0.18 -0.16 0.00 0.59 -1.57 0.00 0.00 179.24 178.28 3ksq n ASN 218 N -5.14 2.98 -0.06 6.45 4.13 -1.26 -4.66 115.26 117.70 3ksq n ASN 218 Ca 0.28 -1.87 -0.08 0.00 1.68 0.00 0.00 54.58 54.59 3ksq n ASN 218 Cb 0.88 -0.20 0.08 0.00 -1.54 0.00 0.00 39.78 39.01 3ksq n ASN 218 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 3ksq h GLU 219 N 3.22 0.72 -0.15 3.52 4.57 -1.70 -2.31 114.58 122.45 3ksq h GLU 219 Ca 0.00 -0.33 -0.08 0.00 -1.18 0.00 0.00 59.36 57.77 3ksq h GLU 219 Cb 0.79 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.36 3ksq h GLU 219 CO 0.00 0.93 -0.27 1.25 -1.18 0.00 0.00 179.01 179.75 3ksq h LEU 220 N 0.61 0.28 -0.22 1.64 5.85 -1.83 -0.55 115.31 121.10 3ksq h LEU 220 Ca 0.07 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 3ksq h LEU 220 Cb 0.83 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 3ksq h LEU 220 CO 0.07 0.55 -0.11 -0.61 -0.34 0.00 0.00 178.44 178.00 3ksq h GLN 221 N 0.25 0.47 -0.54 1.25 4.15 -1.85 -0.74 115.11 118.10 3ksq h GLN 221 Ca 0.04 -0.21 -0.00 0.00 0.77 0.00 0.00 58.65 59.25 3ksq h GLN 221 Cb 0.61 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.27 3ksq h GLN 221 CO 0.04 0.75 0.32 -0.92 -1.93 0.00 0.00 178.83 177.09 3ksq h TYR 222 N 0.17 0.71 -0.40 3.99 3.20 -1.09 -2.01 116.97 121.54 3ksq h TYR 222 Ca 0.05 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.97 3ksq h TYR 222 Cb 0.61 -0.23 -0.05 0.00 1.54 0.00 0.00 36.73 38.60 3ksq h TYR 222 CO 0.06 0.50 0.11 0.28 -1.64 0.00 0.00 178.16 177.47 3ksq h VAL 223 N 0.72 0.83 -0.97 1.81 2.07 -0.94 -1.49 116.25 118.28 3ksq h VAL 223 Ca 0.19 -0.09 0.04 0.00 0.82 0.00 0.00 66.70 67.66 3ksq h VAL 223 Cb 0.00 0.56 -0.06 0.00 -1.52 0.00 0.00 31.29 30.27 3ksq h VAL 223 CO -0.03 0.05 0.63 0.44 0.02 0.00 0.00 177.57 178.68 3ksq h ASP 224 N 0.25 1.05 -0.13 0.57 3.32 -0.83 -0.83 116.42 119.82 3ksq h ASP 224 Ca 0.19 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 3ksq h ASP 224 Cb 0.21 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 3ksq h ASP 224 CO -0.22 0.71 0.00 -0.61 -1.72 0.00 0.00 179.24 177.40 3ksq h GLN 225 N 1.21 0.23 -0.12 3.56 4.15 -0.73 -2.52 115.11 120.88 3ksq h GLN 225 Ca 0.39 -0.07 -0.08 0.00 0.77 0.00 0.00 58.65 59.66 3ksq h GLN 225 Cb 0.03 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 3ksq h GLN 225 CO -0.12 0.46 -0.29 -0.07 -1.93 0.00 0.00 178.83 176.88 3ksq h LEU 226 N -0.03 0.23 -0.98 -2.39 3.38 -0.91 -2.56 115.31 112.04 3ksq h LEU 226 Ca 0.04 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 3ksq h LEU 226 Cb 0.35 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3ksq h LEU 226 CO 0.01 0.52 -0.41 -0.07 0.09 0.00 0.00 178.44 178.58 3ksq h LEU 227 N 0.21 0.21 -0.59 1.67 3.38 -1.11 -1.46 115.31 117.62 3ksq h LEU 227 Ca 0.03 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 3ksq h LEU 227 Cb 0.62 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3ksq h LEU 227 CO 0.04 0.60 0.02 0.11 0.09 0.00 0.00 178.44 179.31 3ksq h LYS 228 N 0.17 1.02 -0.15 1.13 1.57 -1.06 -1.87 116.57 117.39 3ksq h LYS 228 Ca 0.02 -0.31 -0.02 0.00 -1.87 0.00 0.00 60.65 58.46 3ksq h LYS 228 Cb 0.80 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 3ksq h LYS 228 CO 0.06 1.00 0.02 0.93 -0.57 0.00 0.00 179.45 180.89 3ksq h GLU 229 N 0.92 0.25 -1.79 3.15 5.08 -1.17 -3.42 114.58 117.60 3ksq h GLU 229 Ca 0.17 -0.07 -0.23 0.00 -1.00 0.00 0.00 59.36 58.23 3ksq h GLU 229 Cb 0.52 -0.03 -0.29 0.00 0.50 0.00 0.00 28.75 29.45 3ksq h GLU 229 CO 0.03 0.45 -0.57 0.34 -1.00 0.00 0.00 179.01 178.26 3ksq s ASP 230 N -5.72 0.66 0.44 1.42 -1.08 -0.58 -5.00 116.67 106.82 3ksq s ASP 230 Ca -0.14 -0.59 0.30 0.00 -0.52 0.00 0.00 52.55 51.61 3ksq s ASP 230 Cb 0.06 0.96 1.43 0.00 -1.46 0.00 0.00 42.92 43.91 3ksq s ASP 230 CO 0.71 -0.35 1.92 1.62 0.52 0.00 0.00 175.17 179.59 3ksq h VAL 231 N 6.04 0.00 -0.01 1.11 3.04 -1.58 -1.96 116.25 122.89 3ksq h VAL 231 Ca -0.08 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.40 3ksq h VAL 231 Cb 1.11 1.03 0.00 0.00 -2.01 0.00 0.00 31.29 31.41 3ksq h VAL 231 CO 0.27 0.00 -0.01 0.54 -1.01 0.00 0.00 177.57 177.35 3ksq n ARG 232 N -2.66 1.55 -2.32 4.17 1.74 -1.26 -4.73 116.66 113.15 3ksq n ARG 232 Ca -0.00 -0.84 -0.40 0.00 -0.77 0.00 0.00 57.85 55.84 3ksq n ARG 232 Cb 0.18 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.11 3ksq n ARG 232 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3ksq s ASN 233 N -2.03 5.80 0.45 0.55 3.84 -0.74 -4.87 114.94 117.93 3ksq s ASN 233 Ca 0.38 -0.01 0.11 0.00 0.21 0.00 0.00 52.86 53.56 3ksq s ASN 233 Cb 0.21 -2.55 1.00 0.00 -0.55 0.00 0.00 41.25 39.36 3ksq s ASN 233 CO 0.35 -2.04 2.05 -1.13 -2.79 0.00 0.00 177.10 173.54 3ksq h ASN 234 N 12.19 0.21 -0.00 -4.21 -1.24 -1.90 -2.29 115.58 118.34 3ksq h ASN 234 Ca -0.27 -0.02 -0.04 0.00 0.71 0.00 0.00 56.30 56.69 3ksq h ASN 234 Cb 1.10 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 40.09 3ksq h ASN 234 CO 1.24 0.22 -0.08 0.28 -1.29 0.00 0.00 177.43 177.79 3ksq h SER 235 N 0.24 0.20 0.08 1.15 0.02 -1.89 -0.80 113.55 112.54 3ksq h SER 235 Ca 0.06 -0.03 -0.25 0.00 -0.84 0.00 0.00 61.79 60.73 3ksq h SER 235 Cb 0.10 -0.05 0.02 0.00 0.14 0.00 0.00 62.40 62.60 3ksq h SER 235 CO -0.00 0.31 -0.99 0.58 -1.14 0.00 0.00 176.83 175.59 3ksq h VAL 236 N 0.20 1.31 -0.35 2.27 2.07 -1.73 -1.45 116.25 118.58 3ksq h VAL 236 Ca 0.05 -2.27 -0.07 0.00 0.82 0.00 0.00 66.70 65.23 3ksq h VAL 236 Cb 0.29 2.35 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 3ksq h VAL 236 CO 0.01 0.70 -0.09 -0.50 0.02 0.00 0.00 177.57 177.72 3ksq h TRP 237 N 0.37 0.62 -0.53 1.57 4.06 -1.29 -1.39 115.95 119.36 3ksq h TRP 237 Ca -0.11 -0.09 -0.07 0.00 2.06 0.00 0.00 58.89 60.68 3ksq h TRP 237 Cb 1.63 -0.17 -0.02 0.00 -1.00 0.00 0.00 29.16 29.61 3ksq h TRP 237 CO 0.09 0.65 0.05 -0.97 -3.56 0.00 0.00 178.44 174.70 3ksq h ASN 238 N 0.54 0.88 -0.51 -3.49 -1.24 -1.04 -2.58 115.58 108.14 3ksq h ASN 238 Ca 0.10 -0.28 -0.04 0.00 0.71 0.00 0.00 56.30 56.79 3ksq h ASN 238 Cb 0.47 -0.23 -0.03 0.00 0.73 0.00 0.00 38.32 39.26 3ksq h ASN 238 CO 0.03 0.94 0.17 -0.61 -1.29 0.00 0.00 177.43 176.67 3ksq h GLN 239 N 0.78 0.84 0.06 6.67 5.75 -0.74 -0.93 115.11 127.55 3ksq h GLN 239 Ca 0.16 -0.16 0.01 0.00 -0.15 0.00 0.00 58.65 58.51 3ksq h GLN 239 Cb 0.46 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.86 3ksq h GLN 239 CO 0.02 0.73 -0.09 -0.09 -2.65 0.00 0.00 178.83 176.75 3ksq h ARG 240 N 0.82 -0.19 -0.63 1.69 2.43 -1.02 -0.43 114.38 117.05 3ksq h ARG 240 Ca 0.19 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.35 3ksq h ARG 240 Cb 0.25 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 3ksq h ARG 240 CO -0.01 -0.12 0.34 1.25 -1.51 0.00 0.00 179.97 179.92 3ksq h HIS 241 N -0.19 0.87 -0.42 2.20 2.76 -1.30 -1.83 115.15 117.24 3ksq h HIS 241 Ca 0.02 -0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.20 3ksq h HIS 241 Cb 0.20 -0.28 -0.04 0.00 1.55 0.00 0.00 27.41 28.85 3ksq h HIS 241 CO -0.13 0.63 0.19 0.35 -1.30 0.00 0.00 177.93 177.67 3ksq h PHE 242 N 0.86 0.35 0.39 5.26 3.57 -0.75 0.24 116.94 126.86 3ksq h PHE 242 Ca 0.22 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.72 3ksq h PHE 242 Cb 0.05 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.70 3ksq h PHE 242 CO -0.01 0.17 -0.19 0.28 -2.23 0.00 0.00 178.31 176.34 3ksq h VAL 243 N 0.39 0.62 -0.21 1.41 2.07 -0.88 -2.83 116.25 116.82 3ksq h VAL 243 Ca 0.18 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 3ksq h VAL 243 Cb 0.11 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 3ksq h VAL 243 CO -0.14 0.06 0.07 0.40 0.02 0.00 0.00 177.57 177.97 3ksq h ILE 244 N -0.68 1.18 0.00 4.57 2.04 -1.26 -2.24 117.51 121.11 3ksq h ILE 244 Ca -0.05 -0.56 -0.02 0.00 1.00 0.00 0.00 64.86 65.22 3ksq h ILE 244 Cb 0.49 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.72 3ksq h ILE 244 CO 0.09 0.18 -0.11 0.77 0.00 0.00 0.00 178.15 179.08 3ksq h SER 245 N 0.18 0.00 -0.10 1.72 4.64 -1.03 0.19 113.55 119.16 3ksq h SER 245 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3ksq h SER 245 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3ksq h SER 245 CO -0.00 0.11 0.00 0.59 -0.87 0.00 0.00 176.83 176.65 3ksq n ASN 246 N -3.85 2.72 0.00 4.97 3.02 -1.07 -4.34 115.26 116.71 3ksq n ASN 246 Ca -0.02 -1.89 0.00 0.00 -0.03 0.00 0.00 54.58 52.64 3ksq n ASN 246 Cb 0.20 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 3ksq n ASN 246 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3ksq n THR 247 N 1.09 0.00 -0.04 3.41 -2.24 -0.86 -4.94 114.28 110.70 3ksq n THR 247 Ca 0.16 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.80 3ksq n THR 247 Cb 0.54 -0.05 -0.02 0.00 -2.10 0.00 0.00 70.33 68.70 3ksq n THR 247 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3ksq h THR 248 N 0.00 1.29 0.00 4.28 1.35 -1.80 -3.50 112.91 114.53 3ksq h THR 248 Ca 0.00 -1.83 0.00 0.00 -0.55 0.00 0.00 66.41 64.03 3ksq h THR 248 Cb 0.00 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.19 3ksq h THR 248 CO 0.00 0.58 0.00 0.61 -0.25 0.00 0.00 175.52 176.46 3ksq n GLY 249 N 0.43 -0.49 1.01 5.82 0.00 0.63 -4.65 105.19 107.94 3ksq n GLY 249 Ca -0.05 -1.75 0.11 0.00 0.00 0.00 0.00 46.02 44.33 3ksq n GLY 249 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3ksq n TYR 250 N -0.52 0.36 0.11 1.61 4.02 -1.26 -4.38 117.16 117.10 3ksq n TYR 250 Ca 0.00 -0.20 -0.02 0.00 -0.01 0.00 0.00 57.90 57.67 3ksq n TYR 250 Cb 0.00 -0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.34 3ksq n TYR 250 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 3ksq h SER 251 N 4.12 0.00 -2.36 7.72 0.02 -1.98 -3.40 113.55 117.65 3ksq h SER 251 Ca 0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.39 3ksq h SER 251 Cb 0.92 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.46 3ksq h SER 251 CO 0.00 0.74 1.30 -0.62 -1.14 0.00 0.00 176.83 177.11 3ksq s ASP 252 N -6.64 6.04 0.32 3.07 -1.08 -1.26 -4.88 116.67 112.24 3ksq s ASP 252 Ca 0.01 2.02 0.00 0.00 -0.52 0.00 0.00 52.55 54.06 3ksq s ASP 252 Cb 0.10 -2.52 0.54 0.00 -1.46 0.00 0.00 42.92 39.58 3ksq s ASP 252 CO 0.78 -1.47 1.98 0.03 0.52 0.00 0.00 175.17 177.00 3ksq h ARG 253 N 12.36 0.96 -0.51 4.34 3.08 -1.96 -0.73 114.38 131.92 3ksq h ARG 253 Ca -0.41 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 59.47 3ksq h ARG 253 Cb 1.21 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 31.03 3ksq h ARG 253 CO 0.97 0.64 -0.12 0.00 -1.07 0.00 0.00 179.97 180.38 3ksq h ALA 254 N 1.54 0.82 0.14 0.04 0.00 -1.96 -0.79 119.26 119.05 3ksq h ALA 254 Ca 0.29 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3ksq h ALA 254 Cb -0.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3ksq h ALA 254 CO -0.07 0.66 -0.07 0.28 0.00 0.00 0.00 179.25 180.05 3ksq h VAL 255 N 0.85 0.96 -0.64 0.00 2.07 -1.78 -1.37 116.25 116.35 3ksq h VAL 255 Ca 0.13 -0.45 0.08 0.00 0.82 0.00 0.00 66.70 67.28 3ksq h VAL 255 Cb 0.67 1.24 -0.06 0.00 -1.52 0.00 0.00 31.29 31.62 3ksq h VAL 255 CO 0.05 0.11 0.30 0.25 0.02 0.00 0.00 177.57 178.30 3ksq h LEU 256 N -0.41 0.38 -0.20 2.57 5.85 -1.09 -0.35 115.31 122.07 3ksq h LEU 256 Ca -0.02 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3ksq h LEU 256 Cb 0.32 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 3ksq h LEU 256 CO 0.03 0.23 0.08 -0.08 -0.34 0.00 0.00 178.44 178.37 3ksq h GLU 257 N 0.53 0.30 -0.73 1.25 4.57 -1.09 -0.35 114.58 119.07 3ksq h GLU 257 Ca 0.31 -0.06 0.03 0.00 -1.18 0.00 0.00 59.36 58.47 3ksq h GLU 257 Cb 0.31 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.80 3ksq h GLU 257 CO -0.25 0.37 0.46 -0.09 -1.18 0.00 0.00 179.01 178.31 3ksq h ARG 258 N 0.17 0.86 -0.16 1.92 2.43 -0.79 -0.96 114.38 117.85 3ksq h ARG 258 Ca 0.07 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 3ksq h ARG 258 Cb 0.18 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.53 3ksq h ARG 258 CO -0.01 0.57 -0.05 0.93 -1.51 0.00 0.00 179.97 179.91 3ksq h GLU 259 N 0.88 0.31 -0.59 0.20 4.39 -0.80 -0.57 114.58 118.41 3ksq h GLU 259 Ca 0.30 -0.12 -0.03 0.00 0.34 0.00 0.00 59.36 59.84 3ksq h GLU 259 Cb 0.04 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 3ksq h GLU 259 CO -0.12 0.60 0.25 0.28 -1.16 0.00 0.00 179.01 178.86 3ksq h VAL 260 N 0.01 1.22 -0.12 3.13 2.07 -0.97 -0.14 116.25 121.44 3ksq h VAL 260 Ca 0.04 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 3ksq h VAL 260 Cb 0.49 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 3ksq h VAL 260 CO 0.02 0.26 0.04 -0.61 0.02 0.00 0.00 177.57 177.30 3ksq h GLN 261 N 0.81 0.19 -0.44 1.57 5.75 -1.11 0.90 115.11 122.78 3ksq h GLN 261 Ca 0.20 -0.04 0.06 0.00 -0.15 0.00 0.00 58.65 58.72 3ksq h GLN 261 Cb 0.17 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.64 3ksq h GLN 261 CO -0.02 0.32 0.13 -0.92 -2.65 0.00 0.00 178.83 175.69 3ksq h TYR 262 N 0.02 0.23 -0.50 3.99 3.20 -0.97 -0.66 116.97 122.27 3ksq h TYR 262 Ca 0.04 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.89 3ksq h TYR 262 Cb 0.21 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 3ksq h TYR 262 CO -0.00 0.06 0.13 1.15 -1.64 0.00 0.00 178.16 177.86 3ksq h THR 263 N 0.28 1.24 -0.78 1.81 2.02 -0.81 -1.66 112.91 115.02 3ksq h THR 263 Ca 0.21 -0.82 -0.05 0.00 0.77 0.00 0.00 66.41 66.53 3ksq h THR 263 Cb 0.23 0.82 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 3ksq h THR 263 CO -0.24 0.30 0.30 -0.07 0.37 0.00 0.00 175.52 176.18 3ksq h LEU 264 N 0.68 1.07 -0.68 2.58 3.38 -0.33 -0.05 115.31 121.96 3ksq h LEU 264 Ca 0.16 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3ksq h LEU 264 Cb 0.31 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3ksq h LEU 264 CO -0.00 0.95 0.21 -0.33 0.09 0.00 0.00 178.44 179.36 3ksq h GLU 265 N 1.13 1.05 -0.65 1.13 4.39 -0.93 -1.38 114.58 119.32 3ksq h GLU 265 Ca 0.26 -0.23 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 3ksq h GLU 265 Cb 0.22 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 3ksq h GLU 265 CO -0.02 0.91 0.32 0.52 -1.16 0.00 0.00 179.01 179.58 3ksq h MET 266 N 0.99 0.93 -0.80 2.33 2.86 -0.73 -2.29 114.93 118.23 3ksq h MET 266 Ca 0.22 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.68 3ksq h MET 266 Cb 0.30 -0.17 -0.04 0.00 0.06 0.00 0.00 31.60 31.75 3ksq h MET 266 CO -0.01 0.74 0.34 0.82 1.06 0.00 0.00 176.91 179.87 3ksq h ILE 267 N 0.90 1.26 -0.63 -1.22 2.04 -0.71 -1.50 117.51 117.64 3ksq h ILE 267 Ca 0.22 -0.77 -0.06 0.00 1.00 0.00 0.00 64.86 65.24 3ksq h ILE 267 Cb 0.11 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 3ksq h ILE 267 CO -0.03 0.32 0.14 0.11 0.00 0.00 0.00 178.15 178.69 3ksq h LYS 268 N 1.15 1.01 -0.17 2.37 1.57 -0.92 -1.17 116.57 120.41 3ksq h LYS 268 Ca 0.27 -0.25 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 3ksq h LYS 268 Cb 0.18 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 3ksq h LYS 268 CO -0.03 0.92 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.64 3ksq h LEU 269 N 0.93 0.36 -6.53 2.94 3.38 -1.21 -3.38 115.31 111.79 3ksq h LEU 269 Ca 0.20 -0.40 -0.60 0.00 0.09 0.00 0.00 57.88 57.17 3ksq h LEU 269 Cb 0.37 -0.10 -0.41 0.00 0.09 0.00 0.00 40.66 40.62 3ksq h LEU 269 CO 0.00 0.68 -0.75 0.52 0.09 0.00 0.00 178.44 178.98 3ksq n VAL 270 N -4.63 0.82 0.13 1.22 0.31 -0.58 -5.00 118.33 110.60 3ksq n VAL 270 Ca -0.05 -4.50 0.17 0.00 -0.01 0.00 0.00 64.34 59.94 3ksq n VAL 270 Cb 0.29 -2.01 0.73 0.00 -0.91 0.00 0.00 33.84 31.95 3ksq n VAL 270 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 3ksq h PRO 271 N 4.92 0.00 -0.58 5.55 0.11 -1.41 -1.65 132.00 138.94 3ksq h PRO 271 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 3ksq h PRO 271 Cb 0.78 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.89 3ksq h PRO 271 CO 0.63 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 179.14 3ksq n HIS 272 N -4.18 0.95 -2.77 0.65 8.25 -1.26 -4.84 115.22 112.02 3ksq n HIS 272 Ca 0.04 -0.40 -0.42 0.00 -0.26 0.00 0.00 57.72 56.68 3ksq n HIS 272 Cb 0.41 -0.14 -0.04 0.00 1.12 0.00 0.00 29.99 31.35 3ksq n HIS 272 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 3ksq s ASN 273 N -0.83 6.26 0.48 0.41 2.47 -0.62 -4.92 114.94 118.19 3ksq s ASN 273 Ca 0.35 -0.52 0.14 0.00 0.42 0.00 0.00 52.86 53.25 3ksq s ASN 273 Cb 0.22 -2.46 1.14 0.00 -1.45 0.00 0.00 41.25 38.69 3ksq s ASN 273 CO 0.19 -1.43 2.10 -0.08 -3.72 0.00 0.00 177.10 174.15 3ksq h GLU 274 N 9.55 0.19 -0.28 0.43 4.81 -1.89 -3.15 114.58 124.23 3ksq h GLU 274 Ca -0.27 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 58.94 3ksq h GLU 274 Cb 1.07 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.39 3ksq h GLU 274 CO 1.16 0.13 0.16 0.77 -0.73 0.00 0.00 179.01 180.50 3ksq h SER 275 N 0.20 0.35 -0.69 1.04 0.02 -1.90 -0.27 113.55 112.30 3ksq h SER 275 Ca 0.09 -0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.90 3ksq h SER 275 Cb 0.11 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 3ksq h SER 275 CO -0.02 0.32 0.17 0.00 -1.14 0.00 0.00 176.83 176.17 3ksq h ALA 276 N 1.05 0.98 -0.52 3.77 0.00 -1.83 -0.71 119.26 121.99 3ksq h ALA 276 Ca 0.10 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 3ksq h ALA 276 Cb 0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3ksq h ALA 276 CO -0.02 0.66 0.17 -1.49 0.00 0.00 0.00 179.25 178.57 3ksq h TRP 277 N 1.06 0.83 -0.34 0.00 4.06 -1.55 -0.50 115.95 119.52 3ksq h TRP 277 Ca 0.22 -0.08 -0.08 0.00 2.06 0.00 0.00 58.89 61.01 3ksq h TRP 277 Cb 0.36 -0.24 -0.02 0.00 -1.00 0.00 0.00 29.16 28.26 3ksq h TRP 277 CO 0.03 0.71 -0.14 -0.91 -3.56 0.00 0.00 178.44 174.57 3ksq h ASN 278 N 0.71 0.58 -0.17 -3.49 2.35 -0.78 -1.89 115.58 112.90 3ksq h ASN 278 Ca 0.17 -0.17 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 3ksq h ASN 278 Cb 0.27 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 3ksq h ASN 278 CO -0.01 0.75 -0.11 0.22 -1.65 0.00 0.00 177.43 176.63 3ksq h TYR 279 N 0.54 0.44 -0.55 1.19 3.20 -0.85 0.08 116.97 121.03 3ksq h TYR 279 Ca 0.09 -0.12 0.04 0.00 3.14 0.00 0.00 58.73 61.89 3ksq h TYR 279 Cb 0.56 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.69 3ksq h TYR 279 CO 0.02 0.71 0.30 1.25 -1.64 0.00 0.00 178.16 178.80 3ksq h LEU 280 N 0.05 0.44 -0.08 2.82 5.85 -0.95 -1.50 115.31 121.94 3ksq h LEU 280 Ca 0.03 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3ksq h LEU 280 Cb 0.61 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 3ksq h LEU 280 CO 0.03 0.30 0.03 0.50 -0.34 0.00 0.00 178.44 178.97 3ksq h LYS 281 N 0.57 0.13 -0.76 1.25 3.64 -1.31 -2.97 116.57 117.12 3ksq h LYS 281 Ca 0.24 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.62 3ksq h LYS 281 Cb 0.11 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.87 3ksq h LYS 281 CO -0.15 0.25 0.50 0.78 -2.27 0.00 0.00 179.45 178.57 3ksq h GLY 282 N -0.03 1.06 1.89 5.01 0.00 -0.70 0.18 103.07 110.47 3ksq h GLY 282 Ca 0.03 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.99 3ksq h GLY 282 CO -0.00 0.32 -0.10 0.16 0.00 0.00 0.00 176.54 176.92 3ksq h ILE 283 N 0.93 0.00 0.00 2.60 3.07 -1.25 -3.37 117.51 119.49 3ksq h ILE 283 Ca 0.30 -0.83 -0.27 0.00 1.55 0.00 0.00 64.86 65.62 3ksq h ILE 283 Cb 0.03 1.77 -0.05 0.00 -0.27 0.00 0.00 36.82 38.30 3ksq h ILE 283 CO -0.08 0.00 -2.03 0.18 -1.05 0.00 0.00 178.15 175.17 3ksq n LEU 284 N -2.78 0.00 0.24 0.16 4.77 -0.97 -4.52 117.00 113.90 3ksq n LEU 284 Ca 0.04 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.19 3ksq n LEU 284 Cb 0.50 0.36 0.87 0.00 -2.33 0.00 0.00 43.42 42.82 3ksq n LEU 284 CO 0.34 0.36 1.15 1.56 -1.33 0.00 0.00 177.39 179.46 3ksq h GLN 285 N 0.00 0.00 0.00 3.23 4.20 -0.82 -2.68 115.11 119.04 3ksq h GLN 285 Ca -0.40 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.31 3ksq h GLN 285 Cb 1.90 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.68 3ksq h GLN 285 CO 0.02 0.00 0.00 -0.25 -0.67 0.00 0.00 178.83 177.93 3ksq n ASP 286 N -3.72 0.00 0.13 1.46 8.00 -1.26 -2.79 116.55 118.37 3ksq n ASP 286 Ca 0.00 0.87 0.13 0.00 0.71 0.00 0.00 54.79 56.50 3ksq n ASP 286 Cb 0.27 -0.37 0.42 0.00 -0.02 0.00 0.00 41.12 41.42 3ksq n ASP 286 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3ksq h ARG 287 N 0.00 0.00 0.00 -1.24 2.47 -1.87 -3.49 114.38 110.25 3ksq h ARG 287 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3ksq h ARG 287 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3ksq h ARG 287 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 179.97 180.94 3ksq n GLY 288 N 0.91 2.41 0.34 0.04 0.00 -1.01 -4.76 105.19 103.12 3ksq n GLY 288 Ca 0.04 -1.38 0.07 0.00 0.00 0.00 0.00 46.02 44.75 3ksq n GLY 288 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ksq h LEU 289 N 0.00 0.58 -1.37 0.99 3.38 -1.81 -2.32 115.31 114.76 3ksq h LEU 289 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ksq h LEU 289 Cb 0.00 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3ksq h LEU 289 CO 0.00 0.39 0.00 0.77 0.09 0.00 0.00 178.44 179.69 3ksq h SER 290 N 0.67 0.00 1.05 -0.43 4.64 -1.86 -2.42 113.55 115.20 3ksq h SER 290 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 3ksq h SER 290 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3ksq h SER 290 CO -0.08 0.00 0.00 -0.09 -0.87 0.00 0.00 176.83 175.79 3ksq h ARG 291 N 0.00 0.00 -3.43 4.77 2.43 -1.71 -3.37 114.38 113.07 3ksq h ARG 291 Ca 0.00 0.00 -0.71 0.00 -0.81 0.00 0.00 59.98 58.46 3ksq h ARG 291 Cb 0.21 0.00 -0.34 0.00 -0.42 0.00 0.00 29.97 29.42 3ksq h ARG 291 CO 0.00 0.00 -0.14 0.71 -1.51 0.00 0.00 179.97 179.03 3ksq s TYR 292 N -3.64 3.75 0.45 2.20 1.51 -0.91 -4.97 117.35 115.74 3ksq s TYR 292 Ca 0.02 -2.86 0.13 0.00 -1.01 0.00 0.00 57.07 53.34 3ksq s TYR 292 Cb 0.09 -3.29 1.03 0.00 -0.11 0.00 0.00 41.96 39.68 3ksq s TYR 292 CO 0.54 -0.79 2.04 -1.00 -1.11 0.00 0.00 175.55 175.24 3ksq h PRO 293 N 6.45 0.14 0.00 -1.71 0.13 -1.83 -2.94 132.00 132.23 3ksq h PRO 293 Ca 0.10 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 65.14 3ksq h PRO 293 Cb 0.87 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.96 3ksq h PRO 293 CO 0.81 0.19 -0.36 -0.91 -0.23 0.00 0.00 178.00 177.49 3ksq h ASN 294 N 0.14 0.00 -0.45 1.44 2.35 -1.96 -3.32 115.58 113.78 3ksq h ASN 294 Ca 0.03 0.00 0.07 0.00 -0.55 0.00 0.00 56.30 55.86 3ksq h ASN 294 Cb 0.15 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.46 3ksq h ASN 294 CO 0.01 0.36 0.09 0.25 -1.65 0.00 0.00 177.43 176.49 3ksq h LEU 295 N 0.00 0.01 -0.03 1.61 5.85 -1.90 -1.13 115.31 119.72 3ksq h LEU 295 Ca -0.00 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.82 3ksq h LEU 295 Cb 0.78 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.88 3ksq h LEU 295 CO 0.05 0.04 -0.18 0.25 -0.34 0.00 0.00 178.44 178.26 3ksq h LEU 296 N 0.23 -0.53 -0.60 2.25 5.85 -1.76 -0.68 115.31 120.07 3ksq h LEU 296 Ca 0.22 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.98 3ksq h LEU 296 Cb 0.28 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 3ksq h LEU 296 CO -0.29 -0.24 0.24 0.78 -0.34 0.00 0.00 178.44 178.60 3ksq h ASN 297 N -0.27 0.84 0.22 1.25 2.35 -1.70 0.38 115.58 118.65 3ksq h ASN 297 Ca 0.07 -0.17 -0.04 0.00 -0.55 0.00 0.00 56.30 55.60 3ksq h ASN 297 Cb 0.36 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 3ksq h ASN 297 CO -0.19 0.78 -0.18 1.56 -1.65 0.00 0.00 177.43 177.75 3ksq h GLN 298 N 0.84 0.00 0.16 0.81 4.20 -0.89 -1.69 115.11 118.55 3ksq h GLN 298 Ca 0.20 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.57 3ksq h GLN 298 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 3ksq h GLN 298 CO -0.02 0.18 -1.69 -0.07 -0.67 0.00 0.00 178.83 176.57 3ksq h LEU 299 N 0.00 0.54 -2.68 1.46 3.38 -0.81 -3.30 115.31 113.91 3ksq h LEU 299 Ca -0.00 -0.80 -0.00 0.00 0.09 0.00 0.00 57.88 57.16 3ksq h LEU 299 Cb 0.34 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 3ksq h LEU 299 CO 0.02 1.68 -0.00 -0.07 0.09 0.00 0.00 178.44 180.16 3ksq h LEU 300 N 0.09 0.00 -0.34 1.67 4.07 -0.67 -0.66 115.31 119.47 3ksq h LEU 300 Ca -0.31 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.65 3ksq h LEU 300 Cb 2.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.82 3ksq h LEU 300 CO 0.17 0.00 -0.09 0.47 -1.08 0.00 0.00 178.44 177.92 3ksq n ASP 301 N -3.15 0.62 -0.17 -0.43 8.00 -0.66 -3.32 116.55 117.44 3ksq n ASP 301 Ca -0.02 -0.82 0.07 0.00 0.71 0.00 0.00 54.79 54.73 3ksq n ASP 301 Cb 0.11 -0.03 -0.04 0.00 -0.02 0.00 0.00 41.12 41.14 3ksq n ASP 301 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3ksq n LEU 302 N -0.75 1.11 -0.27 0.64 4.77 -0.26 -4.69 117.00 117.55 3ksq n LEU 302 Ca 0.16 -0.63 0.08 0.00 -0.03 0.00 0.00 56.01 55.59 3ksq n LEU 302 Cb 0.27 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.57 3ksq n LEU 302 CO 0.22 0.23 0.90 1.56 -1.33 0.00 0.00 177.39 178.97 3ksq h GLN 303 N 0.82 0.20 0.04 3.23 1.08 -1.54 0.90 115.11 119.84 3ksq h GLN 303 Ca 0.00 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 3ksq h GLN 303 Cb 0.42 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.81 3ksq h GLN 303 CO 0.00 0.13 -0.02 -1.35 -0.95 0.00 0.00 178.83 176.64 3ksq h PRO 304 N 0.20 -0.05 0.00 1.46 0.11 -1.84 -3.37 132.00 128.51 3ksq h PRO 304 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 3ksq h PRO 304 Cb 0.84 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.96 3ksq h PRO 304 CO -0.60 0.60 0.00 0.45 -0.21 0.00 0.00 178.00 178.24 3ksq n SER 305 N -4.73 0.00 -2.63 -2.05 2.88 -1.13 -4.47 113.62 101.49 3ksq n SER 305 Ca -0.08 0.53 -0.32 0.00 -1.33 0.00 0.00 58.87 57.68 3ksq n SER 305 Cb 0.33 -0.28 -0.01 0.00 -0.75 0.00 0.00 64.21 63.49 3ksq n SER 305 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 3ksq n HIS 306 N -1.35 2.17 -1.94 0.66 8.25 0.30 -5.01 115.22 118.30 3ksq n HIS 306 Ca 0.00 -2.12 -0.31 0.00 -0.26 0.00 0.00 57.72 55.03 3ksq n HIS 306 Cb 0.00 -1.30 0.01 0.00 1.12 0.00 0.00 29.99 29.82 3ksq n HIS 306 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3ksq s SER 307 N -0.27 6.23 -0.07 0.41 0.15 -1.16 -4.79 113.70 114.19 3ksq s SER 307 Ca 0.56 1.46 -0.32 0.00 0.70 0.00 0.00 55.95 58.35 3ksq s SER 307 Cb 0.40 -2.48 0.12 0.00 -1.71 0.00 0.00 66.02 62.36 3ksq s SER 307 CO -0.28 -0.87 1.17 -0.94 1.20 0.00 0.00 173.24 173.52 3ksq s SER 308 N -3.95 -0.14 0.14 5.45 1.04 -1.26 -4.87 113.70 110.10 3ksq s SER 308 Ca 0.56 -0.09 0.16 0.00 0.48 0.00 0.00 55.95 57.06 3ksq s SER 308 Cb -0.11 0.22 0.71 0.00 0.10 0.00 0.00 66.02 66.93 3ksq s SER 308 CO 0.50 -0.37 1.48 -0.81 0.98 0.00 0.00 173.24 175.02 3ksq n PRO 309 N -0.28 0.09 -0.01 4.02 -0.04 -1.26 -2.30 135.00 135.21 3ksq n PRO 309 Ca -0.04 0.42 -0.17 0.00 -0.04 0.00 0.00 63.50 63.67 3ksq n PRO 309 Cb 0.60 -1.70 -0.10 0.00 -0.04 0.00 0.00 33.50 32.27 3ksq n PRO 309 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3ksq h TYR 310 N 0.00 0.68 -0.32 0.54 -1.99 -1.95 -1.29 116.97 112.65 3ksq h TYR 310 Ca 0.00 -0.34 -0.00 0.00 2.00 0.00 0.00 58.73 60.39 3ksq h TYR 310 Cb 0.19 -0.09 -0.02 0.00 2.00 0.00 0.00 36.73 38.81 3ksq h TYR 310 CO 0.00 1.13 0.18 1.25 -0.00 0.00 0.00 178.16 180.73 3ksq h LEU 311 N 0.04 0.38 -0.29 3.88 6.46 -1.80 -1.07 115.31 122.90 3ksq h LEU 311 Ca -0.06 -0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.63 3ksq h LEU 311 Cb 1.25 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 41.07 3ksq h LEU 311 CO 0.12 0.34 0.14 0.40 -0.62 0.00 0.00 178.44 178.82 3ksq h ILE 312 N 0.40 1.15 -0.94 4.05 1.08 -1.58 -1.46 117.51 120.20 3ksq h ILE 312 Ca 0.11 -0.43 -0.01 0.00 -0.39 0.00 0.00 64.86 64.14 3ksq h ILE 312 Cb 0.03 0.90 -0.05 0.00 -3.07 0.00 0.00 36.82 34.63 3ksq h ILE 312 CO -0.02 0.16 0.56 0.00 -0.69 0.00 0.00 178.15 178.15 3ksq h ALA 313 N 1.00 1.20 -0.60 1.87 0.00 -1.15 -2.24 119.26 119.35 3ksq h ALA 313 Ca 0.10 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3ksq h ALA 313 Cb 0.12 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3ksq h ALA 313 CO -0.01 0.67 0.09 0.35 0.00 0.00 0.00 179.25 180.34 3ksq h PHE 314 N 1.30 1.07 -0.54 0.00 3.57 -0.86 -1.81 116.94 119.67 3ksq h PHE 314 Ca 0.34 -0.15 0.05 0.00 3.53 0.00 0.00 57.97 61.73 3ksq h PHE 314 Cb -0.04 -0.29 -0.05 0.00 2.79 0.00 0.00 35.95 38.36 3ksq h PHE 314 CO 0.01 0.92 0.28 -0.07 -2.23 0.00 0.00 178.31 177.22 3ksq h LEU 315 N 0.90 0.40 -0.97 0.59 3.38 -0.94 0.13 115.31 118.81 3ksq h LEU 315 Ca 0.18 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 3ksq h LEU 315 Cb 0.44 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 3ksq h LEU 315 CO 0.01 0.28 0.42 0.58 0.09 0.00 0.00 178.44 179.82 3ksq h VAL 316 N 0.54 1.25 -0.68 1.22 2.07 -1.12 -0.90 116.25 118.63 3ksq h VAL 316 Ca 0.24 -0.65 -0.07 0.00 0.82 0.00 0.00 66.70 67.03 3ksq h VAL 316 Cb 0.14 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.05 3ksq h VAL 316 CO -0.16 0.29 0.13 0.44 0.02 0.00 0.00 177.57 178.29 3ksq h ASP 317 N 1.16 1.06 -0.06 0.57 3.32 -0.52 0.53 116.42 122.47 3ksq h ASP 317 Ca 0.29 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 3ksq h ASP 317 Cb 0.07 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.33 3ksq h ASP 317 CO -0.04 1.04 0.04 0.40 -1.72 0.00 0.00 179.24 178.95 3ksq h ILE 318 N 1.04 1.05 -0.67 0.35 2.04 -0.50 -2.54 117.51 118.28 3ksq h ILE 318 Ca 0.21 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.92 3ksq h ILE 318 Cb 0.42 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 3ksq h ILE 318 CO 0.01 0.05 0.39 1.88 0.00 0.00 0.00 178.15 180.47 3ksq h TYR 319 N 0.04 0.89 -0.21 1.37 0.99 -0.96 -1.46 116.97 117.64 3ksq h TYR 319 Ca 0.02 -0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.79 3ksq h TYR 319 Cb 0.04 -0.29 -0.05 0.00 1.00 0.00 0.00 36.73 37.43 3ksq h TYR 319 CO -0.06 0.61 -0.09 0.93 -0.00 0.00 0.00 178.16 179.55 3ksq h GLU 320 N 0.91 -0.06 -0.68 4.88 5.08 -0.83 -1.27 114.58 122.60 3ksq h GLU 320 Ca 0.24 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.54 3ksq h GLU 320 Cb -0.01 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 3ksq h GLU 320 CO -0.04 -0.04 0.18 0.22 -1.00 0.00 0.00 179.01 178.33 3ksq h ASP 321 N -0.06 1.00 -0.53 1.42 3.58 -1.08 -2.23 116.42 118.54 3ksq h ASP 321 Ca 0.11 -0.20 -0.02 0.00 0.42 0.00 0.00 57.03 57.34 3ksq h ASP 321 Cb 0.23 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 3ksq h ASP 321 CO -0.25 0.95 0.25 0.24 -2.88 0.00 0.00 179.24 177.55 3ksq h MET 322 N 1.02 0.76 0.00 0.28 2.86 -1.03 -1.89 114.93 116.93 3ksq h MET 322 Ca 0.22 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 3ksq h MET 322 Cb 0.33 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 3ksq h MET 322 CO -0.00 0.63 -0.15 -0.07 1.06 0.00 0.00 176.91 178.38 3ksq h LEU 323 N 0.70 0.00 0.00 1.22 4.07 -1.01 -2.16 115.31 118.13 3ksq h LEU 323 Ca 0.18 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.14 3ksq h LEU 323 Cb 0.13 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.87 3ksq h LEU 323 CO -0.02 0.15 -0.61 -0.33 -1.08 0.00 0.00 178.44 176.55 3ksq h GLU 324 N 0.00 0.00 -0.60 1.13 5.08 -0.89 -3.37 114.58 115.93 3ksq h GLU 324 Ca -0.00 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.97 3ksq h GLU 324 Cb 0.35 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.36 3ksq h GLU 324 CO 0.02 0.00 -0.09 0.09 -1.00 0.00 0.00 179.01 178.03 3ksq n ASN 325 N -2.71 4.11 -3.76 1.42 3.02 -0.76 -5.00 115.26 111.58 3ksq n ASN 325 Ca 0.02 -3.78 -0.28 0.00 -0.03 0.00 0.00 54.58 50.51 3ksq n ASN 325 Cb 0.52 -0.63 0.01 0.00 -0.61 0.00 0.00 39.78 39.08 3ksq n ASN 325 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ksq n GLN 326 N -0.98 -1.16 -1.97 3.52 3.00 -1.18 -4.97 117.38 113.64 3ksq n GLN 326 Ca 0.43 0.64 -0.30 0.00 -0.01 0.00 0.00 57.00 57.75 3ksq n GLN 326 Cb 0.98 -3.03 0.02 0.00 0.00 0.00 0.00 30.24 28.20 3ksq n GLN 326 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3ksq s ASP 328 N -4.22 6.59 -1.25 0.00 -0.00 -1.26 -3.77 116.67 112.76 3ksq s ASP 328 Ca 0.55 2.01 -0.03 0.00 -0.00 0.00 0.00 52.55 55.09 3ksq s ASP 328 Cb -0.11 -2.58 0.00 0.00 -0.00 0.00 0.00 42.92 40.24 3ksq s ASP 328 CO 0.52 -0.61 1.04 0.59 -0.00 0.00 0.00 175.17 176.71 3ksq n ASN 329 N -0.40 -3.22 -0.20 0.27 3.02 -1.26 -4.86 115.26 108.62 3ksq n ASN 329 Ca 0.07 -0.61 -0.02 0.00 -0.03 0.00 0.00 54.58 53.99 3ksq n ASN 329 Cb 0.51 -5.06 0.05 0.00 -0.61 0.00 0.00 39.78 34.67 3ksq n ASN 329 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3ksq h LYS 330 N -2.12 -0.02 -0.19 3.52 1.63 -1.99 -1.39 116.57 116.02 3ksq h LYS 330 Ca -0.59 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.13 3ksq h LYS 330 Cb 1.35 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.97 3ksq h LYS 330 CO 0.52 -0.01 -0.26 1.49 -3.45 0.00 0.00 179.45 177.74 3ksq h GLU 331 N -0.02 0.34 -0.26 1.90 4.81 -1.92 -2.03 114.58 117.41 3ksq h GLU 331 Ca 0.28 -0.12 -0.09 0.00 -0.13 0.00 0.00 59.36 59.30 3ksq h GLU 331 Cb 0.44 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 3ksq h GLU 331 CO -0.61 0.58 -0.20 0.22 -0.73 0.00 0.00 179.01 178.27 3ksq h ASP 332 N 0.31 0.63 -0.03 1.04 1.82 -1.76 -2.64 116.42 115.78 3ksq h ASP 332 Ca 0.05 -0.45 -0.00 0.00 -0.39 0.00 0.00 57.03 56.24 3ksq h ASP 332 Cb 0.62 -0.18 -0.00 0.00 0.68 0.00 0.00 39.33 40.45 3ksq h ASP 332 CO 0.04 0.94 0.02 0.40 -1.61 0.00 0.00 179.24 179.03 3ksq h ILE 333 N 0.32 1.10 -0.37 2.25 1.08 -1.12 -1.65 117.51 119.12 3ksq h ILE 333 Ca 0.05 -0.29 0.07 0.00 -0.39 0.00 0.00 64.86 64.30 3ksq h ILE 333 Cb 0.74 1.23 -0.07 0.00 -3.07 0.00 0.00 36.82 35.66 3ksq h ILE 333 CO 0.05 0.08 -0.05 0.25 -0.69 0.00 0.00 178.15 177.79 3ksq h LEU 334 N -0.06 -0.25 -0.85 1.44 5.85 -1.42 0.27 115.31 120.29 3ksq h LEU 334 Ca 0.01 0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.75 3ksq h LEU 334 Cb 0.12 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 3ksq h LEU 334 CO -0.00 -0.08 -0.06 0.78 -0.34 0.00 0.00 178.44 178.73 3ksq h ASN 335 N 0.05 0.77 0.06 1.25 2.35 -1.39 0.11 115.58 118.77 3ksq h ASN 335 Ca 0.18 -0.21 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 3ksq h ASN 335 Cb 0.27 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.43 3ksq h ASN 335 CO -0.35 0.87 -0.03 0.11 -1.65 0.00 0.00 177.43 176.39 3ksq h LYS 336 N 0.72 -0.08 -0.12 0.81 1.57 -0.65 -1.49 116.57 117.33 3ksq h LYS 336 Ca 0.13 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.93 3ksq h LYS 336 Cb 0.53 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 3ksq h LYS 336 CO 0.03 -0.05 0.01 0.00 -0.57 0.00 0.00 179.45 178.86 3ksq h ALA 337 N 0.86 0.11 -0.11 3.86 0.00 -0.71 -2.27 119.26 120.99 3ksq h ALA 337 Ca -0.01 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3ksq h ALA 337 Cb 0.06 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3ksq h ALA 337 CO 0.01 -0.45 -0.08 -0.07 0.00 0.00 0.00 179.25 178.66 3ksq h LEU 338 N 0.05 0.15 -0.18 0.00 3.38 -0.68 -0.69 115.31 117.33 3ksq h LEU 338 Ca 0.06 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 3ksq h LEU 338 Cb 0.06 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3ksq h LEU 338 CO -0.09 0.26 -0.07 -0.08 0.09 0.00 0.00 178.44 178.55 3ksq h GLU 339 N 0.16 0.37 -0.65 1.13 4.81 -0.98 -2.30 114.58 117.12 3ksq h GLU 339 Ca 0.04 -0.15 -0.08 0.00 -0.13 0.00 0.00 59.36 59.03 3ksq h GLU 339 Cb 0.25 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 3ksq h GLU 339 CO 0.01 0.66 0.07 -0.07 -0.73 0.00 0.00 179.01 178.95 3ksq h LEU 340 N 0.06 1.05 -0.54 1.64 3.38 -0.99 -1.21 115.31 118.71 3ksq h LEU 340 Ca 0.04 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.77 3ksq h LEU 340 Cb 0.54 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 3ksq h LEU 340 CO 0.02 1.06 0.33 0.00 0.09 0.00 0.00 178.44 179.94 3ksq h GLU 342 N 0.65 0.46 -0.50 0.00 4.81 -1.15 -0.41 114.58 118.45 3ksq h GLU 342 Ca 0.22 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.36 3ksq h GLU 342 Cb 0.01 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 3ksq h GLU 342 CO -0.09 0.58 0.25 0.82 -0.73 0.00 0.00 179.01 179.83 3ksq h ILE 343 N 0.27 0.95 -0.06 2.32 2.04 -0.91 -0.54 117.51 121.58 3ksq h ILE 343 Ca 0.08 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 3ksq h ILE 343 Cb 0.35 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 36.85 3ksq h ILE 343 CO 0.01 0.09 0.02 -0.07 0.00 0.00 0.00 178.15 178.20 3ksq h LEU 344 N 0.49 0.09 -0.84 1.44 3.38 -0.92 0.23 115.31 119.17 3ksq h LEU 344 Ca 0.22 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 3ksq h LEU 344 Cb 0.13 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3ksq h LEU 344 CO -0.16 0.25 -0.04 0.00 0.09 0.00 0.00 178.44 178.58 3ksq h ALA 345 N 0.84 1.03 0.00 1.53 0.00 -0.89 0.23 119.26 122.00 3ksq h ALA 345 Ca 0.02 -0.29 -0.33 0.00 0.00 0.00 0.00 54.91 54.31 3ksq h ALA 345 Cb 0.19 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 3ksq h ALA 345 CO -0.00 0.59 -2.17 1.63 0.00 0.00 0.00 179.25 179.30 3ksq n LYS 346 N -4.19 0.67 0.04 0.00 5.02 -0.23 -4.31 118.16 115.17 3ksq n LYS 346 Ca 0.02 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 3ksq n LYS 346 Cb 0.33 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 3ksq n LYS 346 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3ksq n GLU 347 N -2.81 0.00 0.13 1.97 2.13 0.67 -4.89 120.64 117.85 3ksq n GLU 347 Ca -0.27 0.00 0.13 0.00 0.66 0.00 0.00 57.16 57.68 3ksq n GLU 347 Cb 1.10 -0.19 0.31 0.00 0.27 0.00 0.00 31.44 32.93 3ksq n GLU 347 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 3ksq h LYS 348 N 0.00 0.00 -0.12 5.31 1.79 -1.18 -3.40 116.57 118.96 3ksq h LYS 348 Ca 0.00 0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 58.23 3ksq h LYS 348 Cb 0.00 0.00 -0.17 0.00 -1.58 0.00 0.00 32.23 30.48 3ksq h LYS 348 CO 0.00 0.00 -0.46 -3.47 -1.08 0.00 0.00 179.45 174.44 3ksq n ASP 349 N -2.49 -1.70 0.27 0.86 2.03 0.79 -4.69 116.55 111.63 3ksq n ASP 349 Ca 0.05 -2.79 0.14 0.00 0.52 0.00 0.00 54.79 52.71 3ksq n ASP 349 Cb 0.46 1.09 0.79 0.00 -0.72 0.00 0.00 41.12 42.74 3ksq n ASP 349 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 3ksq h THR 350 N 2.29 0.50 -0.18 5.18 1.35 -1.70 -1.60 112.91 118.75 3ksq h THR 350 Ca -0.21 -0.40 -0.00 0.00 -0.55 0.00 0.00 66.41 65.24 3ksq h THR 350 Cb 1.23 1.27 -0.01 0.00 -1.73 0.00 0.00 68.15 68.91 3ksq h THR 350 CO 0.03 0.08 0.10 -0.29 -0.25 0.00 0.00 175.52 175.20 3ksq h ILE 351 N 0.00 1.05 -0.61 6.82 6.09 -1.90 -1.58 117.51 127.39 3ksq h ILE 351 Ca -0.00 -0.13 -0.09 0.00 -1.37 0.00 0.00 64.86 63.28 3ksq h ILE 351 Cb 0.26 0.81 -0.05 0.00 0.47 0.00 0.00 36.82 38.31 3ksq h ILE 351 CO 0.01 0.06 0.11 0.54 -3.07 0.00 0.00 178.15 175.80 3ksq n ARG 352 N -4.50 4.19 -0.26 2.19 1.74 -0.60 -4.68 116.66 114.74 3ksq n ARG 352 Ca -0.00 -2.91 0.07 0.00 -0.77 0.00 0.00 57.85 54.23 3ksq n ARG 352 Cb 0.09 -2.20 0.20 0.00 -1.02 0.00 0.00 32.46 29.53 3ksq n ARG 352 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 3ksq h LYS 353 N 3.21 0.27 -0.29 5.56 2.10 -1.29 -0.34 116.57 125.79 3ksq h LYS 353 Ca 0.11 -0.02 -0.09 0.00 -2.00 0.00 0.00 60.65 58.65 3ksq h LYS 353 Cb 2.04 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 33.30 3ksq h LYS 353 CO 0.57 0.18 -0.19 0.93 -2.00 0.00 0.00 179.45 178.93 3ksq h GLU 354 N 0.27 0.53 0.08 0.07 4.39 -1.84 -0.64 114.58 117.45 3ksq h GLU 354 Ca 0.44 -0.18 -0.00 0.00 0.34 0.00 0.00 59.36 59.96 3ksq h GLU 354 Cb 0.77 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 3ksq h GLU 354 CO -0.53 0.70 -0.04 -0.92 -1.16 0.00 0.00 179.01 177.06 3ksq h TYR 355 N 0.48 -0.10 -0.13 4.33 3.20 -1.55 -1.69 116.97 121.50 3ksq h TYR 355 Ca 0.08 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.91 3ksq h TYR 355 Cb 0.60 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 3ksq h TYR 355 CO 0.02 0.31 -0.10 -1.49 -1.64 0.00 0.00 178.16 175.27 3ksq h TRP 356 N -0.54 0.21 -0.08 -3.82 4.06 -0.98 -0.60 115.95 114.20 3ksq h TRP 356 Ca -0.01 -0.02 -0.21 0.00 2.06 0.00 0.00 58.89 60.71 3ksq h TRP 356 Cb 0.45 -0.06 0.00 0.00 -1.00 0.00 0.00 29.16 28.56 3ksq h TRP 356 CO 0.07 0.31 -0.82 0.00 -3.56 0.00 0.00 178.44 174.43 3ksq h ARG 357 N 0.20 0.57 -0.19 0.49 3.08 -1.15 -1.76 114.38 115.62 3ksq h ARG 357 Ca 0.04 -0.51 -0.01 0.00 0.07 0.00 0.00 59.98 59.58 3ksq h ARG 357 Cb 0.31 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 3ksq h ARG 357 CO 0.02 1.13 0.09 -0.92 -1.07 0.00 0.00 179.97 179.22 3ksq h TYR 358 N 0.37 0.27 -0.88 3.04 3.20 -0.78 -1.65 116.97 120.54 3ksq h TYR 358 Ca -0.06 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.80 3ksq h TYR 358 Cb 1.43 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 39.58 3ksq h TYR 358 CO 0.07 0.29 0.57 0.82 -1.64 0.00 0.00 178.16 178.28 3ksq h ILE 359 N 0.17 1.23 0.27 1.81 1.08 -1.07 -0.76 117.51 120.24 3ksq h ILE 359 Ca 0.06 -0.44 -0.00 0.00 -0.39 0.00 0.00 64.86 64.10 3ksq h ILE 359 Cb 0.13 -0.06 -0.01 0.00 -3.07 0.00 0.00 36.82 33.81 3ksq h ILE 359 CO -0.01 0.23 -0.21 1.23 -0.69 0.00 0.00 178.15 178.70 3ksq h GLY 360 N 1.20 -0.49 0.98 5.37 0.00 -1.12 -0.48 103.07 108.53 3ksq h GLY 360 Ca 0.32 0.23 0.01 0.00 0.00 0.00 0.00 47.33 47.89 3ksq h GLY 360 CO -0.07 -0.20 0.38 3.21 0.00 0.00 0.00 176.54 179.86 3ksq h ARG 361 N -0.48 0.75 -0.34 4.80 3.08 -1.20 -2.28 114.38 118.69 3ksq h ARG 361 Ca -0.02 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.01 3ksq h ARG 361 Cb 0.42 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 3ksq h ARG 361 CO -0.01 0.49 0.18 1.03 -1.07 0.00 0.00 179.97 180.60 3ksq h SER 362 N 0.77 0.29 -0.76 7.04 0.87 -0.92 0.20 113.55 121.03 3ksq h SER 362 Ca 0.22 0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.73 3ksq h SER 362 Cb -0.07 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 61.81 3ksq h SER 362 CO -0.06 0.21 0.24 -0.07 -0.53 0.00 0.00 176.83 176.62 3ksq h LEU 363 N 0.38 1.10 0.54 2.23 4.07 -0.98 -1.78 115.31 120.86 3ksq h LEU 363 Ca 0.14 -0.21 -0.03 0.00 0.08 0.00 0.00 57.88 57.87 3ksq h LEU 363 Cb 0.03 -0.29 0.01 0.00 1.08 0.00 0.00 40.66 41.49 3ksq h LEU 363 CO -0.08 1.01 -0.26 1.56 -1.08 0.00 0.00 178.44 179.59 3ksq h GLN 364 N 1.13 -0.69 -0.97 1.13 4.20 -1.13 0.15 115.11 118.92 3ksq h GLN 364 Ca 0.24 0.05 0.19 0.00 0.06 0.00 0.00 58.65 59.19 3ksq h GLN 364 Cb 0.30 0.16 -0.09 0.00 0.30 0.00 0.00 27.48 28.15 3ksq h GLN 364 CO -0.01 -0.39 0.61 1.03 -0.67 0.00 0.00 178.83 179.40 3ksq h SER 365 N -0.96 0.68 0.11 1.46 0.87 -0.87 -1.26 113.55 113.58 3ksq h SER 365 Ca -0.07 0.07 -0.30 0.00 -1.23 0.00 0.00 61.79 60.26 3ksq h SER 365 Cb 0.63 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.53 3ksq h SER 365 CO 0.12 0.27 -1.55 0.11 -0.53 0.00 0.00 176.83 175.25 3ksq h LYS 366 N 0.68 0.23 -0.13 2.24 1.57 -1.30 -3.42 116.57 116.43 3ksq h LYS 366 Ca 0.54 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 3ksq h LYS 366 Cb 0.94 0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.40 3ksq h LYS 366 CO -0.30 1.19 0.00 0.72 -0.57 0.00 0.00 179.45 180.49 3ksq n HIS 367 N -3.86 0.16 0.00 -1.35 8.25 0.51 -5.09 115.22 113.85 3ksq n HIS 367 Ca -0.27 -0.21 0.00 0.00 -0.26 0.00 0.00 57.72 56.98 3ksq n HIS 367 Cb 0.92 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 32.02 3ksq n HIS 367 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41