#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k92 h LEU 17 N 0.00 -0.27 -0.15 1.20 6.46 -1.98 0.24 115.31 120.82 3k92 h LEU 17 Ca 0.00 0.17 0.04 0.00 -0.12 0.00 0.00 57.88 57.97 3k92 h LEU 17 Cb 0.00 0.29 -0.05 0.00 -0.73 0.00 0.00 40.66 40.17 3k92 h LEU 17 CO 0.00 -0.13 -0.14 0.15 -0.62 0.00 0.00 178.44 177.71 3k92 h PHE 18 N 0.13 -0.34 -0.07 1.25 -0.00 -1.95 0.18 116.94 116.14 3k92 h PHE 18 Ca 0.37 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 58.35 3k92 h PHE 18 Cb 0.62 0.17 -0.00 0.00 -0.00 0.00 0.00 35.95 36.74 3k92 h PHE 18 CO -0.37 -0.20 0.01 -0.07 -0.00 0.00 0.00 178.31 177.68 3k92 h LEU 19 N -0.16 0.10 -1.41 0.59 3.38 -1.89 0.07 115.31 115.99 3k92 h LEU 19 Ca 0.10 -0.24 0.19 0.00 0.09 0.00 0.00 57.88 58.02 3k92 h LEU 19 Cb 0.30 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.95 3k92 h LEU 19 CO -0.24 0.32 0.60 -1.28 0.09 0.00 0.00 178.44 177.93 3k92 h SER 20 N -0.12 0.50 -0.07 -0.43 0.87 -0.29 -1.71 113.55 112.30 3k92 h SER 20 Ca 0.02 0.05 -0.21 0.00 -1.23 0.00 0.00 61.79 60.42 3k92 h SER 20 Cb 0.26 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.18 3k92 h SER 20 CO 0.00 0.20 -0.74 0.74 -0.53 0.00 0.00 176.83 176.51 3k92 h THR 21 N 0.50 1.30 -0.30 2.23 2.02 -0.08 -2.76 112.91 115.81 3k92 h THR 21 Ca 0.48 -1.98 0.03 0.00 0.77 0.00 0.00 66.41 65.72 3k92 h THR 21 Cb 1.06 1.96 -0.03 0.00 -1.74 0.00 0.00 68.15 69.41 3k92 h THR 21 CO -0.21 0.62 0.12 1.56 0.37 0.00 0.00 175.52 177.98 3k92 h GLN 22 N 0.50 0.25 -0.28 6.66 4.20 -0.23 -2.48 115.11 123.72 3k92 h GLN 22 Ca -0.04 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 3k92 h GLN 22 Cb 1.35 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.06 3k92 h GLN 22 CO 0.15 0.17 0.18 1.15 -0.67 0.00 0.00 178.83 179.80 3k92 h THR 23 N 0.26 1.09 -0.96 -0.54 2.02 -1.37 -0.77 112.91 112.64 3k92 h THR 23 Ca 0.13 -0.21 0.12 0.00 0.77 0.00 0.00 66.41 67.23 3k92 h THR 23 Cb 0.09 0.72 -0.08 0.00 -1.74 0.00 0.00 68.15 67.14 3k92 h THR 23 CO -0.12 0.09 0.61 0.40 0.37 0.00 0.00 175.52 176.87 3k92 h ILE 24 N 0.37 0.91 -0.14 3.11 2.04 -1.33 -1.59 117.51 120.87 3k92 h ILE 24 Ca 0.10 -0.31 -0.21 0.00 1.00 0.00 0.00 64.86 65.44 3k92 h ILE 24 Cb -0.01 -0.08 0.01 0.00 -0.74 0.00 0.00 36.82 36.00 3k92 h ILE 24 CO -0.02 0.17 -0.72 0.40 0.00 0.00 0.00 178.15 177.97 3k92 h ILE 25 N 0.91 1.30 -0.61 -0.67 5.03 -1.00 -2.04 117.51 120.42 3k92 h ILE 25 Ca 0.47 -1.94 0.08 0.00 -0.12 0.00 0.00 64.86 63.35 3k92 h ILE 25 Cb 0.53 2.03 -0.06 0.00 -3.03 0.00 0.00 36.82 36.29 3k92 h ILE 25 CO -0.24 0.61 0.26 0.50 -0.68 0.00 0.00 178.15 178.61 3k92 h LYS 26 N 0.45 0.46 0.02 2.37 3.64 -0.94 -0.47 116.57 122.11 3k92 h LYS 26 Ca -0.05 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.30 3k92 h LYS 26 Cb 1.36 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 3k92 h LYS 26 CO 0.15 0.31 -0.01 1.49 -2.27 0.00 0.00 179.45 179.12 3k92 h GLU 27 N 0.48 -0.03 -0.50 1.90 4.57 -1.20 0.14 114.58 119.95 3k92 h GLU 27 Ca 0.30 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 58.55 3k92 h GLU 27 Cb 0.31 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.84 3k92 h GLU 27 CO -0.26 0.45 0.14 0.00 -1.18 0.00 0.00 179.01 178.16 3k92 h ALA 28 N 0.44 0.58 -0.50 2.92 0.00 -1.34 0.28 119.26 121.64 3k92 h ALA 28 Ca -0.00 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3k92 h ALA 28 Cb 0.49 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3k92 h ALA 28 CO 0.00 -0.27 0.11 -0.07 0.00 0.00 0.00 179.25 179.02 3k92 h LEU 29 N 0.29 0.77 -0.22 0.00 3.38 -1.03 -1.67 115.31 116.83 3k92 h LEU 29 Ca 0.24 -0.24 0.06 0.00 0.09 0.00 0.00 57.88 58.03 3k92 h LEU 29 Cb 0.30 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 3k92 h LEU 29 CO -0.29 0.81 -0.15 -0.09 0.09 0.00 0.00 178.44 178.81 3k92 h ARG 30 N 0.69 -0.14 -0.68 1.13 1.12 -0.13 -1.67 114.38 114.71 3k92 h ARG 30 Ca 0.15 0.01 -0.05 0.00 -1.11 0.00 0.00 59.98 58.98 3k92 h ARG 30 Cb 0.36 0.03 -0.03 0.00 -0.01 0.00 0.00 29.97 30.32 3k92 h ARG 30 CO 0.00 -0.09 0.22 -0.22 -3.11 0.00 0.00 179.97 176.78 3k92 h LYS 31 N -0.14 1.03 0.00 0.20 1.63 -0.29 -1.88 116.57 117.11 3k92 h LYS 31 Ca 0.13 -0.20 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 3k92 h LYS 31 Cb 0.33 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 31.80 3k92 h LYS 31 CO -0.31 0.87 0.00 1.28 -3.45 0.00 0.00 179.45 177.84 3k92 n LEU 32 N -4.27 0.37 0.00 5.20 4.32 -0.64 -4.85 117.00 117.13 3k92 n LEU 32 Ca 0.06 0.65 0.00 0.00 -0.02 0.00 0.00 56.01 56.69 3k92 n LEU 32 Cb 0.21 -0.66 0.00 0.00 -1.62 0.00 0.00 43.42 41.35 3k92 n LEU 32 CO 0.41 -0.68 0.00 0.61 -1.22 0.00 0.00 177.39 176.51 3k92 n GLY 33 N -0.95 1.00 3.82 -0.72 0.00 -0.71 -5.07 105.19 102.57 3k92 n GLY 33 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3k92 n GLY 33 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k92 s TYR 34 N -2.00 3.68 1.07 1.61 2.02 -0.66 -5.03 117.35 118.04 3k92 s TYR 34 Ca 0.00 1.26 -0.16 0.00 -0.37 0.00 0.00 57.07 57.80 3k92 s TYR 34 Cb 0.00 -2.52 0.22 0.00 -0.40 0.00 0.00 41.96 39.27 3k92 s TYR 34 CO 0.00 0.42 1.15 -1.25 -1.57 0.00 0.00 175.55 174.31 3k92 s PRO 35 N -1.77 -0.13 0.42 -1.71 0.04 -1.26 -4.41 135.00 126.18 3k92 s PRO 35 Ca 0.38 0.02 0.16 0.00 0.04 0.00 0.00 61.00 61.60 3k92 s PRO 35 Cb -0.17 -1.72 0.94 0.00 0.04 0.00 0.00 34.50 33.59 3k92 s PRO 35 CO 0.20 -3.00 1.92 0.78 0.04 0.00 0.00 177.00 176.94 3k92 h GLY 36 N -2.07 0.00 1.64 0.56 0.00 -1.98 -2.71 103.07 98.50 3k92 h GLY 36 Ca -0.47 0.00 0.03 0.00 0.00 0.00 0.00 47.33 46.88 3k92 h GLY 36 CO 0.44 0.00 0.18 1.29 0.00 0.00 0.00 176.54 178.46 3k92 h ASP 37 N 0.00 0.22 -0.39 0.19 -0.00 -1.99 -0.86 116.42 113.59 3k92 h ASP 37 Ca -0.00 -0.00 -0.11 0.00 -0.00 0.00 0.00 57.03 56.91 3k92 h ASP 37 Cb 0.50 -0.05 -0.02 0.00 -0.00 0.00 0.00 39.33 39.76 3k92 h ASP 37 CO 0.03 0.15 -0.16 -0.03 -0.00 0.00 0.00 179.24 179.24 3k92 h MET 38 N 0.26 0.86 -0.77 4.15 4.05 -1.86 -0.96 114.93 120.67 3k92 h MET 38 Ca 0.11 -0.32 -0.01 0.00 -0.28 0.00 0.00 59.70 59.19 3k92 h MET 38 Cb 0.13 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 30.84 3k92 h MET 38 CO -0.02 0.96 0.42 -0.92 0.23 0.00 0.00 176.91 177.58 3k92 h TYR 39 N 0.77 1.04 0.00 1.39 5.03 -1.32 -1.56 116.97 122.32 3k92 h TYR 39 Ca 0.12 -0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.32 3k92 h TYR 39 Cb 0.68 -0.34 -0.01 0.00 1.55 0.00 0.00 36.73 38.61 3k92 h TYR 39 CO 0.04 0.72 -0.41 0.93 -1.32 0.00 0.00 178.16 178.12 3k92 h GLU 40 N 1.07 0.00 -0.07 1.82 4.39 -0.43 -1.89 114.58 119.48 3k92 h GLU 40 Ca 0.27 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.80 3k92 h GLU 40 Cb 0.02 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.68 3k92 h GLU 40 CO -0.04 0.41 -0.65 1.25 -1.16 0.00 0.00 179.01 178.81 3k92 h LEU 41 N 0.00 0.68 -0.46 1.33 6.46 -0.98 -3.36 115.31 118.98 3k92 h LEU 41 Ca -0.00 -0.69 0.00 0.00 -0.12 0.00 0.00 57.88 57.07 3k92 h LEU 41 Cb 0.80 -0.20 0.00 0.00 -0.73 0.00 0.00 40.66 40.52 3k92 h LEU 41 CO 0.05 1.27 -0.12 0.23 -0.62 0.00 0.00 178.44 179.25 3k92 n MET 42 N -4.13 0.98 0.07 1.25 2.81 -0.61 -4.28 117.12 113.20 3k92 n MET 42 Ca -0.09 -0.46 0.11 0.00 -1.81 0.00 0.00 57.70 55.46 3k92 n MET 42 Cb 0.68 -1.49 0.01 0.00 -0.71 0.00 0.00 33.22 31.71 3k92 n MET 42 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 3k92 n LYS 43 N -0.61 0.51 -4.15 0.03 2.85 -0.76 -4.80 118.16 111.23 3k92 n LYS 43 Ca 0.16 0.06 -0.16 0.00 -1.05 0.00 0.00 58.31 57.32 3k92 n LYS 43 Cb 0.30 -1.74 -0.11 0.00 -0.65 0.00 0.00 35.03 32.83 3k92 n LYS 43 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 3k92 s GLU 44 N -3.32 0.77 0.46 -1.58 0.41 -1.26 -4.94 118.70 109.24 3k92 s GLU 44 Ca 0.00 -0.98 -0.25 0.00 -0.41 0.00 0.00 54.97 53.34 3k92 s GLU 44 Cb 0.11 -0.63 -0.08 0.00 -1.78 0.00 0.00 34.13 31.76 3k92 s GLU 44 CO 0.79 0.12 1.36 -1.25 -0.49 0.00 0.00 175.26 175.80 3k92 s PRO 45 N -2.03 3.65 0.29 0.39 0.04 -1.26 -4.91 135.00 131.18 3k92 s PRO 45 Ca -0.01 2.26 0.03 0.00 0.04 0.00 0.00 61.00 63.32 3k92 s PRO 45 Cb -0.08 -2.58 0.73 0.00 0.04 0.00 0.00 34.50 32.61 3k92 s PRO 45 CO 0.01 -0.79 1.67 0.37 0.04 0.00 0.00 177.00 178.30 3k92 h GLN 46 N 2.22 0.27 -3.38 4.56 4.15 -0.55 -3.42 115.11 118.96 3k92 h GLN 46 Ca -0.50 -0.02 -0.24 0.00 0.77 0.00 0.00 58.65 58.66 3k92 h GLN 46 Cb 1.27 -0.06 -0.30 0.00 0.21 0.00 0.00 27.48 28.59 3k92 h GLN 46 CO 0.61 0.18 -0.62 1.03 -1.93 0.00 0.00 178.83 178.10 3k92 s ARG 47 N -5.91 0.08 -0.13 1.69 0.52 -0.97 -5.05 118.95 109.18 3k92 s ARG 47 Ca -0.12 0.26 -0.01 0.00 -0.52 0.00 0.00 55.73 55.34 3k92 s ARG 47 Cb 0.26 -0.10 0.03 0.00 0.52 0.00 0.00 34.95 35.65 3k92 s ARG 47 CO 0.77 -0.11 -0.05 1.41 0.02 0.00 0.00 175.30 177.34 3k92 s MET 48 N 0.75 1.33 -0.13 3.54 -2.45 -1.26 -0.06 119.30 121.01 3k92 s MET 48 Ca -0.06 -0.29 0.00 0.00 -1.25 0.00 0.00 55.69 54.09 3k92 s MET 48 Cb -0.08 -1.65 -0.01 0.00 1.25 0.00 0.00 34.83 34.34 3k92 s MET 48 CO -0.03 -0.34 -0.14 -1.17 1.05 0.00 0.00 175.02 174.39 3k92 s LEU 49 N 1.73 2.67 -0.13 4.11 0.20 -0.14 -5.01 118.68 122.12 3k92 s LEU 49 Ca 0.03 -0.35 -0.00 0.00 0.69 0.00 0.00 54.13 54.50 3k92 s LEU 49 Cb -0.14 -1.60 -0.02 0.00 -0.43 0.00 0.00 46.19 44.01 3k92 s LEU 49 CO -0.08 0.16 -0.12 -0.89 -0.29 0.00 0.00 176.35 175.13 3k92 s THR 50 N 0.39 3.15 0.12 3.68 2.01 -1.26 -1.08 115.64 122.66 3k92 s THR 50 Ca -0.11 -0.63 0.08 0.00 0.31 0.00 0.00 61.69 61.34 3k92 s THR 50 Cb -0.16 -2.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.99 3k92 s THR 50 CO 0.05 0.53 -0.20 0.68 -0.69 0.00 0.00 174.62 174.99 3k92 s VAL 51 N 0.26 1.71 -0.20 3.82 -7.23 0.98 -4.97 120.40 114.78 3k92 s VAL 51 Ca -0.09 -1.62 -0.05 0.00 -1.81 0.00 0.00 61.98 58.41 3k92 s VAL 51 Cb -0.15 -1.61 -0.02 0.00 0.56 0.00 0.00 36.38 35.16 3k92 s VAL 51 CO 0.05 -0.13 -0.01 -0.13 -0.31 0.00 0.00 175.10 174.57 3k92 s ARG 52 N -2.12 3.60 -0.30 4.82 0.52 -1.26 -0.63 118.95 123.59 3k92 s ARG 52 Ca 0.08 -0.53 0.03 0.00 -0.52 0.00 0.00 55.73 54.79 3k92 s ARG 52 Cb -0.09 -3.05 0.08 0.00 0.52 0.00 0.00 34.95 32.41 3k92 s ARG 52 CO 0.05 0.02 -0.01 0.42 0.02 0.00 0.00 175.30 175.79 3k92 s ILE 53 N 0.97 2.01 0.19 1.52 1.01 0.12 -4.93 121.20 122.10 3k92 s ILE 53 Ca 0.01 -1.86 -0.30 0.00 0.00 0.00 0.00 60.65 58.50 3k92 s ILE 53 Cb -0.14 -2.33 -0.08 0.00 0.01 0.00 0.00 42.46 39.91 3k92 s ILE 53 CO 0.02 -0.34 1.17 -2.16 0.00 0.00 0.00 174.94 173.62 3k92 s PRO 54 N 1.10 4.52 -0.04 2.79 0.04 -1.26 -0.20 135.00 141.96 3k92 s PRO 54 Ca 0.02 1.85 -0.02 0.00 0.04 0.00 0.00 61.00 62.88 3k92 s PRO 54 Cb -0.19 -3.24 0.02 0.00 0.04 0.00 0.00 34.50 31.13 3k92 s PRO 54 CO -0.08 -0.03 0.09 0.08 0.04 0.00 0.00 177.00 177.09 3k92 s VAL 55 N -0.21 -0.03 -0.24 -0.36 1.01 -0.30 -4.96 120.40 115.32 3k92 s VAL 55 Ca 0.51 0.10 -0.27 0.00 0.00 0.00 0.00 61.98 62.32 3k92 s VAL 55 Cb -0.32 -0.14 0.00 0.00 0.00 0.00 0.00 36.38 35.92 3k92 s VAL 55 CO 0.37 0.04 0.94 -0.75 0.00 0.00 0.00 175.10 175.70 3k92 s LYS 56 N 0.58 4.21 0.35 2.72 2.36 -1.26 -1.42 119.74 127.28 3k92 s LYS 56 Ca -0.04 1.14 -0.08 0.00 -2.55 0.00 0.00 55.97 54.44 3k92 s LYS 56 Cb -0.06 -3.65 -0.06 0.00 -1.05 0.00 0.00 37.83 33.01 3k92 s LYS 56 CO -0.02 -0.59 0.66 -1.64 1.55 0.00 0.00 175.35 175.31 3k92 s MET 57 N 3.04 3.70 0.27 4.03 -1.94 0.30 -4.85 119.30 123.85 3k92 s MET 57 Ca 0.40 0.24 -0.01 0.00 -1.71 0.00 0.00 55.69 54.60 3k92 s MET 57 Cb -0.15 -2.52 0.51 0.00 2.01 0.00 0.00 34.83 34.68 3k92 s MET 57 CO 0.07 0.09 1.82 -0.44 -0.01 0.00 0.00 175.02 176.54 3k92 h ASP 58 N 1.45 0.81 0.00 3.03 3.32 -1.95 0.79 116.42 123.87 3k92 h ASP 58 Ca -0.47 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.63 3k92 h ASP 58 Cb 1.19 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.63 3k92 h ASP 58 CO 0.65 0.43 0.00 -0.46 -1.72 0.00 0.00 179.24 178.14 3k92 n ASN 59 N -4.68 0.00 0.00 6.45 0.23 -1.26 -4.83 115.26 111.17 3k92 n ASN 59 Ca 0.17 -0.74 0.00 0.00 -0.53 0.00 0.00 54.58 53.48 3k92 n ASN 59 Cb 0.34 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.04 3k92 n ASN 59 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3k92 n GLY 60 N -0.08 1.91 3.75 4.83 0.00 0.27 -5.05 105.19 110.83 3k92 n GLY 60 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 3k92 n GLY 60 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k92 s SER 61 N -2.71 3.25 -0.14 1.61 1.04 -1.25 -4.78 113.70 110.72 3k92 s SER 61 Ca 0.00 1.08 -0.00 0.00 0.48 0.00 0.00 55.95 57.51 3k92 s SER 61 Cb 0.00 -1.70 -0.01 0.00 0.10 0.00 0.00 66.02 64.41 3k92 s SER 61 CO 0.00 -2.73 -0.13 -0.69 0.98 0.00 0.00 173.24 170.67 3k92 s VAL 62 N -3.15 2.94 -0.10 5.02 1.01 -1.26 -0.54 120.40 124.31 3k92 s VAL 62 Ca 0.64 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.96 3k92 s VAL 62 Cb -0.16 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 3k92 s VAL 62 CO 0.55 0.52 -0.19 -0.75 0.00 0.00 0.00 175.10 175.23 3k92 s LYS 63 N 0.53 3.02 -0.40 2.72 2.20 -0.51 -4.92 119.74 122.39 3k92 s LYS 63 Ca -0.09 -0.79 -0.14 0.00 -0.36 0.00 0.00 55.97 54.59 3k92 s LYS 63 Cb -0.16 -2.40 0.02 0.00 -1.51 0.00 0.00 37.83 33.78 3k92 s LYS 63 CO 0.04 0.28 0.28 0.08 -0.36 0.00 0.00 175.35 175.67 3k92 s VAL 64 N 0.13 5.15 0.27 4.02 1.01 -1.26 -1.15 120.40 128.57 3k92 s VAL 64 Ca -0.10 -0.63 -0.09 0.00 0.00 0.00 0.00 61.98 61.15 3k92 s VAL 64 Cb -0.16 -3.84 -0.07 0.00 0.00 0.00 0.00 36.38 32.31 3k92 s VAL 64 CO 0.06 -0.26 0.59 -0.36 0.00 0.00 0.00 175.10 175.13 3k92 s PHE 65 N 1.67 3.43 -0.21 5.22 0.40 0.73 -4.80 117.98 124.42 3k92 s PHE 65 Ca 0.05 0.88 -0.09 0.00 -0.60 0.00 0.00 56.93 57.17 3k92 s PHE 65 Cb -0.19 -2.28 -0.04 0.00 0.51 0.00 0.00 43.02 41.02 3k92 s PHE 65 CO 0.10 0.20 0.10 0.99 0.70 0.00 0.00 175.22 177.31 3k92 s THR 66 N -1.93 5.04 0.23 0.64 2.01 -1.26 0.15 115.64 120.51 3k92 s THR 66 Ca 0.48 0.06 0.05 0.00 0.31 0.00 0.00 61.69 62.59 3k92 s THR 66 Cb -0.11 -3.31 -0.05 0.00 0.01 0.00 0.00 72.50 69.04 3k92 s THR 66 CO 0.23 0.42 -0.06 -0.83 -0.69 0.00 0.00 174.62 173.69 3k92 s GLY 67 N 0.64 1.54 0.01 4.40 0.00 0.20 -1.70 107.32 112.42 3k92 s GLY 67 Ca 0.06 -1.75 -0.01 0.00 0.00 0.00 0.00 44.72 43.02 3k92 s GLY 67 CO 0.01 -1.72 0.00 -0.19 0.00 0.00 0.00 173.10 171.20 3k92 s TYR 68 N -3.20 0.17 -0.06 1.90 2.02 0.68 -0.02 117.35 118.84 3k92 s TYR 68 Ca 0.26 -0.35 -0.02 0.00 -0.37 0.00 0.00 57.07 56.59 3k92 s TYR 68 Cb 0.04 -0.13 0.04 0.00 -0.40 0.00 0.00 41.96 41.50 3k92 s TYR 68 CO 0.08 -0.16 0.11 0.50 -1.57 0.00 0.00 175.55 174.51 3k92 s ARG 69 N -1.12 0.01 -0.15 -0.62 6.06 -0.24 -1.50 118.95 121.38 3k92 s ARG 69 Ca -0.12 0.40 -0.01 0.00 -2.50 0.00 0.00 55.73 53.50 3k92 s ARG 69 Cb -0.08 -0.30 -0.01 0.00 0.06 0.00 0.00 34.95 34.63 3k92 s ARG 69 CO -0.00 -0.25 -0.11 0.45 -2.50 0.00 0.00 175.30 172.88 3k92 s SER 70 N 1.75 4.06 -0.33 -2.12 0.15 0.17 -0.96 113.70 116.42 3k92 s SER 70 Ca -0.02 -0.35 -0.01 0.00 0.70 0.00 0.00 55.95 56.28 3k92 s SER 70 Cb -0.12 -1.64 0.07 0.00 -1.71 0.00 0.00 66.02 62.63 3k92 s SER 70 CO -0.05 0.12 0.04 -1.10 1.20 0.00 0.00 173.24 173.46 3k92 s GLN 71 N 0.61 2.16 -0.03 5.44 -0.21 0.91 -0.79 119.66 127.75 3k92 s GLN 71 Ca -0.07 -1.50 -0.18 0.00 0.02 0.00 0.00 55.36 53.63 3k92 s GLN 71 Cb -0.15 -3.25 -0.11 0.00 1.00 0.00 0.00 33.01 30.50 3k92 s GLN 71 CO 0.03 -0.77 0.78 1.25 -2.12 0.00 0.00 175.29 174.46 3k92 h HIS 72 N 7.92 -0.46 -1.99 0.91 -0.00 -0.99 -2.51 115.15 118.03 3k92 h HIS 72 Ca -0.16 -0.01 0.06 0.00 -0.00 0.00 0.00 60.37 60.26 3k92 h HIS 72 Cb 1.05 0.15 -0.20 0.00 -0.00 0.00 0.00 27.41 28.41 3k92 h HIS 72 CO 0.58 -0.19 -0.08 1.21 -0.00 0.00 0.00 177.93 179.45 3k92 s ASN 73 N -5.02 -1.08 -0.26 3.26 3.84 -1.26 -0.61 114.94 113.81 3k92 s ASN 73 Ca -0.10 1.55 0.12 0.00 0.21 0.00 0.00 52.86 54.64 3k92 s ASN 73 Cb 0.01 2.02 0.57 0.00 -0.55 0.00 0.00 41.25 43.29 3k92 s ASN 73 CO 0.33 -0.23 1.54 -0.90 -2.79 0.00 0.00 177.10 175.05 3k92 n ASP 74 N 5.09 3.55 -0.29 -4.21 5.68 -1.26 -3.98 116.55 121.12 3k92 n ASP 74 Ca -0.14 -3.36 -0.00 0.00 -0.50 0.00 0.00 54.79 50.78 3k92 n ASP 74 Cb 0.52 -0.63 0.12 0.00 -1.14 0.00 0.00 41.12 39.99 3k92 n ASP 74 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k92 h ALA 75 N 1.62 1.09 0.00 2.12 0.00 -1.94 -2.35 119.26 119.80 3k92 h ALA 75 Ca 0.16 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.87 3k92 h ALA 75 Cb 1.76 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 19.31 3k92 h ALA 75 CO 0.43 0.24 -0.93 0.28 0.00 0.00 0.00 179.25 179.26 3k92 h VAL 76 N 0.91 1.64 0.00 0.00 2.07 -1.87 -3.46 116.25 115.55 3k92 h VAL 76 Ca 0.35 -3.23 0.00 0.00 0.82 0.00 0.00 66.70 64.64 3k92 h VAL 76 Cb 0.14 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.66 3k92 h VAL 76 CO -0.16 0.91 0.00 0.61 0.02 0.00 0.00 177.57 178.95 3k92 n GLY 77 N 1.24 -1.60 3.71 2.17 0.00 -0.88 -4.56 105.19 105.26 3k92 n GLY 77 Ca 0.00 -1.07 -0.32 0.00 0.00 0.00 0.00 46.02 44.63 3k92 n GLY 77 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k92 s PRO 78 N -1.42 1.58 0.61 1.61 0.04 -1.26 -3.60 135.00 132.56 3k92 s PRO 78 Ca 0.00 1.53 -0.09 0.00 0.04 0.00 0.00 61.00 62.48 3k92 s PRO 78 Cb 0.00 -1.79 -0.02 0.00 0.04 0.00 0.00 34.50 32.73 3k92 s PRO 78 CO 0.00 -2.21 0.98 0.95 0.04 0.00 0.00 177.00 176.76 3k92 s THR 79 N -2.52 4.36 -0.17 1.26 -4.23 -0.56 -1.74 115.64 112.05 3k92 s THR 79 Ca 0.68 0.55 -0.08 0.00 -1.18 0.00 0.00 61.69 61.65 3k92 s THR 79 Cb -0.23 -3.73 0.06 0.00 1.34 0.00 0.00 72.50 69.93 3k92 s THR 79 CO 0.54 -0.89 0.39 -0.75 -0.54 0.00 0.00 174.62 173.37 3k92 s LYS 80 N -5.11 0.36 0.00 3.99 2.47 -0.39 -1.77 119.74 119.30 3k92 s LYS 80 Ca 0.54 0.80 0.00 0.00 -1.56 0.00 0.00 55.97 55.75 3k92 s LYS 80 Cb -0.11 0.01 0.00 0.00 -1.46 0.00 0.00 37.83 36.27 3k92 s LYS 80 CO 0.51 -0.17 0.00 0.41 0.16 0.00 0.00 175.35 176.25 3k92 n GLY 81 N 4.43 2.04 3.67 5.54 0.00 -1.03 -1.48 105.19 118.36 3k92 n GLY 81 Ca -0.21 -0.87 -0.30 0.00 0.00 0.00 0.00 46.02 44.63 3k92 n GLY 81 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3k92 s GLY 82 N 0.00 1.65 -0.12 -0.02 0.00 -1.26 -3.01 107.32 104.56 3k92 s GLY 82 Ca 0.00 0.32 0.03 0.00 0.00 0.00 0.00 44.72 45.07 3k92 s GLY 82 CO 0.00 0.78 -0.22 0.14 0.00 0.00 0.00 173.10 173.80 3k92 s VAL 83 N -2.70 2.01 -0.13 1.40 1.01 -0.65 -1.20 120.40 120.14 3k92 s VAL 83 Ca 0.66 -0.97 -0.07 0.00 0.00 0.00 0.00 61.98 61.60 3k92 s VAL 83 Cb -0.21 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 3k92 s VAL 83 CO 0.59 0.54 0.11 -0.13 0.00 0.00 0.00 175.10 176.21 3k92 s ARG 84 N 0.59 3.52 -0.34 2.72 0.52 -0.57 -3.63 118.95 121.77 3k92 s ARG 84 Ca -0.13 -0.20 -0.03 0.00 -0.52 0.00 0.00 55.73 54.86 3k92 s ARG 84 Cb -0.17 -3.17 0.06 0.00 0.52 0.00 0.00 34.95 32.20 3k92 s ARG 84 CO 0.04 0.67 0.07 -0.06 0.02 0.00 0.00 175.30 176.04 3k92 s PHE 85 N -0.72 3.36 -0.21 -0.53 2.99 -0.39 -0.50 117.98 121.97 3k92 s PHE 85 Ca 0.13 -1.95 -0.27 0.00 0.00 0.00 0.00 56.93 54.84 3k92 s PHE 85 Cb -0.12 -2.45 0.08 0.00 0.00 0.00 0.00 43.02 40.54 3k92 s PHE 85 CO 0.03 -0.84 0.79 -1.58 -0.00 0.00 0.00 175.22 173.62 3k92 s HIS 86 N 1.25 -0.66 0.56 0.36 2.46 -0.92 -4.45 115.29 113.89 3k92 s HIS 86 Ca -0.01 1.48 0.32 0.00 0.47 0.00 0.00 55.06 57.32 3k92 s HIS 86 Cb -0.21 0.34 1.85 0.00 -0.13 0.00 0.00 32.58 34.43 3k92 s HIS 86 CO -0.01 -0.40 2.24 -1.35 -2.47 0.00 0.00 174.74 172.74 3k92 h PRO 87 N 4.17 0.00 -0.01 2.88 0.11 -1.07 -2.44 132.00 135.64 3k92 h PRO 87 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3k92 h PRO 87 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3k92 h PRO 87 CO 0.16 0.02 -0.13 0.39 -0.21 0.00 0.00 178.00 178.23 3k92 n GLU 88 N -3.68 1.44 -1.57 1.05 -0.58 -1.26 -4.72 120.64 111.31 3k92 n GLU 88 Ca -0.03 -0.94 -0.46 0.00 -0.42 0.00 0.00 57.16 55.31 3k92 n GLU 88 Cb 0.11 -1.48 -0.03 0.00 -0.57 0.00 0.00 31.44 29.48 3k92 n GLU 88 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3k92 n VAL 89 N 0.04 1.61 -3.92 2.62 0.31 -0.93 -4.97 118.33 113.09 3k92 n VAL 89 Ca 0.15 -0.40 -0.09 0.00 -0.01 0.00 0.00 64.34 63.99 3k92 n VAL 89 Cb 0.40 -0.86 -0.05 0.00 -0.91 0.00 0.00 33.84 32.42 3k92 n VAL 89 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3k92 s ASN 90 N -0.40 -0.13 0.11 4.52 2.20 -1.26 -4.79 114.94 115.19 3k92 s ASN 90 Ca 0.64 -0.79 -0.21 0.00 -0.94 0.00 0.00 52.86 51.56 3k92 s ASN 90 Cb -0.77 0.58 -0.08 0.00 -2.00 0.00 0.00 41.25 38.98 3k92 s ASN 90 CO 0.57 -1.12 1.74 -0.08 -2.94 0.00 0.00 177.10 175.27 3k92 h GLU 91 N 2.25 0.07 -0.58 3.55 4.81 -1.99 -1.14 114.58 121.55 3k92 h GLU 91 Ca -0.26 -0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.01 3k92 h GLU 91 Cb 1.25 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.56 3k92 h GLU 91 CO 0.36 0.05 0.30 0.93 -0.73 0.00 0.00 179.01 179.92 3k92 h GLU 92 N 0.07 0.56 -0.46 1.92 5.08 -2.00 -0.29 114.58 119.46 3k92 h GLU 92 Ca 0.06 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.34 3k92 h GLU 92 Cb 0.05 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 3k92 h GLU 92 CO -0.08 0.37 0.10 -0.22 -1.00 0.00 0.00 179.01 178.18 3k92 h LYS 93 N 0.57 0.75 -0.46 2.33 3.11 -1.84 -1.90 116.57 119.13 3k92 h LYS 93 Ca 0.26 -0.18 -0.05 0.00 -2.81 0.00 0.00 60.65 57.87 3k92 h LYS 93 Cb 0.17 -0.10 -0.02 0.00 -1.00 0.00 0.00 32.23 31.28 3k92 h LYS 93 CO -0.17 0.74 0.10 0.28 -2.81 0.00 0.00 179.45 177.59 3k92 h VAL 94 N 0.62 1.24 -0.35 2.00 2.07 -0.75 0.19 116.25 121.27 3k92 h VAL 94 Ca 0.14 -0.84 0.02 0.00 0.82 0.00 0.00 66.70 66.84 3k92 h VAL 94 Cb 0.34 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 3k92 h VAL 94 CO 0.00 0.30 0.19 0.11 0.02 0.00 0.00 177.57 178.20 3k92 h LYS 95 N 0.61 0.39 -0.63 1.57 1.57 -0.91 -2.04 116.57 117.13 3k92 h LYS 95 Ca 0.14 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.91 3k92 h LYS 95 Cb 0.34 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 3k92 h LYS 95 CO 0.00 0.26 0.41 0.00 -0.57 0.00 0.00 179.45 179.55 3k92 h ALA 96 N 1.16 0.81 0.00 3.86 0.00 -1.00 -1.63 119.26 122.45 3k92 h ALA 96 Ca 0.14 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 3k92 h ALA 96 Cb 0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3k92 h ALA 96 CO -0.07 0.22 -0.35 -0.07 0.00 0.00 0.00 179.25 178.98 3k92 h LEU 97 N 0.84 0.00 -0.58 0.00 3.38 -0.75 -2.04 115.31 116.15 3k92 h LEU 97 Ca 0.24 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.09 3k92 h LEU 97 Cb -0.08 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3k92 h LEU 97 CO -0.06 0.35 -0.16 0.77 0.09 0.00 0.00 178.44 179.43 3k92 h SER 98 N 0.00 0.98 -0.45 -0.43 4.64 -0.58 -0.72 113.55 116.99 3k92 h SER 98 Ca -0.00 -0.34 0.02 0.00 -0.47 0.00 0.00 61.79 60.99 3k92 h SER 98 Cb 0.67 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.46 3k92 h SER 98 CO 0.04 1.12 0.27 0.40 -0.87 0.00 0.00 176.83 177.80 3k92 h ILE 99 N 0.85 1.07 -0.85 0.95 2.04 -1.10 -1.84 117.51 118.62 3k92 h ILE 99 Ca 0.12 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.82 3k92 h ILE 99 Cb 0.72 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.21 3k92 h ILE 99 CO 0.05 0.10 0.55 -0.50 0.00 0.00 0.00 178.15 178.36 3k92 h TRP 100 N 0.55 1.04 -0.61 1.37 4.06 -1.09 -1.53 115.95 119.74 3k92 h TRP 100 Ca 0.17 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 61.15 3k92 h TRP 100 Cb -0.01 -0.35 -0.03 0.00 -1.00 0.00 0.00 29.16 27.77 3k92 h TRP 100 CO -0.06 0.63 0.36 0.52 -3.56 0.00 0.00 178.44 176.33 3k92 h MET 101 N 1.10 0.82 -0.58 0.49 2.86 -0.67 -1.82 114.93 117.13 3k92 h MET 101 Ca 0.33 -0.07 0.04 0.00 -2.06 0.00 0.00 59.70 57.94 3k92 h MET 101 Cb -0.06 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.38 3k92 h MET 101 CO -0.09 0.58 0.32 1.15 1.06 0.00 0.00 176.91 179.93 3k92 h THR 102 N 0.84 1.00 -0.12 2.22 2.02 -0.47 -0.62 112.91 117.77 3k92 h THR 102 Ca 0.22 -0.21 0.01 0.00 0.77 0.00 0.00 66.41 67.20 3k92 h THR 102 Cb -0.03 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 3k92 h THR 102 CO -0.04 0.11 0.06 -0.07 0.37 0.00 0.00 175.52 175.95 3k92 h LEU 103 N 0.62 0.08 -1.06 2.58 3.38 -0.92 -0.20 115.31 119.79 3k92 h LEU 103 Ca 0.25 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 3k92 h LEU 103 Cb 0.11 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3k92 h LEU 103 CO -0.14 0.07 0.53 0.11 0.09 0.00 0.00 178.44 179.09 3k92 h LYS 104 N 0.13 1.17 -0.68 1.13 1.57 -1.03 0.20 116.57 119.06 3k92 h LYS 104 Ca 0.05 -0.10 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 3k92 h LYS 104 Cb 0.01 -0.25 -0.04 0.00 0.08 0.00 0.00 32.23 32.04 3k92 h LYS 104 CO -0.04 0.81 0.44 0.00 -0.57 0.00 0.00 179.45 180.10 3k92 h GLY 106 N 0.90 0.93 0.80 0.00 0.00 -0.15 0.13 103.07 105.67 3k92 h GLY 106 Ca 0.25 -0.49 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 3k92 h GLY 106 CO -0.07 0.46 -0.00 -2.22 0.00 0.00 0.00 176.54 174.71 3k92 h ILE 107 N 0.84 1.26 -0.25 2.60 2.04 -0.54 -1.84 117.51 121.62 3k92 h ILE 107 Ca 0.20 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.20 3k92 h ILE 107 Cb 0.21 1.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 3k92 h ILE 107 CO -0.01 0.26 0.00 0.00 0.00 0.00 0.00 178.15 178.39 3k92 n ALA 108 N -2.32 2.47 -3.34 1.87 0.00 -0.66 -4.66 120.51 113.88 3k92 n ALA 108 Ca -0.05 -0.45 -0.24 0.00 0.00 0.00 0.00 53.44 52.70 3k92 n ALA 108 Cb 0.22 -0.98 0.02 0.00 0.00 0.00 0.00 19.45 18.71 3k92 n ALA 108 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3k92 n ASN 109 N 0.24 -5.04 -4.79 0.00 5.15 -0.61 -4.95 115.26 105.26 3k92 n ASN 109 Ca 0.08 -0.42 -0.36 0.00 -0.60 0.00 0.00 54.58 53.28 3k92 n ASN 109 Cb 0.22 -4.08 -0.06 0.00 -0.53 0.00 0.00 39.78 35.33 3k92 n ASN 109 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3k92 s LEU 110 N -6.76 4.16 -0.87 1.20 1.43 0.36 -4.94 118.68 113.27 3k92 s LEU 110 Ca 0.42 1.88 -0.07 0.00 -1.03 0.00 0.00 54.13 55.32 3k92 s LEU 110 Cb -0.20 -4.21 -0.13 0.00 0.03 0.00 0.00 46.19 41.68 3k92 s LEU 110 CO 0.52 -0.30 3.15 -0.81 0.23 0.00 0.00 176.35 179.14 3k92 n PRO 111 N 0.02 3.02 -4.07 1.29 -0.04 -1.26 -4.74 135.00 129.22 3k92 n PRO 111 Ca 0.04 -1.87 -0.11 0.00 -0.04 0.00 0.00 63.50 61.52 3k92 n PRO 111 Cb 0.51 -2.42 -0.11 0.00 -0.04 0.00 0.00 33.50 31.44 3k92 n PRO 111 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3k92 s TYR 112 N 1.05 0.62 0.54 0.54 2.02 -1.26 -4.05 117.35 116.81 3k92 s TYR 112 Ca 0.66 -0.63 0.09 0.00 -0.37 0.00 0.00 57.07 56.82 3k92 s TYR 112 Cb 0.25 -0.38 0.07 0.00 -0.40 0.00 0.00 41.96 41.50 3k92 s TYR 112 CO -0.05 -0.14 0.74 0.20 -1.57 0.00 0.00 175.55 174.72 3k92 s GLY 113 N -1.93 1.79 0.02 0.71 0.00 -0.71 -4.66 107.32 102.54 3k92 s GLY 113 Ca -0.06 -2.00 -0.20 0.00 0.00 0.00 0.00 44.72 42.46 3k92 s GLY 113 CO -0.02 -1.61 0.57 -0.32 0.00 0.00 0.00 173.10 171.72 3k92 s GLY 114 N -4.58 2.62 0.13 0.20 0.00 -1.26 -1.26 107.32 103.18 3k92 s GLY 114 Ca 0.60 0.01 -0.00 0.00 0.00 0.00 0.00 44.72 45.33 3k92 s GLY 114 CO 0.38 0.60 0.03 -0.32 0.00 0.00 0.00 173.10 173.78 3k92 s GLY 115 N -0.60 0.96 -0.18 0.20 0.00 -0.55 -0.42 107.32 106.74 3k92 s GLY 115 Ca 0.30 -1.46 -0.28 0.00 0.00 0.00 0.00 44.72 43.27 3k92 s GLY 115 CO 0.17 -1.39 0.84 1.25 0.00 0.00 0.00 173.10 173.98 3k92 s LYS 116 N -4.00 0.77 0.33 2.90 2.47 0.03 -3.26 119.74 118.98 3k92 s LYS 116 Ca 0.22 0.47 0.04 0.00 -1.56 0.00 0.00 55.97 55.13 3k92 s LYS 116 Cb 0.07 0.37 -0.03 0.00 -1.46 0.00 0.00 37.83 36.78 3k92 s LYS 116 CO 0.01 -0.18 0.17 0.20 0.16 0.00 0.00 175.35 175.70 3k92 s GLY 117 N -0.52 2.23 -0.01 5.54 0.00 -0.34 0.42 107.32 114.64 3k92 s GLY 117 Ca -0.03 -1.70 -0.29 0.00 0.00 0.00 0.00 44.72 42.70 3k92 s GLY 117 CO 0.02 -1.62 0.92 -0.32 0.00 0.00 0.00 173.10 172.10 3k92 s GLY 118 N -3.43 -0.44 -0.02 0.20 0.00 -0.57 -1.51 107.32 101.56 3k92 s GLY 118 Ca 0.34 1.01 0.05 0.00 0.00 0.00 0.00 44.72 46.12 3k92 s GLY 118 CO 0.19 0.33 -0.17 -0.42 0.00 0.00 0.00 173.10 173.03 3k92 s ILE 119 N -3.07 1.36 -0.66 0.90 1.01 0.34 -0.23 121.20 120.84 3k92 s ILE 119 Ca 0.06 -0.72 -0.25 0.00 0.00 0.00 0.00 60.65 59.73 3k92 s ILE 119 Cb -0.01 -1.14 0.04 0.00 0.01 0.00 0.00 42.46 41.36 3k92 s ILE 119 CO -0.08 0.39 1.11 -0.63 0.00 0.00 0.00 174.94 175.73 3k92 s ILE 120 N -0.28 4.06 0.11 2.92 1.01 -0.69 -2.17 121.20 126.16 3k92 s ILE 120 Ca 0.04 0.25 -0.26 0.00 0.00 0.00 0.00 60.65 60.68 3k92 s ILE 120 Cb -0.08 -4.75 0.07 0.00 0.01 0.00 0.00 42.46 37.72 3k92 s ILE 120 CO 0.00 -1.52 1.00 0.00 0.00 0.00 0.00 174.94 174.42 3k92 s ASP 122 N -2.90 4.61 0.55 0.00 -1.08 -1.26 -0.50 116.67 116.09 3k92 s ASP 122 Ca 0.12 -2.01 0.36 0.00 -0.52 0.00 0.00 52.55 50.50 3k92 s ASP 122 Cb -0.01 -1.50 1.65 0.00 -1.46 0.00 0.00 42.92 41.61 3k92 s ASP 122 CO 0.00 -0.37 2.06 1.55 0.52 0.00 0.00 175.17 178.94 3k92 h PRO 123 N 7.70 0.00 0.00 4.34 0.13 -1.95 -2.84 132.00 139.38 3k92 h PRO 123 Ca -0.07 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.02 3k92 h PRO 123 Cb 1.02 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.15 3k92 h PRO 123 CO 0.51 0.00 -0.21 0.00 -0.23 0.00 0.00 178.00 178.06 3k92 h ARG 124 N 0.00 0.00 -0.69 0.86 3.08 -1.96 -2.47 114.38 113.19 3k92 h ARG 124 Ca 0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 3k92 h ARG 124 Cb 0.32 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.29 3k92 h ARG 124 CO 0.00 0.21 0.17 0.25 -1.07 0.00 0.00 179.97 179.53 3k92 n THR 125 N -3.67 2.86 -5.04 2.04 -2.24 -1.07 -4.95 114.28 102.22 3k92 n THR 125 Ca -0.01 -1.52 -0.30 0.00 -2.27 0.00 0.00 64.05 59.94 3k92 n THR 125 Cb 0.33 -0.33 -0.15 0.00 -2.10 0.00 0.00 70.33 68.08 3k92 n THR 125 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3k92 s MET 126 N -2.89 1.89 0.96 -0.78 -1.94 -0.93 -5.09 119.30 110.53 3k92 s MET 126 Ca 0.55 -1.04 -0.12 0.00 -1.71 0.00 0.00 55.69 53.36 3k92 s MET 126 Cb 0.43 -1.98 0.17 0.00 2.01 0.00 0.00 34.83 35.46 3k92 s MET 126 CO 0.14 0.52 1.12 -1.54 -0.01 0.00 0.00 175.02 175.25 3k92 s SER 127 N -1.01 2.99 0.19 3.03 1.04 -1.26 -4.87 113.70 113.81 3k92 s SER 127 Ca 0.11 1.04 -0.12 0.00 0.48 0.00 0.00 55.95 57.46 3k92 s SER 127 Cb -0.10 -1.65 0.11 0.00 0.10 0.00 0.00 66.02 64.48 3k92 s SER 127 CO 0.01 -2.88 1.85 -0.26 0.98 0.00 0.00 173.24 172.93 3k92 h PHE 128 N -1.72 0.83 -0.23 5.02 0.04 -1.99 -1.60 116.94 117.29 3k92 h PHE 128 Ca -0.53 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.25 3k92 h PHE 128 Cb 1.33 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 39.19 3k92 h PHE 128 CO 0.24 0.54 0.11 0.78 -0.60 0.00 0.00 178.31 179.39 3k92 h GLY 129 N 0.88 0.36 1.01 -1.45 0.00 -1.99 -0.20 103.07 101.67 3k92 h GLY 129 Ca 0.24 -0.17 0.01 0.00 0.00 0.00 0.00 47.33 47.40 3k92 h GLY 129 CO -0.05 0.17 0.57 0.83 0.00 0.00 0.00 176.54 178.06 3k92 h GLU 130 N 0.25 1.13 -0.70 4.80 5.08 -1.86 -0.62 114.58 122.66 3k92 h GLU 130 Ca 0.08 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 3k92 h GLU 130 Cb 0.11 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 3k92 h GLU 130 CO -0.01 0.75 0.17 -0.07 -1.00 0.00 0.00 179.01 178.85 3k92 h LEU 131 N 1.17 1.06 -0.16 1.33 3.38 -0.76 -0.75 115.31 120.57 3k92 h LEU 131 Ca 0.32 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 58.09 3k92 h LEU 131 Cb -0.13 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.30 3k92 h LEU 131 CO -0.07 1.02 -0.06 -0.08 0.09 0.00 0.00 178.44 179.34 3k92 h GLU 132 N 1.05 -0.02 -0.65 1.13 4.81 -0.75 0.41 114.58 120.55 3k92 h GLU 132 Ca 0.22 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.37 3k92 h GLU 132 Cb 0.37 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 3k92 h GLU 132 CO 0.00 -0.02 0.08 0.00 -0.73 0.00 0.00 179.01 178.34 3k92 h ARG 133 N -0.02 1.09 -0.40 1.92 3.08 -0.88 -0.84 114.38 118.32 3k92 h ARG 133 Ca 0.08 -0.31 -0.10 0.00 0.07 0.00 0.00 59.98 59.73 3k92 h ARG 133 Cb 0.15 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 3k92 h ARG 133 CO -0.18 1.02 -0.13 1.25 -1.07 0.00 0.00 179.97 180.85 3k92 h LEU 134 N 1.02 0.81 -0.48 3.04 5.85 -1.11 -1.62 115.31 122.82 3k92 h LEU 134 Ca 0.20 -0.38 0.04 0.00 0.84 0.00 0.00 57.88 58.58 3k92 h LEU 134 Cb 0.47 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 3k92 h LEU 134 CO 0.02 1.01 0.23 0.28 -0.34 0.00 0.00 178.44 179.64 3k92 h SER 135 N 0.61 0.33 -0.48 1.25 0.02 -0.40 0.29 113.55 115.18 3k92 h SER 135 Ca 0.10 0.03 -0.11 0.00 -0.84 0.00 0.00 61.79 60.97 3k92 h SER 135 Cb 0.67 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 3k92 h SER 135 CO 0.05 0.23 -0.11 0.03 -1.14 0.00 0.00 176.83 175.89 3k92 h ARG 136 N 0.46 0.95 -0.50 3.45 3.08 -1.11 -2.25 114.38 118.46 3k92 h ARG 136 Ca 0.21 -0.34 -0.03 0.00 0.07 0.00 0.00 59.98 59.89 3k92 h ARG 136 Cb 0.13 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3k92 h ARG 136 CO -0.16 1.00 0.19 0.78 -1.07 0.00 0.00 179.97 180.72 3k92 h GLY 137 N 0.96 0.77 0.79 0.04 0.00 -1.03 -0.12 103.07 104.47 3k92 h GLY 137 Ca 0.14 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 3k92 h GLY 137 CO 0.04 0.36 -0.04 -1.82 0.00 0.00 0.00 176.54 175.09 3k92 h TYR 138 N 0.71 -0.10 -0.42 5.60 3.20 -0.67 -0.48 116.97 124.82 3k92 h TYR 138 Ca 0.17 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.05 3k92 h TYR 138 Cb 0.16 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 3k92 h TYR 138 CO 0.01 0.13 0.26 0.28 -1.64 0.00 0.00 178.16 177.20 3k92 h VAL 139 N -0.32 1.07 -0.19 1.81 2.07 -1.08 -1.88 116.25 117.73 3k92 h VAL 139 Ca -0.01 -0.18 -0.06 0.00 0.82 0.00 0.00 66.70 67.27 3k92 h VAL 139 Cb 0.28 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3k92 h VAL 139 CO 0.02 0.10 -0.14 0.03 0.02 0.00 0.00 177.57 177.59 3k92 h ARG 140 N 0.53 0.31 -0.28 1.57 3.08 -0.96 -0.76 114.38 117.87 3k92 h ARG 140 Ca 0.16 -0.08 -0.09 0.00 0.07 0.00 0.00 59.98 60.03 3k92 h ARG 140 Cb -0.02 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3k92 h ARG 140 CO -0.06 0.46 -0.23 0.00 -1.07 0.00 0.00 179.97 179.07 3k92 h ALA 141 N 1.57 1.09 -0.09 0.04 0.00 -0.33 -3.34 119.26 118.20 3k92 h ALA 141 Ca 0.06 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3k92 h ALA 141 Cb 0.43 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3k92 h ALA 141 CO 0.03 0.56 0.00 0.44 0.00 0.00 0.00 179.25 180.28 3k92 n ILE 142 N -4.13 0.30 -0.14 0.00 -5.35 -0.79 -4.78 119.36 104.47 3k92 n ILE 142 Ca -0.00 -0.65 0.17 0.00 -0.27 0.00 0.00 62.75 61.99 3k92 n ILE 142 Cb 0.40 0.98 0.54 0.00 -1.74 0.00 0.00 39.64 39.82 3k92 n ILE 142 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 3k92 h SER 143 N 1.72 0.32 -0.06 7.28 4.64 -1.27 -1.70 113.55 124.48 3k92 h SER 143 Ca 0.00 0.02 0.02 0.00 -0.47 0.00 0.00 61.79 61.36 3k92 h SER 143 Cb 0.47 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3k92 h SER 143 CO 0.00 0.16 0.09 1.56 -0.87 0.00 0.00 176.83 177.77 3k92 h GLN 144 N 0.34 0.00 -0.03 4.77 4.20 -1.87 -3.02 115.11 119.49 3k92 h GLN 144 Ca 0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.07 3k92 h GLN 144 Cb 0.92 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.70 3k92 h GLN 144 CO -0.10 0.00 0.00 0.44 -0.67 0.00 0.00 178.83 178.50 3k92 n ILE 145 N -3.69 1.85 -3.90 2.54 -5.35 -0.64 -5.04 119.36 105.12 3k92 n ILE 145 Ca -0.01 -2.10 -0.10 0.00 -0.27 0.00 0.00 62.75 60.27 3k92 n ILE 145 Cb 0.18 -0.17 -0.09 0.00 -1.74 0.00 0.00 39.64 37.82 3k92 n ILE 145 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 3k92 s VAL 146 N -2.68 0.12 0.00 7.28 1.01 -1.14 -4.56 120.40 120.43 3k92 s VAL 146 Ca 0.30 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 61.29 3k92 s VAL 146 Cb 0.26 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.82 3k92 s VAL 146 CO 0.04 -0.55 0.00 0.61 0.00 0.00 0.00 175.10 175.20 3k92 n GLY 147 N 0.86 2.80 0.34 4.51 0.00 -0.85 -4.81 105.19 108.03 3k92 n GLY 147 Ca -0.20 -1.34 0.19 0.00 0.00 0.00 0.00 46.02 44.67 3k92 n GLY 147 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k92 h PRO 148 N 0.00 0.00 -0.01 1.61 0.14 -1.80 -0.15 132.00 131.79 3k92 h PRO 148 Ca 0.00 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.14 3k92 h PRO 148 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.14 3k92 h PRO 148 CO 0.00 0.00 -0.40 0.25 0.14 0.00 0.00 178.00 177.99 3k92 n THR 149 N -3.25 0.00 0.01 1.56 -2.24 -1.26 -4.78 114.28 104.32 3k92 n THR 149 Ca -0.01 -0.30 -0.03 0.00 -2.27 0.00 0.00 64.05 61.44 3k92 n THR 149 Cb 0.24 1.23 -0.01 0.00 -2.10 0.00 0.00 70.33 69.69 3k92 n THR 149 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3k92 n LYS 150 N -0.04 0.10 -3.46 -0.78 5.02 -0.44 -4.42 118.16 114.15 3k92 n LYS 150 Ca 0.08 0.04 0.01 0.00 -2.02 0.00 0.00 58.31 56.42 3k92 n LYS 150 Cb 0.41 -0.67 -0.04 0.00 -0.02 0.00 0.00 35.03 34.71 3k92 n LYS 150 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3k92 s ASP 151 N -5.84 -0.83 -0.32 4.39 2.15 -0.20 -1.49 116.67 114.52 3k92 s ASP 151 Ca -0.06 1.05 0.02 0.00 0.43 0.00 0.00 52.55 53.99 3k92 s ASP 151 Cb 0.01 1.91 0.10 0.00 -0.30 0.00 0.00 42.92 44.64 3k92 s ASP 151 CO 0.08 -0.16 0.06 -0.63 -0.17 0.00 0.00 175.17 174.35 3k92 s ILE 152 N 2.67 1.75 0.00 4.11 1.01 -0.73 -2.01 121.20 128.00 3k92 s ILE 152 Ca -0.02 -1.93 0.00 0.00 0.00 0.00 0.00 60.65 58.70 3k92 s ILE 152 Cb -0.09 -2.27 0.00 0.00 0.01 0.00 0.00 42.46 40.11 3k92 s ILE 152 CO -0.18 -0.58 0.00 -2.65 0.00 0.00 0.00 174.94 171.53 3k92 n PRO 153 N 4.49 -0.57 -3.74 2.79 -0.02 -1.16 -2.45 135.00 134.33 3k92 n PRO 153 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.47 3k92 n PRO 153 Cb 0.42 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.90 3k92 n PRO 153 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k92 s ALA 154 N -3.41 -1.84 0.78 3.55 0.00 -1.16 -1.59 121.76 118.08 3k92 s ALA 154 Ca 0.00 0.22 -0.11 0.00 0.00 0.00 0.00 51.96 52.07 3k92 s ALA 154 Cb 0.00 0.58 0.06 0.00 0.00 0.00 0.00 23.12 23.77 3k92 s ALA 154 CO 0.00 -1.05 1.11 -2.14 0.00 0.00 0.00 175.76 173.67 3k92 s PRO 155 N -2.84 2.11 0.00 0.00 0.02 -1.26 -1.63 135.00 131.40 3k92 s PRO 155 Ca 0.15 1.29 0.00 0.00 0.02 0.00 0.00 61.00 62.45 3k92 s PRO 155 Cb 0.00 -1.87 0.00 0.00 0.02 0.00 0.00 34.50 32.65 3k92 s PRO 155 CO 0.01 -1.77 0.00 -3.47 -0.33 0.00 0.00 177.00 171.44 3k92 n ASP 156 N -3.46 0.00 -4.66 2.53 -0.08 -1.24 -4.37 116.55 105.27 3k92 n ASP 156 Ca 0.10 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.96 3k92 n ASP 156 Cb 0.53 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.96 3k92 n ASP 156 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 3k92 s VAL 157 N -1.12 3.27 -1.61 5.18 1.01 -1.26 -1.65 120.40 124.21 3k92 s VAL 157 Ca 0.00 0.32 -0.00 0.00 0.00 0.00 0.00 61.98 62.30 3k92 s VAL 157 Cb 0.00 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.17 3k92 s VAL 157 CO 0.00 -0.03 0.01 -1.22 0.00 0.00 0.00 175.10 173.86 3k92 n TYR 158 N 7.43 -0.92 -4.22 5.22 4.01 -1.26 -1.26 117.16 126.16 3k92 n TYR 158 Ca 0.19 0.01 -0.17 0.00 -0.16 0.00 0.00 57.90 57.77 3k92 n TYR 158 Cb 0.42 -3.71 -0.11 0.00 -0.31 0.00 0.00 39.34 35.63 3k92 n TYR 158 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3k92 s THR 159 N -2.95 1.19 0.00 -0.72 -4.23 -0.66 -4.61 115.64 103.66 3k92 s THR 159 Ca 0.01 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 58.80 3k92 s THR 159 Cb -0.00 -1.49 0.00 0.00 1.34 0.00 0.00 72.50 72.35 3k92 s THR 159 CO 0.01 -0.48 0.00 -0.46 -0.54 0.00 0.00 174.62 173.15 3k92 n ASN 160 N 0.50 0.00 0.16 3.99 0.23 -1.26 -3.99 115.26 114.88 3k92 n ASN 160 Ca -0.15 -0.46 0.03 0.00 -0.53 0.00 0.00 54.58 53.47 3k92 n ASN 160 Cb 0.57 0.00 0.20 0.00 -2.08 0.00 0.00 39.78 38.48 3k92 n ASN 160 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 3k92 h SER 161 N 0.00 0.00 -0.28 0.53 4.64 -1.96 -2.13 113.55 114.34 3k92 h SER 161 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3k92 h SER 161 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3k92 h SER 161 CO 0.00 0.50 0.04 -0.61 -0.87 0.00 0.00 176.83 175.89 3k92 h GLN 162 N 0.00 0.47 -0.59 4.77 5.75 -1.96 -0.57 115.11 122.98 3k92 h GLN 162 Ca -0.01 -0.13 -0.03 0.00 -0.15 0.00 0.00 58.65 58.34 3k92 h GLN 162 Cb 1.11 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.58 3k92 h GLN 162 CO 0.07 0.59 0.26 0.82 -2.65 0.00 0.00 178.83 177.91 3k92 h ILE 163 N 0.28 1.22 -0.64 2.39 1.08 -1.87 -2.08 117.51 117.89 3k92 h ILE 163 Ca 0.08 -0.65 0.05 0.00 -0.39 0.00 0.00 64.86 63.96 3k92 h ILE 163 Cb 0.35 0.55 -0.05 0.00 -3.07 0.00 0.00 36.82 34.60 3k92 h ILE 163 CO 0.01 0.26 0.36 0.24 -0.69 0.00 0.00 178.15 178.33 3k92 h MET 164 N 0.80 0.67 -0.91 2.37 2.86 -1.32 -1.27 114.93 118.13 3k92 h MET 164 Ca 0.20 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.82 3k92 h MET 164 Cb 0.16 -0.15 -0.05 0.00 0.06 0.00 0.00 31.60 31.62 3k92 h MET 164 CO -0.02 0.44 0.60 0.00 1.06 0.00 0.00 176.91 178.99 3k92 h ALA 165 N 1.32 1.17 -0.20 6.32 0.00 -0.62 0.25 119.26 127.50 3k92 h ALA 165 Ca 0.28 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.93 3k92 h ALA 165 Cb 0.14 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 17.59 3k92 h ALA 165 CO -0.16 0.51 -0.69 -1.49 0.00 0.00 0.00 179.25 177.43 3k92 h TRP 166 N 1.20 1.05 -0.38 0.00 6.55 -1.03 -1.00 115.95 122.34 3k92 h TRP 166 Ca 0.34 -0.43 -0.11 0.00 0.95 0.00 0.00 58.89 59.64 3k92 h TRP 166 Cb -0.09 -0.18 -0.01 0.00 -0.86 0.00 0.00 29.16 28.02 3k92 h TRP 166 CO -0.01 1.26 -0.22 0.52 -1.05 0.00 0.00 178.44 178.94 3k92 h MET 167 N 0.58 0.74 -0.38 0.49 2.86 -0.80 -1.68 114.93 116.75 3k92 h MET 167 Ca -0.03 -0.29 -0.04 0.00 -2.06 0.00 0.00 59.70 57.28 3k92 h MET 167 Cb 1.30 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.91 3k92 h MET 167 CO 0.14 0.90 0.08 1.98 1.06 0.00 0.00 176.91 181.07 3k92 h MET 168 N 0.65 0.61 -0.14 1.72 1.85 -0.35 -0.94 114.93 118.33 3k92 h MET 168 Ca 0.09 -0.15 0.02 0.00 -0.61 0.00 0.00 59.70 59.05 3k92 h MET 168 Cb 0.72 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 32.65 3k92 h MET 168 CO 0.06 0.65 0.04 0.22 -0.40 0.00 0.00 176.91 177.48 3k92 h ASP 169 N 0.46 0.03 -0.76 1.39 3.58 -1.09 -0.20 116.42 119.83 3k92 h ASP 169 Ca 0.12 0.02 0.04 0.00 0.42 0.00 0.00 57.03 57.62 3k92 h ASP 169 Cb 0.32 0.02 -0.05 0.00 1.72 0.00 0.00 39.33 41.34 3k92 h ASP 169 CO 0.00 0.04 0.48 -0.08 -2.88 0.00 0.00 179.24 176.80 3k92 h GLU 170 N 0.11 0.90 -0.37 0.28 4.57 -1.14 -1.63 114.58 117.29 3k92 h GLU 170 Ca 0.06 -0.05 -0.09 0.00 -1.18 0.00 0.00 59.36 58.10 3k92 h GLU 170 Cb 0.04 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.42 3k92 h GLU 170 CO -0.07 0.59 -0.13 -0.92 -1.18 0.00 0.00 179.01 177.31 3k92 h TYR 171 N 0.93 0.85 -0.54 0.92 3.20 -0.89 -1.99 116.97 119.45 3k92 h TYR 171 Ca 0.31 -0.19 0.03 0.00 3.14 0.00 0.00 58.73 62.01 3k92 h TYR 171 Cb 0.04 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.08 3k92 h TYR 171 CO -0.04 0.91 0.36 0.77 -1.64 0.00 0.00 178.16 178.52 3k92 h SER 172 N 0.54 0.54 -0.25 -2.11 0.02 -0.77 -1.49 113.55 110.03 3k92 h SER 172 Ca 0.09 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 3k92 h SER 172 Cb 0.65 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 3k92 h SER 172 CO 0.04 0.38 -0.13 0.03 -1.14 0.00 0.00 176.83 176.01 3k92 h ARG 173 N 0.63 0.53 -0.97 3.45 2.47 -0.95 0.19 114.38 119.74 3k92 h ARG 173 Ca 0.21 -0.24 0.06 0.00 -1.26 0.00 0.00 59.98 58.75 3k92 h ARG 173 Cb 0.07 -0.01 -0.06 0.00 -1.65 0.00 0.00 29.97 28.31 3k92 h ARG 173 CO -0.05 0.79 0.63 -0.07 0.56 0.00 0.00 179.97 181.83 3k92 h LEU 174 N 0.26 1.01 0.00 3.04 3.38 -0.61 -2.71 115.31 119.68 3k92 h LEU 174 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3k92 h LEU 174 Cb 0.64 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3k92 h LEU 174 CO 0.04 0.66 -0.69 0.03 0.09 0.00 0.00 178.44 178.57 3k92 h ARG 175 N 1.15 0.00 -0.24 1.13 2.47 -1.15 -3.48 114.38 114.26 3k92 h ARG 175 Ca 0.41 0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 59.02 3k92 h ARG 175 Cb 0.12 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.40 3k92 h ARG 175 CO -0.15 0.00 -0.09 0.39 0.56 0.00 0.00 179.97 180.68 3k92 n GLU 176 N -2.38 -0.47 -3.66 0.04 1.02 0.61 -5.01 120.64 110.80 3k92 n GLU 176 Ca 0.02 0.60 -0.15 0.00 -0.02 0.00 0.00 57.16 57.62 3k92 n GLU 176 Cb 0.48 -4.30 -0.08 0.00 -0.02 0.00 0.00 31.44 27.53 3k92 n GLU 176 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 3k92 s PHE 177 N -2.12 -0.50 -0.00 -0.32 -0.12 -0.92 -5.04 117.98 108.95 3k92 s PHE 177 Ca 0.00 1.04 -0.34 0.00 -0.05 0.00 0.00 56.93 57.58 3k92 s PHE 177 Cb 0.00 0.24 -0.12 0.00 -0.63 0.00 0.00 43.02 42.51 3k92 s PHE 177 CO 0.00 -0.41 1.80 -0.25 -0.05 0.00 0.00 175.22 176.30 3k92 n ASP 178 N 1.81 3.40 -3.32 1.98 8.00 -1.26 -4.42 116.55 122.74 3k92 n ASP 178 Ca -0.17 1.00 -0.27 0.00 0.71 0.00 0.00 54.79 56.06 3k92 n ASP 178 Cb 0.56 -1.40 -0.07 0.00 -0.02 0.00 0.00 41.12 40.19 3k92 n ASP 178 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3k92 n SER 179 N 5.71 3.77 -0.10 -2.24 7.64 -1.26 -4.93 113.62 122.20 3k92 n SER 179 Ca 0.21 -3.47 0.06 0.00 1.01 0.00 0.00 58.87 56.68 3k92 n SER 179 Cb 0.30 -0.65 0.40 0.00 -1.01 0.00 0.00 64.21 63.25 3k92 n SER 179 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3k92 h PRO 180 N 3.93 0.62 0.00 1.43 0.13 -1.91 -2.53 132.00 133.66 3k92 h PRO 180 Ca 0.18 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3k92 h PRO 180 Cb 0.64 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.63 3k92 h PRO 180 CO 0.82 0.41 0.00 0.41 -0.23 0.00 0.00 178.00 179.41 3k92 n GLY 181 N -1.47 -0.94 0.30 1.56 0.00 -1.26 -2.71 105.19 100.66 3k92 n GLY 181 Ca 0.08 0.05 0.04 0.00 0.00 0.00 0.00 46.02 46.18 3k92 n GLY 181 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3k92 h PHE 182 N 0.00 0.47 -2.70 1.61 3.57 -1.77 -3.37 116.94 114.75 3k92 h PHE 182 Ca 0.00 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.38 3k92 h PHE 182 Cb 0.18 -0.15 -0.24 0.00 2.79 0.00 0.00 35.95 38.52 3k92 h PHE 182 CO 0.00 0.33 -0.22 -1.50 -2.23 0.00 0.00 178.31 174.69 3k92 s ILE 183 N -5.36 -0.00 0.49 1.41 2.07 -1.10 -2.99 121.20 115.72 3k92 s ILE 183 Ca -0.08 0.01 0.07 0.00 -1.41 0.00 0.00 60.65 59.24 3k92 s ILE 183 Cb 0.17 -0.60 0.02 0.00 0.13 0.00 0.00 42.46 42.18 3k92 s ILE 183 CO 0.73 0.00 0.48 0.42 -1.91 0.00 0.00 174.94 174.67 3k92 s THR 184 N 0.33 2.24 -0.07 4.00 -4.23 -0.62 -4.67 115.64 112.61 3k92 s THR 184 Ca -0.01 -1.30 0.00 0.00 -1.18 0.00 0.00 61.69 59.20 3k92 s THR 184 Cb -0.03 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.27 3k92 s THR 184 CO -0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 3k92 n GLY 185 N -1.78 0.38 3.87 3.99 0.00 -1.26 -4.15 105.19 106.24 3k92 n GLY 185 Ca 0.05 -0.95 -0.31 0.00 0.00 0.00 0.00 46.02 44.81 3k92 n GLY 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k92 s LYS 186 N -3.18 3.76 0.49 1.61 1.02 -1.26 -4.12 119.74 118.06 3k92 s LYS 186 Ca 0.00 0.64 -0.22 0.00 0.02 0.00 0.00 55.97 56.41 3k92 s LYS 186 Cb 0.00 -2.24 -0.09 0.00 -0.52 0.00 0.00 37.83 34.98 3k92 s LYS 186 CO 0.00 -0.25 0.89 -2.30 -0.92 0.00 0.00 175.35 172.77 3k92 n PRO 187 N -1.83 1.04 -0.22 -1.68 -0.02 -1.26 -4.01 135.00 127.02 3k92 n PRO 187 Ca 0.04 0.38 0.03 0.00 -2.02 0.00 0.00 63.50 61.93 3k92 n PRO 187 Cb 0.54 -1.98 0.14 0.00 -0.02 0.00 0.00 33.50 32.18 3k92 n PRO 187 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3k92 h LEU 188 N 1.02 0.09 -0.19 2.45 4.07 -1.93 0.16 115.31 120.99 3k92 h LEU 188 Ca -0.45 0.11 0.00 0.00 0.08 0.00 0.00 57.88 57.62 3k92 h LEU 188 Cb 1.36 0.14 0.00 0.00 1.08 0.00 0.00 40.66 43.24 3k92 h LEU 188 CO 0.53 0.04 0.00 1.33 -1.08 0.00 0.00 178.44 179.26 3k92 n VAL 189 N -5.09 0.73 -0.44 1.22 0.24 -1.26 -1.91 118.33 111.81 3k92 n VAL 189 Ca 0.11 0.14 0.08 0.00 -2.04 0.00 0.00 64.34 62.63 3k92 n VAL 189 Cb 0.37 -0.91 0.33 0.00 -1.47 0.00 0.00 33.84 32.16 3k92 n VAL 189 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3k92 n LEU 190 N -1.78 4.54 0.00 1.34 4.77 0.50 -4.91 117.00 121.46 3k92 n LEU 190 Ca 0.04 -2.29 0.00 0.00 -0.03 0.00 0.00 56.01 53.73 3k92 n LEU 190 Cb 0.25 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 3k92 n LEU 190 CO 0.19 0.69 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 3k92 n GLY 191 N 0.93 1.26 3.69 -0.72 0.00 -0.80 -4.84 105.19 104.71 3k92 n GLY 191 Ca 0.23 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 3k92 n GLY 191 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3k92 s GLY 192 N -2.22 1.61 -0.05 -0.02 0.00 -0.75 -4.75 107.32 101.14 3k92 s GLY 192 Ca 0.00 -0.06 -0.13 0.00 0.00 0.00 0.00 44.72 44.53 3k92 s GLY 192 CO 0.00 0.46 0.33 -0.45 0.00 0.00 0.00 173.10 173.44 3k92 s SER 193 N -3.29 6.67 0.97 1.64 0.15 -1.26 -4.79 113.70 113.79 3k92 s SER 193 Ca 0.64 0.79 -0.11 0.00 0.70 0.00 0.00 55.95 57.98 3k92 s SER 193 Cb -0.19 -2.20 0.16 0.00 -1.71 0.00 0.00 66.02 62.09 3k92 s SER 193 CO 0.58 0.32 1.04 0.00 1.20 0.00 0.00 173.24 176.38 3k92 n GLN 194 N 2.04 -0.82 -1.09 5.44 1.13 -1.26 -4.09 117.38 118.73 3k92 n GLN 194 Ca -0.15 -0.18 -0.03 0.00 -1.94 0.00 0.00 57.00 54.69 3k92 n GLN 194 Cb 0.53 -2.28 -0.01 0.00 0.11 0.00 0.00 30.24 28.58 3k92 n GLN 194 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3k92 n GLY 195 N 0.54 0.62 0.07 1.08 0.00 -1.26 -4.93 105.19 101.32 3k92 n GLY 195 Ca 0.10 -0.41 -0.06 0.00 0.00 0.00 0.00 46.02 45.65 3k92 n GLY 195 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3k92 h ARG 196 N 0.33 0.00 -0.07 1.61 2.43 -1.96 -3.17 114.38 113.55 3k92 h ARG 196 Ca -0.07 0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 58.90 3k92 h ARG 196 Cb 0.35 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 3k92 h ARG 196 CO 0.10 0.92 -0.80 1.49 -1.51 0.00 0.00 179.97 180.17 3k92 h GLU 197 N 0.00 0.47 -0.23 0.20 4.57 -1.92 -3.25 114.58 114.42 3k92 h GLU 197 Ca -0.01 -0.41 0.00 0.00 -1.18 0.00 0.00 59.36 57.76 3k92 h GLU 197 Cb 1.68 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 30.36 3k92 h GLU 197 CO 0.12 1.05 0.00 0.25 -1.18 0.00 0.00 179.01 179.25 3k92 n THR 198 N -3.83 0.71 -0.31 0.32 -2.24 -1.26 -4.69 114.28 102.99 3k92 n THR 198 Ca -0.05 -0.86 0.11 0.00 -2.27 0.00 0.00 64.05 60.97 3k92 n THR 198 Cb 0.75 0.70 0.24 0.00 -2.10 0.00 0.00 70.33 69.92 3k92 n THR 198 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k92 h ALA 199 N 1.90 1.02 -0.10 6.98 0.00 -1.58 0.29 119.26 127.78 3k92 h ALA 199 Ca 0.00 0.29 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 3k92 h ALA 199 Cb 0.63 0.51 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 3k92 h ALA 199 CO 0.00 -0.50 -0.12 1.15 0.00 0.00 0.00 179.25 179.79 3k92 h THR 200 N 0.07 1.37 -0.40 0.00 2.02 -1.83 -3.00 112.91 111.13 3k92 h THR 200 Ca 0.52 -1.31 -0.09 0.00 0.77 0.00 0.00 66.41 66.30 3k92 h THR 200 Cb 1.01 2.01 -0.02 0.00 -1.74 0.00 0.00 68.15 69.42 3k92 h THR 200 CO -0.81 0.37 -0.12 0.00 0.37 0.00 0.00 175.52 175.34 3k92 h ALA 201 N 0.56 1.04 -0.34 6.16 0.00 -1.81 -2.85 119.26 122.02 3k92 h ALA 201 Ca 0.01 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3k92 h ALA 201 Cb 0.65 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 3k92 h ALA 201 CO 0.03 0.58 0.22 1.96 0.00 0.00 0.00 179.25 182.05 3k92 h GLN 202 N 0.65 0.44 0.00 0.00 4.20 -0.95 -1.55 115.11 117.90 3k92 h GLN 202 Ca 0.11 -0.03 -0.15 0.00 0.06 0.00 0.00 58.65 58.64 3k92 h GLN 202 Cb 0.58 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 3k92 h GLN 202 CO 0.04 0.29 -0.72 0.78 -0.67 0.00 0.00 178.83 178.55 3k92 h GLY 203 N 0.45 0.00 0.98 3.46 0.00 -1.36 -2.44 103.07 104.16 3k92 h GLY 203 Ca 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.45 3k92 h GLY 203 CO -0.03 0.00 -0.06 -2.08 0.00 0.00 0.00 176.54 174.38 3k92 h VAL 204 N 0.00 0.90 -0.77 4.60 2.07 -1.10 -1.97 116.25 119.98 3k92 h VAL 204 Ca -0.01 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.51 3k92 h VAL 204 Cb 1.48 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 32.12 3k92 h VAL 204 CO 0.09 0.01 0.47 0.71 0.02 0.00 0.00 177.57 178.88 3k92 h THR 205 N -0.18 1.06 -0.08 2.57 1.35 -1.26 -1.43 112.91 114.93 3k92 h THR 205 Ca -0.02 -0.31 -0.05 0.00 -0.55 0.00 0.00 66.41 65.49 3k92 h THR 205 Cb 0.14 0.09 -0.01 0.00 -1.73 0.00 0.00 68.15 66.64 3k92 h THR 205 CO 0.03 0.16 -0.17 0.40 -0.25 0.00 0.00 175.52 175.69 3k92 h ILE 206 N 0.89 1.16 -0.02 6.82 2.04 -1.30 -0.96 117.51 126.15 3k92 h ILE 206 Ca 0.32 -0.75 -0.12 0.00 1.00 0.00 0.00 64.86 65.31 3k92 h ILE 206 Cb 0.10 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 3k92 h ILE 206 CO -0.15 0.22 -0.56 0.00 0.00 0.00 0.00 178.15 177.67 3k92 h ILE 208 N 0.04 1.06 -0.90 0.00 2.04 -0.43 -2.10 117.51 117.23 3k92 h ILE 208 Ca -0.00 -0.63 0.20 0.00 1.00 0.00 0.00 64.86 65.43 3k92 h ILE 208 Cb 1.00 1.46 -0.07 0.00 -0.74 0.00 0.00 36.82 38.47 3k92 h ILE 208 CO 0.08 0.15 0.59 -0.33 0.00 0.00 0.00 178.15 178.64 3k92 h GLU 209 N -0.42 0.41 0.06 2.37 5.08 -1.20 0.78 114.58 121.66 3k92 h GLU 209 Ca -0.01 -0.02 -0.32 0.00 -1.00 0.00 0.00 59.36 58.00 3k92 h GLU 209 Cb 0.35 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 3k92 h GLU 209 CO 0.02 0.27 -1.82 0.93 -1.00 0.00 0.00 179.01 177.42 3k92 h GLU 210 N 0.42 0.13 -0.51 2.33 4.39 -1.42 -3.10 114.58 116.82 3k92 h GLU 210 Ca 0.47 -0.22 -0.00 0.00 0.34 0.00 0.00 59.36 59.95 3k92 h GLU 210 Cb 1.14 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 3k92 h GLU 210 CO -0.18 0.83 0.31 0.00 -1.16 0.00 0.00 179.01 178.81 3k92 h ALA 211 N 0.58 0.64 -0.25 3.43 0.00 -0.95 -2.94 119.26 119.78 3k92 h ALA 211 Ca -0.34 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.42 3k92 h ALA 211 Cb 2.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 3k92 h ALA 211 CO 0.09 0.13 -0.21 0.28 0.00 0.00 0.00 179.25 179.54 3k92 h VAL 212 N 0.68 1.25 -0.86 0.00 2.07 -0.96 -1.74 116.25 116.69 3k92 h VAL 212 Ca 0.18 -1.16 0.01 0.00 0.82 0.00 0.00 66.70 66.55 3k92 h VAL 212 Cb -0.02 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 3k92 h VAL 212 CO -0.03 0.37 0.57 0.11 0.02 0.00 0.00 177.57 178.61 3k92 h LYS 213 N 0.41 1.13 0.00 1.57 1.57 -1.48 -2.63 116.57 117.13 3k92 h LYS 213 Ca 0.07 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3k92 h LYS 213 Cb 0.60 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 3k92 h LYS 213 CO 0.04 0.75 -0.06 0.87 -0.57 0.00 0.00 179.45 180.48 3k92 h LYS 214 N 1.17 0.00 -0.32 3.15 1.79 -1.14 -2.91 116.57 118.31 3k92 h LYS 214 Ca 0.32 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.69 3k92 h LYS 214 Cb -0.13 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.47 3k92 h LYS 214 CO -0.07 0.06 -0.01 1.17 -1.08 0.00 0.00 179.45 179.52 3k92 n LYS 215 N -3.30 2.41 0.00 3.15 3.00 -1.01 -4.97 118.16 117.44 3k92 n LYS 215 Ca -0.01 -2.98 0.00 0.00 -0.00 0.00 0.00 58.31 55.32 3k92 n LYS 215 Cb 0.24 -1.84 0.00 0.00 0.00 0.00 0.00 35.03 33.43 3k92 n LYS 215 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3k92 n GLY 216 N -0.81 1.12 3.75 3.14 0.00 -1.10 -4.96 105.19 106.33 3k92 n GLY 216 Ca 0.28 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.91 3k92 n GLY 216 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k92 s ILE 217 N -0.17 2.06 0.03 -0.61 1.09 -1.08 -4.94 121.20 117.57 3k92 s ILE 217 Ca 0.00 0.04 -0.16 0.00 -1.10 0.00 0.00 60.65 59.43 3k92 s ILE 217 Cb 0.00 -3.02 -0.06 0.00 -1.06 0.00 0.00 42.46 38.32 3k92 s ILE 217 CO 0.00 0.00 0.47 -0.75 -0.10 0.00 0.00 174.94 174.56 3k92 s LYS 218 N -2.85 4.02 0.18 2.79 2.36 -1.26 -4.27 119.74 120.70 3k92 s LYS 218 Ca 0.70 0.53 -0.13 0.00 -2.55 0.00 0.00 55.97 54.52 3k92 s LYS 218 Cb -0.41 -3.22 0.14 0.00 -1.05 0.00 0.00 37.83 33.30 3k92 s LYS 218 CO 0.49 0.67 1.78 1.25 1.55 0.00 0.00 175.35 181.09 3k92 h LEU 219 N 4.60 0.35 -1.61 5.43 6.46 -1.94 -0.44 115.31 128.15 3k92 h LEU 219 Ca -0.51 0.03 0.14 0.00 -0.12 0.00 0.00 57.88 57.42 3k92 h LEU 219 Cb 1.22 -0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 41.07 3k92 h LEU 219 CO 0.62 0.24 0.48 0.06 -0.62 0.00 0.00 178.44 179.22 3k92 h GLN 220 N 0.48 0.39 -0.04 1.25 3.07 -1.77 -1.58 115.11 116.91 3k92 h GLN 220 Ca 0.23 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.94 3k92 h GLN 220 Cb 0.15 -0.09 0.00 0.00 0.08 0.00 0.00 27.48 27.62 3k92 h GLN 220 CO -0.17 0.26 0.00 0.09 0.09 0.00 0.00 178.83 179.10 3k92 n ASN 221 N -4.47 1.43 -4.74 0.06 5.03 -0.21 -3.50 115.26 108.85 3k92 n ASN 221 Ca 0.13 -1.51 -0.40 0.00 0.87 0.00 0.00 54.58 53.67 3k92 n ASN 221 Cb 0.50 -0.02 -0.05 0.00 -1.02 0.00 0.00 39.78 39.19 3k92 n ASN 221 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3k92 s ALA 222 N -1.96 3.33 -0.21 5.41 0.00 -0.59 -4.91 121.76 122.84 3k92 s ALA 222 Ca 0.37 0.69 -0.05 0.00 0.00 0.00 0.00 51.96 52.97 3k92 s ALA 222 Cb 0.20 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 20.03 3k92 s ALA 222 CO 0.32 0.01 0.01 1.03 0.00 0.00 0.00 175.76 177.13 3k92 s ARG 223 N -0.78 3.62 -0.02 0.00 0.52 -1.26 -1.84 118.95 119.19 3k92 s ARG 223 Ca 0.45 -0.52 0.03 0.00 -0.52 0.00 0.00 55.73 55.17 3k92 s ARG 223 Cb -0.27 -3.10 -0.00 0.00 0.52 0.00 0.00 34.95 32.09 3k92 s ARG 223 CO 0.33 -0.01 -0.12 -1.50 0.02 0.00 0.00 175.30 174.02 3k92 s ILE 224 N 1.07 0.98 -0.13 1.52 2.07 -0.39 -1.12 121.20 125.20 3k92 s ILE 224 Ca 0.02 -0.50 -0.04 0.00 -1.41 0.00 0.00 60.65 58.73 3k92 s ILE 224 Cb -0.14 -0.84 -0.03 0.00 0.13 0.00 0.00 42.46 41.57 3k92 s ILE 224 CO 0.02 0.29 0.00 -0.63 -1.91 0.00 0.00 174.94 172.71 3k92 s ILE 225 N -0.07 4.28 -0.14 2.00 1.01 -0.02 -1.93 121.20 126.33 3k92 s ILE 225 Ca 0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 60.65 60.42 3k92 s ILE 225 Cb -0.07 -2.86 0.03 0.00 0.01 0.00 0.00 42.46 39.57 3k92 s ILE 225 CO 0.00 0.53 -0.08 -0.63 0.00 0.00 0.00 174.94 174.76 3k92 s ILE 226 N -0.12 1.18 0.38 2.92 1.01 -0.66 -0.75 121.20 125.16 3k92 s ILE 226 Ca 0.04 -0.48 -0.24 0.00 0.00 0.00 0.00 60.65 59.98 3k92 s ILE 226 Cb -0.13 -1.22 -0.10 0.00 0.01 0.00 0.00 42.46 41.02 3k92 s ILE 226 CO 0.02 0.31 0.96 -1.10 0.00 0.00 0.00 174.94 175.13 3k92 s GLN 227 N 1.63 4.38 0.00 2.79 -0.21 -0.54 -2.49 119.66 125.22 3k92 s GLN 227 Ca 0.04 1.26 0.00 0.00 0.02 0.00 0.00 55.36 56.67 3k92 s GLN 227 Cb -0.13 -2.50 0.00 0.00 1.00 0.00 0.00 33.01 31.38 3k92 s GLN 227 CO -0.09 0.10 0.00 0.41 -2.12 0.00 0.00 175.29 173.59 3k92 n GLY 228 N 0.02 -3.15 1.04 3.09 0.00 -0.67 -3.83 105.19 101.68 3k92 n GLY 228 Ca 0.04 -1.03 0.04 0.00 0.00 0.00 0.00 46.02 45.07 3k92 n GLY 228 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3k92 n PHE 229 N -0.60 0.00 0.00 1.61 7.35 -1.11 -4.18 117.46 120.53 3k92 n PHE 229 Ca 0.00 -0.67 0.00 0.00 -0.76 0.00 0.00 57.45 56.02 3k92 n PHE 229 Cb 0.00 -0.16 0.00 0.00 0.35 0.00 0.00 39.48 39.67 3k92 n PHE 229 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3k92 n GLY 230 N -0.07 -0.21 0.21 7.13 0.00 -1.26 -4.42 105.19 106.57 3k92 n GLY 230 Ca 0.09 -1.52 -0.01 0.00 0.00 0.00 0.00 46.02 44.58 3k92 n GLY 230 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3k92 h ASN 231 N 0.00 0.05 0.32 1.61 -0.26 -1.99 -0.79 115.58 114.52 3k92 h ASN 231 Ca 0.00 0.09 -0.02 0.00 -0.56 0.00 0.00 56.30 55.82 3k92 h ASN 231 Cb 0.00 0.12 0.00 0.00 -1.06 0.00 0.00 38.32 37.38 3k92 h ASN 231 CO 0.00 0.05 -0.15 0.00 -1.06 0.00 0.00 177.43 176.26 3k92 h ALA 232 N 1.42 -0.43 -0.45 -0.83 0.00 -1.94 -2.85 119.26 114.18 3k92 h ALA 232 Ca 0.28 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3k92 h ALA 232 Cb 0.38 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 3k92 h ALA 232 CO -0.34 -0.54 0.29 0.78 0.00 0.00 0.00 179.25 179.44 3k92 h GLY 233 N -0.83 0.63 1.77 0.00 0.00 -1.68 -2.52 103.07 100.44 3k92 h GLY 233 Ca -0.04 -0.22 -0.10 0.00 0.00 0.00 0.00 47.33 46.96 3k92 h GLY 233 CO 0.07 0.21 -0.36 1.48 0.00 0.00 0.00 176.54 177.94 3k92 h SER 234 N 0.59 0.27 -0.24 0.19 4.64 -1.26 0.90 113.55 118.64 3k92 h SER 234 Ca 0.17 -0.10 -0.04 0.00 -0.47 0.00 0.00 61.79 61.34 3k92 h SER 234 Cb -0.05 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 3k92 h SER 234 CO -0.05 0.62 -0.01 0.15 -0.87 0.00 0.00 176.83 176.66 3k92 h PHE 235 N 0.22 0.48 -0.28 4.77 3.04 -1.24 0.05 116.94 123.99 3k92 h PHE 235 Ca 0.03 -0.09 -0.02 0.00 3.98 0.00 0.00 57.97 61.86 3k92 h PHE 235 Cb 0.75 -0.12 -0.01 0.00 2.56 0.00 0.00 35.95 39.12 3k92 h PHE 235 CO 0.01 0.62 0.08 -0.07 -2.02 0.00 0.00 178.31 176.94 3k92 h LEU 236 N 0.20 0.42 -0.28 0.59 -0.00 -1.17 -0.97 115.31 114.10 3k92 h LEU 236 Ca 0.07 -0.21 0.03 0.00 -0.00 0.00 0.00 57.88 57.76 3k92 h LEU 236 Cb 0.44 -0.11 -0.04 0.00 -0.00 0.00 0.00 40.66 40.96 3k92 h LEU 236 CO 0.02 0.52 -0.18 0.00 -0.00 0.00 0.00 178.44 178.79 3k92 h ALA 237 N 0.91 -0.23 -0.98 1.53 0.00 -0.73 0.13 119.26 119.89 3k92 h ALA 237 Ca 0.09 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.03 3k92 h ALA 237 Cb 0.26 1.06 -0.05 0.00 0.00 0.00 0.00 17.79 19.06 3k92 h ALA 237 CO -0.00 -0.35 0.63 -0.22 0.00 0.00 0.00 179.25 179.31 3k92 h LYS 238 N -0.03 1.30 -0.18 0.00 3.64 -0.91 0.33 116.57 120.72 3k92 h LYS 238 Ca 0.04 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3k92 h LYS 238 Cb 0.14 -0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 3k92 h LYS 238 CO -0.27 0.87 0.12 0.35 -2.27 0.00 0.00 179.45 178.25 3k92 h PHE 239 N 1.33 0.23 -0.16 1.91 3.57 -0.81 0.13 116.94 123.14 3k92 h PHE 239 Ca 0.36 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.84 3k92 h PHE 239 Cb -0.13 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 3k92 h PHE 239 CO 0.00 0.15 0.01 1.98 -2.23 0.00 0.00 178.31 178.23 3k92 h MET 240 N 0.24 0.28 -0.02 1.11 4.05 -0.11 -0.56 114.93 119.92 3k92 h MET 240 Ca 0.07 -0.08 0.03 0.00 -0.28 0.00 0.00 59.70 59.44 3k92 h MET 240 Cb -0.02 -0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 30.71 3k92 h MET 240 CO -0.01 0.47 -0.25 1.25 0.23 0.00 0.00 176.91 178.60 3k92 h HIS 241 N 0.04 -0.67 0.00 1.39 -0.00 -0.82 -2.34 115.15 112.75 3k92 h HIS 241 Ca 0.05 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.43 3k92 h HIS 241 Cb 0.34 0.30 -0.00 0.00 -0.00 0.00 0.00 27.41 28.05 3k92 h HIS 241 CO 0.03 -0.34 -0.06 -0.44 -0.00 0.00 0.00 177.93 177.12 3k92 h ASP 242 N -0.38 0.00 0.65 3.26 3.32 -0.57 -0.56 116.42 122.14 3k92 h ASP 242 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3k92 h ASP 242 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 3k92 h ASP 242 CO -0.23 0.06 0.00 0.00 -1.72 0.00 0.00 179.24 177.34 3k92 n ALA 243 N -2.26 2.00 -0.68 3.45 0.00 -0.23 -4.89 120.51 117.90 3k92 n ALA 243 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.34 3k92 n ALA 243 Cb 0.16 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.27 3k92 n ALA 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k92 n GLY 244 N 0.65 0.66 4.01 0.00 0.00 -0.22 -4.38 105.19 105.92 3k92 n GLY 244 Ca 0.06 -0.66 -0.18 0.00 0.00 0.00 0.00 46.02 45.25 3k92 n GLY 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k92 s ALA 245 N -2.00 4.54 -0.28 4.61 0.00 -0.92 -4.34 121.76 123.37 3k92 s ALA 245 Ca 0.00 -1.76 0.01 0.00 0.00 0.00 0.00 51.96 50.21 3k92 s ALA 245 Cb 0.00 -1.61 0.06 0.00 0.00 0.00 0.00 23.12 21.56 3k92 s ALA 245 CO 0.00 -0.43 -0.06 0.15 0.00 0.00 0.00 175.76 175.42 3k92 s LYS 246 N -4.44 2.31 -1.09 0.00 1.02 -0.77 -4.30 119.74 112.47 3k92 s LYS 246 Ca 0.57 -1.32 -0.22 0.00 0.02 0.00 0.00 55.97 55.01 3k92 s LYS 246 Cb -0.09 -3.02 0.05 0.00 -0.52 0.00 0.00 37.83 34.25 3k92 s LYS 246 CO 0.35 -0.60 1.52 0.08 -0.92 0.00 0.00 175.35 175.78 3k92 s VAL 247 N 1.16 3.96 0.25 3.17 1.01 -1.26 -1.26 120.40 127.43 3k92 s VAL 247 Ca -0.07 -1.04 -0.04 0.00 0.00 0.00 0.00 61.98 60.83 3k92 s VAL 247 Cb -0.20 -5.09 0.21 0.00 0.00 0.00 0.00 36.38 31.31 3k92 s VAL 247 CO -0.03 -1.95 1.75 0.40 0.00 0.00 0.00 175.10 175.27 3k92 h ILE 248 N 6.51 0.73 -3.94 2.22 5.03 -1.62 -0.30 117.51 126.13 3k92 h ILE 248 Ca 0.26 -0.19 -0.21 0.00 -0.12 0.00 0.00 64.86 64.60 3k92 h ILE 248 Cb 0.98 0.14 -0.22 0.00 -3.03 0.00 0.00 36.82 34.68 3k92 h ILE 248 CO 1.44 0.10 -0.71 -0.83 -0.68 0.00 0.00 178.15 177.46 3k92 s GLY 249 N -3.40 0.27 0.33 5.37 0.00 -1.10 -1.20 107.32 107.59 3k92 s GLY 249 Ca -0.12 -0.53 0.03 0.00 0.00 0.00 0.00 44.72 44.10 3k92 s GLY 249 CO 0.77 -0.58 0.09 -1.50 0.00 0.00 0.00 173.10 171.88 3k92 s ILE 250 N -1.16 0.84 -0.12 0.90 2.07 -0.68 -1.65 121.20 121.39 3k92 s ILE 250 Ca -0.11 -2.00 -0.30 0.00 -1.41 0.00 0.00 60.65 56.82 3k92 s ILE 250 Cb -0.08 -2.63 0.12 0.00 0.13 0.00 0.00 42.46 40.00 3k92 s ILE 250 CO -0.00 0.00 1.00 -0.55 -1.91 0.00 0.00 174.94 173.48 3k92 s SER 251 N -3.47 -0.33 0.00 4.50 0.15 -1.04 -2.15 113.70 111.36 3k92 s SER 251 Ca 0.34 0.23 0.00 0.00 0.70 0.00 0.00 55.95 57.21 3k92 s SER 251 Cb 0.07 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.67 3k92 s SER 251 CO 0.15 -0.40 0.00 -0.90 1.20 0.00 0.00 173.24 173.29 3k92 n ASP 252 N 0.35 0.00 -0.28 5.45 5.68 -0.06 -1.67 116.55 126.01 3k92 n ASP 252 Ca -0.08 -0.33 0.03 0.00 -0.50 0.00 0.00 54.79 53.91 3k92 n ASP 252 Cb 0.59 0.00 0.17 0.00 -1.14 0.00 0.00 41.12 40.74 3k92 n ASP 252 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k92 h ALA 253 N 1.40 1.15 -0.02 2.12 0.00 -2.02 -2.78 119.26 119.10 3k92 h ALA 253 Ca 0.00 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3k92 h ALA 253 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3k92 h ALA 253 CO 0.00 0.07 -0.24 -0.91 0.00 0.00 0.00 179.25 178.17 3k92 h ASN 254 N 0.76 0.03 -1.99 0.00 -0.26 -1.99 -3.50 115.58 108.63 3k92 h ASN 254 Ca 0.39 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 56.13 3k92 h ASN 254 Cb 0.38 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.63 3k92 h ASN 254 CO -0.26 0.28 0.00 0.61 -1.06 0.00 0.00 177.43 177.00 3k92 n GLY 255 N -0.81 0.62 3.40 2.83 0.00 -1.05 -4.95 105.19 105.24 3k92 n GLY 255 Ca -0.02 -1.77 -0.25 0.00 0.00 0.00 0.00 46.02 43.98 3k92 n GLY 255 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3k92 s GLY 256 N 0.00 1.64 -0.10 -0.02 0.00 -0.29 -0.88 107.32 107.66 3k92 s GLY 256 Ca 0.00 -1.63 0.02 0.00 0.00 0.00 0.00 44.72 43.10 3k92 s GLY 256 CO 0.00 -1.68 -0.16 1.08 0.00 0.00 0.00 173.10 172.35 3k92 s LEU 257 N -2.81 2.59 0.01 0.66 2.01 -0.92 -1.66 118.68 118.56 3k92 s LEU 257 Ca 0.21 -0.34 0.07 0.00 0.01 0.00 0.00 54.13 54.08 3k92 s LEU 257 Cb -0.07 -1.55 -0.02 0.00 0.01 0.00 0.00 46.19 44.56 3k92 s LEU 257 CO 0.10 0.21 -0.23 -0.47 1.01 0.00 0.00 176.35 176.97 3k92 s TYR 258 N 0.08 2.04 -0.29 0.29 5.04 -1.26 -1.69 117.35 121.55 3k92 s TYR 258 Ca -0.07 -0.39 -0.01 0.00 -2.44 0.00 0.00 57.07 54.16 3k92 s TYR 258 Cb -0.15 -1.27 0.19 0.00 0.35 0.00 0.00 41.96 41.08 3k92 s TYR 258 CO 0.05 0.02 0.75 1.21 -1.34 0.00 0.00 175.55 176.24 3k92 s ASN 259 N -0.79 -1.18 0.63 4.32 3.84 -0.34 -5.01 114.94 116.40 3k92 s ASN 259 Ca 0.09 0.29 0.24 0.00 0.21 0.00 0.00 52.86 53.69 3k92 s ASN 259 Cb -0.09 1.81 1.19 0.00 -0.55 0.00 0.00 41.25 43.61 3k92 s ASN 259 CO 0.00 -0.22 1.65 -0.65 -2.79 0.00 0.00 177.10 175.10 3k92 h PRO 260 N 7.82 0.00 0.00 0.43 0.11 -1.97 -0.50 132.00 137.90 3k92 h PRO 260 Ca -0.08 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.97 3k92 h PRO 260 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3k92 h PRO 260 CO 0.09 0.00 -0.26 -0.44 -0.21 0.00 0.00 178.00 177.17 3k92 h ASP 261 N 0.00 0.00 0.00 -2.05 5.19 -1.96 -3.48 116.42 114.12 3k92 h ASP 261 Ca 0.17 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 3k92 h ASP 261 Cb 1.48 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.99 3k92 h ASP 261 CO -0.00 0.26 0.00 0.61 -3.12 0.00 0.00 179.24 176.99 3k92 n GLY 262 N 1.09 2.73 3.81 2.75 0.00 -0.19 -4.96 105.19 110.42 3k92 n GLY 262 Ca 0.03 -1.29 -0.31 0.00 0.00 0.00 0.00 46.02 44.45 3k92 n GLY 262 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k92 s LEU 263 N 0.00 3.08 -1.19 0.99 1.43 -0.12 -4.94 118.68 117.92 3k92 s LEU 263 Ca 0.00 1.64 -0.16 0.00 -1.03 0.00 0.00 54.13 54.58 3k92 s LEU 263 Cb 0.00 -4.47 0.13 0.00 0.03 0.00 0.00 46.19 41.88 3k92 s LEU 263 CO 0.00 -1.59 1.49 -0.62 0.23 0.00 0.00 176.35 175.86 3k92 s ASP 264 N -3.72 6.93 0.12 2.29 3.68 -1.26 -4.80 116.67 119.91 3k92 s ASP 264 Ca 0.59 -2.66 -0.14 0.00 2.13 0.00 0.00 52.55 52.46 3k92 s ASP 264 Cb -0.15 -2.46 -0.02 0.00 -1.45 0.00 0.00 42.92 38.84 3k92 s ASP 264 CO 0.55 -0.94 1.56 0.40 0.13 0.00 0.00 175.17 176.87 3k92 h ILE 265 N 5.15 1.27 -0.99 4.11 1.08 -1.94 0.54 117.51 126.72 3k92 h ILE 265 Ca 0.33 -1.07 0.21 0.00 -0.39 0.00 0.00 64.86 63.95 3k92 h ILE 265 Cb 0.90 1.16 -0.10 0.00 -3.07 0.00 0.00 36.82 35.70 3k92 h ILE 265 CO 1.30 0.36 0.62 -0.65 -0.69 0.00 0.00 178.15 179.09 3k92 h PRO 266 N 0.55 0.59 0.01 2.37 0.11 -1.99 0.54 132.00 134.18 3k92 h PRO 266 Ca 0.11 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.06 3k92 h PRO 266 Cb 0.52 -0.13 0.01 0.00 0.11 0.00 0.00 31.00 31.51 3k92 h PRO 266 CO 0.03 0.39 -0.48 -0.92 -0.21 0.00 0.00 178.00 176.80 3k92 h TYR 267 N 0.61 0.46 -0.51 0.65 -0.00 -1.76 -2.72 116.97 113.70 3k92 h TYR 267 Ca 0.57 -0.26 -0.09 0.00 -0.00 0.00 0.00 58.73 58.95 3k92 h TYR 267 Cb 1.10 -0.05 -0.02 0.00 -0.00 0.00 0.00 36.73 37.76 3k92 h TYR 267 CO -0.00 1.09 -0.05 -0.07 -0.00 0.00 0.00 178.16 179.13 3k92 h LEU 268 N -0.30 0.87 -0.39 2.82 3.38 -0.34 -1.95 115.31 119.40 3k92 h LEU 268 Ca -0.06 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.68 3k92 h LEU 268 Cb 1.23 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 3k92 h LEU 268 CO 0.09 0.96 0.22 -0.07 0.09 0.00 0.00 178.44 179.73 3k92 h LEU 269 N 0.81 0.35 -2.12 1.67 3.38 -0.05 -3.21 115.31 116.15 3k92 h LEU 269 Ca 0.14 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.19 3k92 h LEU 269 Cb 0.55 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3k92 h LEU 269 CO 0.03 0.26 0.21 -0.78 0.09 0.00 0.00 178.44 178.25 3k92 h ASP 270 N 0.45 0.00 -3.64 -0.43 3.58 -1.02 -3.30 116.42 112.06 3k92 h ASP 270 Ca 0.16 0.00 -0.64 0.00 0.42 0.00 0.00 57.03 56.96 3k92 h ASP 270 Cb 0.02 0.00 -0.39 0.00 1.72 0.00 0.00 39.33 40.68 3k92 h ASP 270 CO -0.08 0.00 -0.75 -1.59 -2.88 0.00 0.00 179.24 173.94 3k92 s LYS 271 N -4.83 1.52 0.35 0.28 -2.85 -1.14 -5.10 119.74 107.97 3k92 s LYS 271 Ca -0.05 -1.55 -0.17 0.00 -1.00 0.00 0.00 55.97 53.20 3k92 s LYS 271 Cb 0.17 -2.90 0.06 0.00 -2.06 0.00 0.00 37.83 33.10 3k92 s LYS 271 CO 0.62 -0.84 0.85 -0.98 0.10 0.00 0.00 175.35 175.10 3k92 s ARG 272 N 1.10 2.06 0.02 1.78 1.70 -1.25 -4.60 118.95 119.76 3k92 s ARG 272 Ca 0.05 -1.33 -0.00 0.00 -0.47 0.00 0.00 55.73 53.97 3k92 s ARG 272 Cb -0.19 0.57 -0.00 0.00 -0.57 0.00 0.00 34.95 34.76 3k92 s ARG 272 CO -0.10 -0.97 -0.01 -0.25 -1.08 0.00 0.00 175.30 172.90 3k92 n ASP 273 N -1.42 0.24 0.05 -2.89 8.00 -1.26 -5.01 116.55 114.26 3k92 n ASP 273 Ca -0.07 0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.46 3k92 n ASP 273 Cb 0.60 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 3k92 n ASP 273 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 3k92 n MET 277 N -2.72 0.00 0.00 -1.24 0.00 -1.26 -5.09 117.12 106.81 3k92 n MET 277 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 3k92 n MET 277 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.23 3k92 n MET 277 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 175.97 177.30 3k92 n VAL 278 N -2.71 0.00 -0.34 1.12 0.24 -1.26 -4.95 118.33 110.43 3k92 n VAL 278 Ca 0.00 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.32 3k92 n VAL 278 Cb 0.00 -0.05 0.16 0.00 -1.47 0.00 0.00 33.84 32.49 3k92 n VAL 278 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 3k92 h THR 279 N 0.00 1.05 -1.18 3.34 2.02 -1.94 -3.06 112.91 113.14 3k92 h THR 279 Ca 0.00 -0.36 0.34 0.00 0.77 0.00 0.00 66.41 67.15 3k92 h THR 279 Cb 0.08 -0.11 -0.07 0.00 -1.74 0.00 0.00 68.15 66.31 3k92 h THR 279 CO 0.00 0.19 0.82 -0.55 0.37 0.00 0.00 175.52 176.36 3k92 h ASN 280 N 1.06 0.13 -0.26 4.18 7.08 -1.94 -2.10 115.58 123.73 3k92 h ASN 280 Ca 0.41 0.03 0.00 0.00 -3.08 0.00 0.00 56.30 53.66 3k92 h ASN 280 Cb 0.20 0.01 0.00 0.00 -2.08 0.00 0.00 38.32 36.45 3k92 h ASN 280 CO -0.18 0.01 0.00 0.18 -2.08 0.00 0.00 177.43 175.36 3k92 n LEU 281 N -4.32 2.80 -4.11 6.14 7.99 -1.16 -4.85 117.00 119.49 3k92 n LEU 281 Ca 0.27 -1.41 -0.17 0.00 -0.01 0.00 0.00 56.01 54.69 3k92 n LEU 281 Cb 1.18 -0.51 -0.12 0.00 -0.11 0.00 0.00 43.42 43.86 3k92 n LEU 281 CO 0.36 0.42 -0.44 -0.36 -1.51 0.00 0.00 177.39 175.85 3k92 s PHE 282 N -1.73 0.99 0.57 -1.77 0.08 -0.79 -5.16 117.98 110.17 3k92 s PHE 282 Ca 0.23 -0.42 -0.03 0.00 0.12 0.00 0.00 56.93 56.83 3k92 s PHE 282 Cb 0.17 -0.57 0.02 0.00 -0.57 0.00 0.00 43.02 42.07 3k92 s PHE 282 CO 0.08 0.00 0.84 0.95 -0.10 0.00 0.00 175.22 177.00 3k92 s THR 283 N -1.13 3.22 -0.75 0.64 -4.23 -1.26 -4.47 115.64 107.66 3k92 s THR 283 Ca -0.04 -0.32 -0.01 0.00 -1.18 0.00 0.00 61.69 60.15 3k92 s THR 283 Cb -0.09 -3.26 0.00 0.00 1.34 0.00 0.00 72.50 70.49 3k92 s THR 283 CO 0.01 -0.23 0.07 0.47 -0.54 0.00 0.00 174.62 174.40 3k92 n ASP 284 N -2.49 -3.23 -4.61 3.99 10.43 -1.26 -4.99 116.55 114.40 3k92 n ASP 284 Ca 0.05 -0.04 -0.43 0.00 2.57 0.00 0.00 54.79 56.95 3k92 n ASP 284 Cb 0.59 -2.42 -0.03 0.00 1.84 0.00 0.00 41.12 41.10 3k92 n ASP 284 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3k92 s VAL 285 N -2.54 4.46 0.70 2.53 1.01 -1.26 -4.78 120.40 120.52 3k92 s VAL 285 Ca 0.03 1.29 -0.04 0.00 0.00 0.00 0.00 61.98 63.26 3k92 s VAL 285 Cb -0.01 -4.43 0.09 0.00 0.00 0.00 0.00 36.38 32.02 3k92 s VAL 285 CO 0.04 -0.67 0.99 0.27 0.00 0.00 0.00 175.10 175.74 3k92 s ILE 286 N 3.78 2.29 0.31 2.22 -4.36 -0.66 -4.84 121.20 119.94 3k92 s ILE 286 Ca 0.42 -0.41 -0.10 0.00 -0.26 0.00 0.00 60.65 60.30 3k92 s ILE 286 Cb -0.11 -2.88 -0.07 0.00 1.25 0.00 0.00 42.46 40.65 3k92 s ILE 286 CO 0.22 0.00 0.65 0.42 0.24 0.00 0.00 174.94 176.47 3k92 s THR 287 N -3.19 4.85 0.52 8.37 -4.23 -1.26 -1.14 115.64 119.57 3k92 s THR 287 Ca 0.63 0.53 0.26 0.00 -1.18 0.00 0.00 61.69 61.92 3k92 s THR 287 Cb -0.08 -3.67 0.41 0.00 1.34 0.00 0.00 72.50 70.50 3k92 s THR 287 CO 0.44 -0.28 1.96 0.78 -0.54 0.00 0.00 174.62 176.98 3k92 h ASN 288 N 1.93 0.05 0.06 3.99 -0.26 -1.92 -0.62 115.58 118.81 3k92 h ASN 288 Ca -0.47 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.27 3k92 h ASN 288 Cb 1.18 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 38.43 3k92 h ASN 288 CO 0.66 0.02 -0.03 -0.33 -1.06 0.00 0.00 177.43 176.70 3k92 h GLU 289 N 0.05 -0.08 0.01 0.81 3.07 -1.99 -2.70 114.58 113.75 3k92 h GLU 289 Ca 0.31 0.01 -0.21 0.00 -0.50 0.00 0.00 59.36 58.96 3k92 h GLU 289 Cb 1.17 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 29.07 3k92 h GLU 289 CO -0.02 -0.00 -1.00 1.05 -1.40 0.00 0.00 179.01 177.64 3k92 h GLU 290 N -0.14 0.02 -0.88 2.33 4.11 -1.73 -3.05 114.58 115.23 3k92 h GLU 290 Ca -0.01 -0.03 0.13 0.00 0.07 0.00 0.00 59.36 59.52 3k92 h GLU 290 Cb 0.12 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.31 3k92 h GLU 290 CO 0.01 1.00 0.57 1.25 0.07 0.00 0.00 179.01 181.92 3k92 h LEU 291 N 0.00 0.69 -1.43 3.06 5.85 -1.14 -2.00 115.31 120.34 3k92 h LEU 291 Ca -0.02 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 3k92 h LEU 291 Cb 1.76 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.67 3k92 h LEU 291 CO 0.13 0.37 0.23 -0.07 -0.34 0.00 0.00 178.44 178.76 3k92 h LEU 292 N 0.74 0.55 -0.83 2.25 3.38 -1.36 -2.97 115.31 117.05 3k92 h LEU 292 Ca 0.43 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.36 3k92 h LEU 292 Cb 0.62 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3k92 h LEU 292 CO -0.19 0.46 -0.07 -0.62 0.09 0.00 0.00 178.44 178.10 3k92 n GLU 293 N -4.41 1.43 -0.83 1.13 1.02 -0.76 -4.46 120.64 113.75 3k92 n GLU 293 Ca 0.03 -0.83 -0.29 0.00 -0.02 0.00 0.00 57.16 56.05 3k92 n GLU 293 Cb 0.11 -1.48 0.20 0.00 -0.02 0.00 0.00 31.44 30.25 3k92 n GLU 293 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3k92 s LYS 294 N -2.15 0.04 0.06 3.49 3.01 -1.13 -4.35 119.74 118.72 3k92 s LYS 294 Ca 0.34 0.86 -0.27 0.00 -1.01 0.00 0.00 55.97 55.88 3k92 s LYS 294 Cb 0.20 -1.66 -0.05 0.00 -1.01 0.00 0.00 37.83 35.31 3k92 s LYS 294 CO 0.39 -3.09 0.86 0.34 0.51 0.00 0.00 175.35 174.36 3k92 s ASP 295 N -2.92 7.32 0.10 2.83 2.15 -1.26 -4.17 116.67 120.72 3k92 s ASP 295 Ca 0.67 1.59 -0.26 0.00 0.43 0.00 0.00 52.55 54.97 3k92 s ASP 295 Cb -0.22 -2.52 0.08 0.00 -0.30 0.00 0.00 42.92 39.96 3k92 s ASP 295 CO 0.61 -0.05 0.99 0.00 -0.17 0.00 0.00 175.17 176.55 3k92 h ASP 297 N 2.00 0.14 -3.22 0.00 3.32 -1.46 -3.35 116.42 113.85 3k92 h ASP 297 Ca -0.24 -0.94 -0.67 0.00 0.02 0.00 0.00 57.03 55.20 3k92 h ASP 297 Cb 1.23 -0.04 -0.34 0.00 0.22 0.00 0.00 39.33 40.39 3k92 h ASP 297 CO 0.27 1.17 -0.87 -0.63 -1.72 0.00 0.00 179.24 177.46 3k92 s ILE 298 N -2.30 2.02 -0.19 0.35 1.01 -1.04 0.17 121.20 121.22 3k92 s ILE 298 Ca -0.19 -0.96 -0.05 0.00 0.00 0.00 0.00 60.65 59.45 3k92 s ILE 298 Cb -0.01 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 3k92 s ILE 298 CO 0.72 0.54 -0.00 -0.22 0.00 0.00 0.00 174.94 175.98 3k92 s LEU 299 N 0.77 3.32 -0.38 2.97 0.20 0.05 -0.84 118.68 124.76 3k92 s LEU 299 Ca -0.08 -0.15 0.04 0.00 0.69 0.00 0.00 54.13 54.62 3k92 s LEU 299 Cb -0.16 -1.83 0.11 0.00 -0.43 0.00 0.00 46.19 43.88 3k92 s LEU 299 CO -0.01 0.10 0.10 -0.69 -0.29 0.00 0.00 176.35 175.56 3k92 s VAL 300 N 0.79 2.22 0.18 1.68 1.01 0.07 -0.88 120.40 125.47 3k92 s VAL 300 Ca 0.00 -2.48 -0.27 0.00 0.00 0.00 0.00 61.98 59.23 3k92 s VAL 300 Cb -0.14 -2.62 -0.08 0.00 0.00 0.00 0.00 36.38 33.54 3k92 s VAL 300 CO 0.02 -0.65 0.84 -2.16 0.00 0.00 0.00 175.10 173.15 3k92 s PRO 301 N 0.70 4.67 0.31 2.72 0.04 -1.25 -1.47 135.00 140.71 3k92 s PRO 301 Ca 0.12 1.28 0.05 0.00 0.04 0.00 0.00 61.00 62.49 3k92 s PRO 301 Cb -0.20 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 31.03 3k92 s PRO 301 CO -0.07 0.51 0.45 0.00 0.04 0.00 0.00 177.00 177.93 3k92 s ALA 302 N -1.00 3.99 0.00 8.56 0.00 -1.25 -2.74 121.76 129.32 3k92 s ALA 302 Ca 0.38 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 51.09 3k92 s ALA 302 Cb -0.24 -1.80 0.00 0.00 0.00 0.00 0.00 23.12 21.08 3k92 s ALA 302 CO 0.28 0.05 0.00 0.00 0.00 0.00 0.00 175.76 176.10 3k92 n ALA 303 N -1.60 0.00 -2.84 0.00 0.00 -1.26 -4.91 120.51 109.90 3k92 n ALA 303 Ca -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.37 3k92 n ALA 303 Cb 0.57 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.00 3k92 n ALA 303 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3k92 n ILE 304 N 0.00 -6.41 -1.76 0.00 2.08 -1.26 -4.53 119.36 107.49 3k92 n ILE 304 Ca 0.00 1.28 -0.39 0.00 0.56 0.00 0.00 62.75 64.21 3k92 n ILE 304 Cb 0.00 -4.31 0.04 0.00 -0.75 0.00 0.00 39.64 34.62 3k92 n ILE 304 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 3k92 s SER 305 N -0.30 5.36 -1.47 4.38 0.01 -1.26 -3.82 113.70 116.60 3k92 s SER 305 Ca -0.13 2.83 -0.11 0.00 1.31 0.00 0.00 55.95 59.86 3k92 s SER 305 Cb 0.01 -2.64 0.06 0.00 0.21 0.00 0.00 66.02 63.66 3k92 s SER 305 CO 0.35 -1.52 0.96 0.59 0.41 0.00 0.00 173.24 174.04 3k92 n ASN 306 N -0.86 -4.37 0.30 2.44 3.02 -0.94 -4.88 115.26 109.97 3k92 n ASN 306 Ca 0.09 -0.76 -0.16 0.00 -0.03 0.00 0.00 54.58 53.73 3k92 n ASN 306 Cb 0.44 -4.06 -0.08 0.00 -0.61 0.00 0.00 39.78 35.46 3k92 n ASN 306 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 3k92 h GLN 307 N -2.13 -0.72 -5.57 3.52 1.08 -1.03 -3.41 115.11 106.86 3k92 h GLN 307 Ca -0.58 0.05 -0.63 0.00 -1.45 0.00 0.00 58.65 56.04 3k92 h GLN 307 Cb 1.37 0.16 -0.13 0.00 -0.05 0.00 0.00 27.48 28.84 3k92 h GLN 307 CO 0.64 -0.42 0.21 0.42 -0.95 0.00 0.00 178.83 178.73 3k92 s ILE 308 N -5.39 4.84 0.00 2.54 1.01 -0.44 -4.90 121.20 118.87 3k92 s ILE 308 Ca -0.16 0.64 0.00 0.00 0.00 0.00 0.00 60.65 61.13 3k92 s ILE 308 Cb 0.03 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.38 3k92 s ILE 308 CO 0.56 -0.36 0.00 0.35 0.00 0.00 0.00 174.94 175.49 3k92 n THR 309 N 5.66 0.00 0.20 2.92 -2.24 -1.26 -1.82 114.28 117.74 3k92 n THR 309 Ca -0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 3k92 n THR 309 Cb 0.48 0.00 0.38 0.00 -2.10 0.00 0.00 70.33 69.10 3k92 n THR 309 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k92 h ALA 310 N 1.00 1.06 0.39 6.98 0.00 -1.95 -1.20 119.26 125.54 3k92 h ALA 310 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 3k92 h ALA 310 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3k92 h ALA 310 CO 0.00 0.43 -0.19 0.87 0.00 0.00 0.00 179.25 180.37 3k92 h LYS 311 N 0.00 -0.50 -0.83 0.00 1.57 -1.98 -3.35 116.57 111.48 3k92 h LYS 311 Ca -0.00 0.03 0.10 0.00 -1.87 0.00 0.00 60.65 58.91 3k92 h LYS 311 Cb 0.81 0.11 -0.06 0.00 0.08 0.00 0.00 32.23 33.18 3k92 h LYS 311 CO 0.04 -0.33 0.54 -0.91 -0.57 0.00 0.00 179.45 178.22 3k92 h ASN 312 N -0.69 0.69 -0.98 0.86 -0.26 -1.90 -3.38 115.58 109.91 3k92 h ASN 312 Ca -0.05 0.02 0.14 0.00 -0.56 0.00 0.00 56.30 55.84 3k92 h ASN 312 Cb 0.40 -0.12 -0.09 0.00 -1.06 0.00 0.00 38.32 37.45 3k92 h ASN 312 CO 0.09 0.40 0.62 0.00 -1.06 0.00 0.00 177.43 177.48 3k92 h ALA 313 N 1.59 1.61 0.00 -0.83 0.00 -1.35 0.12 119.26 120.40 3k92 h ALA 313 Ca 0.39 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.27 3k92 h ALA 313 Cb 0.48 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3k92 h ALA 313 CO -0.16 0.12 -0.27 0.45 0.00 0.00 0.00 179.25 179.39 3k92 h HIS 314 N 0.90 0.00 0.00 0.00 3.86 -1.82 -3.09 115.15 115.00 3k92 h HIS 314 Ca 0.50 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.71 3k92 h HIS 314 Cb 0.60 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.07 3k92 h HIS 314 CO -0.00 0.27 -0.43 -0.91 0.86 0.00 0.00 177.93 177.72 3k92 h ASN 315 N 0.00 0.00 -2.66 2.45 2.35 -1.02 -3.46 115.58 113.24 3k92 h ASN 315 Ca -0.00 -0.12 -0.53 0.00 -0.55 0.00 0.00 56.30 55.09 3k92 h ASN 315 Cb 0.87 0.00 0.03 0.00 0.05 0.00 0.00 38.32 39.27 3k92 h ASN 315 CO 0.04 0.06 1.02 -0.63 -1.65 0.00 0.00 177.43 176.27 3k92 s ILE 316 N -3.16 2.85 -0.60 2.81 1.09 -1.09 -4.64 121.20 118.45 3k92 s ILE 316 Ca 0.07 0.36 0.23 0.00 -1.10 0.00 0.00 60.65 60.21 3k92 s ILE 316 Cb 0.12 -3.23 -0.13 0.00 -1.06 0.00 0.00 42.46 38.16 3k92 s ILE 316 CO 0.69 0.00 0.98 1.67 -0.10 0.00 0.00 174.94 178.18 3k92 n GLN 317 N 5.47 0.29 -2.27 2.79 -0.06 -1.26 -4.97 117.38 117.38 3k92 n GLN 317 Ca 0.16 -0.02 -0.39 0.00 -2.00 0.00 0.00 57.00 54.76 3k92 n GLN 317 Cb 0.40 -1.58 -0.02 0.00 -4.06 0.00 0.00 30.24 24.97 3k92 n GLN 317 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3k92 s ALA 318 N -3.20 3.20 0.17 1.69 0.00 -1.25 -4.62 121.76 117.74 3k92 s ALA 318 Ca 0.03 1.01 0.15 0.00 0.00 0.00 0.00 51.96 53.16 3k92 s ALA 318 Cb 0.14 -3.39 0.49 0.00 0.00 0.00 0.00 23.12 20.36 3k92 s ALA 318 CO 0.81 -0.55 1.65 1.03 0.00 0.00 0.00 175.76 178.71 3k92 h SER 319 N 2.74 0.00 -3.31 0.00 0.87 -0.41 -3.45 113.55 110.00 3k92 h SER 319 Ca -0.49 0.00 -0.44 0.00 -1.23 0.00 0.00 61.79 59.63 3k92 h SER 319 Cb 1.23 0.00 -0.37 0.00 -0.44 0.00 0.00 62.40 62.83 3k92 h SER 319 CO 0.63 0.49 -0.77 -0.63 -0.53 0.00 0.00 176.83 176.01 3k92 s ILE 320 N -3.52 0.51 -0.21 2.23 1.01 -0.44 -0.78 121.20 120.01 3k92 s ILE 320 Ca -0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 60.65 60.57 3k92 s ILE 320 Cb 0.11 -0.61 -0.04 0.00 0.01 0.00 0.00 42.46 41.93 3k92 s ILE 320 CO 0.72 0.26 0.07 -0.69 0.00 0.00 0.00 174.94 175.30 3k92 s VAL 321 N 1.60 4.60 -0.34 2.92 1.01 0.10 -0.77 120.40 129.52 3k92 s VAL 321 Ca -0.00 -0.09 0.02 0.00 0.00 0.00 0.00 61.98 61.91 3k92 s VAL 321 Cb -0.13 -3.10 0.09 0.00 0.00 0.00 0.00 36.38 33.24 3k92 s VAL 321 CO -0.04 0.41 0.05 -0.69 0.00 0.00 0.00 175.10 174.82 3k92 s VAL 322 N 0.89 2.47 0.21 2.92 1.01 -0.06 -0.56 120.40 127.28 3k92 s VAL 322 Ca 0.04 -2.13 -0.31 0.00 0.00 0.00 0.00 61.98 59.58 3k92 s VAL 322 Cb -0.14 -2.72 -0.10 0.00 0.00 0.00 0.00 36.38 33.43 3k92 s VAL 322 CO 0.03 -0.49 1.51 -1.61 0.00 0.00 0.00 175.10 174.54 3k92 s GLU 323 N 0.99 4.23 -0.17 2.72 2.02 -0.69 -3.93 118.70 123.88 3k92 s GLU 323 Ca 0.06 2.34 0.15 0.00 0.02 0.00 0.00 54.97 57.54 3k92 s GLU 323 Cb -0.20 -3.13 0.37 0.00 0.10 0.00 0.00 34.13 31.27 3k92 s GLU 323 CO -0.06 -0.53 1.20 -2.13 0.02 0.00 0.00 175.26 173.76 3k92 n ARG 324 N 3.19 1.50 -3.61 1.61 0.63 -1.11 -4.09 116.66 114.77 3k92 n ARG 324 Ca 0.10 -2.95 -0.01 0.00 -0.92 0.00 0.00 57.85 54.08 3k92 n ARG 324 Cb 0.39 -1.58 -0.01 0.00 0.45 0.00 0.00 32.46 31.71 3k92 n ARG 324 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3k92 s ALA 325 N -3.06 -2.24 -0.66 5.13 0.00 -1.26 -4.62 121.76 115.05 3k92 s ALA 325 Ca 0.36 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.70 3k92 s ALA 325 Cb 0.33 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.41 3k92 s ALA 325 CO -0.02 -0.77 0.00 -1.71 0.00 0.00 0.00 175.76 173.27 3k92 n ASN 326 N -0.23 -3.77 -2.72 0.00 2.85 -1.26 -3.99 115.26 106.14 3k92 n ASN 326 Ca -0.02 0.15 -0.12 0.00 -0.11 0.00 0.00 54.58 54.49 3k92 n ASN 326 Cb 0.60 -2.86 0.06 0.00 1.24 0.00 0.00 39.78 38.81 3k92 n ASN 326 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3k92 n GLY 327 N 0.24 -0.24 0.03 8.20 0.00 -1.26 -4.22 105.19 107.93 3k92 n GLY 327 Ca -0.06 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.12 3k92 n GLY 327 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3k92 n PRO 328 N -3.09 0.06 -4.90 1.61 -0.04 -1.26 -2.21 135.00 125.18 3k92 n PRO 328 Ca -0.16 0.11 -0.33 0.00 -0.04 0.00 0.00 63.50 63.08 3k92 n PRO 328 Cb 0.61 -1.58 -0.15 0.00 -0.04 0.00 0.00 33.50 32.34 3k92 n PRO 328 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3k92 s THR 329 N -3.04 2.68 0.84 0.52 2.01 -1.26 -0.74 115.64 116.65 3k92 s THR 329 Ca 0.12 -0.79 -0.12 0.00 0.31 0.00 0.00 61.69 61.20 3k92 s THR 329 Cb 0.15 -2.10 0.10 0.00 0.01 0.00 0.00 72.50 70.66 3k92 s THR 329 CO 0.49 0.54 1.12 0.42 -0.69 0.00 0.00 174.62 176.49 3k92 s THR 330 N 0.39 2.61 0.29 -0.82 -4.23 -0.75 -4.81 115.64 108.32 3k92 s THR 330 Ca -0.13 0.20 -0.01 0.00 -1.18 0.00 0.00 61.69 60.57 3k92 s THR 330 Cb -0.17 -2.97 0.28 0.00 1.34 0.00 0.00 72.50 70.99 3k92 s THR 330 CO 0.06 -0.26 1.90 0.40 -0.54 0.00 0.00 174.62 176.19 3k92 h ILE 331 N -1.23 1.08 -0.14 2.99 5.03 -1.99 -0.17 117.51 123.09 3k92 h ILE 331 Ca -0.48 -0.37 -0.09 0.00 -0.12 0.00 0.00 64.86 63.79 3k92 h ILE 331 Cb 1.30 -0.10 0.00 0.00 -3.03 0.00 0.00 36.82 34.98 3k92 h ILE 331 CO 0.61 0.20 -0.28 0.44 -0.68 0.00 0.00 178.15 178.44 3k92 h ASP 332 N 1.09 0.48 -0.80 1.72 3.32 -1.96 -2.52 116.42 117.76 3k92 h ASP 332 Ca 0.40 -0.56 -0.02 0.00 0.02 0.00 0.00 57.03 56.87 3k92 h ASP 332 Cb 0.17 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.54 3k92 h ASP 332 CO -0.15 0.95 0.42 0.00 -1.72 0.00 0.00 179.24 178.74 3k92 h ALA 333 N 0.54 1.03 -0.42 3.45 0.00 -1.71 -1.30 119.26 120.85 3k92 h ALA 333 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3k92 h ALA 333 Cb 0.88 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3k92 h ALA 333 CO 0.06 0.56 0.26 1.79 0.00 0.00 0.00 179.25 181.93 3k92 h THR 334 N 1.12 1.12 0.02 0.00 1.35 -1.04 -1.34 112.91 114.14 3k92 h THR 334 Ca 0.28 -0.26 0.03 0.00 -0.55 0.00 0.00 66.41 65.90 3k92 h THR 334 Cb 0.07 0.54 -0.04 0.00 -1.73 0.00 0.00 68.15 66.99 3k92 h THR 334 CO -0.04 0.12 -0.22 0.50 -0.25 0.00 0.00 175.52 175.63 3k92 h LYS 335 N 0.56 -0.35 0.13 4.72 3.64 -0.99 -1.73 116.57 122.55 3k92 h LYS 335 Ca 0.15 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.58 3k92 h LYS 335 Cb -0.03 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 3k92 h LYS 335 CO -0.03 -0.23 -0.36 0.82 -2.27 0.00 0.00 179.45 177.38 3k92 h ILE 336 N -0.37 0.25 -0.52 2.00 2.04 -0.82 -1.76 117.51 118.34 3k92 h ILE 336 Ca 0.06 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.91 3k92 h ILE 336 Cb 0.44 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 3k92 h ILE 336 CO -0.19 0.00 0.31 -0.07 0.00 0.00 0.00 178.15 178.20 3k92 h LEU 337 N -0.59 0.61 0.31 1.44 3.38 -1.20 0.92 115.31 120.18 3k92 h LEU 337 Ca 0.03 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3k92 h LEU 337 Cb 0.62 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.22 3k92 h LEU 337 CO -0.21 0.48 -0.16 -1.13 0.09 0.00 0.00 178.44 177.51 3k92 h ASN 338 N 0.71 -0.37 -0.62 -0.43 -1.24 -0.92 -0.38 115.58 112.33 3k92 h ASN 338 Ca 0.19 0.01 0.03 0.00 0.71 0.00 0.00 56.30 57.24 3k92 h ASN 338 Cb -0.03 0.10 -0.04 0.00 0.73 0.00 0.00 38.32 39.08 3k92 h ASN 338 CO -0.04 -0.26 0.38 -0.33 -1.29 0.00 0.00 177.43 175.89 3k92 h GLU 339 N -0.43 0.71 0.00 6.67 5.08 -0.42 -0.39 114.58 125.81 3k92 h GLU 339 Ca -0.04 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3k92 h GLU 339 Cb 0.33 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3k92 h GLU 339 CO 0.06 0.47 0.00 0.54 -1.00 0.00 0.00 179.01 179.09 3k92 n ARG 340 N -4.73 0.48 -1.19 2.33 1.74 0.22 -4.89 116.66 110.62 3k92 n ARG 340 Ca 0.06 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 57.07 3k92 n ARG 340 Cb 0.09 -1.28 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 3k92 n ARG 340 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k92 n GLY 341 N -0.03 0.85 3.78 -0.13 0.00 -0.16 -5.02 105.19 104.48 3k92 n GLY 341 Ca 0.07 -0.34 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 3k92 n GLY 341 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k92 s VAL 342 N -2.06 4.09 -0.55 1.61 -7.23 -0.23 -5.01 120.40 111.03 3k92 s VAL 342 Ca 0.00 1.72 -0.22 0.00 -1.81 0.00 0.00 61.98 61.66 3k92 s VAL 342 Cb 0.00 -3.94 0.05 0.00 0.56 0.00 0.00 36.38 33.05 3k92 s VAL 342 CO 0.00 0.12 0.84 -0.22 -0.31 0.00 0.00 175.10 175.53 3k92 s LEU 343 N -2.15 4.43 -0.44 1.32 2.96 0.04 -4.41 118.68 120.43 3k92 s LEU 343 Ca 0.51 -0.62 -0.17 0.00 -0.22 0.00 0.00 54.13 53.64 3k92 s LEU 343 Cb -0.20 -2.65 0.03 0.00 0.50 0.00 0.00 46.19 43.88 3k92 s LEU 343 CO 0.25 -1.15 0.42 -0.22 -1.32 0.00 0.00 176.35 174.33 3k92 s LEU 344 N 3.53 5.05 -0.49 -0.68 0.20 -1.26 0.01 118.68 125.05 3k92 s LEU 344 Ca 0.24 -0.85 -0.22 0.00 0.69 0.00 0.00 54.13 53.99 3k92 s LEU 344 Cb -0.15 -2.31 0.04 0.00 -0.43 0.00 0.00 46.19 43.33 3k92 s LEU 344 CO 0.16 -0.60 0.78 -0.69 -0.29 0.00 0.00 176.35 175.71 3k92 s VAL 345 N 2.01 4.64 0.70 1.68 1.01 0.28 -4.48 120.40 126.24 3k92 s VAL 345 Ca 0.10 0.17 -0.12 0.00 0.00 0.00 0.00 61.98 62.13 3k92 s VAL 345 Cb -0.19 -4.37 0.02 0.00 0.00 0.00 0.00 36.38 31.84 3k92 s VAL 345 CO 0.12 -0.84 1.08 -2.16 0.00 0.00 0.00 175.10 173.30 3k92 s PRO 346 N 3.30 2.75 0.25 2.72 0.04 -1.26 -1.70 135.00 141.10 3k92 s PRO 346 Ca 0.26 1.14 -0.04 0.00 0.04 0.00 0.00 61.00 62.40 3k92 s PRO 346 Cb -0.14 -1.96 0.37 0.00 0.04 0.00 0.00 34.50 32.81 3k92 s PRO 346 CO 0.19 -1.26 1.84 0.22 0.04 0.00 0.00 177.00 178.03 3k92 h ASP 347 N -0.54 0.80 0.09 6.66 -0.00 -1.84 -0.02 116.42 121.56 3k92 h ASP 347 Ca -0.45 0.03 -0.02 0.00 -0.00 0.00 0.00 57.03 56.60 3k92 h ASP 347 Cb 1.22 -0.13 -0.00 0.00 -0.00 0.00 0.00 39.33 40.42 3k92 h ASP 347 CO 0.55 0.49 -0.08 -0.29 -0.00 0.00 0.00 179.24 179.90 3k92 h ILE 348 N 0.92 1.01 0.10 2.25 2.10 -1.93 0.28 117.51 122.26 3k92 h ILE 348 Ca 0.39 -0.28 -0.33 0.00 1.08 0.00 0.00 64.86 65.72 3k92 h ILE 348 Cb 0.26 1.15 -0.02 0.00 -1.09 0.00 0.00 36.82 37.12 3k92 h ILE 348 CO -0.20 0.08 -1.76 0.25 -1.08 0.00 0.00 178.15 175.44 3k92 h LEU 349 N 0.00 0.34 -0.64 2.19 5.85 -1.81 -3.38 115.31 117.86 3k92 h LEU 349 Ca -0.00 -0.85 -0.13 0.00 0.84 0.00 0.00 57.88 57.74 3k92 h LEU 349 Cb 0.15 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 3k92 h LEU 349 CO 0.01 1.75 -0.35 0.00 -0.34 0.00 0.00 178.44 179.51 3k92 h ALA 350 N -0.06 0.82 -0.34 1.25 0.00 -0.40 -3.00 119.26 117.52 3k92 h ALA 350 Ca -0.39 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.10 3k92 h ALA 350 Cb 1.85 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.52 3k92 h ALA 350 CO 0.03 0.64 0.00 -1.13 0.00 0.00 0.00 179.25 178.79 3k92 n SER 351 N -4.06 2.37 0.00 0.00 3.41 0.95 -3.23 113.62 113.06 3k92 n SER 351 Ca -0.01 -2.14 0.15 0.00 -0.26 0.00 0.00 58.87 56.61 3k92 n SER 351 Cb 0.49 -0.35 0.80 0.00 -0.26 0.00 0.00 64.21 64.89 3k92 n SER 351 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k92 n ALA 352 N 0.49 2.51 -0.11 7.33 0.00 -1.14 -3.39 120.51 126.21 3k92 n ALA 352 Ca 0.13 -0.16 0.01 0.00 0.00 0.00 0.00 53.44 53.41 3k92 n ALA 352 Cb 0.43 -1.48 0.29 0.00 0.00 0.00 0.00 19.45 18.69 3k92 n ALA 352 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3k92 h GLY 353 N 4.74 0.83 0.80 0.00 0.00 -1.80 -2.01 103.07 105.63 3k92 h GLY 353 Ca 0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 3k92 h GLY 353 CO 0.00 0.35 -0.24 -1.33 0.00 0.00 0.00 176.54 175.32 3k92 h GLY 354 N 0.86 -0.59 1.87 4.60 0.00 -1.74 -1.01 103.07 107.06 3k92 h GLY 354 Ca 0.20 0.28 -0.07 0.00 0.00 0.00 0.00 47.33 47.73 3k92 h GLY 354 CO -0.03 -0.23 -0.29 -2.08 0.00 0.00 0.00 176.54 173.91 3k92 h VAL 355 N -0.57 1.24 -0.07 4.60 2.07 -1.81 -2.44 116.25 119.28 3k92 h VAL 355 Ca -0.02 -1.15 -0.01 0.00 0.82 0.00 0.00 66.70 66.34 3k92 h VAL 355 Cb 0.49 1.50 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 3k92 h VAL 355 CO -0.01 0.34 0.01 0.74 0.02 0.00 0.00 177.57 178.68 3k92 h THR 356 N 0.14 1.20 0.00 2.57 2.02 -0.58 -1.85 112.91 116.42 3k92 h THR 356 Ca 0.02 -0.62 -0.05 0.00 0.77 0.00 0.00 66.41 66.53 3k92 h THR 356 Cb 0.59 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.48 3k92 h THR 356 CO 0.04 0.17 -0.24 -0.37 0.37 0.00 0.00 175.52 175.49 3k92 h VAL 357 N -0.12 0.69 -0.43 3.16 -1.51 -1.11 -1.59 116.25 115.34 3k92 h VAL 357 Ca 0.02 -1.08 -0.11 0.00 -1.23 0.00 0.00 66.70 64.31 3k92 h VAL 357 Cb 0.26 1.69 -0.01 0.00 -2.13 0.00 0.00 31.29 31.10 3k92 h VAL 357 CO 0.00 0.24 -0.15 0.77 -1.23 0.00 0.00 177.57 177.21 3k92 h SER 358 N 0.00 0.86 -0.79 4.19 4.64 -1.34 -1.50 113.55 119.62 3k92 h SER 358 Ca -0.00 -0.38 0.15 0.00 -0.47 0.00 0.00 61.79 61.09 3k92 h SER 358 Cb 0.67 -0.24 -0.10 0.00 -0.31 0.00 0.00 62.40 62.42 3k92 h SER 358 CO 0.03 1.05 0.35 0.22 -0.87 0.00 0.00 176.83 177.61 3k92 h TYR 359 N 0.67 0.60 -0.17 4.77 3.20 -0.97 -2.55 116.97 122.51 3k92 h TYR 359 Ca 0.10 0.04 -0.12 0.00 3.14 0.00 0.00 58.73 61.89 3k92 h TYR 359 Cb 0.69 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 3k92 h TYR 359 CO 0.05 0.09 -0.41 0.74 -1.64 0.00 0.00 178.16 176.99 3k92 h PHE 360 N 0.49 0.46 -0.10 -3.82 0.04 -0.82 -1.76 116.94 111.43 3k92 h PHE 360 Ca 0.44 -0.13 0.02 0.00 2.80 0.00 0.00 57.97 61.09 3k92 h PHE 360 Cb 0.67 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.70 3k92 h PHE 360 CO -0.14 0.75 -0.01 1.49 -0.60 0.00 0.00 178.31 179.80 3k92 h GLU 361 N 0.33 0.02 -0.40 1.51 4.81 -0.88 -1.69 114.58 118.26 3k92 h GLU 361 Ca 0.03 -0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.29 3k92 h GLU 361 Cb 0.87 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.22 3k92 h GLU 361 CO 0.07 0.01 0.27 2.35 -0.73 0.00 0.00 179.01 180.99 3k92 h TRP 362 N 0.02 0.39 -0.39 0.92 7.01 -1.15 -1.47 115.95 121.28 3k92 h TRP 362 Ca 0.05 0.01 -0.14 0.00 2.11 0.00 0.00 58.89 60.91 3k92 h TRP 362 Cb 0.06 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 26.98 3k92 h TRP 362 CO -0.13 0.22 -0.32 0.28 -2.79 0.00 0.00 178.44 175.70 3k92 h VAL 363 N 0.40 1.28 -0.41 2.65 2.07 -0.99 -0.16 116.25 121.08 3k92 h VAL 363 Ca 0.17 -1.48 -0.10 0.00 0.82 0.00 0.00 66.70 66.12 3k92 h VAL 363 Cb 0.17 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 3k92 h VAL 363 CO -0.04 0.49 -0.12 1.56 0.02 0.00 0.00 177.57 179.48 3k92 h GLN 364 N 0.72 0.81 -0.85 1.57 4.20 -0.56 -1.42 115.11 119.57 3k92 h GLN 364 Ca 0.08 -0.32 0.04 0.00 0.06 0.00 0.00 58.65 58.50 3k92 h GLN 364 Cb 0.87 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.56 3k92 h GLN 364 CO 0.08 0.94 0.55 -0.91 -0.67 0.00 0.00 178.83 178.82 3k92 h ASN 365 N 0.63 0.91 -0.59 1.46 2.35 -1.18 0.39 115.58 119.54 3k92 h ASN 365 Ca 0.10 -0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.89 3k92 h ASN 365 Cb 0.66 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.78 3k92 h ASN 365 CO 0.05 0.62 0.33 0.78 -1.65 0.00 0.00 177.43 177.56 3k92 h ASN 366 N 1.06 0.51 0.51 5.81 2.35 -0.29 -2.88 115.58 122.65 3k92 h ASN 366 Ca 0.34 0.02 -0.16 0.00 -0.55 0.00 0.00 56.30 55.96 3k92 h ASN 366 Cb 0.02 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 3k92 h ASN 366 CO -0.12 0.35 -0.69 1.56 -1.65 0.00 0.00 177.43 176.88 3k92 h GLN 367 N 0.64 0.15 -3.06 0.81 4.20 -1.05 -3.48 115.11 113.32 3k92 h GLN 367 Ca 0.25 -0.13 -0.27 0.00 0.06 0.00 0.00 58.65 58.57 3k92 h GLN 367 Cb 0.11 0.03 0.04 0.00 0.30 0.00 0.00 27.48 27.95 3k92 h GLN 367 CO -0.14 0.78 -0.40 0.41 -0.67 0.00 0.00 178.83 178.82 3k92 n GLY 368 N 0.45 -0.10 2.78 3.46 0.00 0.13 -5.04 105.19 106.87 3k92 n GLY 368 Ca -0.02 -0.19 -0.16 0.00 0.00 0.00 0.00 46.02 45.65 3k92 n GLY 368 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3k92 s TYR 369 N -2.95 0.10 -0.15 1.61 5.04 -0.68 -5.03 117.35 115.29 3k92 s TYR 369 Ca 0.19 0.10 -0.03 0.00 -2.44 0.00 0.00 57.07 54.89 3k92 s TYR 369 Cb -0.09 -0.29 -0.02 0.00 0.35 0.00 0.00 41.96 41.91 3k92 s TYR 369 CO 0.24 -0.10 -0.06 0.71 -1.34 0.00 0.00 175.55 175.00 3k92 s TYR 370 N 1.07 2.98 0.33 4.97 1.51 -1.26 -4.53 117.35 122.42 3k92 s TYR 370 Ca -0.09 -0.37 -0.15 0.00 -1.01 0.00 0.00 57.07 55.45 3k92 s TYR 370 Cb -0.13 -1.94 -0.09 0.00 -0.11 0.00 0.00 41.96 39.69 3k92 s TYR 370 CO -0.03 -0.07 0.74 -1.58 -1.11 0.00 0.00 175.55 173.50 3k92 s TRP 371 N 0.36 3.38 0.79 2.71 0.51 -1.26 -5.08 118.94 120.35 3k92 s TRP 371 Ca -0.05 1.21 -0.11 0.00 -2.12 0.00 0.00 56.10 55.03 3k92 s TRP 371 Cb -0.15 -2.53 0.07 0.00 -0.81 0.00 0.00 33.47 30.05 3k92 s TRP 371 CO 0.03 0.08 1.09 -1.54 -0.51 0.00 0.00 176.95 176.11 3k92 s SER 372 N -2.32 4.37 0.28 2.95 1.04 -1.26 -4.49 113.70 114.28 3k92 s SER 372 Ca 0.54 1.80 0.00 0.00 0.48 0.00 0.00 55.95 58.77 3k92 s SER 372 Cb -0.10 -2.49 0.66 0.00 0.10 0.00 0.00 66.02 64.19 3k92 s SER 372 CO 0.18 -2.12 1.64 -0.08 0.98 0.00 0.00 173.24 173.84 3k92 h GLU 373 N -1.18 0.16 -0.26 4.02 4.81 -1.98 -2.24 114.58 117.90 3k92 h GLU 373 Ca -0.44 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 58.68 3k92 h GLU 373 Cb 1.24 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 3k92 h GLU 373 CO 0.51 0.11 -0.21 0.93 -0.73 0.00 0.00 179.01 179.62 3k92 h GLU 374 N 0.17 0.61 -0.78 1.92 3.07 -1.99 -1.43 114.58 116.15 3k92 h GLU 374 Ca 0.53 -0.30 -0.02 0.00 -0.50 0.00 0.00 59.36 59.07 3k92 h GLU 374 Cb 1.04 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.92 3k92 h GLU 374 CO -0.68 0.90 0.42 1.49 -1.40 0.00 0.00 179.01 179.74 3k92 h GLU 375 N 0.34 1.09 -0.49 2.33 4.81 -1.87 0.62 114.58 121.41 3k92 h GLU 375 Ca 0.05 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 3k92 h GLU 375 Cb 0.76 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.90 3k92 h GLU 375 CO 0.06 0.81 0.29 0.28 -0.73 0.00 0.00 179.01 179.72 3k92 h VAL 376 N 1.09 1.16 -0.82 0.32 2.07 -1.19 -1.21 116.25 117.67 3k92 h VAL 376 Ca 0.27 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 3k92 h VAL 376 Cb 0.04 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.29 3k92 h VAL 376 CO -0.04 0.17 0.48 0.00 0.02 0.00 0.00 177.57 178.19 3k92 h ALA 377 N 1.13 1.04 -0.19 1.67 0.00 -0.70 0.57 119.26 122.78 3k92 h ALA 377 Ca 0.18 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3k92 h ALA 377 Cb 0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3k92 h ALA 377 CO -0.03 0.52 0.05 0.93 0.00 0.00 0.00 179.25 180.72 3k92 h GLU 378 N 1.12 0.30 -0.47 0.00 5.08 -0.56 -2.00 114.58 118.04 3k92 h GLU 378 Ca 0.29 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 3k92 h GLU 378 Cb -0.02 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 3k92 h GLU 378 CO -0.05 0.42 0.20 0.87 -1.00 0.00 0.00 179.01 179.44 3k92 h LYS 379 N 0.12 0.67 -0.00 2.33 1.57 -1.10 -2.55 116.57 117.61 3k92 h LYS 379 Ca 0.06 -0.09 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3k92 h LYS 379 Cb 0.25 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 3k92 h LYS 379 CO -0.00 0.55 -0.06 1.25 -0.57 0.00 0.00 179.45 180.62 3k92 h LEU 380 N 0.67 -0.18 -0.38 2.94 6.46 -0.55 -2.62 115.31 121.65 3k92 h LEU 380 Ca 0.16 0.03 -0.09 0.00 -0.12 0.00 0.00 57.88 57.86 3k92 h LEU 380 Cb 0.12 0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.12 3k92 h LEU 380 CO -0.02 -0.09 -0.13 0.08 -0.62 0.00 0.00 178.44 177.66 3k92 h ARG 381 N -0.11 0.77 -0.86 1.25 0.11 -1.09 -1.17 114.38 113.27 3k92 h ARG 381 Ca 0.03 -0.31 0.15 0.00 0.10 0.00 0.00 59.98 59.95 3k92 h ARG 381 Cb 0.14 -0.03 -0.07 0.00 1.11 0.00 0.00 29.97 31.12 3k92 h ARG 381 CO -0.07 0.92 0.56 0.66 0.10 0.00 0.00 179.97 182.15 3k92 h SER 382 N 0.57 0.56 -0.09 0.08 4.64 -1.46 0.07 113.55 117.92 3k92 h SER 382 Ca 0.09 0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.41 3k92 h SER 382 Cb 0.66 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3k92 h SER 382 CO 0.05 0.27 -0.12 0.58 -0.87 0.00 0.00 176.83 176.74 3k92 h VAL 383 N 0.59 1.38 0.10 0.95 2.07 -0.95 -2.43 116.25 117.96 3k92 h VAL 383 Ca 0.44 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 3k92 h VAL 383 Cb 0.82 2.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 3k92 h VAL 383 CO -0.19 0.38 -0.05 0.24 0.02 0.00 0.00 177.57 177.97 3k92 h MET 384 N -0.20 -0.13 -0.39 1.57 2.07 -0.71 -1.25 114.93 115.89 3k92 h MET 384 Ca 0.01 0.01 0.08 0.00 -2.07 0.00 0.00 59.70 57.73 3k92 h MET 384 Cb 0.66 0.03 -0.08 0.00 -1.87 0.00 0.00 31.60 30.34 3k92 h MET 384 CO 0.03 -0.03 -0.14 0.28 1.07 0.00 0.00 176.91 178.12 3k92 h VAL 385 N -0.20 0.53 -0.29 -2.22 2.07 -1.10 0.20 116.25 115.23 3k92 h VAL 385 Ca -0.01 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 3k92 h VAL 385 Cb 0.16 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 3k92 h VAL 385 CO 0.02 0.00 0.02 0.28 0.02 0.00 0.00 177.57 177.91 3k92 h SER 386 N -0.06 0.40 -0.05 0.57 0.02 -1.28 -2.38 113.55 110.77 3k92 h SER 386 Ca 0.19 -0.06 -0.20 0.00 -0.84 0.00 0.00 61.79 60.88 3k92 h SER 386 Cb 0.35 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.79 3k92 h SER 386 CO -0.43 0.46 -0.70 0.28 -1.14 0.00 0.00 176.83 175.30 3k92 h SER 387 N 0.43 0.80 0.58 3.07 0.02 -0.40 -2.18 113.55 115.86 3k92 h SER 387 Ca 0.10 -0.49 -0.02 0.00 -0.84 0.00 0.00 61.79 60.53 3k92 h SER 387 Cb 0.26 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 3k92 h SER 387 CO 0.01 1.27 -0.36 0.15 -1.14 0.00 0.00 176.83 176.75 3k92 h PHE 388 N 0.49 -0.96 -0.57 3.45 3.57 -0.71 -2.52 116.94 119.69 3k92 h PHE 388 Ca -0.03 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.55 3k92 h PHE 388 Cb 1.30 0.34 -0.07 0.00 2.79 0.00 0.00 35.95 40.32 3k92 h PHE 388 CO 0.07 -0.55 0.20 0.93 -2.23 0.00 0.00 178.31 176.73 3k92 h GLU 389 N -0.89 0.37 -0.87 1.11 4.39 -1.47 -1.09 114.58 116.12 3k92 h GLU 389 Ca -0.07 -0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.62 3k92 h GLU 389 Cb 0.73 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 29.25 3k92 h GLU 389 CO 0.07 0.24 0.58 1.15 -1.16 0.00 0.00 179.01 179.89 3k92 h THR 390 N 0.38 1.20 -0.05 1.13 2.02 -1.32 -0.26 112.91 116.02 3k92 h THR 390 Ca 0.28 -0.40 -0.06 0.00 0.77 0.00 0.00 66.41 67.01 3k92 h THR 390 Cb 0.34 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 3k92 h THR 390 CO -0.29 0.21 -0.19 0.40 0.37 0.00 0.00 175.52 176.02 3k92 h ILE 391 N 1.16 1.45 -0.01 3.11 2.04 -0.96 0.50 117.51 124.79 3k92 h ILE 391 Ca 0.33 -1.62 0.03 0.00 1.00 0.00 0.00 64.86 64.60 3k92 h ILE 391 Cb -0.10 2.38 -0.05 0.00 -0.74 0.00 0.00 36.82 38.32 3k92 h ILE 391 CO -0.08 0.45 -0.26 0.22 0.00 0.00 0.00 178.15 178.48 3k92 h TYR 392 N -0.33 -0.70 -0.20 1.37 3.20 -1.12 0.34 116.97 119.54 3k92 h TYR 392 Ca -0.01 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 3k92 h TYR 392 Cb 0.83 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 39.40 3k92 h TYR 392 CO 0.14 -0.35 0.07 1.96 -1.64 0.00 0.00 178.16 178.34 3k92 h GLN 393 N -0.39 0.28 -0.13 1.82 1.08 -1.05 0.20 115.11 116.92 3k92 h GLN 393 Ca 0.07 -0.03 -0.04 0.00 -1.45 0.00 0.00 58.65 57.20 3k92 h GLN 393 Cb 0.48 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.85 3k92 h GLN 393 CO -0.24 0.24 -0.06 1.15 -0.95 0.00 0.00 178.83 178.97 3k92 h THR 394 N 0.28 1.32 -0.07 -0.54 2.02 -0.35 -0.30 112.91 115.27 3k92 h THR 394 Ca 0.07 -1.09 0.03 0.00 0.77 0.00 0.00 66.41 66.19 3k92 h THR 394 Cb 0.08 1.77 -0.03 0.00 -1.74 0.00 0.00 68.15 68.22 3k92 h THR 394 CO -0.01 0.32 -0.12 0.00 0.37 0.00 0.00 175.52 176.08 3k92 h ALA 395 N 0.66 -0.08 0.12 6.16 0.00 0.52 -1.69 119.26 124.95 3k92 h ALA 395 Ca 0.03 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.99 3k92 h ALA 395 Cb 0.53 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 3k92 h ALA 395 CO 0.02 -0.59 -0.48 0.00 0.00 0.00 0.00 179.25 178.20 3k92 h ALA 396 N 0.86 -0.87 0.00 0.00 0.00 -1.03 0.35 119.26 118.57 3k92 h ALA 396 Ca 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3k92 h ALA 396 Cb 0.26 0.80 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3k92 h ALA 396 CO -0.17 -1.06 0.00 1.79 0.00 0.00 0.00 179.25 179.81 3k92 h THR 397 N -0.71 0.00 -0.01 0.00 1.35 -0.68 -2.29 112.91 110.56 3k92 h THR 397 Ca 0.01 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 3k92 h THR 397 Cb 0.73 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 3k92 h THR 397 CO -0.27 0.00 -0.00 1.41 -0.25 0.00 0.00 175.52 176.41 3k92 n HIS 398 N -3.05 0.00 -3.50 4.73 8.25 -0.67 -5.02 115.22 115.96 3k92 n HIS 398 Ca -0.00 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.21 3k92 n HIS 398 Cb 0.25 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.41 3k92 n HIS 398 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3k92 n LYS 399 N 0.60 -1.70 -4.28 -0.41 5.02 0.12 -5.01 118.16 112.50 3k92 n LYS 399 Ca 0.06 0.63 -0.15 0.00 -2.02 0.00 0.00 58.31 56.84 3k92 n LYS 399 Cb 0.27 -4.86 -0.10 0.00 -0.02 0.00 0.00 35.03 30.32 3k92 n LYS 399 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3k92 s VAL 400 N -3.43 0.58 0.81 -0.18 -7.23 -0.98 -5.06 120.40 104.91 3k92 s VAL 400 Ca 0.47 -1.99 -0.11 0.00 -1.81 0.00 0.00 61.98 58.53 3k92 s VAL 400 Cb -0.12 -2.43 0.08 0.00 0.56 0.00 0.00 36.38 34.47 3k92 s VAL 400 CO 0.81 -0.19 1.09 1.51 -0.31 0.00 0.00 175.10 178.01 3k92 s ASP 401 N -3.25 4.31 0.42 4.85 -4.77 -1.26 -4.63 116.67 112.34 3k92 s ASP 401 Ca 0.32 1.51 0.29 0.00 -3.30 0.00 0.00 52.55 51.38 3k92 s ASP 401 Cb 0.07 -2.24 1.20 0.00 -1.09 0.00 0.00 42.92 40.86 3k92 s ASP 401 CO 0.10 -2.11 1.87 0.24 0.70 0.00 0.00 175.17 175.96 3k92 h MET 402 N -1.18 0.00 0.19 2.11 2.86 -1.92 -1.20 114.93 115.78 3k92 h MET 402 Ca -0.47 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.17 3k92 h MET 402 Cb 1.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.92 3k92 h MET 402 CO 0.56 0.00 -0.09 -0.09 1.06 0.00 0.00 176.91 178.35 3k92 h ARG 403 N 0.00 -0.24 -0.23 1.72 2.43 -1.92 0.18 114.38 116.32 3k92 h ARG 403 Ca 0.00 0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 3k92 h ARG 403 Cb 0.45 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 3k92 h ARG 403 CO 0.00 0.16 0.05 1.25 -1.51 0.00 0.00 179.97 179.92 3k92 h LEU 404 N -0.76 0.29 -0.20 3.80 6.46 -1.89 -2.12 115.31 120.88 3k92 h LEU 404 Ca -0.03 -0.03 -0.05 0.00 -0.12 0.00 0.00 57.88 57.66 3k92 h LEU 404 Cb 0.51 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.36 3k92 h LEU 404 CO 0.04 0.30 -0.07 0.00 -0.62 0.00 0.00 178.44 178.10 3k92 h ALA 405 N 1.74 0.27 -0.48 1.25 0.00 -1.19 -1.53 119.26 119.33 3k92 h ALA 405 Ca 0.08 -0.27 0.10 0.00 0.00 0.00 0.00 54.91 54.82 3k92 h ALA 405 Cb 0.14 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 17.77 3k92 h ALA 405 CO -0.00 0.07 -0.07 0.00 0.00 0.00 0.00 179.25 179.25 3k92 h ALA 406 N 0.72 0.37 -0.61 0.00 0.00 -0.03 -0.38 119.26 119.33 3k92 h ALA 406 Ca 0.05 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3k92 h ALA 406 Cb 0.53 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 3k92 h ALA 406 CO 0.02 -0.42 0.37 1.88 0.00 0.00 0.00 179.25 181.10 3k92 h TYR 407 N 0.04 0.79 -0.24 0.00 0.99 -1.25 0.24 116.97 117.54 3k92 h TYR 407 Ca 0.24 0.01 -0.12 0.00 2.00 0.00 0.00 58.73 60.85 3k92 h TYR 407 Cb 0.36 -0.26 -0.00 0.00 1.00 0.00 0.00 36.73 37.83 3k92 h TYR 407 CO -0.37 0.52 -0.33 0.52 -0.00 0.00 0.00 178.16 178.51 3k92 h MET 408 N 0.84 0.65 0.00 4.88 2.86 -0.63 -2.60 114.93 120.93 3k92 h MET 408 Ca 0.22 -0.38 -0.05 0.00 -2.06 0.00 0.00 59.70 57.44 3k92 h MET 408 Cb -0.04 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 3k92 h MET 408 CO -0.04 0.99 -0.23 1.79 1.06 0.00 0.00 176.91 180.48 3k92 h THR 409 N 0.36 0.49 0.33 2.22 1.35 -0.44 -1.97 112.91 115.23 3k92 h THR 409 Ca 0.03 -1.27 -0.00 0.00 -0.55 0.00 0.00 66.41 64.61 3k92 h THR 409 Cb 0.91 1.91 -0.03 0.00 -1.73 0.00 0.00 68.15 69.22 3k92 h THR 409 CO 0.08 0.22 -0.45 1.23 -0.25 0.00 0.00 175.52 176.35 3k92 h GLY 410 N 2.63 -1.19 0.07 5.82 0.00 -0.35 -3.29 103.07 106.75 3k92 h GLY 410 Ca -0.00 0.58 0.00 0.00 0.00 0.00 0.00 47.33 47.91 3k92 h GLY 410 CO 0.03 -0.34 -0.25 0.29 0.00 0.00 0.00 176.54 176.27 3k92 n ILE 411 N -5.12 0.00 -0.12 2.60 -6.64 -1.00 -3.41 119.36 105.67 3k92 n ILE 411 Ca -0.10 -0.15 -0.09 0.00 -1.77 0.00 0.00 62.75 60.65 3k92 n ILE 411 Cb 0.39 0.48 -0.01 0.00 -1.44 0.00 0.00 39.64 39.06 3k92 n ILE 411 CO 0.00 0.00 0.00 -0.09 -1.77 0.00 0.00 176.55 174.69 3k92 h ARG 412 N 1.42 0.54 0.00 6.28 2.43 -1.42 -0.20 114.38 123.42 3k92 h ARG 412 Ca 0.00 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3k92 h ARG 412 Cb 0.53 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 3k92 h ARG 412 CO 0.00 0.45 -0.05 0.87 -1.51 0.00 0.00 179.97 179.73 3k92 h LYS 413 N 0.48 -0.08 -0.51 0.20 1.79 -1.76 0.16 116.57 116.86 3k92 h LYS 413 Ca 0.13 0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.57 3k92 h LYS 413 Cb 0.08 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.72 3k92 h LYS 413 CO -0.02 -0.05 0.16 0.77 -1.08 0.00 0.00 179.45 179.22 3k92 h SER 414 N -0.09 0.69 -0.04 0.86 0.02 -1.80 0.94 113.55 114.13 3k92 h SER 414 Ca 0.02 -0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3k92 h SER 414 Cb 0.11 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.47 3k92 h SER 414 CO -0.05 0.66 0.01 0.00 -1.14 0.00 0.00 176.83 176.31 3k92 h ALA 415 N 1.44 0.06 -0.49 3.77 0.00 -0.38 -0.86 119.26 122.79 3k92 h ALA 415 Ca 0.17 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 3k92 h ALA 415 Cb 0.22 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3k92 h ALA 415 CO -0.01 -0.32 -0.20 0.93 0.00 0.00 0.00 179.25 179.65 3k92 h GLU 416 N -0.16 1.00 -0.75 0.00 5.08 -0.29 -2.52 114.58 116.93 3k92 h GLU 416 Ca 0.01 -0.42 0.08 0.00 -1.00 0.00 0.00 59.36 58.02 3k92 h GLU 416 Cb 0.25 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.40 3k92 h GLU 416 CO 0.00 1.10 0.42 0.00 -1.00 0.00 0.00 179.01 179.54 3k92 h ALA 417 N 0.87 1.04 -0.34 3.43 0.00 -0.82 -0.52 119.26 122.92 3k92 h ALA 417 Ca 0.11 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 3k92 h ALA 417 Cb 0.79 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3k92 h ALA 417 CO 0.07 0.08 -0.35 0.77 0.00 0.00 0.00 179.25 179.82 3k92 h SER 418 N 0.75 0.82 0.87 0.00 0.02 -0.93 -1.26 113.55 113.82 3k92 h SER 418 Ca 0.35 -0.35 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 3k92 h SER 418 Cb 0.27 -0.23 0.01 0.00 0.14 0.00 0.00 62.40 62.59 3k92 h SER 418 CO -0.22 1.08 -0.42 0.03 -1.14 0.00 0.00 176.83 176.17 3k92 h ARG 419 N 0.65 -1.13 -0.93 3.45 2.47 -1.17 -1.76 114.38 115.95 3k92 h ARG 419 Ca 0.06 0.08 0.21 0.00 -1.26 0.00 0.00 59.98 59.07 3k92 h ARG 419 Cb 0.89 0.26 -0.07 0.00 -1.65 0.00 0.00 29.97 29.39 3k92 h ARG 419 CO 0.08 -0.75 0.61 0.74 0.56 0.00 0.00 179.97 181.21 3k92 h PHE 420 N -1.22 0.61 -0.01 3.04 0.04 -1.00 -0.37 116.94 118.02 3k92 h PHE 420 Ca -0.12 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.67 3k92 h PHE 420 Cb 0.90 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.87 3k92 h PHE 420 CO -0.01 0.15 -0.02 0.54 -0.60 0.00 0.00 178.31 178.38 3k92 n ARG 421 N -4.54 1.32 -0.74 1.51 1.74 -0.48 -4.90 116.66 110.57 3k92 n ARG 421 Ca 0.20 -0.55 0.00 0.00 -0.77 0.00 0.00 57.85 56.73 3k92 n ARG 421 Cb 0.70 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 3k92 n ARG 421 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k92 n GLY 422 N 1.13 0.58 0.14 -0.13 0.00 -0.15 -4.97 105.19 101.79 3k92 n GLY 422 Ca 0.20 -0.48 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 3k92 n GLY 422 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3k92 h TRP 423 N 0.00 0.86 0.00 1.61 4.06 -1.52 -3.50 115.95 117.46 3k92 h TRP 423 Ca 0.00 -0.62 0.00 0.00 2.06 0.00 0.00 58.89 60.33 3k92 h TRP 423 Cb 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 29.16 28.12 3k92 h TRP 423 CO 0.00 1.48 0.00 1.33 -3.56 0.00 0.00 178.44 177.69