#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ksw s THR 31 N 0.00 3.62 0.64 0.58 -4.23 -1.26 0.19 115.64 115.18 3ksw s THR 31 Ca 0.00 1.14 -0.14 0.00 -1.18 0.00 0.00 61.69 61.51 3ksw s THR 31 Cb 0.00 -3.54 -0.01 0.00 1.34 0.00 0.00 72.50 70.28 3ksw s THR 31 CO 0.00 -0.08 1.07 -2.16 -0.54 0.00 0.00 174.62 172.90 3ksw s PRO 32 N -2.81 3.07 0.64 3.99 0.04 -1.26 -4.86 135.00 133.82 3ksw s PRO 32 Ca 0.63 1.17 -0.17 0.00 0.04 0.00 0.00 61.00 62.67 3ksw s PRO 32 Cb -0.21 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.32 3ksw s PRO 32 CO 0.26 -1.00 1.19 -2.14 0.04 0.00 0.00 177.00 175.35 3ksw s PRO 33 N -4.36 2.71 0.08 0.56 0.02 -1.26 -4.78 135.00 127.96 3ksw s PRO 33 Ca 0.63 1.73 0.07 0.00 0.02 0.00 0.00 61.00 63.44 3ksw s PRO 33 Cb -0.16 -1.91 -0.03 0.00 0.02 0.00 0.00 34.50 32.42 3ksw s PRO 33 CO 0.43 -1.39 -0.19 0.08 -0.33 0.00 0.00 177.00 175.60 3ksw s VAL 34 N -1.84 1.53 0.06 3.83 1.01 -1.26 -2.07 120.40 121.66 3ksw s VAL 34 Ca 0.75 -1.37 -0.11 0.00 0.00 0.00 0.00 61.98 61.25 3ksw s VAL 34 Cb -0.28 -1.39 -0.06 0.00 0.00 0.00 0.00 36.38 34.65 3ksw s VAL 34 CO 0.38 -0.02 0.41 -0.47 0.00 0.00 0.00 175.10 175.39 3ksw s TYR 35 N -1.07 3.62 -0.13 5.22 5.04 -1.22 -5.01 117.35 123.81 3ksw s TYR 35 Ca 0.05 0.85 -0.18 0.00 -2.44 0.00 0.00 57.07 55.35 3ksw s TYR 35 Cb -0.09 -2.20 -0.04 0.00 0.35 0.00 0.00 41.96 39.97 3ksw s TYR 35 CO 0.03 0.55 0.46 -1.25 -1.34 0.00 0.00 175.55 174.00 3ksw s PRO 36 N -1.69 4.31 0.12 4.97 0.04 -1.26 -4.97 135.00 136.53 3ksw s PRO 36 Ca 0.31 0.41 0.01 0.00 0.04 0.00 0.00 61.00 61.76 3ksw s PRO 36 Cb -0.15 -3.45 -0.04 0.00 0.04 0.00 0.00 34.50 30.90 3ksw s PRO 36 CO 0.17 0.12 0.28 0.08 0.04 0.00 0.00 177.00 177.69 3ksw s VAL 37 N 0.74 5.32 -0.09 -0.36 1.01 -1.26 -5.06 120.40 120.71 3ksw s VAL 37 Ca 0.25 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.73 3ksw s VAL 37 Cb -0.15 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 3ksw s VAL 37 CO 0.10 -0.01 -0.05 0.71 0.00 0.00 0.00 175.10 175.85 3ksw h THR 38 N 1.82 0.00 -3.27 3.92 1.35 -1.98 -3.46 112.91 111.29 3ksw h THR 38 Ca -0.47 -0.77 -0.57 0.00 -0.55 0.00 0.00 66.41 64.05 3ksw h THR 38 Cb 1.18 0.00 -0.05 0.00 -1.73 0.00 0.00 68.15 67.55 3ksw h THR 38 CO 0.72 0.00 -0.04 0.68 -0.25 0.00 0.00 175.52 176.63 3ksw s VAL 39 N -1.61 4.87 0.23 6.82 -7.23 -1.26 -4.98 120.40 117.24 3ksw s VAL 39 Ca -0.04 1.20 -0.03 0.00 -1.81 0.00 0.00 61.98 61.30 3ksw s VAL 39 Cb 0.01 -3.90 0.05 0.00 0.56 0.00 0.00 36.38 33.09 3ksw s VAL 39 CO 0.06 0.47 1.65 -0.65 -0.31 0.00 0.00 175.10 176.32 3ksw h PRO 40 N 5.27 0.73 -0.71 4.82 0.11 -2.03 -3.32 132.00 136.86 3ksw h PRO 40 Ca -0.47 -0.28 -0.06 0.00 0.11 0.00 0.00 66.00 65.30 3ksw h PRO 40 Cb 1.21 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 3ksw h PRO 40 CO 0.67 0.88 0.21 0.35 -0.21 0.00 0.00 178.00 179.90 3ksw h PHE 41 N 0.64 1.16 -3.22 0.65 -0.00 -1.95 -3.40 116.94 110.81 3ksw h PHE 41 Ca 0.09 -0.12 -0.58 0.00 -0.00 0.00 0.00 57.97 57.36 3ksw h PHE 41 Cb 0.71 -0.33 -0.35 0.00 -0.00 0.00 0.00 35.95 35.97 3ksw h PHE 41 CO 0.03 0.93 -0.83 -0.51 -0.00 0.00 0.00 178.31 177.93 3ksw s LEU 42 N -9.60 1.62 -0.62 0.59 2.01 -1.25 -4.65 118.68 106.77 3ksw s LEU 42 Ca -0.12 -0.41 -0.13 0.00 0.01 0.00 0.00 54.13 53.48 3ksw s LEU 42 Cb 0.15 -1.05 0.16 0.00 0.01 0.00 0.00 46.19 45.45 3ksw s LEU 42 CO 0.84 -0.02 0.55 -0.83 1.01 0.00 0.00 176.35 177.89 3ksw s GLY 43 N 1.21 2.30 -1.73 -3.19 0.00 -1.26 -4.55 107.32 100.10 3ksw s GLY 43 Ca -0.02 -2.86 0.00 0.00 0.00 0.00 0.00 44.72 41.84 3ksw s GLY 43 CO -0.05 1.19 0.00 1.42 0.00 0.00 0.00 173.10 175.66 3ksw n HIS 44 N 4.60 -0.20 -0.05 1.90 8.25 -1.26 -2.93 115.22 125.53 3ksw n HIS 44 Ca -0.02 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.30 3ksw n HIS 44 Cb 0.42 -3.07 -0.07 0.00 1.12 0.00 0.00 29.99 28.39 3ksw n HIS 44 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 3ksw h ILE 45 N 0.00 1.37 -0.77 1.59 6.09 -1.99 -2.69 117.51 121.11 3ksw h ILE 45 Ca -0.36 -1.49 -0.05 0.00 -1.37 0.00 0.00 64.86 61.59 3ksw h ILE 45 Cb 1.16 2.00 -0.03 0.00 0.47 0.00 0.00 36.82 40.41 3ksw h ILE 45 CO 0.50 0.44 0.30 1.62 -3.07 0.00 0.00 178.15 177.95 3ksw h VAL 46 N 0.01 1.26 -0.22 2.19 3.04 -1.95 -2.23 116.25 118.35 3ksw h VAL 46 Ca 0.01 -0.82 -0.01 0.00 -1.01 0.00 0.00 66.70 64.87 3ksw h VAL 46 Cb 0.82 0.35 -0.01 0.00 -2.01 0.00 0.00 31.29 30.44 3ksw h VAL 46 CO 0.05 0.33 0.09 1.56 -1.01 0.00 0.00 177.57 178.60 3ksw h GLN 47 N 1.12 0.30 -0.47 4.17 1.08 -1.89 -1.19 115.11 118.22 3ksw h GLN 47 Ca 0.26 -0.03 -0.09 0.00 -1.45 0.00 0.00 58.65 57.34 3ksw h GLN 47 Cb 0.22 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.58 3ksw h GLN 47 CO -0.02 0.25 -0.05 0.35 -0.95 0.00 0.00 178.83 178.41 3ksw h PHE 48 N 0.30 0.95 -0.69 2.96 3.57 -1.06 -3.16 116.94 119.81 3ksw h PHE 48 Ca 0.08 -0.18 -0.03 0.00 3.53 0.00 0.00 57.97 61.36 3ksw h PHE 48 Cb 0.06 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.52 3ksw h PHE 48 CO 0.00 0.92 0.30 0.78 -2.23 0.00 0.00 178.31 178.09 3ksw h GLY 49 N 0.71 1.07 -1.58 2.40 0.00 -0.82 -3.36 103.07 101.50 3ksw h GLY 49 Ca 0.13 -0.54 -0.51 0.00 0.00 0.00 0.00 47.33 46.40 3ksw h GLY 49 CO 0.03 0.51 0.35 1.25 0.00 0.00 0.00 176.54 178.69 3ksw s LYS 50 N -5.52 2.42 0.12 4.80 2.47 -0.63 -4.79 119.74 118.63 3ksw s LYS 50 Ca -0.11 1.41 -0.35 0.00 -1.56 0.00 0.00 55.97 55.36 3ksw s LYS 50 Cb 0.16 -1.90 -0.14 0.00 -1.46 0.00 0.00 37.83 34.49 3ksw s LYS 50 CO 0.81 -1.55 1.54 -1.71 0.16 0.00 0.00 175.35 174.60 3ksw n ASN 51 N -2.88 2.75 0.02 1.43 5.15 -1.26 -4.82 115.26 115.65 3ksw n ASN 51 Ca 0.11 1.09 0.12 0.00 -0.60 0.00 0.00 54.58 55.29 3ksw n ASN 51 Cb 0.52 -1.36 0.23 0.00 -0.53 0.00 0.00 39.78 38.64 3ksw n ASN 51 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 3ksw n PRO 52 N 3.39 0.10 -0.06 1.20 -0.04 -1.26 -3.70 135.00 134.62 3ksw n PRO 52 Ca 0.18 0.02 -0.11 0.00 -0.04 0.00 0.00 63.50 63.55 3ksw n PRO 52 Cb 0.26 -1.56 -0.04 0.00 -0.04 0.00 0.00 33.50 32.12 3ksw n PRO 52 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3ksw h LEU 53 N 0.00 0.29 -0.26 1.53 5.85 -1.94 -0.85 115.31 119.94 3ksw h LEU 53 Ca 0.00 -0.18 -0.08 0.00 0.84 0.00 0.00 57.88 58.47 3ksw h LEU 53 Cb 0.58 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 3ksw h LEU 53 CO 0.00 0.39 -0.13 -0.08 -0.34 0.00 0.00 178.44 178.28 3ksw h GLU 54 N 0.18 0.55 -0.39 1.25 4.22 -1.97 -2.57 114.58 115.85 3ksw h GLU 54 Ca 0.07 -0.24 0.07 0.00 0.08 0.00 0.00 59.36 59.34 3ksw h GLU 54 Cb 0.20 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.34 3ksw h GLU 54 CO -0.00 0.81 -0.40 0.35 -2.18 0.00 0.00 179.01 177.58 3ksw h PHE 55 N 0.28 -1.17 -0.72 0.92 3.57 -1.61 0.23 116.94 118.44 3ksw h PHE 55 Ca 0.06 0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 3ksw h PHE 55 Cb 0.65 0.57 -0.03 0.00 2.79 0.00 0.00 35.95 39.92 3ksw h PHE 55 CO 0.06 -0.43 0.25 0.52 -2.23 0.00 0.00 178.31 176.48 3ksw h MET 56 N -0.32 1.09 -0.22 1.11 2.86 -1.18 -2.75 114.93 115.52 3ksw h MET 56 Ca 0.14 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 3ksw h MET 56 Cb 0.58 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 3ksw h MET 56 CO -0.56 0.91 0.11 1.96 1.06 0.00 0.00 176.91 180.40 3ksw h GLN 57 N 1.06 0.31 -0.63 1.72 4.20 -0.92 -2.80 115.11 118.04 3ksw h GLN 57 Ca 0.24 -0.04 0.11 0.00 0.06 0.00 0.00 58.65 59.02 3ksw h GLN 57 Cb 0.26 -0.06 -0.12 0.00 0.30 0.00 0.00 27.48 27.86 3ksw h GLN 57 CO -0.01 0.30 -0.32 -0.09 -0.67 0.00 0.00 178.83 178.04 3ksw h ARG 58 N 0.24 -0.13 -0.60 1.46 2.43 -0.29 -1.65 114.38 115.84 3ksw h ARG 58 Ca 0.08 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.29 3ksw h ARG 58 Cb 0.08 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.62 3ksw h ARG 58 CO -0.01 -0.08 0.36 0.00 -1.51 0.00 0.00 179.97 178.73 3ksw h LYS 60 N 0.71 0.85 -0.04 0.00 3.64 -1.06 -1.41 116.57 119.26 3ksw h LYS 60 Ca 0.25 -0.10 -0.15 0.00 -1.27 0.00 0.00 60.65 59.38 3ksw h LYS 60 Cb 0.05 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 3ksw h LYS 60 CO -0.12 0.65 -0.67 -0.09 -2.27 0.00 0.00 179.45 176.95 3ksw h ARG 61 N 0.86 0.17 0.04 1.90 2.43 -1.08 -1.81 114.38 116.89 3ksw h ARG 61 Ca 0.22 -0.13 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 3ksw h ARG 61 Cb 0.06 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 3ksw h ARG 61 CO -0.03 0.78 -0.02 -0.44 -1.51 0.00 0.00 179.97 178.75 3ksw h ASP 62 N 0.12 -0.04 0.53 -3.80 3.32 -1.05 -3.31 116.42 112.18 3ksw h ASP 62 Ca -0.01 -0.33 0.00 0.00 0.02 0.00 0.00 57.03 56.70 3ksw h ASP 62 Cb 1.20 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.76 3ksw h ASP 62 CO 0.10 0.61 0.00 0.18 -1.72 0.00 0.00 179.24 178.41 3ksw n LEU 63 N -4.76 0.00 -3.78 1.55 4.32 -0.58 -4.94 117.00 108.81 3ksw n LEU 63 Ca -0.04 0.29 -0.28 0.00 -0.02 0.00 0.00 56.01 55.96 3ksw n LEU 63 Cb 0.18 -0.29 0.02 0.00 -1.62 0.00 0.00 43.42 41.71 3ksw n LEU 63 CO 0.14 -0.02 -0.13 0.29 -1.22 0.00 0.00 177.39 176.45 3ksw n LYS 64 N -1.29 -2.38 -3.61 3.23 5.02 -0.68 -4.97 118.16 113.48 3ksw n LYS 64 Ca 0.13 0.46 -0.12 0.00 -2.02 0.00 0.00 58.31 56.76 3ksw n LYS 64 Cb 0.22 -4.38 -0.07 0.00 -0.02 0.00 0.00 35.03 30.79 3ksw n LYS 64 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3ksw s SER 65 N -3.89 -0.54 0.00 4.39 0.15 -1.20 -5.03 113.70 107.58 3ksw s SER 65 Ca 0.26 0.91 0.28 0.00 0.70 0.00 0.00 55.95 58.09 3ksw s SER 65 Cb -0.09 0.87 1.43 0.00 -1.71 0.00 0.00 66.02 66.52 3ksw s SER 65 CO 0.86 -0.27 1.95 0.61 1.20 0.00 0.00 173.24 177.59 3ksw n GLY 66 N 1.88 -0.61 2.78 9.45 0.00 -1.26 -4.72 105.19 112.70 3ksw n GLY 66 Ca -0.13 -0.27 -0.22 0.00 0.00 0.00 0.00 46.02 45.39 3ksw n GLY 66 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ksw s VAL 67 N -1.98 0.36 0.32 1.61 1.01 -1.26 -0.50 120.40 119.95 3ksw s VAL 67 Ca 0.40 0.12 -0.07 0.00 0.00 0.00 0.00 61.98 62.43 3ksw s VAL 67 Cb 0.20 -0.51 0.01 0.00 0.00 0.00 0.00 36.38 36.08 3ksw s VAL 67 CO 0.32 0.25 0.51 0.72 0.00 0.00 0.00 175.10 176.91 3ksw s PHE 68 N 1.85 0.75 -0.06 5.22 -0.12 -1.17 -4.28 117.98 120.18 3ksw s PHE 68 Ca 0.03 -1.07 0.04 0.00 -0.05 0.00 0.00 56.93 55.87 3ksw s PHE 68 Cb -0.12 0.11 0.00 0.00 -0.63 0.00 0.00 43.02 42.38 3ksw s PHE 68 CO -0.05 -1.15 -0.17 0.99 -0.05 0.00 0.00 175.22 174.79 3ksw s THR 69 N -3.22 1.47 -0.11 -4.49 2.01 -0.88 -0.34 115.64 110.07 3ksw s THR 69 Ca 0.26 -0.72 -0.16 0.00 0.31 0.00 0.00 61.69 61.39 3ksw s THR 69 Cb -0.01 -1.27 -0.26 0.00 0.01 0.00 0.00 72.50 70.96 3ksw s THR 69 CO 0.16 0.42 0.52 0.16 -0.69 0.00 0.00 174.62 175.19 3ksw h ILE 70 N 5.45 1.01 -5.27 1.82 3.07 0.47 -3.22 117.51 120.84 3ksw h ILE 70 Ca -0.31 -2.37 -0.30 0.00 1.55 0.00 0.00 64.86 63.43 3ksw h ILE 70 Cb 1.18 2.67 0.15 0.00 -0.27 0.00 0.00 36.82 40.56 3ksw h ILE 70 CO 0.48 0.68 -0.68 -1.54 -1.05 0.00 0.00 178.15 176.04 3ksw n SER 71 N -3.95 -2.41 -4.70 2.16 3.41 -1.25 -4.69 113.62 102.18 3ksw n SER 71 Ca -0.26 -0.55 -0.42 0.00 -0.26 0.00 0.00 58.87 57.38 3ksw n SER 71 Cb 0.88 -4.63 -0.03 0.00 -0.26 0.00 0.00 64.21 60.17 3ksw n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ksw n ILE 72 N -3.89 0.18 -2.99 -1.33 3.06 0.12 -2.62 119.36 111.88 3ksw n ILE 72 Ca -0.23 -0.03 -0.22 0.00 -2.50 0.00 0.00 62.75 59.76 3ksw n ILE 72 Cb 0.64 -2.04 0.02 0.00 0.54 0.00 0.00 39.64 38.81 3ksw n ILE 72 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3ksw n GLY 73 N 4.09 -0.52 2.01 4.50 0.00 -1.15 -0.39 105.19 113.73 3ksw n GLY 73 Ca 0.17 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.30 3ksw n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ksw n GLY 74 N -1.39 1.37 3.19 -0.02 0.00 -1.08 -4.76 105.19 102.50 3ksw n GLY 74 Ca -0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 3ksw n GLY 74 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ksw s GLN 75 N -0.33 2.39 0.26 1.61 2.00 0.48 -5.04 119.66 121.03 3ksw s GLN 75 Ca 0.00 -1.35 -0.30 0.00 -2.00 0.00 0.00 55.36 51.71 3ksw s GLN 75 Cb 0.00 -3.32 -0.14 0.00 0.80 0.00 0.00 33.01 30.36 3ksw s GLN 75 CO 0.00 -0.71 1.22 0.54 -0.50 0.00 0.00 175.29 175.84 3ksw n ARG 76 N 4.66 1.71 -3.71 1.67 1.74 -1.26 0.11 116.66 121.57 3ksw n ARG 76 Ca -0.11 0.60 -0.21 0.00 -0.77 0.00 0.00 57.85 57.36 3ksw n ARG 76 Cb 0.43 -2.13 -0.18 0.00 -1.02 0.00 0.00 32.46 29.56 3ksw n ARG 76 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3ksw s VAL 77 N -0.59 0.06 -0.19 1.55 1.01 -1.26 -3.63 120.40 117.35 3ksw s VAL 77 Ca 0.63 0.32 -0.12 0.00 0.00 0.00 0.00 61.98 62.82 3ksw s VAL 77 Cb -0.68 -0.29 -0.05 0.00 0.00 0.00 0.00 36.38 35.36 3ksw s VAL 77 CO 0.56 0.21 0.20 -0.89 0.00 0.00 0.00 175.10 175.18 3ksw s THR 78 N 2.09 5.36 -0.18 3.92 2.01 0.26 0.11 115.64 129.21 3ksw s THR 78 Ca 0.05 0.33 -0.06 0.00 0.31 0.00 0.00 61.69 62.32 3ksw s THR 78 Cb -0.12 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.81 3ksw s THR 78 CO -0.04 0.40 0.02 -0.63 -0.69 0.00 0.00 174.62 173.68 3ksw s ILE 79 N 0.55 4.33 -0.45 1.82 1.01 0.54 -0.52 121.20 128.48 3ksw s ILE 79 Ca 0.11 -0.20 -0.14 0.00 0.00 0.00 0.00 60.65 60.43 3ksw s ILE 79 Cb -0.12 -2.94 0.07 0.00 0.01 0.00 0.00 42.46 39.48 3ksw s ILE 79 CO 0.01 0.47 0.36 -0.69 0.00 0.00 0.00 174.94 175.09 3ksw s VAL 80 N 0.47 5.03 -0.41 2.92 1.01 0.02 -3.03 120.40 126.42 3ksw s VAL 80 Ca 0.00 -1.09 0.10 0.00 0.00 0.00 0.00 61.98 60.99 3ksw s VAL 80 Cb -0.13 -4.00 0.42 0.00 0.00 0.00 0.00 36.38 32.67 3ksw s VAL 80 CO 0.02 -0.53 1.02 0.61 0.00 0.00 0.00 175.10 176.21 3ksw n GLY 81 N 5.14 4.26 2.74 4.51 0.00 0.34 -4.12 105.19 118.06 3ksw n GLY 81 Ca -0.12 -2.19 -0.24 0.00 0.00 0.00 0.00 46.02 43.47 3ksw n GLY 81 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3ksw s ASP 82 N -3.33 1.95 0.42 1.61 -1.08 -1.25 -4.73 116.67 110.25 3ksw s ASP 82 Ca 0.40 -0.30 0.23 0.00 -0.52 0.00 0.00 52.55 52.36 3ksw s ASP 82 Cb 0.41 -0.43 1.24 0.00 -1.46 0.00 0.00 42.92 42.68 3ksw s ASP 82 CO -0.10 -0.24 1.71 -0.65 0.52 0.00 0.00 175.17 176.41 3ksw h PRO 83 N 8.33 0.25 -0.08 4.34 0.11 -1.94 0.31 132.00 143.31 3ksw h PRO 83 Ca -0.18 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.88 3ksw h PRO 83 Cb 1.13 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3ksw h PRO 83 CO 0.27 0.17 -0.11 0.45 -0.21 0.00 0.00 178.00 178.57 3ksw h HIS 84 N 0.26 0.12 -0.10 0.65 3.86 -1.94 -3.11 115.15 114.90 3ksw h HIS 84 Ca 0.68 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.88 3ksw h HIS 84 Cb 1.95 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 30.38 3ksw h HIS 84 CO -0.00 0.24 0.00 0.39 0.86 0.00 0.00 177.93 179.41 3ksw n GLU 85 N -4.34 1.89 -0.04 2.45 -0.58 0.11 -4.46 120.64 115.68 3ksw n GLU 85 Ca -0.02 -1.31 0.18 0.00 -0.42 0.00 0.00 57.16 55.59 3ksw n GLU 85 Cb 0.22 -1.46 0.63 0.00 -0.57 0.00 0.00 31.44 30.26 3ksw n GLU 85 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3ksw h HIS 86 N 2.96 0.15 0.00 -0.32 3.86 -1.59 -1.53 115.15 118.68 3ksw h HIS 86 Ca 0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.16 3ksw h HIS 86 Cb 0.64 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 29.05 3ksw h HIS 86 CO 0.06 0.06 -0.27 0.66 0.86 0.00 0.00 177.93 179.30 3ksw h SER 87 N 0.14 0.00 0.29 2.45 4.64 -1.86 -2.62 113.55 116.59 3ksw h SER 87 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 3ksw h SER 87 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 3ksw h SER 87 CO -0.04 0.27 0.00 0.54 -0.87 0.00 0.00 176.83 176.73 3ksw n ARG 88 N -3.34 0.19 -0.01 4.77 5.12 -0.58 -2.73 116.66 120.09 3ksw n ARG 88 Ca 0.01 0.16 -0.01 0.00 -1.93 0.00 0.00 57.85 56.07 3ksw n ARG 88 Cb 0.50 -1.50 -0.01 0.00 -1.16 0.00 0.00 32.46 30.29 3ksw n ARG 88 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 3ksw n PHE 89 N -1.30 0.00 0.04 -1.55 7.35 -1.00 -4.73 117.46 116.27 3ksw n PHE 89 Ca 0.07 0.00 0.08 0.00 -0.76 0.00 0.00 57.45 56.83 3ksw n PHE 89 Cb 0.12 -0.07 -0.08 0.00 0.35 0.00 0.00 39.48 39.80 3ksw n PHE 89 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 3ksw n PHE 90 N -2.27 0.60 0.07 -5.13 3.01 -1.11 -4.47 117.46 108.15 3ksw n PHE 90 Ca -0.03 0.18 -0.10 0.00 1.01 0.00 0.00 57.45 58.51 3ksw n PHE 90 Cb 0.54 -0.84 -0.01 0.00 -0.01 0.00 0.00 39.48 39.17 3ksw n PHE 90 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3ksw h SER 91 N 0.00 0.41 -4.22 4.37 0.02 -1.78 -3.10 113.55 109.24 3ksw h SER 91 Ca -0.07 -0.31 -0.52 0.00 -0.84 0.00 0.00 61.79 60.05 3ksw h SER 91 Cb 1.20 -0.12 0.14 0.00 0.14 0.00 0.00 62.40 63.75 3ksw h SER 91 CO 0.01 1.09 0.35 -2.84 -1.14 0.00 0.00 176.83 174.30 3ksw s PRO 92 N -3.36 2.28 0.79 3.45 0.02 -1.26 -4.81 135.00 132.11 3ksw s PRO 92 Ca -0.05 1.47 -0.06 0.00 0.02 0.00 0.00 61.00 62.39 3ksw s PRO 92 Cb 0.10 -1.88 0.15 0.00 0.02 0.00 0.00 34.50 32.89 3ksw s PRO 92 CO 0.84 -1.67 1.09 0.50 -0.33 0.00 0.00 177.00 177.44 3ksw s ARG 93 N -4.27 1.39 0.21 5.54 3.52 -1.26 -4.90 118.95 119.19 3ksw s ARG 93 Ca 0.68 -0.87 -0.02 0.00 -0.13 0.00 0.00 55.73 55.39 3ksw s ARG 93 Cb -0.23 -2.18 0.17 0.00 -1.56 0.00 0.00 34.95 31.15 3ksw s ARG 93 CO 0.47 -1.72 1.55 -0.91 -0.81 0.00 0.00 175.30 173.88 3ksw h ASN 94 N -0.86 0.58 -0.49 -2.12 2.35 -1.97 -1.68 115.58 111.39 3ksw h ASN 94 Ca -0.39 -0.29 -0.04 0.00 -0.55 0.00 0.00 56.30 55.04 3ksw h ASN 94 Cb 1.26 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 39.44 3ksw h ASN 94 CO 0.40 0.97 0.19 -0.33 -1.65 0.00 0.00 177.43 177.02 3ksw h GLU 95 N 0.42 0.79 0.14 0.81 3.07 -2.00 -2.67 114.58 115.14 3ksw h GLU 95 Ca 0.02 -0.13 -0.22 0.00 -0.50 0.00 0.00 59.36 58.53 3ksw h GLU 95 Cb 1.01 -0.14 0.01 0.00 -0.84 0.00 0.00 28.75 28.80 3ksw h GLU 95 CO 0.09 0.67 -1.03 0.82 -1.40 0.00 0.00 179.01 178.17 3ksw h ILE 96 N 0.78 1.36 -3.54 3.13 2.04 -1.95 -3.44 117.51 115.88 3ksw h ILE 96 Ca 0.18 -2.50 -0.61 0.00 1.00 0.00 0.00 64.86 62.93 3ksw h ILE 96 Cb 0.19 3.04 -0.39 0.00 -0.74 0.00 0.00 36.82 38.93 3ksw h ILE 96 CO -0.01 0.71 -0.77 -0.76 0.00 0.00 0.00 178.15 177.32 3ksw s LEU 97 N -7.77 2.90 -0.01 1.44 1.43 -0.63 -1.25 118.68 114.78 3ksw s LEU 97 Ca -0.15 -1.45 -0.15 0.00 -1.03 0.00 0.00 54.13 51.34 3ksw s LEU 97 Cb 0.02 -1.19 -0.06 0.00 0.03 0.00 0.00 46.19 45.00 3ksw s LEU 97 CO 0.81 -0.30 0.42 -0.94 0.23 0.00 0.00 176.35 176.57 3ksw s SER 98 N 1.36 6.81 0.04 2.29 1.04 -1.02 -4.05 113.70 120.17 3ksw s SER 98 Ca 0.01 0.96 0.22 0.00 0.48 0.00 0.00 55.95 57.62 3ksw s SER 98 Cb -0.19 -2.26 -0.15 0.00 0.10 0.00 0.00 66.02 63.53 3ksw s SER 98 CO -0.10 0.30 0.79 -0.81 0.98 0.00 0.00 173.24 174.39 3ksw n PRO 99 N 1.97 0.48 -0.20 4.02 -0.04 -1.26 -2.56 135.00 137.41 3ksw n PRO 99 Ca -0.13 -0.06 -0.06 0.00 -0.04 0.00 0.00 63.50 63.21 3ksw n PRO 99 Cb 0.52 -1.60 0.04 0.00 -0.04 0.00 0.00 33.50 32.42 3ksw n PRO 99 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 3ksw h ARG 100 N 0.00 0.77 -0.47 0.54 2.43 -1.92 -3.18 114.38 112.55 3ksw h ARG 100 Ca 0.00 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.05 3ksw h ARG 100 Cb 0.87 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.23 3ksw h ARG 100 CO 0.00 0.51 -0.01 0.93 -1.51 0.00 0.00 179.97 179.89 3ksw h GLU 101 N 0.79 0.84 -0.41 0.20 4.39 -1.92 -3.27 114.58 115.20 3ksw h GLU 101 Ca 0.22 -0.27 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 3ksw h GLU 101 Cb -0.09 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.47 3ksw h GLU 101 CO -0.05 0.89 0.19 0.28 -1.16 0.00 0.00 179.01 179.17 3ksw h VAL 102 N 0.69 1.18 -3.36 3.13 2.07 -1.82 -3.33 116.25 114.81 3ksw h VAL 102 Ca 0.13 -0.50 -0.71 0.00 0.82 0.00 0.00 66.70 66.44 3ksw h VAL 102 Cb 0.52 0.76 -0.20 0.00 -1.52 0.00 0.00 31.29 30.84 3ksw h VAL 102 CO 0.03 0.19 -0.21 -0.31 0.02 0.00 0.00 177.57 177.28 3ksw s TYR 103 N -5.70 3.18 0.00 1.57 2.02 -1.23 -4.85 117.35 112.34 3ksw s TYR 103 Ca -0.13 -0.68 0.00 0.00 -0.37 0.00 0.00 57.07 55.89 3ksw s TYR 103 Cb 0.10 -3.15 0.00 0.00 -0.40 0.00 0.00 41.96 38.51 3ksw s TYR 103 CO 0.75 -0.82 0.61 -2.37 -1.57 0.00 0.00 175.55 172.14 3ksw n THR 104 N 5.36 0.31 -0.07 -0.71 5.66 -1.25 -4.76 114.28 118.82 3ksw n THR 104 Ca -0.10 -0.58 -0.18 0.00 -3.05 0.00 0.00 64.05 60.14 3ksw n THR 104 Cb 0.45 0.94 -0.13 0.00 -1.55 0.00 0.00 70.33 70.04 3ksw n THR 104 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 175.07 174.32 3ksw n ILE 105 N -0.16 1.61 -0.12 1.09 -6.64 -1.26 -3.83 119.36 110.05 3ksw n ILE 105 Ca 0.00 -0.64 0.01 0.00 -1.77 0.00 0.00 62.75 60.35 3ksw n ILE 105 Cb 0.13 -1.45 0.29 0.00 -1.44 0.00 0.00 39.64 37.17 3ksw n ILE 105 CO 0.00 0.00 0.00 0.24 -1.77 0.00 0.00 176.55 175.02 3ksw h MET 106 N 0.03 0.79 -0.67 6.28 2.86 -1.99 -1.48 114.93 120.75 3ksw h MET 106 Ca -0.50 -0.08 0.10 0.00 -2.06 0.00 0.00 59.70 57.17 3ksw h MET 106 Cb 1.99 -0.16 -0.12 0.00 0.06 0.00 0.00 31.60 33.37 3ksw h MET 106 CO 0.00 0.58 -0.41 1.15 1.06 0.00 0.00 176.91 179.29 3ksw h THR 107 N 0.80 0.09 -1.01 2.22 2.02 -1.86 2.94 112.91 118.11 3ksw h THR 107 Ca 0.21 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.49 3ksw h THR 107 Cb 0.02 0.09 -0.08 0.00 -1.74 0.00 0.00 68.15 66.44 3ksw h THR 107 CO -0.03 0.00 0.64 -0.65 0.37 0.00 0.00 175.52 175.85 3ksw h PRO 108 N -0.17 1.04 -0.24 6.66 0.11 -1.43 -2.87 132.00 135.10 3ksw h PRO 108 Ca 0.22 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.18 3ksw h PRO 108 Cb 0.56 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 31.43 3ksw h PRO 108 CO -0.75 0.69 -0.19 0.28 -0.21 0.00 0.00 178.00 177.82 3ksw h VAL 109 N 1.07 1.31 -0.17 3.15 2.07 0.56 -3.40 116.25 120.85 3ksw h VAL 109 Ca 0.47 -1.33 -0.07 0.00 0.82 0.00 0.00 66.70 66.60 3ksw h VAL 109 Cb 0.37 1.64 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 3ksw h VAL 109 CO -0.23 0.42 -0.15 -0.26 0.02 0.00 0.00 177.57 177.36 3ksw h PHE 110 N 0.27 0.48 0.00 1.57 0.05 -0.73 -3.49 116.94 115.09 3ksw h PHE 110 Ca 0.05 -0.14 0.00 0.00 3.82 0.00 0.00 57.97 61.69 3ksw h PHE 110 Cb 0.73 -0.10 0.00 0.00 2.00 0.00 0.00 35.95 38.58 3ksw h PHE 110 CO 0.07 0.77 0.00 0.41 -0.18 0.00 0.00 178.31 179.38 3ksw n GLY 111 N 0.17 2.28 3.76 -1.45 0.00 -1.24 -4.51 105.19 104.18 3ksw n GLY 111 Ca -0.06 -0.97 -0.40 0.00 0.00 0.00 0.00 46.02 44.59 3ksw n GLY 111 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ksw s GLU 112 N -2.00 4.65 -1.30 1.61 0.41 -1.26 -3.69 118.70 117.11 3ksw s GLU 112 Ca 0.00 1.78 -0.05 0.00 -0.41 0.00 0.00 54.97 56.28 3ksw s GLU 112 Cb 0.00 -3.21 0.01 0.00 -1.78 0.00 0.00 34.13 29.15 3ksw s GLU 112 CO 0.00 0.21 0.72 0.41 -0.49 0.00 0.00 175.26 176.11 3ksw n GLY 113 N 1.33 -0.37 0.00 -1.39 0.00 -1.24 -5.01 105.19 98.51 3ksw n GLY 113 Ca -0.01 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3ksw n GLY 113 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3ksw n VAL 114 N -4.49 0.00 -1.79 1.61 3.14 -0.97 -4.20 118.33 111.63 3ksw n VAL 114 Ca -0.06 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.90 3ksw n VAL 114 Cb 0.59 -1.04 -0.02 0.00 -1.06 0.00 0.00 33.84 32.30 3ksw n VAL 114 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3ksw s ALA 115 N -2.88 3.79 0.00 1.55 0.00 -1.26 0.41 121.76 123.37 3ksw s ALA 115 Ca 0.00 1.55 0.00 0.00 0.00 0.00 0.00 51.96 53.51 3ksw s ALA 115 Cb 0.00 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.47 3ksw s ALA 115 CO 0.00 -0.94 0.00 0.66 0.00 0.00 0.00 175.76 175.48 3ksw n TYR 116 N 2.73 0.00 -0.52 0.00 4.02 -1.26 -4.61 117.16 117.53 3ksw n TYR 116 Ca 0.10 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 58.05 3ksw n TYR 116 Cb 0.37 -0.15 0.11 0.00 -0.02 0.00 0.00 39.34 39.65 3ksw n TYR 116 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3ksw n ALA 117 N 0.42 2.26 -3.00 -0.72 0.00 1.37 -4.94 120.51 115.91 3ksw n ALA 117 Ca 0.00 -1.74 -0.10 0.00 0.00 0.00 0.00 53.44 51.61 3ksw n ALA 117 Cb 0.00 -0.30 -0.05 0.00 0.00 0.00 0.00 19.45 19.10 3ksw n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ksw s ALA 118 N -1.87 -0.55 0.31 0.00 0.00 0.41 -2.29 121.76 117.77 3ksw s ALA 118 Ca 0.20 -0.46 -0.29 0.00 0.00 0.00 0.00 51.96 51.41 3ksw s ALA 118 Cb 0.16 0.81 -0.11 0.00 0.00 0.00 0.00 23.12 23.98 3ksw s ALA 118 CO 0.05 -0.70 1.46 -1.25 0.00 0.00 0.00 175.76 175.32 3ksw s PRO 119 N -3.90 4.20 0.24 0.00 0.04 -1.26 -4.68 135.00 129.65 3ksw s PRO 119 Ca 0.11 2.43 -0.05 0.00 0.04 0.00 0.00 61.00 63.53 3ksw s PRO 119 Cb 0.01 -3.04 0.46 0.00 0.04 0.00 0.00 34.50 31.97 3ksw s PRO 119 CO -0.04 -0.46 1.67 1.88 0.04 0.00 0.00 177.00 180.09 3ksw h TYR 120 N 4.06 0.19 -0.97 0.56 0.99 -2.00 0.53 116.97 120.33 3ksw h TYR 120 Ca -0.48 0.05 0.14 0.00 2.00 0.00 0.00 58.73 60.44 3ksw h TYR 120 Cb 1.23 0.03 -0.09 0.00 1.00 0.00 0.00 36.73 38.90 3ksw h TYR 120 CO 0.57 -0.13 0.61 -1.35 -0.00 0.00 0.00 178.16 177.86 3ksw h PRO 121 N 0.22 0.83 0.08 4.88 0.11 -2.00 0.22 132.00 136.35 3ksw h PRO 121 Ca 0.41 -0.05 -0.23 0.00 0.11 0.00 0.00 66.00 66.24 3ksw h PRO 121 Cb 0.72 -0.19 0.02 0.00 0.11 0.00 0.00 31.00 31.66 3ksw h PRO 121 CO -0.55 0.55 -0.94 0.00 -0.21 0.00 0.00 178.00 176.85 3ksw h ARG 122 N 0.86 0.50 -0.53 1.05 -0.00 -0.53 -3.24 114.38 112.47 3ksw h ARG 122 Ca 0.50 -0.64 -0.05 0.00 -0.50 0.00 0.00 59.98 59.29 3ksw h ARG 122 Cb 0.65 0.21 -0.02 0.00 0.00 0.00 0.00 29.97 30.81 3ksw h ARG 122 CO -0.27 1.26 0.16 1.98 0.00 0.00 0.00 179.97 183.10 3ksw h MET 123 N 0.03 0.84 -0.92 0.04 1.85 0.24 -2.84 114.93 114.17 3ksw h MET 123 Ca -0.14 -0.19 0.03 0.00 -0.61 0.00 0.00 59.70 58.79 3ksw h MET 123 Cb 1.66 -0.12 -0.05 0.00 0.43 0.00 0.00 31.60 33.52 3ksw h MET 123 CO 0.18 0.78 0.61 -0.09 -0.40 0.00 0.00 176.91 177.98 3ksw h ARG 124 N 0.74 1.14 -0.41 0.39 9.65 -0.68 -0.60 114.38 124.61 3ksw h ARG 124 Ca 0.17 -0.07 0.04 0.00 -1.10 0.00 0.00 59.98 59.03 3ksw h ARG 124 Cb 0.30 -0.26 -0.04 0.00 -1.39 0.00 0.00 29.97 28.58 3ksw h ARG 124 CO -0.00 0.75 0.16 1.49 2.80 0.00 0.00 179.97 185.17 3ksw h GLU 125 N 1.17 0.32 -0.55 0.20 4.81 -1.53 -3.01 114.58 115.99 3ksw h GLU 125 Ca 0.36 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.50 3ksw h GLU 125 Cb -0.01 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 3ksw h GLU 125 CO -0.10 0.21 0.07 1.96 -0.73 0.00 0.00 179.01 180.42 3ksw h GLN 126 N 0.33 0.89 -0.97 1.92 4.20 -1.03 -2.57 115.11 117.89 3ksw h GLN 126 Ca 0.18 -0.22 0.20 0.00 0.06 0.00 0.00 58.65 58.88 3ksw h GLN 126 Cb 0.15 -0.11 -0.09 0.00 0.30 0.00 0.00 27.48 27.72 3ksw h GLN 126 CO -0.17 0.84 0.62 -0.07 -0.67 0.00 0.00 178.83 179.38 3ksw h LEU 127 N 0.84 0.60 -0.44 1.46 3.38 -1.36 -2.53 115.31 117.26 3ksw h LEU 127 Ca 0.17 0.07 -0.15 0.00 0.09 0.00 0.00 57.88 58.06 3ksw h LEU 127 Cb 0.40 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 3ksw h LEU 127 CO 0.01 0.21 -0.35 0.78 0.09 0.00 0.00 178.44 179.18 3ksw h ASN 128 N 0.58 0.97 -0.55 -0.43 2.35 -1.52 -1.70 115.58 115.29 3ksw h ASN 128 Ca 0.54 -0.43 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 3ksw h ASN 128 Cb 1.08 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 39.15 3ksw h ASN 128 CO -0.29 1.22 0.29 -0.26 -1.65 0.00 0.00 177.43 176.74 3ksw h PHE 129 N 0.76 0.76 -0.60 1.19 -1.00 -1.53 -2.20 116.94 114.32 3ksw h PHE 129 Ca 0.07 -0.02 -0.05 0.00 2.81 0.00 0.00 57.97 60.78 3ksw h PHE 129 Cb 0.94 -0.24 -0.03 0.00 3.61 0.00 0.00 35.95 40.23 3ksw h PHE 129 CO 0.06 0.56 0.18 1.25 -1.61 0.00 0.00 178.31 178.75 3ksw h LEU 130 N 0.74 0.89 -1.05 1.54 5.85 -1.44 -3.03 115.31 118.81 3ksw h LEU 130 Ca 0.19 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 3ksw h LEU 130 Cb 0.06 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 3ksw h LEU 130 CO -0.03 0.87 0.32 0.00 -0.34 0.00 0.00 178.44 179.26 3ksw h ALA 131 N 1.05 1.26 0.00 1.25 0.00 -1.01 -2.39 119.26 119.41 3ksw h ALA 131 Ca 0.19 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3ksw h ALA 131 Cb 0.31 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3ksw h ALA 131 CO -0.00 0.57 -0.25 0.93 0.00 0.00 0.00 179.25 180.50 3ksw h GLU 132 N 0.99 0.00 -0.70 0.00 4.39 -1.28 -2.12 114.58 115.86 3ksw h GLU 132 Ca 0.24 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.87 3ksw h GLU 132 Cb 0.12 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 3ksw h GLU 132 CO -0.03 0.25 0.18 0.93 -1.16 0.00 0.00 179.01 179.17 3ksw h GLU 133 N 0.00 1.12 -4.08 2.33 4.39 -1.38 -3.35 114.58 113.61 3ksw h GLU 133 Ca -0.00 -0.27 -0.76 0.00 0.34 0.00 0.00 59.36 58.67 3ksw h GLU 133 Cb 0.44 -0.15 -0.24 0.00 -0.10 0.00 0.00 28.75 28.71 3ksw h GLU 133 CO 0.03 0.99 -0.20 -0.51 -1.16 0.00 0.00 179.01 178.15 3ksw s LEU 134 N -9.55 6.22 0.15 1.33 1.43 -0.80 -4.89 118.68 112.57 3ksw s LEU 134 Ca -0.12 -1.84 -0.11 0.00 -1.03 0.00 0.00 54.13 51.03 3ksw s LEU 134 Cb 0.15 -2.21 0.00 0.00 0.03 0.00 0.00 46.19 44.16 3ksw s LEU 134 CO 0.84 -0.84 0.31 -0.89 0.23 0.00 0.00 176.35 176.00 3ksw s THR 135 N 1.52 0.07 0.52 5.49 2.01 -1.26 -4.89 115.64 119.11 3ksw s THR 135 Ca 0.04 -1.21 0.21 0.00 0.31 0.00 0.00 61.69 61.03 3ksw s THR 135 Cb -0.29 -1.68 0.34 0.00 0.01 0.00 0.00 72.50 70.88 3ksw s THR 135 CO 0.02 -0.33 2.06 0.40 -0.69 0.00 0.00 174.62 176.08 3ksw h ILE 136 N 2.52 0.86 0.00 1.82 2.04 -1.95 -1.93 117.51 120.87 3ksw h ILE 136 Ca -0.32 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.53 3ksw h ILE 136 Cb 1.23 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.14 3ksw h ILE 136 CO 0.48 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.63 3ksw n ALA 137 N -2.59 1.33 -0.12 1.87 0.00 -1.26 -2.38 120.51 117.36 3ksw n ALA 137 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3ksw n ALA 137 Cb 0.38 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.71 3ksw n ALA 137 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ksw n LYS 138 N -1.49 1.37 0.00 0.00 5.02 -0.73 -4.66 118.16 117.66 3ksw n LYS 138 Ca 0.02 -1.04 0.15 0.00 -2.02 0.00 0.00 58.31 55.42 3ksw n LYS 138 Cb 0.08 -0.94 0.80 0.00 -0.02 0.00 0.00 35.03 34.95 3ksw n LYS 138 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3ksw n PHE 139 N -0.28 0.00 -0.28 2.13 3.72 -1.00 -4.37 117.46 117.38 3ksw n PHE 139 Ca 0.00 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.48 3ksw n PHE 139 Cb 0.19 -0.12 0.23 0.00 -0.94 0.00 0.00 39.48 38.85 3ksw n PHE 139 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 3ksw h GLN 140 N 0.29 0.48 -0.43 -1.08 1.08 -1.83 -2.60 115.11 111.02 3ksw h GLN 140 Ca 0.00 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 3ksw h GLN 140 Cb 0.19 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 3ksw h GLN 140 CO 0.00 0.32 0.00 0.09 -0.95 0.00 0.00 178.83 178.29 3ksw n ASN 141 N -4.97 3.16 0.07 1.46 4.13 -1.26 -4.60 115.26 113.25 3ksw n ASN 141 Ca 0.17 -1.99 -0.19 0.00 1.68 0.00 0.00 54.58 54.26 3ksw n ASN 141 Cb 0.49 -0.29 -0.10 0.00 -1.54 0.00 0.00 39.78 38.34 3ksw n ASN 141 CO 0.00 0.00 0.00 -0.26 0.28 0.00 0.00 177.26 177.28 3ksw h PHE 142 N 2.62 0.90 0.07 3.10 0.04 -1.73 -3.37 116.94 118.57 3ksw h PHE 142 Ca 0.00 -0.53 0.00 0.00 2.80 0.00 0.00 57.97 60.24 3ksw h PHE 142 Cb 0.79 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.84 3ksw h PHE 142 CO 0.29 1.36 -0.14 0.28 -0.60 0.00 0.00 178.31 179.51 3ksw h VAL 143 N 0.30 0.00 -0.35 -0.55 2.07 -1.81 -2.39 116.25 113.51 3ksw h VAL 143 Ca -0.14 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.48 3ksw h VAL 143 Cb 1.77 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 3ksw h VAL 143 CO 0.21 0.00 0.37 -0.65 0.02 0.00 0.00 177.57 177.52 3ksw h PRO 144 N -0.22 0.00 -0.21 1.57 0.11 -1.80 0.91 132.00 132.35 3ksw h PRO 144 Ca -0.01 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.93 3ksw h PRO 144 Cb 0.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.32 3ksw h PRO 144 CO -0.05 0.00 -0.58 0.00 -0.21 0.00 0.00 178.00 177.16 3ksw h ALA 145 N 1.59 0.58 -0.26 -0.75 0.00 -1.61 -3.09 119.26 115.72 3ksw h ALA 145 Ca 0.17 -0.53 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 3ksw h ALA 145 Cb 0.90 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3ksw h ALA 145 CO -0.00 0.69 0.06 0.82 0.00 0.00 0.00 179.25 180.82 3ksw h ILE 146 N 0.51 1.21 -0.87 0.00 2.04 -0.34 -3.07 117.51 116.99 3ksw h ILE 146 Ca 0.00 -0.70 0.08 0.00 1.00 0.00 0.00 64.86 65.24 3ksw h ILE 146 Cb 1.15 1.18 -0.07 0.00 -0.74 0.00 0.00 36.82 38.35 3ksw h ILE 146 CO 0.12 0.23 0.53 1.56 0.00 0.00 0.00 178.15 180.58 3ksw h GLN 147 N 0.25 0.90 0.15 2.37 4.20 -1.52 -2.62 115.11 118.83 3ksw h GLN 147 Ca 0.08 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3ksw h GLN 147 Cb 0.29 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 3ksw h GLN 147 CO 0.00 0.59 -0.13 1.25 -0.67 0.00 0.00 178.83 179.87 3ksw h HIS 148 N 0.92 -0.35 -0.65 2.96 2.76 -1.46 -1.56 115.15 117.78 3ksw h HIS 148 Ca 0.40 0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.58 3ksw h HIS 148 Cb 0.27 0.13 -0.03 0.00 1.55 0.00 0.00 27.41 29.33 3ksw h HIS 148 CO -0.04 -0.21 0.43 0.93 -1.30 0.00 0.00 177.93 177.74 3ksw h GLU 149 N -0.30 0.85 -0.14 5.26 4.39 -1.41 0.57 114.58 123.79 3ksw h GLU 149 Ca 0.00 -0.05 -0.10 0.00 0.34 0.00 0.00 59.36 59.55 3ksw h GLU 149 Cb 0.28 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 3ksw h GLU 149 CO -0.03 0.56 -0.37 -0.24 -1.16 0.00 0.00 179.01 177.77 3ksw h VAL 150 N 0.87 1.29 -0.03 3.13 3.04 -1.39 -2.11 116.25 121.06 3ksw h VAL 150 Ca 0.24 -1.43 -0.24 0.00 -1.01 0.00 0.00 66.70 64.26 3ksw h VAL 150 Cb -0.09 1.60 0.01 0.00 -2.01 0.00 0.00 31.29 30.79 3ksw h VAL 150 CO -0.06 0.43 -0.93 0.03 -1.01 0.00 0.00 177.57 176.04 3ksw h ARG 151 N 0.25 0.58 0.66 4.17 3.08 -0.81 -1.67 114.38 120.64 3ksw h ARG 151 Ca 0.03 -0.58 -0.03 0.00 0.07 0.00 0.00 59.98 59.47 3ksw h ARG 151 Cb 0.77 0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.97 3ksw h ARG 151 CO 0.06 1.20 -0.36 -0.22 -1.07 0.00 0.00 179.97 179.58 3ksw h LYS 152 N 0.35 -0.90 -0.38 0.04 3.64 -0.74 -1.95 116.57 116.63 3ksw h LYS 152 Ca -0.09 0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 3ksw h LYS 152 Cb 1.56 0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 33.56 3ksw h LYS 152 CO 0.17 -0.60 0.17 0.35 -2.27 0.00 0.00 179.45 177.28 3ksw h PHE 153 N -0.94 0.32 -0.59 1.91 3.57 -1.47 -3.11 116.94 116.63 3ksw h PHE 153 Ca -0.09 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.46 3ksw h PHE 153 Cb 0.74 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.35 3ksw h PHE 153 CO -0.06 0.16 0.36 1.98 -2.23 0.00 0.00 178.31 178.52 3ksw h MET 154 N 0.36 0.69 0.00 1.11 4.05 -1.23 -0.82 114.93 119.08 3ksw h MET 154 Ca 0.16 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.54 3ksw h MET 154 Cb 0.09 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 30.73 3ksw h MET 154 CO -0.13 0.45 0.00 0.00 0.23 0.00 0.00 176.91 177.47 3ksw n ALA 155 N -2.30 1.94 -0.08 0.39 0.00 -0.74 -2.67 120.51 117.05 3ksw n ALA 155 Ca 0.05 -0.01 -0.10 0.00 0.00 0.00 0.00 53.44 53.39 3ksw n ALA 155 Cb 0.09 -1.39 -0.08 0.00 0.00 0.00 0.00 19.45 18.07 3ksw n ALA 155 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3ksw n GLU 156 N -1.93 0.86 0.00 0.00 -0.00 -1.02 -4.71 120.64 113.84 3ksw n GLU 156 Ca 0.04 0.07 -0.18 0.00 -0.00 0.00 0.00 57.16 57.09 3ksw n GLU 156 Cb 0.29 -1.33 -0.10 0.00 -0.00 0.00 0.00 31.44 30.29 3ksw n GLU 156 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 3ksw h ASN 157 N 0.00 0.63 -3.55 -1.84 4.21 -1.21 -3.41 115.58 110.42 3ksw h ASN 157 Ca -0.36 -0.73 -0.66 0.00 1.21 0.00 0.00 56.30 55.75 3ksw h ASN 157 Cb 1.64 -0.19 -0.25 0.00 -1.12 0.00 0.00 38.32 38.39 3ksw h ASN 157 CO -0.03 1.28 -0.66 0.26 -1.29 0.00 0.00 177.43 176.99 3ksw s TRP 158 N -3.32 3.06 0.00 1.19 0.51 -1.09 -4.95 118.94 114.34 3ksw s TRP 158 Ca -0.12 -0.76 0.00 0.00 -2.12 0.00 0.00 56.10 53.10 3ksw s TRP 158 Cb 0.05 -2.20 0.00 0.00 -0.81 0.00 0.00 33.47 30.51 3ksw s TRP 158 CO 0.84 -0.48 0.00 0.36 -0.51 0.00 0.00 176.95 177.16 3ksw n LYS 159 N 4.86 2.11 -1.28 4.98 2.85 -1.26 -4.55 118.16 125.87 3ksw n LYS 159 Ca -0.16 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.79 3ksw n LYS 159 Cb 0.50 -0.86 0.09 0.00 -0.65 0.00 0.00 35.03 34.12 3ksw n LYS 159 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 3ksw s GLU 160 N -1.72 2.19 0.37 -1.58 0.41 -1.26 -4.94 118.70 112.16 3ksw s GLU 160 Ca 0.00 1.10 0.17 0.00 -0.41 0.00 0.00 54.97 55.83 3ksw s GLU 160 Cb 0.00 -1.89 0.70 0.00 -1.78 0.00 0.00 34.13 31.15 3ksw s GLU 160 CO 0.00 -1.67 1.76 -0.44 -0.49 0.00 0.00 175.26 174.42 3ksw h ASP 161 N -1.15 0.00 -3.38 -0.19 3.32 -1.98 -3.42 116.42 109.62 3ksw h ASP 161 Ca -0.44 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.24 3ksw h ASP 161 Cb 1.24 0.00 -0.37 0.00 0.22 0.00 0.00 39.33 40.42 3ksw h ASP 161 CO 0.52 0.40 -0.75 -1.61 -1.72 0.00 0.00 179.24 176.09 3ksw s GLU 162 N -3.79 0.16 0.18 3.56 0.41 -1.26 -4.09 118.70 113.87 3ksw s GLU 162 Ca -0.01 0.21 -0.08 0.00 -0.41 0.00 0.00 54.97 54.69 3ksw s GLU 162 Cb 0.12 -0.55 -0.02 0.00 -1.78 0.00 0.00 34.13 31.91 3ksw s GLU 162 CO 0.70 -0.25 0.28 0.20 -0.49 0.00 0.00 175.26 175.70 3ksw s GLY 163 N 1.64 0.70 -0.23 -1.39 0.00 -1.21 -5.02 107.32 101.81 3ksw s GLY 163 Ca -0.01 -1.07 0.02 0.00 0.00 0.00 0.00 44.72 43.65 3ksw s GLY 163 CO -0.03 -0.93 -0.13 0.14 0.00 0.00 0.00 173.10 172.14 3ksw s VAL 164 N -4.02 2.03 0.18 1.40 1.01 -1.26 -2.08 120.40 117.65 3ksw s VAL 164 Ca 0.23 -1.32 0.07 0.00 0.00 0.00 0.00 61.98 60.95 3ksw s VAL 164 Cb 0.03 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 3ksw s VAL 164 CO 0.04 0.16 -0.13 0.27 0.00 0.00 0.00 175.10 175.44 3ksw s ILE 165 N 1.22 1.52 -0.42 2.22 -5.25 -0.90 -4.99 121.20 114.60 3ksw s ILE 165 Ca -0.04 -2.10 -0.16 0.00 -0.99 0.00 0.00 60.65 57.36 3ksw s ILE 165 Cb -0.17 -1.92 0.02 0.00 2.95 0.00 0.00 42.46 43.34 3ksw s ILE 165 CO -0.08 -0.61 0.37 0.21 -1.79 0.00 0.00 174.94 173.04 3ksw s ASN 166 N -3.15 6.15 0.12 4.36 2.47 -1.26 -2.16 114.94 121.48 3ksw s ASN 166 Ca 0.19 -0.81 -0.21 0.00 0.42 0.00 0.00 52.86 52.45 3ksw s ASN 166 Cb -0.00 -2.19 -0.04 0.00 -1.45 0.00 0.00 41.25 37.56 3ksw s ASN 166 CO 0.04 -0.53 1.70 0.25 -3.72 0.00 0.00 177.10 174.85 3ksw h LEU 167 N 8.85 -0.22 -1.73 3.21 5.85 -1.93 -2.19 115.31 127.14 3ksw h LEU 167 Ca -0.27 0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.57 3ksw h LEU 167 Cb 1.11 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 3ksw h LEU 167 CO 0.77 -0.09 0.29 0.25 -0.34 0.00 0.00 178.44 179.32 3ksw h LEU 168 N -0.04 0.29 0.00 2.25 5.85 -1.94 0.53 115.31 122.24 3ksw h LEU 168 Ca 0.08 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 3ksw h LEU 168 Cb 0.17 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 3ksw h LEU 168 CO -0.18 0.19 -0.37 -0.08 -0.34 0.00 0.00 178.44 177.66 3ksw h GLU 169 N 0.33 0.00 0.00 1.25 4.81 -1.88 -3.31 114.58 115.79 3ksw h GLU 169 Ca 0.19 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 3ksw h GLU 169 Cb 0.32 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 3ksw h GLU 169 CO -0.04 0.12 -1.24 -0.25 -0.73 0.00 0.00 179.01 176.87 3ksw n ASP 170 N -3.04 0.71 0.18 1.04 8.00 0.02 -3.79 116.55 119.68 3ksw n ASP 170 Ca 0.02 0.28 0.09 0.00 0.71 0.00 0.00 54.79 55.90 3ksw n ASP 170 Cb 0.60 0.64 0.11 0.00 -0.02 0.00 0.00 41.12 42.45 3ksw n ASP 170 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ksw h GLY 172 N 3.87 0.03 1.48 0.00 0.00 -1.66 -2.76 103.07 104.04 3ksw h GLY 172 Ca -0.01 -0.06 -0.23 0.00 0.00 0.00 0.00 47.33 47.03 3ksw h GLY 172 CO 0.02 0.06 -0.97 0.00 0.00 0.00 0.00 176.54 175.65 3ksw h ALA 173 N 1.12 0.31 -0.04 3.60 0.00 -1.66 -3.12 119.26 119.47 3ksw h ALA 173 Ca -0.02 -0.71 -0.18 0.00 0.00 0.00 0.00 54.91 54.00 3ksw h ALA 173 Cb 1.51 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 3ksw h ALA 173 CO 0.11 0.79 -0.78 0.52 0.00 0.00 0.00 179.25 179.90 3ksw h MET 174 N 0.26 0.29 -0.46 0.00 2.86 -1.60 -2.57 114.93 113.71 3ksw h MET 174 Ca -0.09 -0.26 -0.09 0.00 -2.06 0.00 0.00 59.70 57.20 3ksw h MET 174 Cb 1.61 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 33.31 3ksw h MET 174 CO 0.17 0.93 -0.07 0.82 1.06 0.00 0.00 176.91 179.82 3ksw h ILE 175 N 0.19 1.27 0.11 -1.22 1.08 -1.56 -2.48 117.51 114.89 3ksw h ILE 175 Ca -0.03 -1.17 -0.01 0.00 -0.39 0.00 0.00 64.86 63.26 3ksw h ILE 175 Cb 1.36 1.10 0.00 0.00 -3.07 0.00 0.00 36.82 36.21 3ksw h ILE 175 CO 0.12 0.40 -0.05 -0.29 -0.69 0.00 0.00 178.15 177.64 3ksw h ILE 176 N 0.69 1.10 0.00 -0.67 6.09 -1.55 -3.06 117.51 120.11 3ksw h ILE 176 Ca 0.12 -1.10 0.00 0.00 -1.37 0.00 0.00 64.86 62.51 3ksw h ILE 176 Cb 0.60 1.76 0.00 0.00 0.47 0.00 0.00 36.82 39.65 3ksw h ILE 176 CO 0.04 0.25 0.00 0.78 -3.07 0.00 0.00 178.15 176.15 3ksw h ASN 177 N -0.69 0.00 0.25 2.19 2.35 -1.53 -3.08 115.58 115.07 3ksw h ASN 177 Ca -0.02 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.39 3ksw h ASN 177 Cb 0.53 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.87 3ksw h ASN 177 CO 0.02 0.00 -1.91 1.07 -1.65 0.00 0.00 177.43 174.97 3ksw n THR 178 N -2.46 1.73 -0.19 2.81 5.66 -0.93 -3.81 114.28 117.08 3ksw n THR 178 Ca -0.00 -0.70 -0.08 0.00 -3.05 0.00 0.00 64.05 60.21 3ksw n THR 178 Cb 0.12 -1.50 0.02 0.00 -1.55 0.00 0.00 70.33 67.42 3ksw n THR 178 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3ksw h ALA 179 N 0.38 0.71 -0.61 1.79 0.00 -1.44 -2.68 119.26 117.41 3ksw h ALA 179 Ca -0.38 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 3ksw h ALA 179 Cb 2.03 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 19.58 3ksw h ALA 179 CO 0.09 0.33 0.32 0.00 0.00 0.00 0.00 179.25 179.98 3ksw h GLN 181 N 0.85 1.16 -0.44 0.00 5.75 -1.58 -2.28 115.11 118.57 3ksw h GLN 181 Ca 0.21 -0.07 -0.14 0.00 -0.15 0.00 0.00 58.65 58.50 3ksw h GLN 181 Cb 0.05 -0.26 -0.01 0.00 1.07 0.00 0.00 27.48 28.33 3ksw h GLN 181 CO -0.03 0.77 -0.27 0.00 -2.65 0.00 0.00 178.83 176.64 3ksw n LEU 183 N -4.11 0.57 -4.82 0.00 4.77 -0.05 -5.02 117.00 108.34 3ksw n LEU 183 Ca -0.01 -0.67 -0.35 0.00 -0.03 0.00 0.00 56.01 54.95 3ksw n LEU 183 Cb 0.49 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.51 3ksw n LEU 183 CO 0.47 0.13 -0.22 -0.36 -1.33 0.00 0.00 177.39 176.08 3ksw s PHE 184 N -1.02 3.42 0.55 -1.77 2.99 -0.89 -4.31 117.98 116.95 3ksw s PHE 184 Ca 0.03 0.35 -0.16 0.00 0.00 0.00 0.00 56.93 57.14 3ksw s PHE 184 Cb 0.03 -1.84 -0.06 0.00 0.00 0.00 0.00 43.02 41.16 3ksw s PHE 184 CO 0.12 0.62 1.03 0.20 -0.00 0.00 0.00 175.22 177.19 3ksw s GLY 185 N -1.34 2.13 0.32 4.36 0.00 -1.26 -4.85 107.32 106.67 3ksw s GLY 185 Ca 0.19 0.32 0.10 0.00 0.00 0.00 0.00 44.72 45.33 3ksw s GLY 185 CO 0.09 0.62 1.72 -2.09 0.00 0.00 0.00 173.10 173.44 3ksw h GLU 186 N 0.71 0.54 0.00 2.90 4.81 -1.98 0.13 114.58 121.70 3ksw h GLU 186 Ca -0.47 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 58.67 3ksw h GLU 186 Cb 1.21 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 3ksw h GLU 186 CO 0.59 0.36 -0.26 0.38 -0.73 0.00 0.00 179.01 179.35 3ksw h ASP 187 N 0.56 0.00 1.44 1.04 3.04 -2.01 -3.24 116.42 117.24 3ksw h ASP 187 Ca 0.65 0.00 -0.07 0.00 -3.24 0.00 0.00 57.03 54.37 3ksw h ASP 187 Cb 1.26 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.54 3ksw h ASP 187 CO -0.49 0.26 -0.58 0.25 -2.04 0.00 0.00 179.24 176.65 3ksw h LEU 188 N 0.00 0.00 -0.10 0.15 5.85 -1.35 -3.23 115.31 116.63 3ksw h LEU 188 Ca -0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 3ksw h LEU 188 Cb 1.19 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.21 3ksw h LEU 188 CO 0.03 0.29 -0.05 0.03 -0.34 0.00 0.00 178.44 178.40 3ksw h ARG 189 N 0.00 0.00 -0.38 1.25 3.08 -1.43 -2.87 114.38 114.02 3ksw h ARG 189 Ca -0.03 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.86 3ksw h ARG 189 Cb 1.25 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 3ksw h ARG 189 CO 0.03 0.05 -0.39 0.87 -1.07 0.00 0.00 179.97 179.47 3ksw h LYS 190 N 0.00 0.93 0.00 0.04 1.57 -1.62 -3.14 116.57 114.35 3ksw h LYS 190 Ca -0.00 -0.49 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 3ksw h LYS 190 Cb 1.01 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.33 3ksw h LYS 190 CO 0.01 1.14 -0.57 0.00 -0.57 0.00 0.00 179.45 179.46 3ksw h ARG 191 N 0.76 0.00 -3.53 3.15 2.47 -1.68 -3.42 114.38 112.12 3ksw h ARG 191 Ca 0.06 0.00 -0.43 0.00 -1.26 0.00 0.00 59.98 58.35 3ksw h ARG 191 Cb 0.98 0.00 -0.39 0.00 -1.65 0.00 0.00 29.97 28.91 3ksw h ARG 191 CO 0.09 0.00 -0.76 -1.17 0.56 0.00 0.00 179.97 178.70 3ksw s LEU 192 N -4.39 0.53 0.77 3.04 2.96 -1.09 -5.13 118.68 115.37 3ksw s LEU 192 Ca 0.06 -0.18 -0.12 0.00 -0.22 0.00 0.00 54.13 53.67 3ksw s LEU 192 Cb 0.13 -0.37 0.06 0.00 0.50 0.00 0.00 46.19 46.50 3ksw s LEU 192 CO 0.71 -0.23 1.15 0.54 -1.32 0.00 0.00 176.35 177.19 3ksw s ASN 193 N 2.02 4.84 -0.02 3.68 2.20 -1.23 -4.19 114.94 122.25 3ksw s ASN 193 Ca 0.04 0.90 -0.23 0.00 -0.94 0.00 0.00 52.86 52.63 3ksw s ASN 193 Cb -0.13 -1.50 -0.15 0.00 -2.00 0.00 0.00 41.25 37.47 3ksw s ASN 193 CO -0.05 -1.70 1.03 0.00 -2.94 0.00 0.00 177.10 173.44 3ksw h ALA 194 N -0.90 -0.42 -0.32 3.54 0.00 -1.97 -3.10 119.26 116.08 3ksw h ALA 194 Ca -0.46 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.30 3ksw h ALA 194 Cb 1.30 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 19.20 3ksw h ALA 194 CO 0.65 -0.51 -0.37 -0.09 0.00 0.00 0.00 179.25 178.93 3ksw h ARG 195 N -0.89 -0.22 -0.77 0.00 2.43 -1.97 -2.27 114.38 110.68 3ksw h ARG 195 Ca -0.04 0.02 0.17 0.00 -0.81 0.00 0.00 59.98 59.31 3ksw h ARG 195 Cb 0.52 0.05 -0.11 0.00 -0.42 0.00 0.00 29.97 30.01 3ksw h ARG 195 CO 0.07 -0.15 0.22 1.25 -1.51 0.00 0.00 179.97 179.85 3ksw h HIS 196 N -0.23 0.35 -0.71 2.20 2.76 -1.98 -1.93 115.15 115.60 3ksw h HIS 196 Ca 0.05 0.04 0.01 0.00 -2.20 0.00 0.00 60.37 58.28 3ksw h HIS 196 Cb 0.38 -0.03 -0.04 0.00 1.55 0.00 0.00 27.41 29.27 3ksw h HIS 196 CO -0.72 -0.08 0.47 0.35 -1.30 0.00 0.00 177.93 176.65 3ksw h PHE 197 N 0.30 0.89 -0.82 5.26 3.04 -1.33 -2.23 116.94 122.05 3ksw h PHE 197 Ca 0.45 0.02 0.06 0.00 3.98 0.00 0.00 57.97 62.47 3ksw h PHE 197 Cb 0.78 -0.30 -0.05 0.00 2.56 0.00 0.00 35.95 38.94 3ksw h PHE 197 CO -0.24 0.55 0.53 0.00 -2.02 0.00 0.00 178.31 177.13 3ksw h ALA 198 N 1.27 1.58 -0.67 2.41 0.00 -1.05 -0.58 119.26 122.22 3ksw h ALA 198 Ca 0.27 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 3ksw h ALA 198 Cb -0.09 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 3ksw h ALA 198 CO -0.07 0.31 0.38 1.96 0.00 0.00 0.00 179.25 181.83 3ksw h GLN 199 N 0.92 0.92 -0.95 0.00 4.20 -1.35 -2.79 115.11 116.07 3ksw h GLN 199 Ca 0.34 -0.10 0.06 0.00 0.06 0.00 0.00 58.65 59.02 3ksw h GLN 199 Cb 0.18 -0.18 -0.06 0.00 0.30 0.00 0.00 27.48 27.71 3ksw h GLN 199 CO -0.12 0.68 0.62 -0.07 -0.67 0.00 0.00 178.83 179.27 3ksw h LEU 200 N 0.91 0.98 -1.06 1.46 3.38 -0.85 -1.60 115.31 118.53 3ksw h LEU 200 Ca 0.24 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.12 3ksw h LEU 200 Cb 0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3ksw h LEU 200 CO -0.04 0.63 -0.39 -0.07 0.09 0.00 0.00 178.44 178.67 3ksw h LEU 201 N 1.11 0.17 -0.71 1.67 3.38 -1.21 -3.18 115.31 116.53 3ksw h LEU 201 Ca 0.40 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.27 3ksw h LEU 201 Cb 0.16 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 3ksw h LEU 201 CO -0.15 0.55 0.29 -1.28 0.09 0.00 0.00 178.44 177.94 3ksw h SER 202 N 0.14 0.98 -0.76 -0.43 0.87 -1.03 -2.75 113.55 110.56 3ksw h SER 202 Ca 0.01 -0.17 -0.03 0.00 -1.23 0.00 0.00 61.79 60.38 3ksw h SER 202 Cb 0.75 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 62.42 3ksw h SER 202 CO 0.06 0.87 0.37 0.11 -0.53 0.00 0.00 176.83 177.71 3ksw h LYS 203 N 1.02 1.11 -0.84 2.24 1.57 -1.52 -1.60 116.57 118.54 3ksw h LYS 203 Ca 0.24 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 3ksw h LYS 203 Cb 0.20 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.26 3ksw h LYS 203 CO -0.02 0.86 0.43 0.52 -0.57 0.00 0.00 179.45 180.66 3ksw h MET 204 N 1.10 1.20 -0.87 3.15 2.86 -1.58 -2.87 114.93 117.91 3ksw h MET 204 Ca 0.27 -0.16 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 3ksw h MET 204 Cb 0.11 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 31.51 3ksw h MET 204 CO -0.03 0.90 0.44 1.05 1.06 0.00 0.00 176.91 180.33 3ksw h GLU 205 N 1.19 1.24 0.00 1.72 -0.00 -1.03 -2.13 114.58 115.59 3ksw h GLU 205 Ca 0.29 -0.17 0.00 0.00 -0.00 0.00 0.00 59.36 59.49 3ksw h GLU 205 Cb 0.08 -0.23 0.00 0.00 -0.00 0.00 0.00 28.75 28.60 3ksw h GLU 205 CO -0.04 0.94 0.00 0.77 -0.00 0.00 0.00 179.01 180.67 3ksw h SER 206 N 1.24 0.00 0.15 3.06 0.02 -1.24 1.44 113.55 118.23 3ksw h SER 206 Ca 0.30 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.25 3ksw h SER 206 Cb 0.08 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 3ksw h SER 206 CO -0.04 0.00 -0.02 -1.28 -1.14 0.00 0.00 176.83 174.34 3ksw h SER 207 N 0.00 0.00 -2.90 3.07 0.87 -1.45 -3.43 113.55 109.72 3ksw h SER 207 Ca 0.00 0.00 -0.56 0.00 -1.23 0.00 0.00 61.79 60.00 3ksw h SER 207 Cb 0.10 0.00 0.08 0.00 -0.44 0.00 0.00 62.40 62.14 3ksw h SER 207 CO 0.00 0.02 0.74 0.18 -0.53 0.00 0.00 176.83 177.24 3ksw n LEU 208 N -3.45 3.63 -4.34 2.23 4.77 0.49 -4.91 117.00 115.42 3ksw n LEU 208 Ca -0.02 1.14 -0.36 0.00 -0.03 0.00 0.00 56.01 56.74 3ksw n LEU 208 Cb 0.13 -1.50 -0.13 0.00 -2.33 0.00 0.00 43.42 39.58 3ksw n LEU 208 CO 0.25 -0.21 -0.35 -0.51 -1.33 0.00 0.00 177.39 175.25 3ksw s ILE 209 N 0.04 3.64 0.05 -0.08 2.07 -1.26 -5.08 121.20 120.57 3ksw s ILE 209 Ca 0.67 -0.50 -0.23 0.00 -1.41 0.00 0.00 60.65 59.19 3ksw s ILE 209 Cb -0.59 -2.72 -0.06 0.00 0.13 0.00 0.00 42.46 39.23 3ksw s ILE 209 CO 0.48 0.33 0.67 -2.84 -1.91 0.00 0.00 174.94 171.68 3ksw s PRO 210 N 1.50 4.40 0.00 3.50 0.02 -1.26 -3.61 135.00 139.54 3ksw s PRO 210 Ca 0.05 0.91 0.00 0.00 0.02 0.00 0.00 61.00 61.98 3ksw s PRO 210 Cb -0.15 -3.32 0.00 0.00 0.02 0.00 0.00 34.50 31.05 3ksw s PRO 210 CO -0.01 0.42 0.00 0.00 -0.33 0.00 0.00 177.00 177.08 3ksw n ALA 211 N 2.41 0.00 -1.84 -1.55 0.00 -1.26 -4.92 120.51 113.34 3ksw n ALA 211 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.97 3ksw n ALA 211 Cb 0.50 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.95 3ksw n ALA 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ksw n ALA 212 N 0.62 5.94 -1.77 0.00 0.00 -1.24 -4.94 120.51 119.13 3ksw n ALA 212 Ca 0.00 -3.96 -0.38 0.00 0.00 0.00 0.00 53.44 49.10 3ksw n ALA 212 Cb 0.00 -3.30 -0.02 0.00 0.00 0.00 0.00 19.45 16.13 3ksw n ALA 212 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3ksw s VAL 213 N 1.92 3.13 0.21 0.00 1.01 -1.26 -4.82 120.40 120.59 3ksw s VAL 213 Ca 0.49 0.96 -0.32 0.00 0.00 0.00 0.00 61.98 63.12 3ksw s VAL 213 Cb 0.14 -3.54 -0.11 0.00 0.00 0.00 0.00 36.38 32.86 3ksw s VAL 213 CO -0.06 0.10 1.68 -0.36 0.00 0.00 0.00 175.10 176.46 3ksw s PHE 214 N -1.39 2.93 0.13 5.22 0.08 -1.26 -3.38 117.98 120.30 3ksw s PHE 214 Ca 0.56 0.44 0.11 0.00 0.12 0.00 0.00 56.93 58.17 3ksw s PHE 214 Cb -0.31 -4.09 -0.04 0.00 -0.57 0.00 0.00 43.02 38.01 3ksw s PHE 214 CO 0.39 -4.06 -0.26 1.41 -0.10 0.00 0.00 175.22 172.60 3ksw s MET 215 N 1.02 1.39 0.00 0.44 1.75 -1.26 -5.08 119.30 117.56 3ksw s MET 215 Ca 0.73 -1.35 0.00 0.00 -1.25 0.00 0.00 55.69 53.82 3ksw s MET 215 Cb -0.48 -1.86 0.00 0.00 2.84 0.00 0.00 34.83 35.33 3ksw s MET 215 CO 0.33 0.44 0.00 -2.30 -0.65 0.00 0.00 175.02 172.84 3ksw n PRO 216 N 0.88 0.00 0.00 4.11 -0.02 -1.22 -5.17 135.00 133.59 3ksw n PRO 216 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 3ksw n PRO 216 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.01 3ksw n PRO 216 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 3ksw n LEU 221 N 0.00 0.00 -4.51 2.45 -0.00 -1.26 -5.10 117.00 108.58 3ksw n LEU 221 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 56.01 55.58 3ksw n LEU 221 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.34 3ksw n LEU 221 CO 0.00 0.00 0.20 -2.16 -0.00 0.00 0.00 177.39 175.43 3ksw s PRO 222 N -2.03 3.24 0.75 1.47 0.04 -1.26 -5.04 135.00 132.17 3ksw s PRO 222 Ca 0.00 -0.55 -0.07 0.00 0.04 0.00 0.00 61.00 60.42 3ksw s PRO 222 Cb 0.00 -3.93 0.10 0.00 0.04 0.00 0.00 34.50 30.70 3ksw s PRO 222 CO 0.00 -0.85 1.06 -0.51 0.04 0.00 0.00 177.00 176.73 3ksw s LEU 223 N 2.36 2.85 0.33 -3.56 1.02 -1.26 -4.79 118.68 115.62 3ksw s LEU 223 Ca 0.16 0.24 0.12 0.00 0.02 0.00 0.00 54.13 54.67 3ksw s LEU 223 Cb -0.16 -2.73 0.96 0.00 0.02 0.00 0.00 46.19 44.28 3ksw s LEU 223 CO 0.15 -1.84 1.71 1.55 0.02 0.00 0.00 176.35 177.94 3ksw h PRO 224 N -0.75 0.48 0.00 1.29 0.13 -1.98 4.18 132.00 135.34 3ksw h PRO 224 Ca -0.43 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.64 3ksw h PRO 224 Cb 1.29 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 3ksw h PRO 224 CO 0.52 0.31 -0.14 1.96 -0.23 0.00 0.00 178.00 180.42 3ksw h GLN 225 N 0.49 0.00 0.00 0.86 7.50 -1.95 0.05 115.11 122.06 3ksw h GLN 225 Ca 0.68 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.80 3ksw h GLN 225 Cb 1.39 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.92 3ksw h GLN 225 CO -0.52 0.14 -0.14 0.77 -1.50 0.00 0.00 178.83 177.59 3ksw h SER 226 N 0.00 0.00 -0.36 1.46 0.02 0.76 -3.02 113.55 112.40 3ksw h SER 226 Ca -0.00 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 3ksw h SER 226 Cb 0.42 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 3ksw h SER 226 CO 0.02 0.14 -0.20 0.00 -1.14 0.00 0.00 176.83 175.65 3ksw h ALA 227 N 1.86 0.83 -0.31 3.77 0.00 0.15 0.83 119.26 126.40 3ksw h ALA 227 Ca -0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 3ksw h ALA 227 Cb 1.10 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 3ksw h ALA 227 CO 0.02 0.64 0.02 0.00 0.00 0.00 0.00 179.25 179.94 3ksw h ARG 228 N 0.74 0.53 -0.89 0.00 3.08 -1.51 -2.51 114.38 113.83 3ksw h ARG 228 Ca 0.10 -0.16 0.08 0.00 0.07 0.00 0.00 59.98 60.08 3ksw h ARG 228 Cb 0.73 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.66 3ksw h ARG 228 CO 0.06 0.65 0.57 0.00 -1.07 0.00 0.00 179.97 180.18 3ksw h ARG 230 N 0.94 0.06 -0.07 0.00 3.08 -0.64 -3.15 114.38 114.59 3ksw h ARG 230 Ca 0.40 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.44 3ksw h ARG 230 Cb 0.31 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 3ksw h ARG 230 CO -0.16 0.04 0.04 0.93 -1.07 0.00 0.00 179.97 179.74 3ksw h GLU 231 N 0.06 0.10 -0.65 0.04 5.08 -0.77 -3.17 114.58 115.27 3ksw h GLU 231 Ca 0.05 -0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.53 3ksw h GLU 231 Cb 0.05 -0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.18 3ksw h GLU 231 CO -0.07 0.17 0.11 0.00 -1.00 0.00 0.00 179.01 178.22 3ksw h ALA 232 N 0.92 0.76 -0.48 3.43 0.00 -1.06 -1.60 119.26 121.23 3ksw h ALA 232 Ca 0.02 0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 3ksw h ALA 232 Cb 0.10 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3ksw h ALA 232 CO -0.00 -0.34 -0.17 0.00 0.00 0.00 0.00 179.25 178.74 3ksw h ARG 233 N 0.23 0.94 -0.63 0.00 3.08 -1.58 -2.15 114.38 114.27 3ksw h ARG 233 Ca 0.35 -0.37 0.02 0.00 0.07 0.00 0.00 59.98 60.05 3ksw h ARG 233 Cb 0.56 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.53 3ksw h ARG 233 CO -0.47 1.03 0.40 0.00 -1.07 0.00 0.00 179.97 179.87 3ksw h ALA 234 N 0.97 0.82 -0.07 0.04 0.00 -1.29 1.12 119.26 120.85 3ksw h ALA 234 Ca 0.12 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3ksw h ALA 234 Cb 0.72 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3ksw h ALA 234 CO 0.06 0.18 -0.25 1.49 0.00 0.00 0.00 179.25 180.73 3ksw h GLU 235 N 0.81 0.13 0.04 0.00 4.81 -1.24 0.18 114.58 119.32 3ksw h GLU 235 Ca 0.25 -0.04 -0.24 0.00 -0.13 0.00 0.00 59.36 59.20 3ksw h GLU 235 Cb -0.03 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 3ksw h GLU 235 CO -0.08 0.37 -1.12 1.25 -0.73 0.00 0.00 179.01 178.71 3ksw h LEU 236 N 0.12 0.15 -0.28 1.64 5.85 -0.60 -3.10 115.31 119.09 3ksw h LEU 236 Ca 0.02 -0.16 -0.12 0.00 0.84 0.00 0.00 57.88 58.45 3ksw h LEU 236 Cb 0.51 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.48 3ksw h LEU 236 CO 0.04 1.13 -0.31 -0.61 -0.34 0.00 0.00 178.44 178.34 3ksw h GLN 237 N 0.03 0.70 0.35 1.25 4.15 0.17 -3.16 115.11 118.60 3ksw h GLN 237 Ca -0.07 -0.38 -0.02 0.00 0.77 0.00 0.00 58.65 58.95 3ksw h GLN 237 Cb 1.85 0.02 0.00 0.00 0.21 0.00 0.00 27.48 29.56 3ksw h GLN 237 CO 0.15 1.00 -0.17 -0.22 -1.93 0.00 0.00 178.83 177.66 3ksw h LYS 238 N 0.44 -0.46 -0.27 1.69 3.64 -1.06 -3.03 116.57 117.53 3ksw h LYS 238 Ca 0.04 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.53 3ksw h LYS 238 Cb 0.89 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 3ksw h LYS 238 CO 0.08 -0.29 0.21 0.82 -2.27 0.00 0.00 179.45 178.00 3ksw h ILE 239 N -0.50 0.73 -0.72 2.00 2.04 -1.61 -1.69 117.51 117.76 3ksw h ILE 239 Ca -0.05 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.76 3ksw h ILE 239 Cb 0.38 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 3ksw h ILE 239 CO 0.08 0.00 0.23 -0.07 0.00 0.00 0.00 178.15 178.39 3ksw h LEU 240 N 0.00 1.03 -0.82 1.44 3.38 -1.49 -3.12 115.31 115.73 3ksw h LEU 240 Ca 0.13 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 57.92 3ksw h LEU 240 Cb 0.55 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 3ksw h LEU 240 CO -0.00 0.96 0.53 1.23 0.09 0.00 0.00 178.44 181.24 3ksw h GLY 241 N 1.05 1.18 1.37 0.83 0.00 -1.37 -2.75 103.07 103.39 3ksw h GLY 241 Ca 0.23 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 47.12 3ksw h GLY 241 CO -0.01 0.35 0.14 0.83 0.00 0.00 0.00 176.54 177.85 3ksw h GLU 242 N 1.03 0.79 0.00 4.80 3.07 -1.62 -2.37 114.58 120.28 3ksw h GLU 242 Ca 0.32 -0.15 -0.04 0.00 -0.50 0.00 0.00 59.36 58.99 3ksw h GLU 242 Cb -0.00 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 27.77 3ksw h GLU 242 CO -0.11 0.70 -0.19 0.82 -1.40 0.00 0.00 179.01 178.84 3ksw h ILE 243 N 0.77 0.46 -0.00 3.13 1.08 -1.52 -3.25 117.51 118.17 3ksw h ILE 243 Ca 0.17 -1.04 -0.02 0.00 -0.39 0.00 0.00 64.86 63.59 3ksw h ILE 243 Cb 0.26 1.74 0.00 0.00 -3.07 0.00 0.00 36.82 35.76 3ksw h ILE 243 CO -0.00 0.18 -0.06 0.40 -0.69 0.00 0.00 178.15 177.98 3ksw h ILE 244 N 0.00 1.57 -0.29 -0.67 2.04 -1.27 -2.90 117.51 115.98 3ksw h ILE 244 Ca -0.00 -1.75 0.06 0.00 1.00 0.00 0.00 64.86 64.16 3ksw h ILE 244 Cb 0.73 2.73 -0.05 0.00 -0.74 0.00 0.00 36.82 39.48 3ksw h ILE 244 CO 0.02 0.46 -0.04 0.58 0.00 0.00 0.00 178.15 179.17 3ksw h VAL 245 N -0.66 0.74 0.00 1.67 2.07 -1.56 0.45 116.25 118.96 3ksw h VAL 245 Ca -0.01 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 3ksw h VAL 245 Cb 0.79 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 3ksw h VAL 245 CO 0.01 0.01 -0.11 0.00 0.02 0.00 0.00 177.57 177.50 3ksw h ALA 246 N 1.28 1.01 0.11 1.67 0.00 -1.69 -3.06 119.26 118.57 3ksw h ALA 246 Ca 0.14 -0.10 -0.28 0.00 0.00 0.00 0.00 54.91 54.67 3ksw h ALA 246 Cb 0.20 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 3ksw h ALA 246 CO -0.27 0.14 -1.31 -0.09 0.00 0.00 0.00 179.25 177.71 3ksw h ARG 247 N 0.00 0.23 -0.54 0.00 2.43 -1.06 -3.29 114.38 112.15 3ksw h ARG 247 Ca -0.00 -0.39 -0.05 0.00 -0.81 0.00 0.00 59.98 58.73 3ksw h ARG 247 Cb 0.67 0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 3ksw h ARG 247 CO 0.01 1.14 0.13 1.49 -1.51 0.00 0.00 179.97 181.24 3ksw h GLU 248 N 0.06 0.86 -0.51 0.20 4.81 -0.85 3.70 114.58 122.86 3ksw h GLU 248 Ca -0.16 -0.21 -0.03 0.00 -0.13 0.00 0.00 59.36 58.84 3ksw h GLU 248 Cb 1.96 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 31.21 3ksw h GLU 248 CO 0.18 0.81 0.20 0.87 -0.73 0.00 0.00 179.01 180.34 3ksw h LYS 249 N 0.76 0.76 -0.57 1.92 1.57 -1.70 4.05 116.57 123.36 3ksw h LYS 249 Ca 0.17 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.71 3ksw h LYS 249 Cb 0.33 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 3ksw h LYS 249 CO 0.00 0.68 -0.03 0.93 -0.57 0.00 0.00 179.45 180.46 3ksw h GLU 250 N 0.68 1.01 -0.93 3.15 4.39 -1.58 -2.27 114.58 119.03 3ksw h GLU 250 Ca 0.17 -0.33 -0.01 0.00 0.34 0.00 0.00 59.36 59.53 3ksw h GLU 250 Cb 0.20 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 3ksw h GLU 250 CO -0.01 1.01 0.53 0.93 -1.16 0.00 0.00 179.01 180.31 3ksw h GLU 251 N 0.92 1.27 -7.16 2.33 3.07 0.81 -2.24 114.58 113.58 3ksw h GLU 251 Ca 0.16 -0.13 -0.51 0.00 -0.50 0.00 0.00 59.36 58.38 3ksw h GLU 251 Cb 0.57 -0.26 0.10 0.00 -0.84 0.00 0.00 28.75 28.32 3ksw h GLU 251 CO 0.03 0.91 0.40 0.00 -1.40 0.00 0.00 179.01 178.95 3ksw s ALA 252 N -5.90 2.50 0.00 3.43 0.00 1.33 -2.90 121.76 120.22 3ksw s ALA 252 Ca -0.13 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.51 3ksw s ALA 252 Cb 0.17 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.94 3ksw s ALA 252 CO 0.83 -1.19 0.00 0.43 0.00 0.00 0.00 175.76 175.83 3ksw n SER 253 N -2.10 -1.10 -2.99 0.00 7.64 -1.25 -4.17 113.62 109.65 3ksw n SER 253 Ca 0.11 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.86 3ksw n SER 253 Cb 0.51 -0.18 0.07 0.00 -1.01 0.00 0.00 64.21 63.60 3ksw n SER 253 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 3ksw n LYS 254 N -2.37 -4.38 -1.66 1.43 2.85 -1.14 -4.87 118.16 108.02 3ksw n LYS 254 Ca 0.00 0.71 -0.46 0.00 -1.05 0.00 0.00 58.31 57.51 3ksw n LYS 254 Cb 0.00 -5.23 -0.04 0.00 -0.65 0.00 0.00 35.03 29.12 3ksw n LYS 254 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 3ksw n ASP 255 N -2.81 2.84 -0.22 -5.58 2.03 -0.84 -4.86 116.55 107.11 3ksw n ASP 255 Ca -0.18 1.11 -0.08 0.00 0.52 0.00 0.00 54.79 56.16 3ksw n ASP 255 Cb 0.63 -1.41 0.03 0.00 -0.72 0.00 0.00 41.12 39.65 3ksw n ASP 255 CO 0.00 0.00 0.00 -1.13 -1.92 0.00 0.00 177.20 174.15 3ksw h ASN 256 N 5.09 0.90 0.24 1.67 -1.24 -1.89 -3.37 115.58 116.99 3ksw h ASN 256 Ca -0.45 -0.22 -0.01 0.00 0.71 0.00 0.00 56.30 56.32 3ksw h ASN 256 Cb 1.27 -0.24 0.00 0.00 0.73 0.00 0.00 38.32 40.08 3ksw h ASN 256 CO 0.82 0.89 -0.12 -1.13 -1.29 0.00 0.00 177.43 176.61 3ksw h ASN 257 N 0.87 -0.28 0.00 1.15 -0.73 -1.99 -3.47 115.58 111.14 3ksw h ASN 257 Ca 0.19 0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.37 3ksw h ASN 257 Cb 0.33 0.07 0.00 0.00 0.27 0.00 0.00 38.32 38.99 3ksw h ASN 257 CO -0.00 -0.04 0.00 1.07 -0.37 0.00 0.00 177.43 178.09 3ksw n THR 258 N -3.74 0.00 -0.48 -3.57 5.66 -1.26 -4.84 114.28 106.05 3ksw n THR 258 Ca -0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 3ksw n THR 258 Cb 0.13 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.91 3ksw n THR 258 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 3ksw n SER 259 N 2.32 0.00 -4.77 1.09 7.64 -1.26 -4.98 113.62 113.66 3ksw n SER 259 Ca 0.00 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.48 3ksw n SER 259 Cb 0.00 -0.42 -0.01 0.00 -1.01 0.00 0.00 64.21 62.77 3ksw n SER 259 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3ksw s ASP 260 N -3.16 6.35 0.20 6.43 -1.08 -1.26 -4.88 116.67 119.26 3ksw s ASP 260 Ca 0.00 2.69 -0.10 0.00 -0.52 0.00 0.00 52.55 54.62 3ksw s ASP 260 Cb 0.00 -2.64 0.13 0.00 -1.46 0.00 0.00 42.92 38.94 3ksw s ASP 260 CO 0.00 -0.83 1.77 0.17 0.52 0.00 0.00 175.17 176.80 3ksw h LEU 261 N 2.76 0.96 -0.82 -1.34 8.10 -1.94 0.15 115.31 123.18 3ksw h LEU 261 Ca -0.50 -0.15 0.02 0.00 0.11 0.00 0.00 57.88 57.36 3ksw h LEU 261 Cb 1.24 -0.25 -0.04 0.00 -0.44 0.00 0.00 40.66 41.17 3ksw h LEU 261 CO 0.63 0.85 0.54 -0.07 -4.11 0.00 0.00 178.44 176.27 3ksw h LEU 262 N 1.01 0.91 -0.32 0.17 4.07 -1.90 0.36 115.31 119.62 3ksw h LEU 262 Ca 0.24 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.19 3ksw h LEU 262 Cb 0.16 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 41.67 3ksw h LEU 262 CO -0.03 0.65 0.21 1.23 -1.08 0.00 0.00 178.44 179.42 3ksw h GLY 263 N 1.07 0.45 0.61 0.83 0.00 -1.47 0.46 103.07 105.02 3ksw h GLY 263 Ca 0.31 -0.17 0.15 0.00 0.00 0.00 0.00 47.33 47.63 3ksw h GLY 263 CO -0.09 0.16 0.53 -1.33 0.00 0.00 0.00 176.54 175.82 3ksw h GLY 264 N 0.43 0.86 1.90 4.60 0.00 0.13 0.35 103.07 111.35 3ksw h GLY 264 Ca 0.12 -0.21 -0.10 0.00 0.00 0.00 0.00 47.33 47.14 3ksw h GLY 264 CO -0.03 0.07 -0.41 1.41 0.00 0.00 0.00 176.54 177.58 3ksw h LEU 265 N 0.50 0.11 -0.79 3.11 3.38 0.36 -3.06 115.31 118.93 3ksw h LEU 265 Ca 0.40 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.25 3ksw h LEU 265 Cb 0.83 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 3ksw h LEU 265 CO -0.15 0.51 0.09 -0.07 0.09 0.00 0.00 178.44 178.92 3ksw h LEU 266 N 0.09 0.96 -0.72 1.67 3.38 0.29 -3.06 115.31 117.92 3ksw h LEU 266 Ca 0.01 -0.22 -0.12 0.00 0.09 0.00 0.00 57.88 57.63 3ksw h LEU 266 Cb 0.77 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3ksw h LEU 266 CO 0.06 0.97 -0.34 0.11 0.09 0.00 0.00 178.44 179.33 3ksw h LYS 267 N 0.95 0.59 -5.67 1.13 1.57 -1.39 -3.44 116.57 110.31 3ksw h LYS 267 Ca 0.19 -0.27 -0.69 0.00 -1.87 0.00 0.00 60.65 58.00 3ksw h LYS 267 Cb 0.42 -0.01 0.07 0.00 0.08 0.00 0.00 32.23 32.80 3ksw h LYS 267 CO 0.01 0.85 -0.21 0.00 -0.57 0.00 0.00 179.45 179.53 3ksw n ALA 268 N -2.50 -3.15 -3.57 3.86 0.00 -1.16 -4.96 120.51 109.04 3ksw n ALA 268 Ca -0.01 0.49 -0.31 0.00 0.00 0.00 0.00 53.44 53.61 3ksw n ALA 268 Cb 0.48 -1.60 -0.17 0.00 0.00 0.00 0.00 19.45 18.17 3ksw n ALA 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3ksw s VAL 269 N -0.45 1.87 0.73 0.00 0.11 -1.26 -4.13 120.40 117.26 3ksw s VAL 269 Ca 0.74 -0.88 -0.15 0.00 -2.93 0.00 0.00 61.98 58.76 3ksw s VAL 269 Cb -1.05 -1.66 0.04 0.00 -1.53 0.00 0.00 36.38 32.18 3ksw s VAL 269 CO 0.53 0.51 1.20 -0.31 -3.33 0.00 0.00 175.10 173.71 3ksw s TYR 270 N 0.76 2.06 0.22 1.54 2.02 0.33 -4.88 117.35 119.40 3ksw s TYR 270 Ca -0.10 1.60 -0.09 0.00 -0.37 0.00 0.00 57.07 58.12 3ksw s TYR 270 Cb -0.16 -3.46 0.23 0.00 -0.40 0.00 0.00 41.96 38.17 3ksw s TYR 270 CO 0.00 -2.59 1.84 -0.09 -1.57 0.00 0.00 175.55 173.15 3ksw h ARG 271 N -0.31 0.85 -0.55 -0.62 2.43 -2.00 -1.55 114.38 112.63 3ksw h ARG 271 Ca -0.48 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 58.61 3ksw h ARG 271 Cb 1.29 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.63 3ksw h ARG 271 CO 0.50 0.56 0.19 0.38 -1.51 0.00 0.00 179.97 180.09 3ksw h ASP 272 N 0.87 0.73 0.00 -3.80 3.04 -2.05 -3.46 116.42 111.76 3ksw h ASP 272 Ca 0.31 -0.10 0.00 0.00 -3.24 0.00 0.00 57.03 54.00 3ksw h ASP 272 Cb 0.07 -0.19 0.00 0.00 -1.04 0.00 0.00 39.33 38.18 3ksw h ASP 272 CO -0.13 0.68 0.00 0.61 -2.04 0.00 0.00 179.24 178.36 3ksw n GLY 273 N -1.01 0.54 3.25 7.15 0.00 -0.58 -5.17 105.19 109.37 3ksw n GLY 273 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 3ksw n GLY 273 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ksw s THR 274 N -1.00 1.36 0.34 2.61 -4.23 -1.23 -4.92 115.64 108.57 3ksw s THR 274 Ca 0.00 -1.73 0.03 0.00 -1.18 0.00 0.00 61.69 58.81 3ksw s THR 274 Cb 0.00 -1.55 -0.02 0.00 1.34 0.00 0.00 72.50 72.27 3ksw s THR 274 CO 0.00 -0.41 0.50 -0.60 -0.54 0.00 0.00 174.62 173.58 3ksw s ARG 275 N -2.67 3.31 0.42 3.99 6.06 -1.26 0.12 118.95 128.91 3ksw s ARG 275 Ca 0.09 -0.63 -0.24 0.00 -2.50 0.00 0.00 55.73 52.45 3ksw s ARG 275 Cb -0.05 -2.74 -0.08 0.00 0.06 0.00 0.00 34.95 32.14 3ksw s ARG 275 CO 0.03 0.12 1.11 -1.64 -2.50 0.00 0.00 175.30 172.42 3ksw s MET 276 N -4.24 4.03 0.32 5.12 -1.94 -1.26 -4.90 119.30 116.43 3ksw s MET 276 Ca 0.41 1.66 -0.04 0.00 -1.71 0.00 0.00 55.69 56.01 3ksw s MET 276 Cb -0.09 -2.54 -0.05 0.00 2.01 0.00 0.00 34.83 34.16 3ksw s MET 276 CO 0.33 -0.29 0.58 -1.54 -0.01 0.00 0.00 175.02 174.10 3ksw s SER 277 N -1.41 6.41 0.22 3.03 1.04 -1.26 -4.97 113.70 116.77 3ksw s SER 277 Ca 0.59 0.72 -0.10 0.00 0.48 0.00 0.00 55.95 57.64 3ksw s SER 277 Cb -0.26 -2.15 0.32 0.00 0.10 0.00 0.00 66.02 64.03 3ksw s SER 277 CO 0.32 -0.25 1.67 0.25 0.98 0.00 0.00 173.24 176.20 3ksw h LEU 278 N 1.40 -0.23 -0.60 2.42 7.12 -2.00 -2.03 115.31 121.40 3ksw h LEU 278 Ca -0.48 0.15 0.10 0.00 0.13 0.00 0.00 57.88 57.78 3ksw h LEU 278 Cb 1.19 0.26 -0.11 0.00 -0.53 0.00 0.00 40.66 41.47 3ksw h LEU 278 CO 0.65 -0.10 -0.37 -0.74 -0.13 0.00 0.00 178.44 177.74 3ksw h HIS 279 N 0.14 -1.07 0.03 1.25 2.76 -2.00 -0.61 115.15 115.66 3ksw h HIS 279 Ca 0.33 0.08 -0.00 0.00 -2.20 0.00 0.00 60.37 58.58 3ksw h HIS 279 Cb 0.54 0.55 0.00 0.00 1.55 0.00 0.00 27.41 30.06 3ksw h HIS 279 CO -0.35 -0.40 -0.01 0.93 -1.30 0.00 0.00 177.93 176.80 3ksw h GLU 280 N -0.18 -0.04 -0.44 5.26 5.08 -1.78 -2.31 114.58 120.17 3ksw h GLU 280 Ca 0.22 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.67 3ksw h GLU 280 Cb 0.56 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.73 3ksw h GLU 280 CO -0.69 0.24 -0.15 0.28 -1.00 0.00 0.00 179.01 177.68 3ksw h VAL 281 N -0.32 0.48 -0.75 3.13 2.07 -1.10 0.16 116.25 119.92 3ksw h VAL 281 Ca -0.00 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.67 3ksw h VAL 281 Cb 0.30 0.48 -0.10 0.00 -1.52 0.00 0.00 31.29 30.44 3ksw h VAL 281 CO 0.01 0.00 0.26 0.00 0.02 0.00 0.00 177.57 177.85 3ksw h GLY 283 N 0.37 -0.39 0.43 0.00 0.00 -0.18 -2.79 103.07 100.51 3ksw h GLY 283 Ca 0.42 0.15 0.08 0.00 0.00 0.00 0.00 47.33 47.98 3ksw h GLY 283 CO -0.45 -0.14 0.20 -0.33 0.00 0.00 0.00 176.54 175.82 3ksw h MET 284 N -0.44 0.37 -0.06 4.80 2.86 -0.52 -1.58 114.93 120.35 3ksw h MET 284 Ca -0.04 -0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 3ksw h MET 284 Cb 0.34 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 3ksw h MET 284 CO 0.06 0.24 -0.02 0.82 1.06 0.00 0.00 176.91 179.07 3ksw h ILE 285 N 0.38 0.92 -0.59 -1.22 2.04 -1.32 -1.83 117.51 115.89 3ksw h ILE 285 Ca 0.28 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.22 3ksw h ILE 285 Cb 0.33 0.92 -0.06 0.00 -0.74 0.00 0.00 36.82 37.27 3ksw h ILE 285 CO -0.29 0.00 0.25 0.58 0.00 0.00 0.00 178.15 178.70 3ksw h VAL 286 N -0.02 0.85 -0.16 1.67 2.07 -1.20 -2.37 116.25 117.09 3ksw h VAL 286 Ca 0.03 -0.16 0.05 0.00 0.82 0.00 0.00 66.70 67.44 3ksw h VAL 286 Cb 0.06 0.34 -0.07 0.00 -1.52 0.00 0.00 31.29 30.10 3ksw h VAL 286 CO -0.07 0.09 -0.32 0.00 0.02 0.00 0.00 177.57 177.29 3ksw h ALA 287 N 1.37 -0.34 -0.44 1.67 0.00 -0.70 0.39 119.26 121.21 3ksw h ALA 287 Ca 0.28 0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.32 3ksw h ALA 287 Cb 0.29 0.61 -0.09 0.00 0.00 0.00 0.00 17.79 18.60 3ksw h ALA 287 CO -0.25 -0.78 -0.15 0.00 0.00 0.00 0.00 179.25 178.06 3ksw h ALA 288 N 0.47 0.22 -0.21 0.00 0.00 -0.92 -2.12 119.26 116.70 3ksw h ALA 288 Ca 0.10 0.17 -0.15 0.00 0.00 0.00 0.00 54.91 55.03 3ksw h ALA 288 Cb 0.54 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 3ksw h ALA 288 CO -0.37 -0.49 -0.51 0.52 0.00 0.00 0.00 179.25 178.40 3ksw h MET 289 N -0.05 0.57 -0.57 0.00 2.86 -0.87 -3.19 114.93 113.68 3ksw h MET 289 Ca 0.22 -0.34 -0.09 0.00 -2.06 0.00 0.00 59.70 57.43 3ksw h MET 289 Cb 0.38 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.05 3ksw h MET 289 CO -0.49 0.94 -0.00 0.35 1.06 0.00 0.00 176.91 178.78 3ksw h PHE 290 N 0.45 1.07 -0.17 -0.22 3.57 0.20 -3.26 116.94 118.58 3ksw h PHE 290 Ca 0.02 -0.18 -0.21 0.00 3.53 0.00 0.00 57.97 61.13 3ksw h PHE 290 Cb 1.04 -0.28 0.01 0.00 2.79 0.00 0.00 35.95 39.50 3ksw h PHE 290 CO 0.04 0.95 -0.72 0.00 -2.23 0.00 0.00 178.31 176.35 3ksw h ALA 291 N 1.08 0.39 -0.20 2.41 0.00 -1.40 -3.38 119.26 118.17 3ksw h ALA 291 Ca 0.17 -0.58 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 3ksw h ALA 291 Cb 0.53 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 3ksw h ALA 291 CO 0.03 0.69 -0.33 0.78 0.00 0.00 0.00 179.25 180.43 3ksw h GLY 292 N 0.71 0.62 0.45 0.00 0.00 -1.59 -3.39 103.07 99.87 3ksw h GLY 292 Ca -0.04 -0.71 -0.02 0.00 0.00 0.00 0.00 47.33 46.57 3ksw h GLY 292 CO 0.15 0.63 -0.37 0.06 0.00 0.00 0.00 176.54 177.01 3ksw h GLN 293 N 0.24 -0.77 0.27 4.80 -0.00 -1.74 -2.63 115.11 115.28 3ksw h GLN 293 Ca 0.01 0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.72 3ksw h GLN 293 Cb 0.91 0.17 -0.02 0.00 -0.00 0.00 0.00 27.48 28.55 3ksw h GLN 293 CO 0.07 -0.51 -0.26 0.45 -0.00 0.00 0.00 178.83 178.58 3ksw h HIS 294 N -0.80 -0.69 -0.61 0.06 3.86 -1.82 -2.48 115.15 112.67 3ksw h HIS 294 Ca -0.06 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.14 3ksw h HIS 294 Cb 0.67 0.27 -0.03 0.00 1.06 0.00 0.00 27.41 29.38 3ksw h HIS 294 CO -0.15 -0.38 0.31 1.79 0.86 0.00 0.00 177.93 180.36 3ksw h THR 295 N -0.56 1.21 -0.33 2.45 1.35 -1.74 -2.35 112.91 112.94 3ksw h THR 295 Ca -0.01 -0.55 -0.05 0.00 -0.55 0.00 0.00 66.41 65.25 3ksw h THR 295 Cb 0.51 0.46 -0.01 0.00 -1.73 0.00 0.00 68.15 67.38 3ksw h THR 295 CO -0.05 0.23 0.01 0.28 -0.25 0.00 0.00 175.52 175.73 3ksw h SER 296 N 0.82 0.57 0.19 5.36 0.02 -1.48 -2.47 113.55 116.56 3ksw h SER 296 Ca 0.21 -0.30 0.01 0.00 -0.84 0.00 0.00 61.79 60.87 3ksw h SER 296 Cb 0.08 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.44 3ksw h SER 296 CO -0.03 0.73 -0.36 0.74 -1.14 0.00 0.00 176.83 176.77 3ksw h THR 297 N 0.38 0.25 -0.39 -2.27 2.02 -1.21 0.20 112.91 111.90 3ksw h THR 297 Ca 0.09 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.36 3ksw h THR 297 Cb 0.44 0.25 -0.08 0.00 -1.74 0.00 0.00 68.15 67.01 3ksw h THR 297 CO 0.02 0.00 -0.17 0.40 0.37 0.00 0.00 175.52 176.14 3ksw h ILE 298 N -0.64 0.48 -0.83 3.11 2.04 -1.48 0.48 117.51 120.67 3ksw h ILE 298 Ca 0.01 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.99 3ksw h ILE 298 Cb 0.64 0.48 -0.08 0.00 -0.74 0.00 0.00 36.82 37.11 3ksw h ILE 298 CO -0.17 0.00 0.45 0.74 0.00 0.00 0.00 178.15 179.17 3ksw h THR 299 N -0.09 0.81 -0.36 -0.27 2.02 -0.94 -1.02 112.91 113.07 3ksw h THR 299 Ca 0.19 -0.24 -0.07 0.00 0.77 0.00 0.00 66.41 67.07 3ksw h THR 299 Cb 0.39 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 3ksw h THR 299 CO -0.45 0.13 -0.04 0.74 0.37 0.00 0.00 175.52 176.27 3ksw h THR 300 N 0.69 1.27 0.07 3.16 2.02 -0.09 -3.00 112.91 117.03 3ksw h THR 300 Ca 0.43 -1.06 -0.00 0.00 0.77 0.00 0.00 66.41 66.55 3ksw h THR 300 Cb 0.51 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.16 3ksw h THR 300 CO -0.31 0.35 -0.03 0.28 0.37 0.00 0.00 175.52 176.18 3ksw h SER 301 N 0.46 -0.08 -0.91 4.18 0.02 0.00 -2.66 113.55 114.57 3ksw h SER 301 Ca 0.10 -0.04 0.07 0.00 -0.84 0.00 0.00 61.79 61.07 3ksw h SER 301 Cb 0.52 0.02 -0.06 0.00 0.14 0.00 0.00 62.40 63.02 3ksw h SER 301 CO 0.03 -0.01 0.59 -0.50 -1.14 0.00 0.00 176.83 175.80 3ksw h TRP 302 N -0.14 1.04 -0.14 3.45 4.06 -1.29 -2.67 115.95 120.26 3ksw h TRP 302 Ca -0.01 0.03 -0.08 0.00 2.06 0.00 0.00 58.89 60.89 3ksw h TRP 302 Cb 0.12 -0.34 -0.01 0.00 -1.00 0.00 0.00 29.16 27.92 3ksw h TRP 302 CO -0.06 0.53 -0.27 0.77 -3.56 0.00 0.00 178.44 175.85 3ksw h SER 303 N 1.01 0.25 1.11 -3.49 0.02 -1.33 -2.80 113.55 108.33 3ksw h SER 303 Ca 0.39 -0.08 -0.17 0.00 -0.84 0.00 0.00 61.79 61.10 3ksw h SER 303 Cb 0.23 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.67 3ksw h SER 303 CO -0.15 0.53 -0.92 0.24 -1.14 0.00 0.00 176.83 175.39 3ksw h MET 304 N 0.23 0.00 0.45 3.45 2.86 -1.23 -3.24 114.93 117.45 3ksw h MET 304 Ca 0.03 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.65 3ksw h MET 304 Cb 0.61 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.27 3ksw h MET 304 CO 0.04 0.65 -0.21 -0.07 1.06 0.00 0.00 176.91 178.38 3ksw h LEU 305 N 0.00 -0.51 -1.69 1.22 3.38 -1.31 -2.84 115.31 113.56 3ksw h LEU 305 Ca -0.05 0.02 0.42 0.00 0.09 0.00 0.00 57.88 58.35 3ksw h LEU 305 Cb 1.61 0.13 -0.09 0.00 0.09 0.00 0.00 40.66 42.40 3ksw h LEU 305 CO 0.09 -0.21 0.96 0.45 0.09 0.00 0.00 178.44 179.81 3ksw h HIS 306 N -0.91 0.29 0.00 1.13 3.86 -1.66 -1.02 115.15 116.85 3ksw h HIS 306 Ca -0.06 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 3ksw h HIS 306 Cb 0.46 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.86 3ksw h HIS 306 CO 0.03 -0.07 -0.50 -0.11 0.86 0.00 0.00 177.93 178.15 3ksw n LEU 307 N -4.38 0.57 -1.44 2.43 7.94 -1.17 -3.96 117.00 116.99 3ksw n LEU 307 Ca 0.34 0.19 -0.10 0.00 -1.11 0.00 0.00 56.01 55.33 3ksw n LEU 307 Cb 1.44 -0.24 0.19 0.00 0.53 0.00 0.00 43.42 45.34 3ksw n LEU 307 CO 0.32 0.01 0.82 1.15 -1.11 0.00 0.00 177.39 178.58 3ksw n MET 308 N -1.85 1.97 -5.00 1.96 0.00 -0.38 -4.87 117.12 108.94 3ksw n MET 308 Ca 0.04 -3.18 -0.32 0.00 0.00 0.00 0.00 57.70 54.24 3ksw n MET 308 Cb 0.39 -1.91 -0.16 0.00 0.00 0.00 0.00 33.22 31.54 3ksw n MET 308 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 3ksw s HIS 309 N -3.29 2.68 0.43 3.17 5.04 -1.25 -4.34 115.29 117.73 3ksw s HIS 309 Ca 0.48 -0.82 0.34 0.00 -1.54 0.00 0.00 55.06 53.51 3ksw s HIS 309 Cb 0.43 -1.77 1.43 0.00 0.04 0.00 0.00 32.58 32.71 3ksw s HIS 309 CO 0.02 -0.30 1.45 -2.30 -2.34 0.00 0.00 174.74 171.27 3ksw n PRO 310 N 3.47 -0.03 0.27 2.88 -0.02 -1.26 -0.22 135.00 140.09 3ksw n PRO 310 Ca -0.18 1.13 -0.14 0.00 -2.02 0.00 0.00 63.50 62.29 3ksw n PRO 310 Cb 0.53 -2.30 -0.07 0.00 -0.02 0.00 0.00 33.50 31.64 3ksw n PRO 310 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3ksw h LYS 311 N 0.00 -0.68 -3.58 -0.52 1.79 -1.94 -3.27 116.57 108.37 3ksw h LYS 311 Ca 0.83 0.05 -0.70 0.00 -2.18 0.00 0.00 60.65 58.64 3ksw h LYS 311 Cb 2.81 0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 33.58 3ksw h LYS 311 CO -0.35 -0.37 3.23 0.09 -1.08 0.00 0.00 179.45 180.97 3ksw n ASN 312 N -5.28 5.71 -0.13 0.86 3.02 0.69 -4.13 115.26 115.99 3ksw n ASN 312 Ca -0.11 -2.80 -0.22 0.00 -0.03 0.00 0.00 54.58 51.43 3ksw n ASN 312 Cb 0.32 -1.60 -0.11 0.00 -0.61 0.00 0.00 39.78 37.78 3ksw n ASN 312 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3ksw n LYS 313 N 4.90 0.62 -0.32 3.52 0.00 -1.23 -4.19 118.16 121.46 3ksw n LYS 313 Ca 0.60 0.19 0.17 0.00 0.00 0.00 0.00 58.31 59.27 3ksw n LYS 313 Cb 0.33 -1.50 0.35 0.00 0.00 0.00 0.00 35.03 34.21 3ksw n LYS 313 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 3ksw h LYS 314 N -0.38 0.10 -0.00 1.64 3.64 -1.88 0.12 116.57 119.82 3ksw h LYS 314 Ca -0.62 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.75 3ksw h LYS 314 Cb 1.78 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.58 3ksw h LYS 314 CO -0.22 0.07 -0.39 0.91 -2.27 0.00 0.00 179.45 177.55 3ksw n TRP 315 N -5.32 0.00 0.03 1.91 8.01 -1.26 -3.81 117.44 117.00 3ksw n TRP 315 Ca 0.25 0.00 -0.10 0.00 -1.31 0.00 0.00 57.50 56.34 3ksw n TRP 315 Cb 0.83 -0.29 0.03 0.00 -2.01 0.00 0.00 31.31 29.87 3ksw n TRP 315 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.69 177.93 3ksw h LEU 316 N 0.04 0.55 -0.26 -0.99 5.85 -0.92 -3.09 115.31 116.49 3ksw h LEU 316 Ca 0.00 -0.34 -0.07 0.00 0.84 0.00 0.00 57.88 58.32 3ksw h LEU 316 Cb 0.50 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 3ksw h LEU 316 CO 0.00 1.07 -0.10 0.44 -0.34 0.00 0.00 178.44 179.51 3ksw h ASP 317 N 0.33 0.54 -0.79 1.25 5.19 -1.64 -2.92 116.42 118.38 3ksw h ASP 317 Ca -0.02 -0.39 0.23 0.00 -0.62 0.00 0.00 57.03 56.23 3ksw h ASP 317 Cb 1.24 -0.15 -0.03 0.00 0.18 0.00 0.00 39.33 40.57 3ksw h ASP 317 CO 0.12 0.81 0.58 0.50 -3.12 0.00 0.00 179.24 178.13 3ksw h LYS 318 N 0.27 0.00 -0.08 3.56 3.64 -1.66 0.43 116.57 122.73 3ksw h LYS 318 Ca 0.06 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.34 3ksw h LYS 318 Cb 0.59 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 3ksw h LYS 318 CO 0.03 0.00 -0.36 1.25 -2.27 0.00 0.00 179.45 178.11 3ksw h LEU 319 N 0.00 0.45 -1.81 5.20 5.85 -1.44 -3.11 115.31 120.45 3ksw h LEU 319 Ca 0.38 -0.65 -0.03 0.00 0.84 0.00 0.00 57.88 58.42 3ksw h LEU 319 Cb 1.54 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.43 3ksw h LEU 319 CO -0.00 1.02 -0.13 0.45 -0.34 0.00 0.00 178.44 179.43 3ksw h HIS 320 N -0.10 0.00 0.00 1.25 3.86 -0.93 -0.70 115.15 118.53 3ksw h HIS 320 Ca -0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 3ksw h HIS 320 Cb 1.01 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.48 3ksw h HIS 320 CO 0.13 0.13 0.00 1.63 0.86 0.00 0.00 177.93 180.68 3ksw n LYS 321 N -4.19 0.41 0.00 2.45 4.76 -0.33 -2.63 118.16 118.63 3ksw n LYS 321 Ca -0.02 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 3ksw n LYS 321 Cb 0.21 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 3ksw n LYS 321 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 3ksw n GLU 322 N -1.03 2.93 -0.02 1.97 2.13 -0.29 -4.78 120.64 121.55 3ksw n GLU 322 Ca 0.10 -0.09 0.01 0.00 0.66 0.00 0.00 57.16 57.84 3ksw n GLU 322 Cb 0.05 -0.46 0.01 0.00 0.27 0.00 0.00 31.44 31.32 3ksw n GLU 322 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 3ksw n ILE 323 N -0.44 0.78 -0.81 6.31 -5.35 -1.06 -4.69 119.36 114.09 3ksw n ILE 323 Ca 0.00 -0.80 0.08 0.00 -0.27 0.00 0.00 62.75 61.76 3ksw n ILE 323 Cb 0.03 0.58 0.30 0.00 -1.74 0.00 0.00 39.64 38.81 3ksw n ILE 323 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3ksw n ASP 324 N -0.42 4.35 -0.06 7.28 8.00 -1.13 -4.42 116.55 130.16 3ksw n ASP 324 Ca 0.01 -2.77 -0.07 0.00 0.71 0.00 0.00 54.79 52.67 3ksw n ASP 324 Cb 0.35 -0.54 -0.07 0.00 -0.02 0.00 0.00 41.12 40.84 3ksw n ASP 324 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3ksw n GLU 325 N 0.16 1.08 -1.20 -1.24 -0.58 -1.26 -5.04 120.64 112.57 3ksw n GLU 325 Ca 0.22 0.04 -0.32 0.00 -0.42 0.00 0.00 57.16 56.69 3ksw n GLU 325 Cb 0.90 -1.26 0.11 0.00 -0.57 0.00 0.00 31.44 30.63 3ksw n GLU 325 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 3ksw s PHE 326 N -2.25 2.22 0.79 -0.32 2.99 -1.26 -5.05 117.98 115.09 3ksw s PHE 326 Ca -0.13 1.63 -0.13 0.00 0.00 0.00 0.00 56.93 58.30 3ksw s PHE 326 Cb 0.04 -3.22 0.18 0.00 0.00 0.00 0.00 43.02 40.02 3ksw s PHE 326 CO 0.34 -2.21 0.96 -0.35 -0.00 0.00 0.00 175.22 173.96 3ksw n PRO 327 N -3.43 -1.39 0.00 0.24 -0.04 -1.26 -4.94 135.00 124.18 3ksw n PRO 327 Ca 0.11 -1.50 0.10 0.00 -0.04 0.00 0.00 63.50 62.17 3ksw n PRO 327 Cb 0.52 -1.08 0.50 0.00 -0.04 0.00 0.00 33.50 33.39 3ksw n PRO 327 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ksw n ALA 328 N -3.84 2.04 -3.88 0.55 0.00 -1.26 -4.41 120.51 109.71 3ksw n ALA 328 Ca -0.16 -0.09 -0.30 0.00 0.00 0.00 0.00 53.44 52.88 3ksw n ALA 328 Cb 0.44 -1.32 -0.15 0.00 0.00 0.00 0.00 19.45 18.41 3ksw n ALA 328 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3ksw s GLN 329 N -2.60 1.18 0.57 0.00 -1.52 -1.26 -5.12 119.66 110.91 3ksw s GLN 329 Ca 0.18 -1.33 -0.17 0.00 -1.95 0.00 0.00 55.36 52.09 3ksw s GLN 329 Cb 0.13 -2.56 -0.04 0.00 -0.22 0.00 0.00 33.01 30.32 3ksw s GLN 329 CO 0.31 -0.88 1.06 -0.51 -0.25 0.00 0.00 175.29 175.02 3ksw s LEU 330 N 1.31 3.58 0.25 2.90 1.43 -1.26 -5.08 118.68 121.81 3ksw s LEU 330 Ca 0.07 1.87 0.04 0.00 -1.03 0.00 0.00 54.13 55.08 3ksw s LEU 330 Cb -0.18 -4.54 -0.05 0.00 0.03 0.00 0.00 46.19 41.44 3ksw s LEU 330 CO -0.15 -1.12 -0.01 0.54 0.23 0.00 0.00 176.35 175.84 3ksw s ASN 331 N -2.55 2.07 0.34 2.29 4.22 -1.26 -4.55 114.94 115.50 3ksw s ASN 331 Ca 0.65 -1.22 0.14 0.00 -2.14 0.00 0.00 52.86 50.28 3ksw s ASN 331 Cb -0.17 -0.04 1.04 0.00 1.28 0.00 0.00 41.25 43.36 3ksw s ASN 331 CO 0.33 -0.48 1.68 0.22 -2.04 0.00 0.00 177.10 176.81 3ksw h TYR 332 N 2.40 0.94 0.87 1.54 3.20 -1.93 -2.88 116.97 121.11 3ksw h TYR 332 Ca -0.39 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.48 3ksw h TYR 332 Cb 1.23 -0.26 0.01 0.00 1.54 0.00 0.00 36.73 39.25 3ksw h TYR 332 CO 0.60 -0.10 -0.42 -0.44 -1.64 0.00 0.00 178.16 176.17 3ksw h ASP 333 N 0.40 -0.99 0.17 -2.11 3.32 -1.98 -2.68 116.42 112.56 3ksw h ASP 333 Ca 0.71 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.79 3ksw h ASP 333 Cb 1.56 0.25 0.00 0.00 0.22 0.00 0.00 39.33 41.36 3ksw h ASP 333 CO -0.55 -0.68 0.00 -0.55 -1.72 0.00 0.00 179.24 175.74 3ksw h ASN 334 N -1.21 0.00 0.20 6.45 -0.00 -1.90 -1.59 115.58 117.53 3ksw h ASN 334 Ca -0.12 0.00 -0.35 0.00 -0.00 0.00 0.00 56.30 55.83 3ksw h ASN 334 Cb 0.90 0.00 -0.04 0.00 -0.00 0.00 0.00 38.32 39.18 3ksw h ASN 334 CO 0.20 0.00 -2.02 0.52 -0.00 0.00 0.00 177.43 176.13 3ksw n VAL 335 N -2.89 1.66 -0.04 6.14 0.31 -1.20 -2.83 118.33 119.48 3ksw n VAL 335 Ca -0.02 -0.70 -0.16 0.00 -0.01 0.00 0.00 64.34 63.45 3ksw n VAL 335 Cb 0.10 -1.38 -0.07 0.00 -0.91 0.00 0.00 33.84 31.58 3ksw n VAL 335 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 3ksw h MET 336 N 0.04 0.65 0.00 5.55 2.86 -1.11 -3.40 114.93 119.51 3ksw h MET 336 Ca -0.42 -0.48 0.00 0.00 -2.06 0.00 0.00 59.70 56.75 3ksw h MET 336 Cb 2.03 0.08 0.00 0.00 0.06 0.00 0.00 31.60 33.77 3ksw h MET 336 CO 0.06 1.10 -0.87 -0.25 1.06 0.00 0.00 176.91 178.00 3ksw n ASP 337 N -4.16 4.27 -1.80 1.22 9.92 -0.63 -4.71 116.55 120.66 3ksw n ASP 337 Ca -0.07 -0.07 -0.01 0.00 -0.53 0.00 0.00 54.79 54.12 3ksw n ASP 337 Cb 0.61 1.01 0.32 0.00 -0.64 0.00 0.00 41.12 42.42 3ksw n ASP 337 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3ksw n GLU 338 N -1.44 3.88 -3.16 -1.24 1.02 -1.13 -4.53 120.64 114.04 3ksw n GLU 338 Ca -0.00 -3.09 -0.21 0.00 -0.02 0.00 0.00 57.16 53.84 3ksw n GLU 338 Cb 0.00 -2.17 -0.04 0.00 -0.02 0.00 0.00 31.44 29.21 3ksw n GLU 338 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 3ksw n MET 339 N -0.03 1.36 -0.01 3.49 2.81 -1.18 -4.88 117.12 118.68 3ksw n MET 339 Ca 0.35 -3.65 -0.13 0.00 -1.81 0.00 0.00 57.70 52.46 3ksw n MET 339 Cb 1.27 -1.74 -0.09 0.00 -0.71 0.00 0.00 33.22 31.94 3ksw n MET 339 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 3ksw h PRO 340 N 3.19 0.04 -0.24 0.03 0.13 -1.92 -3.34 132.00 129.89 3ksw h PRO 340 Ca 0.10 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.21 3ksw h PRO 340 Cb 0.87 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 3ksw h PRO 340 CO 0.56 0.43 0.11 0.35 -0.23 0.00 0.00 178.00 179.22 3ksw h PHE 341 N -0.35 0.35 -1.15 1.56 3.57 -1.99 -2.48 116.94 116.45 3ksw h PHE 341 Ca 0.00 -0.02 0.40 0.00 3.53 0.00 0.00 57.97 61.89 3ksw h PHE 341 Cb 0.42 -0.11 -0.15 0.00 2.79 0.00 0.00 35.95 38.90 3ksw h PHE 341 CO 0.06 0.35 0.69 0.00 -2.23 0.00 0.00 178.31 177.19 3ksw h ALA 342 N 0.97 2.38 0.00 2.41 0.00 -1.98 1.62 119.26 124.65 3ksw h ALA 342 Ca 0.08 0.18 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 3ksw h ALA 342 Cb 0.14 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3ksw h ALA 342 CO -0.01 -1.06 -0.26 1.49 0.00 0.00 0.00 179.25 179.42 3ksw h GLU 343 N 0.11 0.00 0.00 0.00 4.81 -1.56 -2.34 114.58 115.61 3ksw h GLU 343 Ca 0.81 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 60.04 3ksw h GLU 343 Cb 2.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.65 3ksw h GLU 343 CO -0.57 0.26 0.00 0.00 -0.73 0.00 0.00 179.01 177.97 3ksw h ARG 344 N 0.00 0.00 0.12 1.92 3.08 0.24 -3.09 114.38 116.65 3ksw h ARG 344 Ca -0.00 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.83 3ksw h ARG 344 Cb 0.70 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.76 3ksw h ARG 344 CO 0.03 0.00 -1.05 0.00 -1.07 0.00 0.00 179.97 177.88 3ksw h VAL 346 N -0.40 1.04 0.22 0.00 2.07 -1.58 -2.83 116.25 114.77 3ksw h VAL 346 Ca -0.21 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 3ksw h VAL 346 Cb 1.65 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 3ksw h VAL 346 CO 0.09 0.12 -0.10 0.03 0.02 0.00 0.00 177.57 177.72 3ksw h ARG 347 N 0.66 -0.28 -0.74 1.57 2.47 -1.65 -2.93 114.38 113.47 3ksw h ARG 347 Ca 0.25 0.02 0.04 0.00 -1.26 0.00 0.00 59.98 59.03 3ksw h ARG 347 Cb 0.18 0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 28.52 3ksw h ARG 347 CO -0.07 -0.01 0.49 1.49 0.56 0.00 0.00 179.97 182.43 3ksw h GLU 348 N -0.54 0.85 0.43 0.04 4.57 -1.53 -0.73 114.58 117.67 3ksw h GLU 348 Ca -0.03 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 3ksw h GLU 348 Cb 0.40 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 3ksw h GLU 348 CO 0.05 0.56 -0.28 0.77 -1.18 0.00 0.00 179.01 178.93 3ksw h SER 349 N 0.87 -0.70 -0.91 1.04 0.02 -1.48 -1.32 113.55 111.07 3ksw h SER 349 Ca 0.30 0.04 0.07 0.00 -0.84 0.00 0.00 61.79 61.37 3ksw h SER 349 Cb 0.11 0.21 -0.07 0.00 0.14 0.00 0.00 62.40 62.79 3ksw h SER 349 CO -0.09 -0.43 0.57 0.40 -1.14 0.00 0.00 176.83 176.14 3ksw h ILE 350 N -0.68 1.04 -0.65 3.27 2.04 -1.25 -2.16 117.51 119.12 3ksw h ILE 350 Ca -0.05 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 3ksw h ILE 350 Cb 0.56 -0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 3ksw h ILE 350 CO 0.04 0.19 0.37 -0.09 0.00 0.00 0.00 178.15 178.65 3ksw h ARG 351 N 1.02 0.90 -0.02 2.37 1.12 -0.72 -2.71 114.38 116.35 3ksw h ARG 351 Ca 0.40 -0.10 -0.15 0.00 -1.11 0.00 0.00 59.98 59.02 3ksw h ARG 351 Cb 0.21 -0.18 0.01 0.00 -0.01 0.00 0.00 29.97 30.00 3ksw h ARG 351 CO -0.19 0.67 -0.58 -0.09 -3.11 0.00 0.00 179.97 176.68 3ksw h ARG 352 N 0.89 0.42 -2.79 0.20 2.43 -1.02 -3.40 114.38 111.11 3ksw h ARG 352 Ca 0.23 -0.43 -0.61 0.00 -0.81 0.00 0.00 59.98 58.36 3ksw h ARG 352 Cb 0.03 0.12 -0.40 0.00 -0.42 0.00 0.00 29.97 29.29 3ksw h ARG 352 CO -0.04 1.09 -0.75 -0.51 -1.51 0.00 0.00 179.97 178.25 3ksw s ASP 353 N -6.73 3.36 0.11 -3.80 -0.00 -0.83 -5.06 116.67 103.72 3ksw s ASP 353 Ca -0.13 -3.44 -0.31 0.00 -0.00 0.00 0.00 52.55 48.67 3ksw s ASP 353 Cb 0.04 -1.10 -0.08 0.00 -0.00 0.00 0.00 42.92 41.78 3ksw s ASP 353 CO 0.82 -0.13 1.41 -2.16 -0.00 0.00 0.00 175.17 175.11 3ksw s PRO 354 N -0.70 4.31 0.44 8.23 0.04 -1.02 -4.68 135.00 141.61 3ksw s PRO 354 Ca 0.27 2.10 0.10 0.00 0.04 0.00 0.00 61.00 63.51 3ksw s PRO 354 Cb -0.03 -3.26 0.97 0.00 0.04 0.00 0.00 34.50 32.22 3ksw s PRO 354 CO -0.16 -0.46 2.07 -1.35 0.04 0.00 0.00 177.00 177.13 3ksw h PRO 355 N 6.86 0.41 -4.99 0.56 0.11 -1.84 -3.41 132.00 129.70 3ksw h PRO 355 Ca -0.42 -0.02 -0.65 0.00 0.11 0.00 0.00 66.00 65.01 3ksw h PRO 355 Cb 1.21 -0.09 -0.24 0.00 0.11 0.00 0.00 31.00 31.99 3ksw h PRO 355 CO 0.87 0.27 -0.66 -1.17 -0.21 0.00 0.00 178.00 177.10 3ksw s LEU 356 N -9.38 3.26 0.10 2.35 0.20 -1.26 -1.42 118.68 112.53 3ksw s LEU 356 Ca -0.07 -0.26 -0.19 0.00 0.69 0.00 0.00 54.13 54.30 3ksw s LEU 356 Cb 0.18 -1.86 -0.07 0.00 -0.43 0.00 0.00 46.19 44.01 3ksw s LEU 356 CO 0.72 -0.02 1.64 0.17 -0.29 0.00 0.00 176.35 178.58 3ksw h LEU 357 N 8.10 0.33 -7.00 -0.68 8.10 -1.80 -3.43 115.31 118.92 3ksw h LEU 357 Ca -0.39 -0.16 0.13 0.00 0.11 0.00 0.00 57.88 57.56 3ksw h LEU 357 Cb 1.17 -0.08 -0.19 0.00 -0.44 0.00 0.00 40.66 41.11 3ksw h LEU 357 CO 0.59 0.40 0.58 0.00 -4.11 0.00 0.00 178.44 175.90 3ksw s MET 358 N -5.56 0.62 0.13 0.17 0.23 -1.26 -4.13 119.30 109.50 3ksw s MET 358 Ca -0.13 -0.08 0.04 0.00 -1.03 0.00 0.00 55.69 54.49 3ksw s MET 358 Cb 0.08 0.29 -0.04 0.00 -1.53 0.00 0.00 34.83 33.63 3ksw s MET 358 CO 0.72 -0.24 0.10 0.14 -2.03 0.00 0.00 175.02 173.71 3ksw s VAL 359 N -2.14 4.43 0.15 5.16 -7.23 -1.08 -5.01 120.40 114.68 3ksw s VAL 359 Ca 0.03 -0.99 -0.01 0.00 -1.81 0.00 0.00 61.98 59.21 3ksw s VAL 359 Cb -0.01 -3.21 -0.04 0.00 0.56 0.00 0.00 36.38 33.68 3ksw s VAL 359 CO -0.04 -0.02 0.07 -0.04 -0.31 0.00 0.00 175.10 174.76 3ksw s MET 360 N -2.81 1.00 -0.07 4.82 -1.94 -1.26 -2.24 119.30 116.81 3ksw s MET 360 Ca 0.30 -1.49 -0.30 0.00 -1.71 0.00 0.00 55.69 52.49 3ksw s MET 360 Cb -0.11 0.20 0.11 0.00 2.01 0.00 0.00 34.83 37.04 3ksw s MET 360 CO 0.22 -0.27 0.93 1.03 -0.01 0.00 0.00 175.02 176.92 3ksw s ARG 361 N -4.06 0.73 0.27 2.03 0.52 -1.00 -4.91 118.95 112.53 3ksw s ARG 361 Ca 0.27 -0.13 -0.06 0.00 -0.52 0.00 0.00 55.73 55.29 3ksw s ARG 361 Cb 0.07 0.34 -0.06 0.00 0.52 0.00 0.00 34.95 35.83 3ksw s ARG 361 CO 0.04 -0.29 0.54 -1.64 0.02 0.00 0.00 175.30 173.97 3ksw s MET 362 N -2.38 3.67 -0.63 3.54 -1.94 -1.06 -2.59 119.30 117.90 3ksw s MET 362 Ca 0.03 0.06 -0.10 0.00 -1.71 0.00 0.00 55.69 53.96 3ksw s MET 362 Cb -0.01 -2.66 0.16 0.00 2.01 0.00 0.00 34.83 34.34 3ksw s MET 362 CO -0.05 0.25 0.52 0.08 -0.01 0.00 0.00 175.02 175.81 3ksw s VAL 363 N -2.01 4.66 -0.04 -6.03 1.01 -1.05 -3.31 120.40 113.63 3ksw s VAL 363 Ca 0.44 -2.27 0.30 0.00 0.00 0.00 0.00 61.98 60.46 3ksw s VAL 363 Cb -0.11 -3.98 0.37 0.00 0.00 0.00 0.00 36.38 32.66 3ksw s VAL 363 CO 0.28 -0.89 1.87 0.11 0.00 0.00 0.00 175.10 176.47 3ksw h LYS 364 N 7.93 0.00 -3.22 2.72 1.79 -1.47 -1.83 116.57 122.50 3ksw h LYS 364 Ca -0.07 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.30 3ksw h LYS 364 Cb 1.04 0.00 -0.18 0.00 -1.58 0.00 0.00 32.23 31.50 3ksw h LYS 364 CO 0.81 0.02 -0.27 0.00 -1.08 0.00 0.00 179.45 178.93 3ksw s ALA 365 N -3.54 -0.69 0.47 3.86 0.00 -1.23 -4.85 121.76 115.79 3ksw s ALA 365 Ca 0.03 0.10 -0.23 0.00 0.00 0.00 0.00 51.96 51.85 3ksw s ALA 365 Cb 0.08 0.22 -0.09 0.00 0.00 0.00 0.00 23.12 23.33 3ksw s ALA 365 CO 0.58 -0.35 1.15 -1.91 0.00 0.00 0.00 175.76 175.24 3ksw n GLU 366 N 0.87 1.55 -4.09 0.00 2.13 -1.26 -4.82 120.64 115.01 3ksw n GLU 366 Ca -0.20 0.56 -0.15 0.00 0.66 0.00 0.00 57.16 58.04 3ksw n GLU 366 Cb 0.58 -2.27 -0.14 0.00 0.27 0.00 0.00 31.44 29.88 3ksw n GLU 366 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 3ksw s VAL 367 N -1.29 0.36 0.05 6.31 -7.23 -1.14 -5.02 120.40 112.45 3ksw s VAL 367 Ca 0.65 -0.36 -0.23 0.00 -1.81 0.00 0.00 61.98 60.23 3ksw s VAL 367 Cb -0.49 -0.34 -0.06 0.00 0.56 0.00 0.00 36.38 36.04 3ksw s VAL 367 CO 0.55 -0.01 0.69 -0.54 -0.31 0.00 0.00 175.10 175.48 3ksw s LYS 368 N -0.41 4.42 -0.08 4.82 1.02 -1.26 -2.15 119.74 126.10 3ksw s LYS 368 Ca -0.01 0.94 -0.02 0.00 0.02 0.00 0.00 55.97 56.90 3ksw s LYS 368 Cb -0.03 -3.33 0.03 0.00 -0.52 0.00 0.00 37.83 33.98 3ksw s LYS 368 CO -0.00 0.39 0.03 0.08 -0.92 0.00 0.00 175.35 174.93 3ksw s VAL 369 N -0.37 0.18 0.00 3.17 1.01 -0.49 -4.98 120.40 118.93 3ksw s VAL 369 Ca 0.35 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.49 3ksw s VAL 369 Cb -0.20 -0.44 0.00 0.00 0.00 0.00 0.00 36.38 35.74 3ksw s VAL 369 CO 0.21 0.16 0.00 0.61 0.00 0.00 0.00 175.10 176.08 3ksw n GLY 370 N 5.20 1.90 0.56 4.51 0.00 -1.26 0.05 105.19 116.15 3ksw n GLY 370 Ca -0.06 0.42 0.07 0.00 0.00 0.00 0.00 46.02 46.45 3ksw n GLY 370 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ksw n SER 371 N 9.07 3.12 -4.28 1.61 3.41 -1.26 -5.02 113.62 120.27 3ksw n SER 371 Ca 0.00 -2.67 -0.18 0.00 -0.26 0.00 0.00 58.87 55.76 3ksw n SER 371 Cb 0.00 -0.38 -0.10 0.00 -0.26 0.00 0.00 64.21 63.47 3ksw n SER 371 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3ksw s TYR 372 N -2.18 1.63 0.08 7.33 1.51 0.11 -4.77 117.35 121.05 3ksw s TYR 372 Ca 0.31 -1.18 0.02 0.00 -1.01 0.00 0.00 57.07 55.21 3ksw s TYR 372 Cb 0.24 -0.97 -0.03 0.00 -0.11 0.00 0.00 41.96 41.08 3ksw s TYR 372 CO 0.08 -0.30 -0.08 0.08 -1.11 0.00 0.00 175.55 174.22 3ksw s VAL 373 N -3.63 0.69 -0.16 0.71 1.01 0.51 -1.39 120.40 118.14 3ksw s VAL 373 Ca 0.37 -1.53 -0.00 0.00 0.00 0.00 0.00 61.98 60.81 3ksw s VAL 373 Cb 0.07 -1.19 -0.00 0.00 0.00 0.00 0.00 36.38 35.26 3ksw s VAL 373 CO 0.15 -0.61 -0.14 -0.69 0.00 0.00 0.00 175.10 173.81 3ksw s VAL 374 N -2.48 2.80 1.48 2.92 1.01 -0.91 -4.30 120.40 120.91 3ksw s VAL 374 Ca 0.02 -0.72 -0.25 0.00 0.00 0.00 0.00 61.98 61.03 3ksw s VAL 374 Cb -0.03 -2.19 0.38 0.00 0.00 0.00 0.00 36.38 34.55 3ksw s VAL 374 CO -0.02 0.51 0.90 -2.84 0.00 0.00 0.00 175.10 173.65 3ksw s PRO 375 N 0.81 -3.40 0.07 2.72 0.02 -1.26 -2.89 135.00 131.07 3ksw s PRO 375 Ca -0.05 0.07 -0.09 0.00 0.02 0.00 0.00 61.00 60.95 3ksw s PRO 375 Cb -0.15 -1.33 -0.06 0.00 0.02 0.00 0.00 34.50 32.98 3ksw s PRO 375 CO 0.00 -5.17 0.38 0.21 -0.33 0.00 0.00 177.00 172.10 3ksw s LYS 376 N -5.12 3.74 0.00 5.54 2.20 -1.26 -4.28 119.74 120.56 3ksw s LYS 376 Ca 0.68 0.14 0.00 0.00 -0.36 0.00 0.00 55.97 56.44 3ksw s LYS 376 Cb -0.12 -3.01 0.00 0.00 -1.51 0.00 0.00 37.83 33.19 3ksw s LYS 376 CO 0.57 0.57 0.00 0.41 -0.36 0.00 0.00 175.35 176.54 3ksw n GLY 377 N 0.94 0.77 3.98 5.54 0.00 -0.69 -5.05 105.19 110.68 3ksw n GLY 377 Ca -0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 3ksw n GLY 377 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ksw s ASP 378 N -2.38 5.11 -0.18 1.61 1.01 -1.26 -4.88 116.67 115.69 3ksw s ASP 378 Ca 0.00 -0.15 -0.02 0.00 0.71 0.00 0.00 52.55 53.10 3ksw s ASP 378 Cb 0.00 -0.63 -0.00 0.00 1.01 0.00 0.00 42.92 43.29 3ksw s ASP 378 CO 0.00 -1.27 -0.11 -0.63 0.21 0.00 0.00 175.17 173.37 3ksw s ILE 379 N -2.81 2.99 0.05 0.77 1.01 -1.24 -2.52 121.20 119.46 3ksw s ILE 379 Ca 0.59 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.66 3ksw s ILE 379 Cb -0.09 -2.31 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 3ksw s ILE 379 CO 0.39 0.48 -0.12 -0.51 0.00 0.00 0.00 174.94 175.19 3ksw s ILE 380 N 1.05 3.27 0.02 2.92 2.07 -1.07 0.91 121.20 130.36 3ksw s ILE 380 Ca -0.00 -1.07 -0.03 0.00 -1.41 0.00 0.00 60.65 58.14 3ksw s ILE 380 Cb -0.15 -2.44 -0.01 0.00 0.13 0.00 0.00 42.46 39.99 3ksw s ILE 380 CO -0.02 0.29 0.04 0.00 -1.91 0.00 0.00 174.94 173.33 3ksw s ALA 381 N -1.04 -0.03 -0.06 1.50 0.00 0.32 -2.38 121.76 120.07 3ksw s ALA 381 Ca 0.18 -0.47 0.03 0.00 0.00 0.00 0.00 51.96 51.70 3ksw s ALA 381 Cb -0.11 0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.17 3ksw s ALA 381 CO 0.09 -0.20 -0.14 0.00 0.00 0.00 0.00 175.76 175.50 3ksw s SER 383 N 0.48 4.66 0.28 0.00 0.15 -1.26 -2.64 113.70 115.36 3ksw s SER 383 Ca -0.12 -0.93 -0.03 0.00 0.70 0.00 0.00 55.95 55.57 3ksw s SER 383 Cb -0.15 -1.73 0.39 0.00 -1.71 0.00 0.00 66.02 62.82 3ksw s SER 383 CO 0.04 -0.18 1.93 -0.65 1.20 0.00 0.00 173.24 175.58 3ksw h PRO 384 N 8.07 1.16 -0.46 5.44 0.11 -1.86 -2.22 132.00 142.25 3ksw h PRO 384 Ca -0.30 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 3ksw h PRO 384 Cb 1.10 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 3ksw h PRO 384 CO 0.57 0.77 0.26 1.25 -0.21 0.00 0.00 178.00 180.64 3ksw h LEU 385 N 1.20 0.57 -0.14 2.35 5.85 -1.83 -1.98 115.31 121.32 3ksw h LEU 385 Ca 0.37 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.94 3ksw h LEU 385 Cb -0.02 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 40.87 3ksw h LEU 385 CO -0.11 0.48 -0.17 0.25 -0.34 0.00 0.00 178.44 178.55 3ksw h LEU 386 N 0.61 0.40 -0.98 2.25 5.85 -1.87 -3.30 115.31 118.27 3ksw h LEU 386 Ca 0.16 -0.50 -0.03 0.00 0.84 0.00 0.00 57.88 58.35 3ksw h LEU 386 Cb 0.03 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 3ksw h LEU 386 CO -0.03 0.82 0.37 0.28 -0.34 0.00 0.00 178.44 179.55 3ksw h SER 387 N -0.01 0.99 0.24 1.25 0.02 -1.36 -2.08 113.55 112.61 3ksw h SER 387 Ca 0.02 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3ksw h SER 387 Cb 0.72 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.01 3ksw h SER 387 CO 0.04 0.84 0.00 1.41 -1.14 0.00 0.00 176.83 177.98 3ksw n HIS 388 N -4.32 0.00 -0.38 3.45 8.25 -0.75 -2.36 115.22 119.11 3ksw n HIS 388 Ca 0.07 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.58 3ksw n HIS 388 Cb 0.14 -0.31 0.09 0.00 1.12 0.00 0.00 29.99 31.03 3ksw n HIS 388 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3ksw n HIS 389 N -1.31 0.20 -2.53 4.41 -0.00 -0.78 -4.82 115.22 110.39 3ksw n HIS 389 Ca 0.05 -0.65 -0.42 0.00 -0.00 0.00 0.00 57.72 56.70 3ksw n HIS 389 Cb 0.10 -0.10 -0.03 0.00 -0.00 0.00 0.00 29.99 29.96 3ksw n HIS 389 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 3ksw s ASP 390 N -1.52 7.19 0.44 0.41 -1.08 -1.00 -4.85 116.67 116.27 3ksw s ASP 390 Ca 0.17 1.89 0.11 0.00 -0.52 0.00 0.00 52.55 54.20 3ksw s ASP 390 Cb 0.12 -2.58 0.97 0.00 -1.46 0.00 0.00 42.92 39.98 3ksw s ASP 390 CO 0.05 -0.39 2.03 -0.08 0.52 0.00 0.00 175.17 177.30 3ksw h GLU 391 N 6.77 0.23 -0.43 4.34 4.57 -1.92 -2.58 114.58 125.56 3ksw h GLU 391 Ca -0.41 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 57.67 3ksw h GLU 391 Cb 1.22 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.75 3ksw h GLU 391 CO 0.79 0.24 -0.01 1.49 -1.18 0.00 0.00 179.01 180.34 3ksw h GLU 392 N 0.23 0.77 0.10 1.92 4.81 -1.94 -3.27 114.58 117.21 3ksw h GLU 392 Ca 0.06 -0.25 -0.30 0.00 -0.13 0.00 0.00 59.36 58.74 3ksw h GLU 392 Cb 0.13 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 3ksw h GLU 392 CO 0.00 0.85 -1.51 0.00 -0.73 0.00 0.00 179.01 177.62 3ksw h ALA 393 N 0.90 0.33 -3.25 2.92 0.00 -1.91 -3.43 119.26 114.81 3ksw h ALA 393 Ca 0.12 -1.13 -0.54 0.00 0.00 0.00 0.00 54.91 53.37 3ksw h ALA 393 Cb 0.50 0.27 -0.36 0.00 0.00 0.00 0.00 17.79 18.20 3ksw h ALA 393 CO 0.02 1.19 -0.81 -0.06 0.00 0.00 0.00 179.25 179.59 3ksw s PHE 394 N -2.62 1.60 0.18 0.00 0.40 -0.98 -2.59 117.98 113.96 3ksw s PHE 394 Ca -0.08 -0.75 -0.12 0.00 -0.60 0.00 0.00 56.93 55.38 3ksw s PHE 394 Cb 0.07 -1.24 0.08 0.00 0.51 0.00 0.00 43.02 42.44 3ksw s PHE 394 CO 0.85 -0.46 1.76 -1.35 0.70 0.00 0.00 175.22 176.72 3ksw h PRO 395 N 7.73 0.86 -3.58 0.24 0.11 -1.85 -3.37 132.00 132.14 3ksw h PRO 395 Ca -0.31 -0.12 -0.58 0.00 0.11 0.00 0.00 66.00 65.09 3ksw h PRO 395 Cb 1.15 -0.16 -0.40 0.00 0.11 0.00 0.00 31.00 31.71 3ksw h PRO 395 CO 0.45 0.69 -0.76 1.21 -0.21 0.00 0.00 178.00 179.38 3ksw s ASN 396 N -5.99 4.04 0.42 -2.05 3.84 -1.26 -4.92 114.94 109.02 3ksw s ASN 396 Ca -0.13 -1.64 0.08 0.00 0.21 0.00 0.00 52.86 51.38 3ksw s ASN 396 Cb 0.13 -0.88 0.89 0.00 -0.55 0.00 0.00 41.25 40.84 3ksw s ASN 396 CO 0.78 -0.41 2.05 -0.65 -2.79 0.00 0.00 177.10 176.08 3ksw h PRO 397 N 8.08 0.51 0.00 0.43 0.11 -1.88 -2.80 132.00 136.45 3ksw h PRO 397 Ca -0.13 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3ksw h PRO 397 Cb 1.02 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3ksw h PRO 397 CO 0.47 0.34 -0.50 -2.13 -0.21 0.00 0.00 178.00 175.97 3ksw n ARG 398 N -4.48 0.13 -2.81 1.05 3.00 -1.26 -4.88 116.66 107.42 3ksw n ARG 398 Ca 0.04 0.04 -0.32 0.00 -0.00 0.00 0.00 57.85 57.61 3ksw n ARG 398 Cb 0.10 -1.59 -0.05 0.00 0.00 0.00 0.00 32.46 30.92 3ksw n ARG 398 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 3ksw s LEU 399 N -3.57 3.88 -0.40 6.15 1.98 -1.06 -5.05 118.68 120.61 3ksw s LEU 399 Ca 0.09 1.45 -0.05 0.00 -2.89 0.00 0.00 54.13 52.73 3ksw s LEU 399 Cb 0.16 -4.31 0.09 0.00 0.66 0.00 0.00 46.19 42.79 3ksw s LEU 399 CO 0.69 -0.38 0.20 0.86 -1.89 0.00 0.00 176.35 175.83 3ksw s TRP 400 N -2.27 3.45 -0.06 5.38 -0.00 -1.26 -5.02 118.94 119.15 3ksw s TRP 400 Ca 0.57 -2.01 -0.02 0.00 -0.00 0.00 0.00 56.10 54.65 3ksw s TRP 400 Cb -0.10 -2.99 0.03 0.00 -0.00 0.00 0.00 33.47 30.41 3ksw s TRP 400 CO 0.22 -0.91 0.03 0.34 -0.00 0.00 0.00 176.95 176.63 3ksw s ASP 401 N 1.90 1.35 0.31 5.86 -1.08 -1.26 -5.03 116.67 118.72 3ksw s ASP 401 Ca 0.04 -0.01 0.25 0.00 -0.52 0.00 0.00 52.55 52.31 3ksw s ASP 401 Cb -0.23 -0.31 0.68 0.00 -1.46 0.00 0.00 42.92 41.60 3ksw s ASP 401 CO -0.01 -0.21 1.72 1.55 0.52 0.00 0.00 175.17 178.73 3ksw h PRO 402 N 8.33 0.00 -0.57 4.34 0.13 -1.96 -3.23 132.00 139.04 3ksw h PRO 402 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 3ksw h PRO 402 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3ksw h PRO 402 CO 0.22 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.38 3ksw n GLU 403 N -2.59 2.51 -2.36 0.86 1.02 -1.26 -4.83 120.64 113.99 3ksw n GLU 403 Ca 0.05 -2.33 -0.33 0.00 -0.02 0.00 0.00 57.16 54.53 3ksw n GLU 403 Cb 0.45 -1.52 -0.02 0.00 -0.02 0.00 0.00 31.44 30.33 3ksw n GLU 403 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 3ksw s ARG 404 N -1.25 3.75 0.04 3.49 1.70 -1.22 -5.08 118.95 120.38 3ksw s ARG 404 Ca 0.43 1.13 0.05 0.00 -0.47 0.00 0.00 55.73 56.87 3ksw s ARG 404 Cb 0.23 -2.10 -0.02 0.00 -0.57 0.00 0.00 34.95 32.49 3ksw s ARG 404 CO 0.31 -0.45 -0.14 -0.51 -1.08 0.00 0.00 175.30 173.43 3ksw s ASP 405 N -2.68 1.70 0.32 -2.89 1.11 -1.26 -5.12 116.67 107.85 3ksw s ASP 405 Ca 0.62 -0.47 -0.29 0.00 0.18 0.00 0.00 52.55 52.59 3ksw s ASP 405 Cb -0.13 -0.11 -0.10 0.00 1.07 0.00 0.00 42.92 43.65 3ksw s ASP 405 CO 0.29 0.03 1.40 -1.83 1.18 0.00 0.00 175.17 176.24 3ksw s GLU 406 N -1.19 4.26 0.14 8.23 -1.05 -1.26 -4.92 118.70 122.91 3ksw s GLU 406 Ca 0.02 2.35 0.24 0.00 -0.15 0.00 0.00 54.97 57.42 3ksw s GLU 406 Cb -0.08 -3.05 0.26 0.00 -0.44 0.00 0.00 34.13 30.82 3ksw s GLU 406 CO 0.01 -0.36 1.26 0.87 0.95 0.00 0.00 175.26 177.99 3ksw h LYS 407 N 3.77 0.00 -4.89 -4.83 1.79 -1.77 -3.44 116.57 107.20 3ksw h LYS 407 Ca -0.49 0.00 -0.61 0.00 -2.18 0.00 0.00 60.65 57.37 3ksw h LYS 407 Cb 1.23 0.00 -0.34 0.00 -1.58 0.00 0.00 32.23 31.53 3ksw h LYS 407 CO 0.69 0.00 -0.85 0.08 -1.08 0.00 0.00 179.45 178.29 3ksw s VAL 408 N -3.21 1.67 0.01 0.50 1.01 -1.26 -4.99 120.40 114.12 3ksw s VAL 408 Ca 0.05 -0.75 -0.30 0.00 0.00 0.00 0.00 61.98 60.98 3ksw s VAL 408 Cb 0.12 -1.50 -0.06 0.00 0.00 0.00 0.00 36.38 34.94 3ksw s VAL 408 CO 0.74 0.47 1.51 -1.81 0.00 0.00 0.00 175.10 176.02 3ksw s ASP 409 N 0.90 6.75 0.00 3.32 1.01 -1.26 -2.92 116.67 124.47 3ksw s ASP 409 Ca -0.08 2.24 0.00 0.00 0.71 0.00 0.00 52.55 55.43 3ksw s ASP 409 Cb -0.15 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.22 3ksw s ASP 409 CO -0.01 -0.80 0.00 0.61 0.21 0.00 0.00 175.17 175.18 3ksw n GLY 410 N 3.82 0.93 0.17 0.21 0.00 -1.26 -4.99 105.19 104.08 3ksw n GLY 410 Ca 0.15 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 3ksw n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ksw h ALA 411 N 0.00 0.35 0.34 4.61 0.00 -1.83 -3.41 119.26 119.33 3ksw h ALA 411 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 3ksw h ALA 411 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3ksw h ALA 411 CO 0.00 0.22 -0.17 0.35 0.00 0.00 0.00 179.25 179.66 3ksw h PHE 412 N 0.25 -0.43 -4.21 0.00 3.57 -1.95 -3.45 116.94 110.72 3ksw h PHE 412 Ca 0.06 -0.01 -0.21 0.00 3.53 0.00 0.00 57.97 61.34 3ksw h PHE 412 Cb 0.63 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.50 3ksw h PHE 412 CO 0.06 -0.12 -0.28 0.44 -2.23 0.00 0.00 178.31 176.19 3ksw n ILE 413 N -5.18 -0.51 -0.14 1.41 -5.35 -1.26 -4.80 119.36 103.54 3ksw n ILE 413 Ca -0.10 0.00 -0.09 0.00 -0.27 0.00 0.00 62.75 62.29 3ksw n ILE 413 Cb 0.26 -1.41 0.06 0.00 -1.74 0.00 0.00 39.64 36.81 3ksw n ILE 413 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3ksw h GLY 414 N -0.09 0.98 -2.44 3.28 0.00 -1.97 -2.70 103.07 100.14 3ksw h GLY 414 Ca -0.25 -0.80 0.00 0.00 0.00 0.00 0.00 47.33 46.28 3ksw h GLY 414 CO 0.29 0.73 0.00 0.69 0.00 0.00 0.00 176.54 178.25 3ksw n PHE 415 N -4.14 1.09 -2.97 5.60 3.01 -1.26 -5.03 117.46 113.76 3ksw n PHE 415 Ca 0.01 -0.45 0.00 0.00 1.01 0.00 0.00 57.45 58.02 3ksw n PHE 415 Cb 0.41 -0.16 0.00 0.00 -0.01 0.00 0.00 39.48 39.72 3ksw n PHE 415 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3ksw n GLY 416 N 1.06 -1.85 3.82 1.37 0.00 -1.02 -2.81 105.19 105.75 3ksw n GLY 416 Ca 0.20 -1.55 -0.05 0.00 0.00 0.00 0.00 46.02 44.62 3ksw n GLY 416 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ksw s ALA 417 N -1.26 -1.41 0.00 4.61 0.00 -1.14 -4.59 121.76 117.97 3ksw s ALA 417 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.71 3ksw s ALA 417 Cb 0.00 0.71 0.00 0.00 0.00 0.00 0.00 23.12 23.83 3ksw s ALA 417 CO 0.00 -1.04 0.00 0.41 0.00 0.00 0.00 175.76 175.13 3ksw n GLY 418 N -0.56 3.07 0.18 0.00 0.00 -1.26 -2.73 105.19 103.89 3ksw n GLY 418 Ca -0.05 -0.17 -0.04 0.00 0.00 0.00 0.00 46.02 45.75 3ksw n GLY 418 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3ksw h VAL 419 N 0.00 1.36 -3.24 1.61 -1.51 -1.85 -3.35 116.25 109.27 3ksw h VAL 419 Ca 0.00 -1.82 -0.75 0.00 -1.23 0.00 0.00 66.70 62.90 3ksw h VAL 419 Cb 0.00 1.89 -0.27 0.00 -2.13 0.00 0.00 31.29 30.78 3ksw h VAL 419 CO 0.00 0.54 -0.27 -1.00 -1.23 0.00 0.00 177.57 175.61 3ksw s HIS 420 N -3.89 3.36 -0.07 5.19 0.09 -1.10 -5.04 115.29 113.83 3ksw s HIS 420 Ca -0.04 -1.62 0.05 0.00 -0.00 0.00 0.00 55.06 53.45 3ksw s HIS 420 Cb 0.12 -3.66 -0.01 0.00 -0.00 0.00 0.00 32.58 29.04 3ksw s HIS 420 CO 0.79 -1.00 -0.25 0.15 -0.00 0.00 0.00 174.74 174.43 3ksw s LYS 421 N 1.37 2.69 0.54 1.40 1.02 -1.25 -2.89 119.74 122.61 3ksw s LYS 421 Ca 0.05 -0.89 -0.20 0.00 0.02 0.00 0.00 55.97 54.95 3ksw s LYS 421 Cb -0.27 -2.19 -0.07 0.00 -0.52 0.00 0.00 37.83 34.78 3ksw s LYS 421 CO 0.00 0.32 0.98 0.00 -0.92 0.00 0.00 175.35 175.74 3ksw n ILE 423 N -1.31 1.38 1.78 0.00 5.41 -1.26 -4.42 119.36 120.95 3ksw n ILE 423 Ca 0.12 -0.64 0.11 0.00 1.00 0.00 0.00 62.75 63.33 3ksw n ILE 423 Cb 0.45 -1.05 0.63 0.00 -0.71 0.00 0.00 39.64 38.95 3ksw n ILE 423 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3ksw n GLY 424 N 2.14 -0.89 0.36 7.39 0.00 -1.26 -4.29 105.19 108.64 3ksw n GLY 424 Ca -0.39 -0.13 -0.10 0.00 0.00 0.00 0.00 46.02 45.39 3ksw n GLY 424 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3ksw h GLN 425 N 0.00 -0.21 -0.87 1.61 4.15 -1.99 0.15 115.11 117.95 3ksw h GLN 425 Ca 0.00 0.01 0.08 0.00 0.77 0.00 0.00 58.65 59.52 3ksw h GLN 425 Cb 0.00 0.05 -0.07 0.00 0.21 0.00 0.00 27.48 27.67 3ksw h GLN 425 CO 0.00 -0.14 0.53 0.87 -1.93 0.00 0.00 178.83 178.15 3ksw h LYS 426 N -0.22 0.89 -0.04 1.69 1.79 -1.94 -2.52 116.57 116.22 3ksw h LYS 426 Ca 0.08 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.49 3ksw h LYS 426 Cb 0.43 -0.20 -0.00 0.00 -1.58 0.00 0.00 32.23 30.88 3ksw h LYS 426 CO -0.57 0.59 -0.02 0.35 -1.08 0.00 0.00 179.45 178.72 3ksw h PHE 427 N 0.91 0.09 -1.00 -1.35 3.57 -1.56 -2.89 116.94 114.72 3ksw h PHE 427 Ca 0.40 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.94 3ksw h PHE 427 Cb 0.28 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 38.93 3ksw h PHE 427 CO -0.04 0.48 0.65 0.00 -2.23 0.00 0.00 178.31 177.17 3ksw h ALA 428 N 0.60 1.40 0.10 2.41 0.00 -0.62 -2.45 119.26 120.70 3ksw h ALA 428 Ca 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ksw h ALA 428 Cb 0.45 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3ksw h ALA 428 CO 0.01 0.46 -0.05 -0.07 0.00 0.00 0.00 179.25 179.60 3ksw h LEU 429 N 1.19 -0.12 -1.06 0.00 3.38 -1.47 -1.02 115.31 116.22 3ksw h LEU 429 Ca 0.42 -0.27 0.12 0.00 0.09 0.00 0.00 57.88 58.25 3ksw h LEU 429 Cb 0.13 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.83 3ksw h LEU 429 CO -0.16 0.21 0.62 0.25 0.09 0.00 0.00 178.44 179.45 3ksw h LEU 430 N -0.45 0.89 -0.11 1.67 6.46 -1.34 0.22 115.31 122.66 3ksw h LEU 430 Ca -0.01 0.04 -0.04 0.00 -0.12 0.00 0.00 57.88 57.75 3ksw h LEU 430 Cb 0.37 -0.13 -0.00 0.00 -0.73 0.00 0.00 40.66 40.17 3ksw h LEU 430 CO 0.02 0.48 -0.10 -0.61 -0.62 0.00 0.00 178.44 177.61 3ksw h GLN 431 N 0.96 0.26 -0.83 1.25 4.15 -1.36 -2.79 115.11 116.74 3ksw h GLN 431 Ca 0.48 -0.13 -0.03 0.00 0.77 0.00 0.00 58.65 59.74 3ksw h GLN 431 Cb 0.51 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.16 3ksw h GLN 431 CO -0.25 0.66 0.42 0.28 -1.93 0.00 0.00 178.83 178.02 3ksw h VAL 432 N -0.14 1.25 -0.63 2.39 2.07 -0.51 -2.76 116.25 117.92 3ksw h VAL 432 Ca 0.02 -0.68 -0.08 0.00 0.82 0.00 0.00 66.70 66.78 3ksw h VAL 432 Cb 0.61 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 3ksw h VAL 432 CO 0.03 0.30 0.10 0.11 0.02 0.00 0.00 177.57 178.12 3ksw h LYS 433 N 1.18 1.05 -0.29 1.57 1.57 -1.01 -2.93 116.57 117.71 3ksw h LYS 433 Ca 0.29 -0.28 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 3ksw h LYS 433 Cb 0.08 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 3ksw h LYS 433 CO -0.04 0.98 -0.13 1.15 -0.57 0.00 0.00 179.45 180.84 3ksw h THR 434 N 0.96 1.23 0.14 -0.16 2.02 -1.25 -2.51 112.91 113.35 3ksw h THR 434 Ca 0.19 -1.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.34 3ksw h THR 434 Cb 0.44 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 3ksw h THR 434 CO 0.01 0.33 -0.07 0.40 0.37 0.00 0.00 175.52 176.57 3ksw h ILE 435 N 0.45 1.00 -0.53 3.11 2.04 -1.38 -2.43 117.51 119.78 3ksw h ILE 435 Ca 0.08 -0.73 0.10 0.00 1.00 0.00 0.00 64.86 65.31 3ksw h ILE 435 Cb 0.50 1.45 -0.09 0.00 -0.74 0.00 0.00 36.82 37.94 3ksw h ILE 435 CO 0.03 0.17 -0.00 -0.07 0.00 0.00 0.00 178.15 178.27 3ksw h LEU 436 N -0.55 -0.24 -0.96 1.44 3.38 -1.43 -1.86 115.31 115.08 3ksw h LEU 436 Ca -0.02 0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.13 3ksw h LEU 436 Cb 0.43 0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.35 3ksw h LEU 436 CO 0.03 -0.08 0.62 0.00 0.09 0.00 0.00 178.44 179.10 3ksw h ALA 437 N 1.47 1.30 0.00 1.53 0.00 -1.39 -2.40 119.26 119.77 3ksw h ALA 437 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3ksw h ALA 437 Cb 0.41 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3ksw h ALA 437 CO -0.45 0.46 -0.04 2.41 0.00 0.00 0.00 179.25 181.63 3ksw n THR 438 N -4.50 0.24 -0.11 0.00 -1.04 -0.75 -3.77 114.28 104.35 3ksw n THR 438 Ca 0.13 -0.12 -0.24 0.00 -2.04 0.00 0.00 64.05 61.79 3ksw n THR 438 Cb 0.13 -0.49 -0.11 0.00 -1.82 0.00 0.00 70.33 68.04 3ksw n THR 438 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3ksw n ALA 439 N -1.62 1.19 0.26 2.41 0.00 -0.92 -4.39 120.51 117.43 3ksw n ALA 439 Ca 0.06 -0.96 0.14 0.00 0.00 0.00 0.00 53.44 52.69 3ksw n ALA 439 Cb 0.38 -0.15 0.71 0.00 0.00 0.00 0.00 19.45 20.39 3ksw n ALA 439 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3ksw h PHE 440 N -0.51 0.00 0.00 0.00 0.04 -1.65 -1.91 116.94 112.91 3ksw h PHE 440 Ca -0.58 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.17 3ksw h PHE 440 Cb 1.73 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.88 3ksw h PHE 440 CO -0.00 0.11 -0.08 -0.09 -0.60 0.00 0.00 178.31 177.65 3ksw h ARG 441 N 0.00 0.00 0.00 1.51 2.43 -1.77 -3.35 114.38 113.21 3ksw h ARG 441 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3ksw h ARG 441 Cb 0.44 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 3ksw h ARG 441 CO 0.01 0.08 -0.98 0.39 -1.51 0.00 0.00 179.97 177.97 3ksw n GLU 442 N -3.40 3.51 -4.40 0.20 1.02 -0.92 -5.00 120.64 111.65 3ksw n GLU 442 Ca -0.01 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.88 3ksw n GLU 442 Cb 0.24 -0.99 -0.10 0.00 -0.02 0.00 0.00 31.44 30.57 3ksw n GLU 442 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3ksw s TYR 443 N -1.98 2.42 -0.10 -0.32 1.51 -0.77 -2.71 117.35 115.41 3ksw s TYR 443 Ca 0.00 -0.30 0.01 0.00 -1.01 0.00 0.00 57.07 55.77 3ksw s TYR 443 Cb 0.00 -1.12 0.02 0.00 -0.11 0.00 0.00 41.96 40.75 3ksw s TYR 443 CO 0.00 0.61 -0.11 -0.51 -1.11 0.00 0.00 175.55 174.43 3ksw s ASP 444 N -3.20 2.13 0.24 2.29 1.01 -1.21 -4.51 116.67 113.42 3ksw s ASP 444 Ca 0.27 -0.34 0.06 0.00 0.71 0.00 0.00 52.55 53.25 3ksw s ASP 444 Cb -0.07 -0.90 -0.03 0.00 1.01 0.00 0.00 42.92 42.93 3ksw s ASP 444 CO 0.14 -0.04 0.28 -0.36 0.21 0.00 0.00 175.17 175.41 3ksw s PHE 445 N 1.24 3.31 -0.11 4.23 0.40 -1.26 -1.00 117.98 124.79 3ksw s PHE 445 Ca -0.03 -0.05 -0.05 0.00 -0.60 0.00 0.00 56.93 56.20 3ksw s PHE 445 Cb -0.14 -1.51 0.05 0.00 0.51 0.00 0.00 43.02 41.93 3ksw s PHE 445 CO -0.04 0.48 0.25 -1.14 0.70 0.00 0.00 175.22 175.48 3ksw s GLN 446 N -3.86 0.21 0.11 0.44 0.74 -0.65 -4.98 119.66 111.67 3ksw s GLN 446 Ca 0.33 0.56 -0.27 0.00 0.05 0.00 0.00 55.36 56.04 3ksw s GLN 446 Cb -0.09 -0.11 -0.06 0.00 1.10 0.00 0.00 33.01 33.85 3ksw s GLN 446 CO 0.27 -0.17 0.83 -1.17 -0.55 0.00 0.00 175.29 174.50 3ksw s LEU 447 N 1.37 4.52 -0.04 3.68 0.20 -1.26 -2.19 118.68 124.96 3ksw s LEU 447 Ca -0.08 1.63 0.11 0.00 0.69 0.00 0.00 54.13 56.47 3ksw s LEU 447 Cb -0.10 -3.37 -0.23 0.00 -0.43 0.00 0.00 46.19 42.06 3ksw s LEU 447 CO -0.09 0.06 0.69 -0.07 -0.29 0.00 0.00 176.35 176.65 3ksw h LEU 448 N 5.17 0.04-10.35 -0.68 3.38 -1.95 -3.48 115.31 107.43 3ksw h LEU 448 Ca -0.45 -0.08 -0.48 0.00 0.09 0.00 0.00 57.88 56.97 3ksw h LEU 448 Cb 1.21 -0.01 0.14 0.00 0.09 0.00 0.00 40.66 42.09 3ksw h LEU 448 CO 0.70 1.07 0.26 -0.60 0.09 0.00 0.00 178.44 179.95 3ksw s ARG 449 N -2.60 1.26 0.10 1.13 3.52 -1.26 -4.99 118.95 116.11 3ksw s ARG 449 Ca -0.06 0.74 -0.17 0.00 -0.13 0.00 0.00 55.73 56.11 3ksw s ARG 449 Cb 0.08 -1.82 -0.05 0.00 -1.56 0.00 0.00 34.95 31.60 3ksw s ARG 449 CO 0.82 -2.22 1.59 -0.44 -0.81 0.00 0.00 175.30 174.24 3ksw h ASP 450 N -1.53 0.48 -5.25 -2.12 3.32 -1.99 -3.47 116.42 105.86 3ksw h ASP 450 Ca -0.50 -0.25 -0.08 0.00 0.02 0.00 0.00 57.03 56.22 3ksw h ASP 450 Cb 1.29 -0.13 -0.11 0.00 0.22 0.00 0.00 39.33 40.60 3ksw h ASP 450 CO 0.56 0.61 -0.22 -1.61 -1.72 0.00 0.00 179.24 176.85 3ksw s GLU 451 N -5.22 1.32 0.33 3.56 2.02 -1.26 -5.12 118.70 114.33 3ksw s GLU 451 Ca -0.13 -1.18 -0.29 0.00 0.02 0.00 0.00 54.97 53.39 3ksw s GLU 451 Cb 0.08 0.42 -0.12 0.00 0.10 0.00 0.00 34.13 34.62 3ksw s GLU 451 CO 0.75 -0.52 1.38 0.28 0.02 0.00 0.00 175.26 177.18 3ksw n VAL 452 N -0.29 1.72 -1.06 2.63 0.31 -1.26 -4.88 118.33 115.50 3ksw n VAL 452 Ca -0.05 -0.43 -0.34 0.00 -0.01 0.00 0.00 64.34 63.50 3ksw n VAL 452 Cb 0.63 -1.68 0.11 0.00 -0.91 0.00 0.00 33.84 31.98 3ksw n VAL 452 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3ksw n PRO 453 N 0.95 0.07 -3.44 5.55 -0.02 -1.26 -5.01 135.00 131.84 3ksw n PRO 453 Ca 0.06 0.08 -0.24 0.00 -2.02 0.00 0.00 63.50 61.37 3ksw n PRO 453 Cb 0.36 -2.04 -0.01 0.00 -0.02 0.00 0.00 33.50 31.79 3ksw n PRO 453 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ksw s ASP 454 N -1.86 6.31 0.60 2.55 1.01 -1.26 -4.91 116.67 119.11 3ksw s ASP 454 Ca 0.65 0.44 -0.16 0.00 0.71 0.00 0.00 52.55 54.19 3ksw s ASP 454 Cb -0.29 -2.03 -0.03 0.00 1.01 0.00 0.00 42.92 41.59 3ksw s ASP 454 CO 0.59 -0.26 1.06 -2.84 0.21 0.00 0.00 175.17 173.93 3ksw s PRO 455 N -4.18 3.27 -0.26 8.23 0.02 -1.26 -1.30 135.00 139.52 3ksw s PRO 455 Ca 0.40 1.22 0.02 0.00 0.02 0.00 0.00 61.00 62.65 3ksw s PRO 455 Cb -0.10 -2.02 0.07 0.00 0.02 0.00 0.00 34.50 32.47 3ksw s PRO 455 CO 0.35 -0.85 -0.05 0.34 -0.33 0.00 0.00 177.00 176.46 3ksw s ASP 456 N -2.78 4.10 0.00 2.53 2.15 -1.00 -4.68 116.67 117.00 3ksw s ASP 456 Ca 0.64 -1.37 0.14 0.00 0.43 0.00 0.00 52.55 52.39 3ksw s ASP 456 Cb -0.16 -1.30 0.53 0.00 -0.30 0.00 0.00 42.92 41.69 3ksw s ASP 456 CO 0.37 -0.25 1.38 -1.22 -0.17 0.00 0.00 175.17 175.29 3ksw n TYR 457 N 4.58 0.25 0.17 -5.34 4.02 -1.26 -4.33 117.16 115.26 3ksw n TYR 457 Ca -0.10 -0.13 -0.14 0.00 -0.01 0.00 0.00 57.90 57.52 3ksw n TYR 457 Cb 0.43 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.68 3ksw n TYR 457 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3ksw h HIS 458 N 1.56 -0.63 -3.96 -0.72 3.86 -1.94 -3.45 115.15 109.88 3ksw h HIS 458 Ca 0.00 0.00 -0.44 0.00 -1.16 0.00 0.00 60.37 58.77 3ksw h HIS 458 Cb 0.35 0.24 0.16 0.00 1.06 0.00 0.00 27.41 29.22 3ksw h HIS 458 CO 0.13 -0.35 0.34 0.95 0.86 0.00 0.00 177.93 179.85 3ksw s THR 459 N -6.08 1.90 -0.03 2.45 -4.23 -1.26 -5.02 115.64 103.37 3ksw s THR 459 Ca -0.16 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 60.37 3ksw s THR 459 Cb 0.06 -2.84 -0.25 0.00 1.34 0.00 0.00 72.50 70.81 3ksw s THR 459 CO 0.64 0.00 0.71 0.00 -0.54 0.00 0.00 174.62 175.43 3ksw h MET 460 N -1.83 0.16 -4.45 3.99 -0.00 -1.95 -3.42 114.93 107.43 3ksw h MET 460 Ca -0.45 -0.27 -0.72 0.00 -0.00 0.00 0.00 59.70 58.26 3ksw h MET 460 Cb 1.27 0.10 -0.25 0.00 -0.00 0.00 0.00 31.60 32.72 3ksw h MET 460 CO 0.41 0.93 -0.43 0.08 -0.00 0.00 0.00 176.91 177.90 3ksw s VAL 461 N -2.60 4.74 -0.25 -0.10 1.01 -1.26 -4.48 120.40 117.46 3ksw s VAL 461 Ca -0.10 -1.08 -0.19 0.00 0.00 0.00 0.00 61.98 60.61 3ksw s VAL 461 Cb 0.07 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 3ksw s VAL 461 CO 0.82 -0.44 0.59 -0.69 0.00 0.00 0.00 175.10 175.38 3ksw s VAL 462 N 1.55 5.02 0.24 2.92 1.01 -0.51 -5.04 120.40 125.61 3ksw s VAL 462 Ca 0.03 1.05 0.02 0.00 0.00 0.00 0.00 61.98 63.07 3ksw s VAL 462 Cb -0.22 -3.90 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 3ksw s VAL 462 CO 0.06 0.06 0.06 0.61 0.00 0.00 0.00 175.10 175.89 3ksw n GLY 463 N 4.19 3.68 3.74 4.51 0.00 -1.26 -4.30 105.19 115.75 3ksw n GLY 463 Ca -0.02 -2.10 -0.35 0.00 0.00 0.00 0.00 46.02 43.55 3ksw n GLY 463 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ksw s PRO 464 N -2.92 2.60 0.22 1.61 0.04 -1.26 -2.37 135.00 132.92 3ksw s PRO 464 Ca 0.08 1.75 -0.30 0.00 0.04 0.00 0.00 61.00 62.58 3ksw s PRO 464 Cb 0.00 -1.89 -0.09 0.00 0.04 0.00 0.00 34.50 32.56 3ksw s PRO 464 CO 0.06 -1.48 1.32 -0.08 0.04 0.00 0.00 177.00 176.86 3ksw s THR 465 N -1.84 3.09 0.15 1.26 -1.32 -0.42 -4.71 115.64 111.85 3ksw s THR 465 Ca 0.75 0.92 -0.13 0.00 -1.21 0.00 0.00 61.69 62.02 3ksw s THR 465 Cb -0.29 -3.59 0.02 0.00 -1.51 0.00 0.00 72.50 67.13 3ksw s THR 465 CO 0.39 0.15 1.63 0.25 -2.21 0.00 0.00 174.62 174.83 3ksw h LEU 466 N 5.12 0.77 0.00 9.08 5.85 -1.92 -3.18 115.31 131.02 3ksw h LEU 466 Ca -0.45 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.01 3ksw h LEU 466 Cb 1.22 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.04 3ksw h LEU 466 CO 0.76 0.83 0.00 0.59 -0.34 0.00 0.00 178.44 180.28 3ksw n ASN 467 N -4.43 0.00 -0.87 1.25 3.02 -1.26 -2.23 115.26 110.74 3ksw n ASN 467 Ca 0.01 0.09 0.10 0.00 -0.03 0.00 0.00 54.58 54.75 3ksw n ASN 467 Cb 0.25 -0.30 0.12 0.00 -0.61 0.00 0.00 39.78 39.24 3ksw n ASN 467 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ksw n GLN 468 N -1.30 1.97 0.00 3.52 6.02 -1.20 -4.58 117.38 121.81 3ksw n GLN 468 Ca 0.07 -1.85 0.13 0.00 -0.01 0.00 0.00 57.00 55.35 3ksw n GLN 468 Cb 0.13 -1.40 0.47 0.00 1.02 0.00 0.00 30.24 30.46 3ksw n GLN 468 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3ksw s LEU 470 N -2.44 4.37 0.03 0.00 1.02 -1.26 -3.67 118.68 116.73 3ksw s LEU 470 Ca 0.27 2.79 -0.01 0.00 0.02 0.00 0.00 54.13 57.20 3ksw s LEU 470 Cb 0.20 -3.60 -0.02 0.00 0.02 0.00 0.00 46.19 42.78 3ksw s LEU 470 CO 0.49 -0.92 -0.01 -0.69 0.02 0.00 0.00 176.35 175.24 3ksw s VAL 471 N 1.05 0.14 -0.15 -1.59 1.01 -0.92 -4.18 120.40 115.77 3ksw s VAL 471 Ca 0.72 -1.18 -0.02 0.00 0.00 0.00 0.00 61.98 61.50 3ksw s VAL 471 Cb -0.48 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 3ksw s VAL 471 CO 0.33 -0.65 -0.08 -0.75 0.00 0.00 0.00 175.10 173.95 3ksw s LYS 472 N -2.28 3.53 0.13 2.72 2.20 -0.93 -2.11 119.74 123.00 3ksw s LYS 472 Ca -0.08 -0.60 0.04 0.00 -0.36 0.00 0.00 55.97 54.97 3ksw s LYS 472 Cb -0.04 -2.79 -0.04 0.00 -1.51 0.00 0.00 37.83 33.45 3ksw s LYS 472 CO -0.04 0.20 0.10 1.52 -0.36 0.00 0.00 175.35 176.78 3ksw s TYR 473 N 0.43 3.14 0.12 4.03 -0.85 -0.89 -1.63 117.35 121.69 3ksw s TYR 473 Ca -0.07 0.01 0.01 0.00 -0.52 0.00 0.00 57.07 56.50 3ksw s TYR 473 Cb -0.15 -1.54 -0.00 0.00 0.38 0.00 0.00 41.96 40.65 3ksw s TYR 473 CO 0.04 0.52 0.02 2.41 -1.52 0.00 0.00 175.55 177.02 3ksw n THR 474 N -0.03 0.00 -3.73 -3.49 -1.04 -0.17 -3.35 114.28 102.47 3ksw n THR 474 Ca -0.09 -0.64 -0.12 0.00 -2.04 0.00 0.00 64.05 61.17 3ksw n THR 474 Cb 0.54 0.19 -0.12 0.00 -1.82 0.00 0.00 70.33 69.11 3ksw n THR 474 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 3ksw s ARG 475 N -2.44 0.28 0.36 -2.82 3.52 -1.26 -3.33 118.95 113.26 3ksw s ARG 475 Ca 0.03 0.56 -0.07 0.00 -0.13 0.00 0.00 55.73 56.12 3ksw s ARG 475 Cb 0.00 -0.02 -0.06 0.00 -1.56 0.00 0.00 34.95 33.31 3ksw s ARG 475 CO 0.02 -0.13 0.68 0.15 -0.81 0.00 0.00 175.30 175.21 3ksw s LYS 476 N 1.00 3.69 0.00 5.12 1.02 -1.10 -4.96 119.74 124.52 3ksw s LYS 476 Ca -0.07 0.24 0.00 0.00 0.02 0.00 0.00 55.97 56.16 3ksw s LYS 476 Cb -0.08 -2.50 0.00 0.00 -0.52 0.00 0.00 37.83 34.73 3ksw s LYS 476 CO -0.07 0.05 0.00 1.17 -0.92 0.00 0.00 175.35 175.58