#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kvm h THR 32 N 0.00 0.82 0.31 0.00 1.03 -1.98 -0.80 112.91 112.29 3kvm h THR 32 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 66.41 66.38 3kvm h THR 32 Cb 0.00 0.94 0.00 0.00 -1.07 0.00 0.00 68.15 68.03 3kvm h THR 32 CO 0.00 0.00 -0.15 1.23 -0.01 0.00 0.00 175.52 176.59 3kvm h GLY 33 N 0.00 -0.44 1.84 2.99 0.00 -2.04 -2.27 103.07 103.16 3kvm h GLY 33 Ca 0.05 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.54 3kvm h GLY 33 CO -0.00 -0.16 -0.01 2.09 0.00 0.00 0.00 176.54 178.46 3kvm n ASP 34 N -3.20 0.01 0.08 0.19 5.68 -1.19 -1.96 116.55 116.15 3kvm n ASP 34 Ca -0.05 0.28 -0.12 0.00 -0.50 0.00 0.00 54.79 54.40 3kvm n ASP 34 Cb 0.16 -0.42 -0.06 0.00 -1.14 0.00 0.00 41.12 39.66 3kvm n ASP 34 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3kvm h GLU 35 N 0.01 -0.15 -0.17 0.11 5.08 -1.10 0.19 114.58 118.55 3kvm h GLU 35 Ca 0.00 0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.22 3kvm h GLU 35 Cb 0.43 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 3kvm h GLU 35 CO 0.00 -0.10 -0.53 0.00 -1.00 0.00 0.00 179.01 177.38 3kvm h ARG 36 N -0.16 0.50 -0.56 2.33 3.08 -1.17 -1.81 114.38 116.59 3kvm h ARG 36 Ca 0.01 -0.31 -0.06 0.00 0.07 0.00 0.00 59.98 59.69 3kvm h ARG 36 Cb 0.16 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 3kvm h ARG 36 CO -0.03 0.91 0.13 0.35 -1.07 0.00 0.00 179.97 180.26 3kvm h PHE 37 N 0.39 0.95 -0.37 3.04 3.57 -1.27 0.29 116.94 123.54 3kvm h PHE 37 Ca 0.01 -0.12 -0.17 0.00 3.53 0.00 0.00 57.97 61.23 3kvm h PHE 37 Cb 1.06 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.53 3kvm h PHE 37 CO 0.04 0.82 -0.42 1.88 -2.23 0.00 0.00 178.31 178.40 3kvm h TYR 38 N 0.80 1.12 -0.06 0.41 -1.99 -0.60 -0.57 116.97 116.08 3kvm h TYR 38 Ca 0.18 -0.35 -0.25 0.00 2.00 0.00 0.00 58.73 60.31 3kvm h TYR 38 Cb 0.35 -0.23 0.02 0.00 2.00 0.00 0.00 36.73 38.87 3kvm h TYR 38 CO 0.02 1.18 -0.93 0.00 -0.00 0.00 0.00 178.16 178.44 3kvm h ALA 39 N 0.76 0.19 0.00 3.88 0.00 -1.14 -0.73 119.26 122.23 3kvm h ALA 39 Ca 0.05 -0.66 -0.27 0.00 0.00 0.00 0.00 54.91 54.03 3kvm h ALA 39 Cb 1.02 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.79 3kvm h ALA 39 CO 0.10 0.67 -1.63 0.93 0.00 0.00 0.00 179.25 179.32 3kvm h GLU 40 N 0.44 0.00 0.00 0.00 5.08 -0.50 -3.42 114.58 116.18 3kvm h GLU 40 Ca -0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3kvm h GLU 40 Cb 1.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.83 3kvm h GLU 40 CO 0.19 0.50 -0.32 0.72 -1.00 0.00 0.00 179.01 179.09 3kvm n HIS 41 N -3.05 -0.42 0.32 4.33 8.25 -0.57 -4.75 115.22 119.32 3kvm n HIS 41 Ca -0.15 0.07 -0.16 0.00 -0.26 0.00 0.00 57.72 57.22 3kvm n HIS 41 Cb 1.02 0.16 -0.08 0.00 1.12 0.00 0.00 29.99 32.21 3kvm n HIS 41 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3kvm h LEU 42 N 0.00 -0.68 -0.36 2.41 5.85 -1.18 -2.49 115.31 118.87 3kvm h LEU 42 Ca 0.00 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 3kvm h LEU 42 Cb 0.32 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 3kvm h LEU 42 CO 0.00 -0.38 0.10 0.24 -0.34 0.00 0.00 178.44 178.06 3kvm h MET 43 N -0.95 0.56 -0.56 1.25 2.86 -1.37 -0.98 114.93 115.74 3kvm h MET 43 Ca -0.08 -0.13 0.06 0.00 -2.06 0.00 0.00 59.70 57.49 3kvm h MET 43 Cb 0.66 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.21 3kvm h MET 43 CO 0.13 0.59 0.37 -1.35 1.06 0.00 0.00 176.91 177.72 3kvm h PRO 44 N 0.42 0.49 -0.19 -0.22 0.11 -1.77 -0.42 132.00 130.42 3kvm h PRO 44 Ca 0.11 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 65.99 3kvm h PRO 44 Cb 0.27 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 31.28 3kvm h PRO 44 CO -0.00 0.33 -0.68 1.15 -0.21 0.00 0.00 178.00 178.59 3kvm h THR 45 N 0.51 1.28 -0.54 -1.15 2.02 -0.97 -1.63 112.91 112.43 3kvm h THR 45 Ca 0.24 -1.87 0.05 0.00 0.77 0.00 0.00 66.41 65.59 3kvm h THR 45 Cb 0.30 1.88 -0.05 0.00 -1.74 0.00 0.00 68.15 68.55 3kvm h THR 45 CO -0.07 0.60 0.28 0.25 0.37 0.00 0.00 175.52 176.95 3kvm h LEU 46 N 0.55 0.41 -0.97 2.58 5.85 -0.44 -2.04 115.31 121.24 3kvm h LEU 46 Ca -0.03 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 3kvm h LEU 46 Cb 1.30 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 3kvm h LEU 46 CO 0.14 0.28 -0.45 1.56 -0.34 0.00 0.00 178.44 179.63 3kvm h GLN 47 N 0.55 0.00 0.00 1.25 4.20 -1.04 -0.62 115.11 119.45 3kvm h GLN 47 Ca 0.24 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.88 3kvm h GLN 47 Cb 0.13 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 3kvm h GLN 47 CO -0.16 0.45 -0.33 0.78 -0.67 0.00 0.00 178.83 178.91 3kvm h GLY 48 N 1.77 0.00 0.63 3.46 0.00 -0.93 -3.31 103.07 104.69 3kvm h GLY 48 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.00 3kvm h GLY 48 CO 0.06 0.00 -1.96 1.04 0.00 0.00 0.00 176.54 175.68 3kvm n LEU 49 N -3.51 0.60 -4.09 3.11 4.77 -0.80 -4.96 117.00 112.12 3kvm n LEU 49 Ca -0.00 0.26 -0.23 0.00 -0.03 0.00 0.00 56.01 56.01 3kvm n LEU 49 Cb 0.48 0.26 -0.15 0.00 -2.33 0.00 0.00 43.42 41.68 3kvm n LEU 49 CO 0.36 0.44 -0.47 -0.76 -1.33 0.00 0.00 177.39 175.62 3kvm s LEU 50 N -5.89 1.94 0.95 2.23 1.43 -0.30 -5.11 118.68 113.93 3kvm s LEU 50 Ca -0.07 -0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 52.65 3kvm s LEU 50 Cb 0.07 -0.76 0.16 0.00 0.03 0.00 0.00 46.19 45.69 3kvm s LEU 50 CO 0.82 0.15 1.09 1.51 0.23 0.00 0.00 176.35 180.15 3kvm s ASP 51 N -0.12 2.92 0.15 2.29 -4.77 -1.26 -4.55 116.67 111.32 3kvm s ASP 51 Ca 0.01 1.67 -0.17 0.00 -3.30 0.00 0.00 52.55 50.76 3kvm s ASP 51 Cb -0.08 -2.31 0.06 0.00 -1.09 0.00 0.00 42.92 39.50 3kvm s ASP 51 CO 0.00 -3.02 1.72 -0.65 0.70 0.00 0.00 175.17 173.92 3kvm h PRO 52 N -1.81 0.13 -0.34 2.11 0.11 -1.93 -0.70 132.00 129.57 3kvm h PRO 52 Ca -0.50 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.49 3kvm h PRO 52 Cb 1.29 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 3kvm h PRO 52 CO 0.51 0.08 -0.25 1.49 -0.21 0.00 0.00 178.00 179.62 3kvm h GLU 53 N 0.13 0.67 -0.59 1.05 4.81 -1.92 -0.46 114.58 118.26 3kvm h GLU 53 Ca 0.16 -0.27 -0.07 0.00 -0.13 0.00 0.00 59.36 59.05 3kvm h GLU 53 Cb 0.21 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 3kvm h GLU 53 CO -0.25 0.85 0.10 0.77 -0.73 0.00 0.00 179.01 179.76 3kvm h SER 54 N 0.58 0.93 -0.58 1.04 0.02 -1.83 -1.14 113.55 112.57 3kvm h SER 54 Ca 0.08 -0.26 -0.04 0.00 -0.84 0.00 0.00 61.79 60.73 3kvm h SER 54 Cb 0.73 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 3kvm h SER 54 CO 0.06 0.95 0.19 0.00 -1.14 0.00 0.00 176.83 176.89 3kvm h ALA 55 N 1.02 0.76 -0.32 3.77 0.00 -0.84 -1.41 119.26 122.23 3kvm h ALA 55 Ca 0.18 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3kvm h ALA 55 Cb 0.41 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3kvm h ALA 55 CO 0.01 0.41 0.14 1.25 0.00 0.00 0.00 179.25 181.06 3kvm h HIS 56 N 0.81 0.26 -0.21 0.00 6.17 -0.86 0.24 115.15 121.56 3kvm h HIS 56 Ca 0.19 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.28 3kvm h HIS 56 Cb 0.26 -0.07 -0.01 0.00 2.52 0.00 0.00 27.41 30.11 3kvm h HIS 56 CO 0.02 0.13 0.14 0.00 0.71 0.00 0.00 177.93 178.93 3kvm h ARG 57 N 0.30 0.28 -0.70 5.26 3.08 -0.99 -1.31 114.38 120.30 3kvm h ARG 57 Ca 0.14 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 3kvm h ARG 57 Cb 0.07 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 3kvm h ARG 57 CO -0.11 0.19 0.37 1.25 -1.07 0.00 0.00 179.97 180.60 3kvm h LEU 58 N 0.28 0.88 -0.71 3.04 5.85 -1.03 -1.70 115.31 121.93 3kvm h LEU 58 Ca 0.08 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 3kvm h LEU 58 Cb -0.03 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 3kvm h LEU 58 CO -0.02 0.74 0.32 0.00 -0.34 0.00 0.00 178.44 179.14 3kvm h ALA 59 N 1.18 0.91 -0.91 1.25 0.00 -0.73 0.67 119.26 121.63 3kvm h ALA 59 Ca 0.24 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3kvm h ALA 59 Cb 0.06 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 3kvm h ALA 59 CO -0.04 0.49 0.51 0.28 0.00 0.00 0.00 179.25 180.49 3kvm h VAL 60 N 0.99 1.26 0.04 0.00 2.07 -0.96 -0.12 116.25 119.53 3kvm h VAL 60 Ca 0.24 -0.63 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 3kvm h VAL 60 Cb 0.15 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 3kvm h VAL 60 CO -0.03 0.29 -0.02 0.03 0.02 0.00 0.00 177.57 177.86 3kvm h ARG 61 N 1.27 -0.05 -0.86 1.57 3.08 -0.48 -1.74 114.38 117.16 3kvm h ARG 61 Ca 0.32 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.37 3kvm h ARG 61 Cb 0.01 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 3kvm h ARG 61 CO -0.05 0.08 0.52 0.74 -1.07 0.00 0.00 179.97 180.19 3kvm h PHE 62 N -0.18 1.13 -0.50 3.04 -1.00 -0.71 -2.41 116.94 116.31 3kvm h PHE 62 Ca -0.01 -0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.72 3kvm h PHE 62 Cb 0.16 -0.37 -0.02 0.00 3.61 0.00 0.00 35.95 39.33 3kvm h PHE 62 CO -0.03 0.75 0.12 1.15 -1.61 0.00 0.00 178.31 178.69 3kvm h THR 63 N 1.18 1.24 0.00 -1.55 2.02 -0.92 -1.04 112.91 113.84 3kvm h THR 63 Ca 0.31 -0.85 -0.02 0.00 0.77 0.00 0.00 66.41 66.62 3kvm h THR 63 Cb -0.06 0.84 -0.00 0.00 -1.74 0.00 0.00 68.15 67.19 3kvm h THR 63 CO -0.06 0.31 -0.09 0.77 0.37 0.00 0.00 175.52 176.82 3kvm h SER 64 N 0.69 0.00 0.29 4.18 4.64 -0.99 -1.37 113.55 120.99 3kvm h SER 64 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3kvm h SER 64 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3kvm h SER 64 CO 0.00 0.09 -0.45 0.18 -0.87 0.00 0.00 176.83 175.78 3kvm n LEU 65 N -3.33 0.90 0.00 5.97 4.77 -0.94 -4.80 117.00 119.57 3kvm n LEU 65 Ca -0.01 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 3kvm n LEU 65 Cb 0.28 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 3kvm n LEU 65 CO 0.28 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 3kvm n GLY 66 N 1.43 0.47 2.78 -0.72 0.00 -0.52 -4.93 105.19 103.71 3kvm n GLY 66 Ca 0.08 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 3kvm n GLY 66 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kvm n LEU 67 N 0.00 6.34 -4.47 0.99 4.77 -0.48 -4.88 117.00 119.28 3kvm n LEU 67 Ca 0.00 -3.86 -0.24 0.00 -0.03 0.00 0.00 56.01 51.88 3kvm n LEU 67 Cb 0.00 -1.53 -0.10 0.00 -2.33 0.00 0.00 43.42 39.46 3kvm n LEU 67 CO 0.00 0.84 -0.47 -0.76 -1.33 0.00 0.00 177.39 175.67 3kvm s LEU 68 N 1.83 2.60 0.80 2.23 2.01 -1.26 -4.73 118.68 122.15 3kvm s LEU 68 Ca 0.50 -1.04 -0.12 0.00 0.01 0.00 0.00 54.13 53.49 3kvm s LEU 68 Cb 0.14 -1.06 0.08 0.00 0.01 0.00 0.00 46.19 45.35 3kvm s LEU 68 CO -0.04 0.01 1.13 -2.16 1.01 0.00 0.00 176.35 176.30 3kvm s PRO 69 N -3.53 1.91 0.25 1.29 0.04 -1.26 -4.95 135.00 128.76 3kvm s PRO 69 Ca 0.30 1.40 -0.31 0.00 0.04 0.00 0.00 61.00 62.43 3kvm s PRO 69 Cb -0.04 -1.84 -0.12 0.00 0.04 0.00 0.00 34.50 32.54 3kvm s PRO 69 CO 0.15 -1.94 1.67 1.03 0.04 0.00 0.00 177.00 177.95 3kvm s ARG 70 N -4.58 4.11 -1.04 4.56 0.52 -1.26 -4.94 118.95 116.32 3kvm s ARG 70 Ca 0.66 2.61 -0.06 0.00 -0.52 0.00 0.00 55.73 58.42 3kvm s ARG 70 Cb -0.21 -3.04 0.26 0.00 0.52 0.00 0.00 34.95 32.48 3kvm s ARG 70 CO 0.53 -0.71 1.05 0.00 0.02 0.00 0.00 175.30 176.19 3kvm n ALA 71 N 3.07 4.20 0.19 2.13 0.00 -1.26 -4.90 120.51 123.94 3kvm n ALA 71 Ca 0.12 -4.66 0.07 0.00 0.00 0.00 0.00 53.44 48.96 3kvm n ALA 71 Cb 0.36 -2.19 0.27 0.00 0.00 0.00 0.00 19.45 17.89 3kvm n ALA 71 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 3kvm h ARG 72 N 6.27 0.00 -6.40 0.00 0.11 -1.96 -3.45 114.38 108.96 3kvm h ARG 72 Ca 0.18 0.00 -0.55 0.00 0.10 0.00 0.00 59.98 59.71 3kvm h ARG 72 Cb 0.82 0.00 0.03 0.00 1.11 0.00 0.00 29.97 31.93 3kvm h ARG 72 CO 1.00 0.33 1.15 0.34 0.10 0.00 0.00 179.97 182.89 3kvm n PHE 73 N -3.34 2.51 -3.58 4.08 7.35 -1.26 -4.96 117.46 118.26 3kvm n PHE 73 Ca 0.01 -0.20 -0.37 0.00 -0.76 0.00 0.00 57.45 56.13 3kvm n PHE 73 Cb 0.55 -2.74 -0.09 0.00 0.35 0.00 0.00 39.48 37.56 3kvm n PHE 73 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 3kvm s GLN 74 N 3.64 4.13 0.07 -4.13 -0.21 -1.26 -5.05 119.66 116.84 3kvm s GLN 74 Ca 0.87 -0.10 -0.31 0.00 0.02 0.00 0.00 55.36 55.84 3kvm s GLN 74 Cb -0.51 -3.52 -0.07 0.00 1.00 0.00 0.00 33.01 29.91 3kvm s GLN 74 CO 0.42 0.07 1.42 -0.51 -2.12 0.00 0.00 175.29 174.57 3kvm s ASP 75 N 0.93 6.81 0.49 5.90 -0.00 -1.26 -5.01 116.67 124.54 3kvm s ASP 75 Ca 0.11 2.27 -0.03 0.00 -0.00 0.00 0.00 52.55 54.90 3kvm s ASP 75 Cb -0.14 -2.58 -0.01 0.00 -0.00 0.00 0.00 42.92 40.20 3kvm s ASP 75 CO 0.05 -0.69 0.76 -0.94 -0.00 0.00 0.00 175.17 174.35 3kvm s SER 76 N 1.48 5.91 0.59 0.27 1.04 -1.26 -4.97 113.70 116.75 3kvm s SER 76 Ca 0.65 0.61 0.29 0.00 0.48 0.00 0.00 55.95 57.98 3kvm s SER 76 Cb -0.35 -1.82 1.74 0.00 0.10 0.00 0.00 66.02 65.68 3kvm s SER 76 CO 0.29 -0.75 2.19 0.44 0.98 0.00 0.00 173.24 176.40 3kvm h ASP 77 N 0.20 0.00 -0.38 7.02 3.45 -1.95 -1.69 116.42 123.07 3kvm h ASP 77 Ca -0.46 0.00 0.11 0.00 0.43 0.00 0.00 57.03 57.11 3kvm h ASP 77 Cb 1.24 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.99 3kvm h ASP 77 CO 0.60 0.00 0.28 0.24 -1.57 0.00 0.00 179.24 178.79 3kvm h MET 78 N 0.00 0.00 -0.00 3.56 2.86 -1.93 -2.33 114.93 117.09 3kvm h MET 78 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 3kvm h MET 78 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 3kvm h MET 78 CO -0.00 0.00 -0.48 1.28 1.06 0.00 0.00 176.91 178.77 3kvm n LEU 79 N -4.36 0.73 -4.75 1.22 4.77 -0.64 -1.13 117.00 112.85 3kvm n LEU 79 Ca 0.06 -0.14 -0.41 0.00 -0.03 0.00 0.00 56.01 55.49 3kvm n LEU 79 Cb 0.46 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.34 3kvm n LEU 79 CO 0.35 0.16 0.90 -0.70 -1.33 0.00 0.00 177.39 176.77 3kvm s GLU 80 N -2.85 4.49 0.00 3.23 2.12 -0.88 -3.50 118.70 121.31 3kvm s GLU 80 Ca 0.14 1.94 0.04 0.00 0.36 0.00 0.00 54.97 57.46 3kvm s GLU 80 Cb 0.18 -3.20 -0.01 0.00 0.26 0.00 0.00 34.13 31.36 3kvm s GLU 80 CO 0.66 -0.07 -0.13 0.08 -0.54 0.00 0.00 175.26 175.26 3kvm s VAL 81 N -0.40 1.03 -0.22 3.70 1.01 0.00 -4.59 120.40 120.93 3kvm s VAL 81 Ca 0.51 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.86 3kvm s VAL 81 Cb -0.34 -0.88 0.03 0.00 0.00 0.00 0.00 36.38 35.19 3kvm s VAL 81 CO 0.40 0.23 -0.13 -0.13 0.00 0.00 0.00 175.10 175.47 3kvm s ARG 82 N -0.47 2.80 0.19 2.72 0.52 -1.26 0.44 118.95 123.89 3kvm s ARG 82 Ca 0.04 -0.98 -0.21 0.00 -0.52 0.00 0.00 55.73 54.07 3kvm s ARG 82 Cb -0.06 -2.80 0.05 0.00 0.52 0.00 0.00 34.95 32.66 3kvm s ARG 82 CO -0.00 -0.35 0.59 0.54 0.02 0.00 0.00 175.30 176.10 3kvm s VAL 83 N 1.27 0.01 -1.92 3.52 0.11 -0.47 -4.94 120.40 117.99 3kvm s VAL 83 Ca 0.00 -0.45 0.00 0.00 -2.93 0.00 0.00 61.98 58.61 3kvm s VAL 83 Cb -0.16 -1.36 0.00 0.00 -1.53 0.00 0.00 36.38 33.33 3kvm s VAL 83 CO -0.08 -0.05 0.00 0.18 -3.33 0.00 0.00 175.10 171.82 3kvm n LEU 84 N -0.37 -1.36 0.00 2.54 4.77 -1.26 -0.84 117.00 120.47 3kvm n LEU 84 Ca -0.12 0.43 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 3kvm n LEU 84 Cb 0.63 -2.59 0.00 0.00 -2.33 0.00 0.00 43.42 39.13 3kvm n LEU 84 CO 0.14 -0.91 0.00 0.61 -1.33 0.00 0.00 177.39 175.91 3kvm n GLY 85 N -0.38 0.53 3.16 -0.72 0.00 -1.26 -4.77 105.19 101.74 3kvm n GLY 85 Ca -0.19 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.21 3kvm n GLY 85 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3kvm s HIS 86 N -2.00 0.49 -0.11 1.61 3.76 -0.02 -5.14 115.29 113.88 3kvm s HIS 86 Ca 0.00 -0.95 -0.14 0.00 -0.15 0.00 0.00 55.06 53.82 3kvm s HIS 86 Cb 0.00 -0.29 -0.05 0.00 1.11 0.00 0.00 32.58 33.35 3kvm s HIS 86 CO 0.00 -0.49 0.32 0.21 -0.85 0.00 0.00 174.74 173.93 3kvm s LYS 87 N -3.94 4.06 -0.17 1.40 2.20 -1.26 -1.36 119.74 120.67 3kvm s LYS 87 Ca 0.11 0.19 -0.00 0.00 -0.36 0.00 0.00 55.97 55.91 3kvm s LYS 87 Cb 0.07 -3.34 0.00 0.00 -1.51 0.00 0.00 37.83 33.05 3kvm s LYS 87 CO -0.07 0.43 -0.15 -0.06 -0.36 0.00 0.00 175.35 175.14 3kvm s PHE 88 N -0.15 2.80 0.11 4.03 0.40 0.17 -4.15 117.98 121.19 3kvm s PHE 88 Ca 0.19 -1.20 0.18 0.00 -0.60 0.00 0.00 56.93 55.50 3kvm s PHE 88 Cb -0.14 -1.93 0.58 0.00 0.51 0.00 0.00 43.02 42.04 3kvm s PHE 88 CO 0.07 -0.58 1.68 0.07 0.70 0.00 0.00 175.22 177.16 3kvm h ARG 89 N 7.60 0.00 -3.87 0.44 0.11 -1.14 0.05 114.38 117.57 3kvm h ARG 89 Ca -0.37 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.61 3kvm h ARG 89 Cb 1.17 0.00 -0.14 0.00 1.11 0.00 0.00 29.97 32.12 3kvm h ARG 89 CO 0.59 0.40 -0.38 0.54 0.10 0.00 0.00 179.97 181.22 3kvm s ASN 90 N -6.43 0.13 0.00 0.08 2.20 -1.25 -3.42 114.94 106.24 3kvm s ASN 90 Ca 0.01 -0.74 0.11 0.00 -0.94 0.00 0.00 52.86 51.30 3kvm s ASN 90 Cb 0.10 0.35 0.34 0.00 -2.00 0.00 0.00 41.25 40.05 3kvm s ASN 90 CO 0.69 -0.76 1.27 -0.81 -2.94 0.00 0.00 177.10 174.56 3kvm n PRO 91 N -0.09 1.74 -3.61 3.55 -0.04 -1.23 -4.27 135.00 131.05 3kvm n PRO 91 Ca -0.13 -1.14 -0.40 0.00 -0.04 0.00 0.00 63.50 61.79 3kvm n PRO 91 Cb 0.63 -1.27 -0.10 0.00 -0.04 0.00 0.00 33.50 32.72 3kvm n PRO 91 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3kvm s VAL 92 N -1.59 4.31 0.33 0.52 1.01 -1.26 -0.60 120.40 123.12 3kvm s VAL 92 Ca 0.23 -1.24 0.07 0.00 0.00 0.00 0.00 61.98 61.05 3kvm s VAL 92 Cb 0.12 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.91 3kvm s VAL 92 CO 0.16 -0.42 0.28 -0.83 0.00 0.00 0.00 175.10 174.29 3kvm s GLY 93 N 1.94 1.78 -0.14 4.51 0.00 0.32 -0.65 107.32 115.08 3kvm s GLY 93 Ca 0.02 -1.66 -0.19 0.00 0.00 0.00 0.00 44.72 42.90 3kvm s GLY 93 CO 0.03 -1.59 0.50 -1.50 0.00 0.00 0.00 173.10 170.55 3kvm s ILE 94 N -2.31 5.16 0.66 0.90 1.10 -1.06 -1.87 121.20 123.78 3kvm s ILE 94 Ca 0.41 0.98 -0.13 0.00 -0.51 0.00 0.00 60.65 61.40 3kvm s ILE 94 Cb -0.06 -3.84 -0.00 0.00 0.15 0.00 0.00 42.46 38.71 3kvm s ILE 94 CO 0.26 0.28 1.07 0.00 -2.11 0.00 0.00 174.94 174.44 3kvm s ALA 95 N 0.90 2.63 0.57 1.50 0.00 -0.81 -2.85 121.76 123.70 3kvm s ALA 95 Ca 0.26 0.26 -0.19 0.00 0.00 0.00 0.00 51.96 52.29 3kvm s ALA 95 Cb -0.15 -3.22 -0.06 0.00 0.00 0.00 0.00 23.12 19.68 3kvm s ALA 95 CO 0.10 -1.14 0.90 0.00 0.00 0.00 0.00 175.76 175.63 3kvm n ALA 96 N -2.70 -0.03 0.00 0.00 0.00 -1.25 -3.77 120.51 112.75 3kvm n ALA 96 Ca 0.08 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3kvm n ALA 96 Cb 0.53 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.92 3kvm n ALA 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kvm n GLY 97 N 1.35 1.76 0.08 0.00 0.00 0.24 -4.91 105.19 103.71 3kvm n GLY 97 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 3kvm n GLY 97 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3kvm h PHE 98 N 0.00 0.00 -3.57 1.61 3.57 -1.78 -3.40 116.94 113.36 3kvm h PHE 98 Ca 0.00 0.00 -0.79 0.00 3.53 0.00 0.00 57.97 60.71 3kvm h PHE 98 Cb 0.00 0.00 -0.28 0.00 2.79 0.00 0.00 35.95 38.46 3kvm h PHE 98 CO 0.00 0.64 0.37 0.34 -2.23 0.00 0.00 178.31 177.43 3kvm s ASP 99 N -6.19 7.15 0.36 0.41 2.15 -1.26 -4.89 116.67 114.40 3kvm s ASP 99 Ca -0.19 -3.53 0.13 0.00 0.43 0.00 0.00 52.55 49.39 3kvm s ASP 99 Cb 0.03 -2.18 0.69 0.00 -0.30 0.00 0.00 42.92 41.16 3kvm s ASP 99 CO 0.37 -0.30 1.80 0.11 -0.17 0.00 0.00 175.17 176.98 3kvm h LYS 100 N 6.71 0.00 -0.14 4.34 1.57 -1.79 -2.47 116.57 124.78 3kvm h LYS 100 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3kvm h LYS 100 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.19 3kvm h LYS 100 CO 0.98 0.40 0.00 0.72 -0.57 0.00 0.00 179.45 180.97 3kvm n HIS 101 N -4.00 0.23 -2.67 -1.35 8.25 -1.26 -2.84 115.22 111.57 3kvm n HIS 101 Ca -0.02 -0.58 -0.07 0.00 -0.26 0.00 0.00 57.72 56.79 3kvm n HIS 101 Cb 0.44 -0.07 0.02 0.00 1.12 0.00 0.00 29.99 31.49 3kvm n HIS 101 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kvm n GLY 102 N -0.25 0.41 0.00 -1.41 0.00 -1.24 -4.70 105.19 98.00 3kvm n GLY 102 Ca 0.07 -0.44 0.10 0.00 0.00 0.00 0.00 46.02 45.75 3kvm n GLY 102 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kvm n GLU 103 N -1.82 0.29 -0.59 1.61 1.02 -1.26 -4.59 120.64 115.31 3kvm n GLU 103 Ca -0.01 -0.03 0.02 0.00 -0.02 0.00 0.00 57.16 57.11 3kvm n GLU 103 Cb 0.53 -1.47 0.02 0.00 -0.02 0.00 0.00 31.44 30.50 3kvm n GLU 103 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kvm n ALA 104 N -1.60 2.12 -0.15 0.62 0.00 -1.26 -4.59 120.51 115.65 3kvm n ALA 104 Ca 0.03 -1.43 -0.05 0.00 0.00 0.00 0.00 53.44 51.98 3kvm n ALA 104 Cb 0.35 -0.51 0.03 0.00 0.00 0.00 0.00 19.45 19.32 3kvm n ALA 104 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3kvm h VAL 105 N 6.02 0.97 -0.25 0.00 2.07 -1.94 -1.28 116.25 121.85 3kvm h VAL 105 Ca -0.03 -0.16 -0.14 0.00 0.82 0.00 0.00 66.70 67.19 3kvm h VAL 105 Cb 1.41 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 3kvm h VAL 105 CO 0.01 0.08 -0.43 0.44 0.02 0.00 0.00 177.57 177.69 3kvm h ASP 106 N 0.46 0.66 -0.23 0.57 5.19 -1.92 -2.31 116.42 118.85 3kvm h ASP 106 Ca 0.20 -0.31 -0.02 0.00 -0.62 0.00 0.00 57.03 56.27 3kvm h ASP 106 Cb 0.10 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.41 3kvm h ASP 106 CO -0.14 1.01 0.08 1.23 -3.12 0.00 0.00 179.24 178.31 3kvm h GLY 107 N 1.01 0.45 1.35 2.75 0.00 -1.56 -1.45 103.07 105.62 3kvm h GLY 107 Ca 0.04 -0.22 -0.17 0.00 0.00 0.00 0.00 47.33 46.98 3kvm h GLY 107 CO 0.09 0.21 -0.55 1.41 0.00 0.00 0.00 176.54 177.69 3kvm h LEU 108 N 0.42 0.76 -0.99 3.11 3.38 -0.75 -1.29 115.31 119.95 3kvm h LEU 108 Ca 0.10 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 3kvm h LEU 108 Cb 0.15 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 3kvm h LEU 108 CO -0.01 1.16 0.21 1.88 0.09 0.00 0.00 178.44 181.77 3kvm h TYR 109 N 0.52 0.97 0.00 1.13 0.99 -1.15 -2.27 116.97 117.15 3kvm h TYR 109 Ca 0.01 -0.07 -0.03 0.00 2.00 0.00 0.00 58.73 60.64 3kvm h TYR 109 Cb 1.12 -0.29 -0.00 0.00 1.00 0.00 0.00 36.73 38.56 3kvm h TYR 109 CO 0.06 0.77 -0.14 -0.22 -0.00 0.00 0.00 178.16 178.62 3kvm h LYS 110 N 0.92 0.00 0.00 4.88 3.64 -0.84 -0.55 116.57 124.62 3kvm h LYS 110 Ca 0.21 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 3kvm h LYS 110 Cb 0.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 3kvm h LYS 110 CO -0.01 0.14 0.00 1.98 -2.27 0.00 0.00 179.45 179.29 3kvm h MET 111 N 0.00 0.00 0.00 1.90 4.05 -0.64 -3.43 114.93 116.82 3kvm h MET 111 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3kvm h MET 111 Cb 0.25 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.05 3kvm h MET 111 CO 0.02 0.00 0.00 0.41 0.23 0.00 0.00 176.91 177.57 3kvm n GLY 112 N 0.03 0.87 3.76 1.39 0.00 -0.22 -4.67 105.19 106.35 3kvm n GLY 112 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3kvm n GLY 112 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kvm s PHE 113 N -2.00 2.97 -0.71 1.61 0.40 -1.20 -4.92 117.98 114.13 3kvm s PHE 113 Ca 0.00 1.24 0.26 0.00 -0.60 0.00 0.00 56.93 57.83 3kvm s PHE 113 Cb 0.00 -3.78 0.76 0.00 0.51 0.00 0.00 43.02 40.51 3kvm s PHE 113 CO 0.00 -2.32 1.76 0.78 0.70 0.00 0.00 175.22 176.13 3kvm h GLY 114 N 3.92 0.00 -3.14 4.36 0.00 -1.07 -3.43 103.07 103.71 3kvm h GLY 114 Ca -0.48 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.82 3kvm h GLY 114 CO 0.70 0.00 0.19 -0.11 0.00 0.00 0.00 176.54 177.32 3kvm s PHE 115 N -3.11 -0.54 -0.05 5.60 -0.12 -1.25 -3.89 117.98 114.62 3kvm s PHE 115 Ca 0.10 0.42 0.03 0.00 -0.05 0.00 0.00 56.93 57.44 3kvm s PHE 115 Cb 0.12 0.53 0.00 0.00 -0.63 0.00 0.00 43.02 43.03 3kvm s PHE 115 CO 0.60 -0.81 -0.15 0.08 -0.05 0.00 0.00 175.22 174.90 3kvm s VAL 116 N -3.40 1.27 -0.16 -2.49 1.01 -1.03 -2.55 120.40 113.05 3kvm s VAL 116 Ca -0.01 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.37 3kvm s VAL 116 Cb -0.01 -1.11 0.01 0.00 0.00 0.00 0.00 36.38 35.27 3kvm s VAL 116 CO -0.10 0.38 -0.18 -0.70 0.00 0.00 0.00 175.10 174.50 3kvm s GLU 117 N 0.24 3.09 0.35 2.72 2.12 -1.13 0.19 118.70 126.27 3kvm s GLU 117 Ca -0.07 -0.80 0.07 0.00 0.36 0.00 0.00 54.97 54.53 3kvm s GLU 117 Cb -0.12 -2.58 -0.02 0.00 0.26 0.00 0.00 34.13 31.67 3kvm s GLU 117 CO 0.03 -0.09 0.40 0.96 -0.54 0.00 0.00 175.26 176.01 3kvm s ILE 118 N 1.04 3.70 0.00 -3.70 -4.36 -0.33 -3.91 121.20 113.65 3kvm s ILE 118 Ca -0.01 -1.17 0.00 0.00 -0.26 0.00 0.00 60.65 59.21 3kvm s ILE 118 Cb -0.14 -3.27 0.00 0.00 1.25 0.00 0.00 42.46 40.30 3kvm s ILE 118 CO -0.06 -0.14 0.00 0.61 0.24 0.00 0.00 174.94 175.59 3kvm n GLY 119 N -1.54 -0.78 3.77 6.27 0.00 -0.93 -0.29 105.19 111.68 3kvm n GLY 119 Ca -0.00 -2.23 -0.38 0.00 0.00 0.00 0.00 46.02 43.41 3kvm n GLY 119 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kvm s SER 120 N -2.50 6.86 -0.13 1.61 0.01 -1.26 -0.59 113.70 117.70 3kvm s SER 120 Ca 0.00 2.20 -0.02 0.00 1.31 0.00 0.00 55.95 59.44 3kvm s SER 120 Cb 0.00 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 3kvm s SER 120 CO 0.00 -0.43 -0.05 -0.69 0.41 0.00 0.00 173.24 172.48 3kvm s VAL 121 N -1.42 3.79 0.21 3.43 1.01 -0.13 -4.80 120.40 122.48 3kvm s VAL 121 Ca 0.53 -0.41 0.05 0.00 0.00 0.00 0.00 61.98 62.16 3kvm s VAL 121 Cb -0.28 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 3kvm s VAL 121 CO 0.35 0.52 0.23 0.42 0.00 0.00 0.00 175.10 176.62 3kvm s THR 122 N 0.05 4.77 0.09 3.92 -4.23 -1.26 0.06 115.64 119.04 3kvm s THR 122 Ca -0.01 -1.11 -0.27 0.00 -1.18 0.00 0.00 61.69 59.12 3kvm s THR 122 Cb -0.14 -3.52 -0.13 0.00 1.34 0.00 0.00 72.50 70.05 3kvm s THR 122 CO 0.03 -0.24 1.68 -0.65 -0.54 0.00 0.00 174.62 174.90 3kvm h PRO 123 N 1.78 -0.39 -6.06 3.99 0.11 -1.86 -1.71 132.00 127.86 3kvm h PRO 123 Ca -0.49 0.03 -0.55 0.00 0.11 0.00 0.00 66.00 65.10 3kvm h PRO 123 Cb 1.22 0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.39 3kvm h PRO 123 CO 0.63 -0.26 -0.45 0.15 -0.21 0.00 0.00 178.00 177.86 3kvm s LYS 124 N -6.12 3.45 0.48 1.05 -0.14 -1.26 -2.03 119.74 115.17 3kvm s LYS 124 Ca -0.15 -0.55 -0.24 0.00 -1.36 0.00 0.00 55.97 53.67 3kvm s LYS 124 Cb 0.06 -2.96 -0.08 0.00 -1.68 0.00 0.00 37.83 33.18 3kvm s LYS 124 CO 0.65 0.51 1.32 -2.30 -0.76 0.00 0.00 175.35 174.77 3kvm n PRO 125 N -0.49 1.89 -3.59 -1.68 -0.02 -1.26 -4.41 135.00 125.43 3kvm n PRO 125 Ca -0.07 0.68 -0.12 0.00 -2.02 0.00 0.00 63.50 61.98 3kvm n PRO 125 Cb 0.54 -2.49 -0.04 0.00 -0.02 0.00 0.00 33.50 31.48 3kvm n PRO 125 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 3kvm s GLN 126 N -2.50 1.08 0.23 -0.52 -2.07 -0.69 -4.94 119.66 110.25 3kvm s GLN 126 Ca 0.65 -0.55 0.22 0.00 -1.82 0.00 0.00 55.36 53.86 3kvm s GLN 126 Cb -0.46 0.48 0.04 0.00 -1.09 0.00 0.00 33.01 31.99 3kvm s GLN 126 CO 0.55 -0.42 1.13 0.93 -1.32 0.00 0.00 175.29 176.15 3kvm h GLU 127 N 2.44 0.00 0.00 9.60 5.08 -1.86 -1.22 114.58 128.63 3kvm h GLU 127 Ca -0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 3kvm h GLU 127 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3kvm h GLU 127 CO 0.44 0.05 0.00 0.41 -1.00 0.00 0.00 179.01 178.91 3kvm n GLY 128 N 1.19 -2.00 3.82 -3.84 0.00 -1.26 -4.47 105.19 98.63 3kvm n GLY 128 Ca -0.00 -1.40 -0.31 0.00 0.00 0.00 0.00 46.02 44.30 3kvm n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kvm s ASN 129 N -4.00 5.32 0.61 1.61 0.01 0.51 -4.95 114.94 114.04 3kvm s ASN 129 Ca 0.00 1.63 -0.18 0.00 -0.71 0.00 0.00 52.86 53.59 3kvm s ASN 129 Cb 0.00 -2.49 -0.03 0.00 0.41 0.00 0.00 41.25 39.14 3kvm s ASN 129 CO 0.00 -1.49 1.22 -2.16 -1.51 0.00 0.00 177.10 173.17 3kvm s PRO 130 N -5.04 2.87 0.50 -0.60 0.04 -1.26 -4.95 135.00 126.56 3kvm s PRO 130 Ca 0.58 1.86 -0.14 0.00 0.04 0.00 0.00 61.00 63.34 3kvm s PRO 130 Cb -0.14 -1.91 -0.07 0.00 0.04 0.00 0.00 34.50 32.42 3kvm s PRO 130 CO 0.55 -1.30 0.93 1.03 0.04 0.00 0.00 177.00 178.25 3kvm s ARG 131 N -3.37 3.85 0.50 4.56 0.52 -1.26 -4.24 118.95 119.51 3kvm s ARG 131 Ca 0.78 0.79 -0.20 0.00 -0.52 0.00 0.00 55.73 56.58 3kvm s ARG 131 Cb -0.31 -2.20 -0.08 0.00 0.52 0.00 0.00 34.95 32.88 3kvm s ARG 131 CO 0.35 -0.25 1.05 -1.25 0.02 0.00 0.00 175.30 175.22 3kvm s PRO 132 N -4.18 3.73 0.00 3.54 0.04 -1.26 -5.14 135.00 131.73 3kvm s PRO 132 Ca 0.56 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.99 3kvm s PRO 132 Cb -0.10 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.36 3kvm s PRO 132 CO 0.35 -0.50 0.36 2.89 0.04 0.00 0.00 177.00 180.14 3kvm n ARG 133 N -1.04 0.00 -4.05 4.56 1.85 -1.26 -5.00 116.66 111.72 3kvm n ARG 133 Ca 0.10 -0.36 -0.15 0.00 -1.00 0.00 0.00 57.85 56.43 3kvm n ARG 133 Cb 0.52 -0.41 -0.15 0.00 -1.05 0.00 0.00 32.46 31.38 3kvm n ARG 133 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3kvm s VAL 134 N 0.00 0.28 -0.01 8.89 1.01 -1.26 -0.17 120.40 129.13 3kvm s VAL 134 Ca 0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 61.98 61.87 3kvm s VAL 134 Cb 0.00 -0.27 0.01 0.00 0.00 0.00 0.00 36.38 36.13 3kvm s VAL 134 CO 0.00 0.10 0.03 -0.36 0.00 0.00 0.00 175.10 174.87 3kvm s PHE 135 N 0.20 -0.01 0.03 5.22 0.40 0.74 -4.65 117.98 119.92 3kvm s PHE 135 Ca -0.02 0.09 -0.17 0.00 -0.60 0.00 0.00 56.93 56.23 3kvm s PHE 135 Cb -0.05 -0.09 -0.06 0.00 0.51 0.00 0.00 43.02 43.33 3kvm s PHE 135 CO -0.00 -0.05 0.49 1.03 0.70 0.00 0.00 175.22 177.39 3kvm s ARG 136 N 0.46 4.06 -0.68 0.44 0.52 -1.26 -1.11 118.95 121.38 3kvm s ARG 136 Ca -0.04 0.56 0.05 0.00 -0.52 0.00 0.00 55.73 55.79 3kvm s ARG 136 Cb -0.05 -3.24 0.17 0.00 0.52 0.00 0.00 34.95 32.34 3kvm s ARG 136 CO -0.01 0.65 0.47 -0.51 0.02 0.00 0.00 175.30 175.91 3kvm s LEU 137 N -1.02 4.64 0.31 2.53 1.02 -0.06 -4.73 118.68 121.38 3kvm s LEU 137 Ca 0.26 -3.75 0.00 0.00 0.02 0.00 0.00 54.13 50.66 3kvm s LEU 137 Cb -0.18 -1.59 0.53 0.00 0.02 0.00 0.00 46.19 44.97 3kvm s LEU 137 CO 0.16 -0.10 1.95 -0.65 0.02 0.00 0.00 176.35 177.73 3kvm h PRO 138 N 5.50 0.99 0.00 1.29 0.11 -1.97 -1.04 132.00 136.88 3kvm h PRO 138 Ca 0.13 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3kvm h PRO 138 Cb 0.77 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.66 3kvm h PRO 138 CO 0.70 0.65 0.00 0.93 -0.21 0.00 0.00 178.00 180.07 3kvm h GLU 139 N 1.02 0.00 -0.01 1.05 3.07 -1.93 -2.61 114.58 115.16 3kvm h GLU 139 Ca 0.33 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 3kvm h GLU 139 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 3kvm h GLU 139 CO -0.10 0.00 -0.02 -0.25 -1.40 0.00 0.00 179.01 177.25 3kvm n ASP 140 N -2.77 1.71 -3.95 1.42 8.00 -0.47 -4.85 116.55 115.65 3kvm n ASP 140 Ca 0.00 -1.36 -0.32 0.00 0.71 0.00 0.00 54.79 53.83 3kvm n ASP 140 Cb 0.23 0.05 -0.01 0.00 -0.02 0.00 0.00 41.12 41.37 3kvm n ASP 140 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kvm n GLN 141 N 0.45 -1.88 -4.12 -1.24 6.02 -0.75 -4.27 117.38 111.59 3kvm n GLN 141 Ca 0.05 0.32 -0.08 0.00 -0.01 0.00 0.00 57.00 57.28 3kvm n GLN 141 Cb 0.23 -3.94 -0.10 0.00 1.02 0.00 0.00 30.24 27.45 3kvm n GLN 141 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3kvm s ALA 142 N -3.81 0.67 0.06 -1.58 0.00 -0.91 -1.94 121.76 114.25 3kvm s ALA 142 Ca 0.21 -1.25 0.06 0.00 0.00 0.00 0.00 51.96 50.98 3kvm s ALA 142 Cb -0.09 0.23 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 3kvm s ALA 142 CO 0.91 -0.32 -0.16 0.08 0.00 0.00 0.00 175.76 176.27 3kvm s VAL 143 N -3.77 1.31 -0.10 0.00 1.01 -1.07 -0.88 120.40 116.89 3kvm s VAL 143 Ca 0.08 -1.22 0.03 0.00 0.00 0.00 0.00 61.98 60.87 3kvm s VAL 143 Cb 0.07 -1.20 -0.00 0.00 0.00 0.00 0.00 36.38 35.25 3kvm s VAL 143 CO -0.08 -0.05 -0.22 -0.63 0.00 0.00 0.00 175.10 174.12 3kvm s ILE 144 N -1.03 2.20 0.03 2.22 1.01 -0.27 -0.58 121.20 124.78 3kvm s ILE 144 Ca 0.02 -0.97 0.03 0.00 0.00 0.00 0.00 60.65 59.74 3kvm s ILE 144 Cb -0.09 -1.85 -0.02 0.00 0.01 0.00 0.00 42.46 40.51 3kvm s ILE 144 CO 0.02 0.55 -0.10 0.54 0.00 0.00 0.00 174.94 175.95 3kvm s ASN 145 N 0.34 1.20 -0.39 3.58 2.20 -0.85 -0.18 114.94 120.83 3kvm s ASN 145 Ca -0.18 -0.37 0.12 0.00 -0.94 0.00 0.00 52.86 51.49 3kvm s ASN 145 Cb -0.18 -0.07 0.41 0.00 -2.00 0.00 0.00 41.25 39.41 3kvm s ASN 145 CO 0.09 -0.01 0.93 -2.11 -2.94 0.00 0.00 177.10 173.05 3kvm n ARG 146 N 2.12 1.84 -0.22 3.55 1.85 0.76 -1.12 116.66 125.44 3kvm n ARG 146 Ca -0.18 -3.75 0.03 0.00 -1.00 0.00 0.00 57.85 52.95 3kvm n ARG 146 Cb 0.56 -1.70 0.14 0.00 -1.05 0.00 0.00 32.46 30.41 3kvm n ARG 146 CO 0.00 0.00 0.00 1.88 -0.01 0.00 0.00 177.63 179.50 3kvm h TYR 147 N 2.91 0.18 -0.30 2.89 0.99 -1.95 -3.40 116.97 118.30 3kvm h TYR 147 Ca 0.06 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.83 3kvm h TYR 147 Cb 0.98 0.02 0.00 0.00 1.00 0.00 0.00 36.73 38.74 3kvm h TYR 147 CO 0.60 -0.09 0.00 0.41 -0.00 0.00 0.00 178.16 179.08 3kvm n GLY 148 N -1.35 0.58 3.07 3.88 0.00 -1.26 -0.37 105.19 109.74 3kvm n GLY 148 Ca 0.11 -0.81 -0.16 0.00 0.00 0.00 0.00 46.02 45.16 3kvm n GLY 148 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3kvm n PHE 149 N -3.48 -2.03 -1.80 1.61 0.99 -1.26 -4.29 117.46 107.20 3kvm n PHE 149 Ca 0.00 0.79 -0.42 0.00 -0.00 0.00 0.00 57.45 57.82 3kvm n PHE 149 Cb 0.49 -4.37 -0.03 0.00 -1.00 0.00 0.00 39.48 34.57 3kvm n PHE 149 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3kvm s ASN 150 N -3.69 6.47 -0.20 4.37 4.22 -1.26 -4.44 114.94 120.41 3kvm s ASN 150 Ca 0.23 2.74 -0.18 0.00 -2.14 0.00 0.00 52.86 53.51 3kvm s ASN 150 Cb -0.10 -2.59 0.05 0.00 1.28 0.00 0.00 41.25 39.90 3kvm s ASN 150 CO 0.59 -0.93 0.53 -0.55 -2.04 0.00 0.00 177.10 174.70 3kvm s SER 151 N 1.60 -0.57 0.15 3.54 0.15 -0.46 -4.94 113.70 113.17 3kvm s SER 151 Ca 0.75 1.08 0.20 0.00 0.70 0.00 0.00 55.95 58.68 3kvm s SER 151 Cb -0.46 1.07 0.84 0.00 -1.71 0.00 0.00 66.02 65.76 3kvm s SER 151 CO 0.33 -0.19 1.61 1.41 1.20 0.00 0.00 173.24 177.60 3kvm n HIS 152 N 2.99 0.48 0.00 3.44 8.25 -1.26 -1.70 115.22 127.42 3kvm n HIS 152 Ca -0.15 0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 3kvm n HIS 152 Cb 0.56 -0.81 0.00 0.00 1.12 0.00 0.00 29.99 30.87 3kvm n HIS 152 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kvm n GLY 153 N 0.02 -0.60 0.20 -1.41 0.00 -1.26 -4.24 105.19 97.90 3kvm n GLY 153 Ca 0.03 -1.66 -0.05 0.00 0.00 0.00 0.00 46.02 44.35 3kvm n GLY 153 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3kvm h LEU 154 N 0.00 0.31 -0.27 0.99 3.38 -0.69 -2.77 115.31 116.26 3kvm h LEU 154 Ca 0.00 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3kvm h LEU 154 Cb 0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3kvm h LEU 154 CO 0.00 0.22 0.13 -1.28 0.09 0.00 0.00 178.44 177.60 3kvm h SER 155 N 0.45 0.35 -0.48 -0.43 0.87 -1.85 0.28 113.55 112.73 3kvm h SER 155 Ca 0.21 -0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.63 3kvm h SER 155 Cb 0.15 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 3kvm h SER 155 CO -0.17 0.37 0.23 0.58 -0.53 0.00 0.00 176.83 177.31 3kvm h VAL 156 N 0.31 1.19 -0.43 2.23 2.07 -1.75 -2.40 116.25 117.47 3kvm h VAL 156 Ca 0.09 -0.55 -0.11 0.00 0.82 0.00 0.00 66.70 66.95 3kvm h VAL 156 Cb 0.11 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 3kvm h VAL 156 CO -0.01 0.21 -0.18 0.58 0.02 0.00 0.00 177.57 178.20 3kvm h VAL 157 N 0.64 1.27 -0.23 2.57 2.07 -1.19 -1.73 116.25 119.65 3kvm h VAL 157 Ca 0.17 -1.28 0.04 0.00 0.82 0.00 0.00 66.70 66.44 3kvm h VAL 157 Cb 0.13 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 3kvm h VAL 157 CO -0.02 0.44 -0.02 -0.08 0.02 0.00 0.00 177.57 177.91 3kvm h GLU 158 N 0.72 0.05 -0.28 1.57 4.81 -0.29 -0.01 114.58 121.15 3kvm h GLU 158 Ca 0.11 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.24 3kvm h GLU 158 Cb 0.69 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 3kvm h GLU 158 CO 0.05 0.03 -0.23 0.45 -0.73 0.00 0.00 179.01 178.58 3kvm h HIS 159 N 0.05 0.61 -0.46 0.92 3.86 -1.29 0.18 115.15 119.02 3kvm h HIS 159 Ca 0.11 -0.13 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 3kvm h HIS 159 Cb 0.15 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 3kvm h HIS 159 CO -0.20 0.73 0.28 -0.09 0.86 0.00 0.00 177.93 179.51 3kvm h ARG 160 N 0.48 0.62 -0.09 2.45 2.43 -0.81 -2.34 114.38 117.11 3kvm h ARG 160 Ca 0.07 -0.06 -0.20 0.00 -0.81 0.00 0.00 59.98 58.99 3kvm h ARG 160 Cb 0.67 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.08 3kvm h ARG 160 CO 0.05 0.46 -0.75 -0.07 -1.51 0.00 0.00 179.97 178.14 3kvm h LEU 161 N 0.61 0.60 -1.65 3.80 3.38 -0.71 -3.05 115.31 118.28 3kvm h LEU 161 Ca 0.16 -0.40 0.03 0.00 0.09 0.00 0.00 57.88 57.77 3kvm h LEU 161 Cb -0.01 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3kvm h LEU 161 CO -0.03 1.15 0.28 0.03 0.09 0.00 0.00 178.44 179.96 3kvm h ARG 162 N 0.34 0.45 0.00 1.13 3.08 -0.85 -1.36 114.38 117.17 3kvm h ARG 162 Ca -0.04 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3kvm h ARG 162 Cb 1.34 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.29 3kvm h ARG 162 CO 0.14 0.30 0.00 0.00 -1.07 0.00 0.00 179.97 179.33 3kvm h ALA 163 N 1.76 1.00 0.00 0.04 0.00 -1.31 -2.80 119.26 117.95 3kvm h ALA 163 Ca 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3kvm h ALA 163 Cb 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3kvm h ALA 163 CO -0.04 0.00 -0.18 2.89 0.00 0.00 0.00 179.25 181.92 3kvm n ARG 164 N -2.86 0.88 -0.28 0.00 1.85 -0.81 -4.88 116.66 110.56 3kvm n ARG 164 Ca 0.01 -2.11 -0.03 0.00 -1.00 0.00 0.00 57.85 54.71 3kvm n ARG 164 Cb 0.26 -1.18 0.09 0.00 -1.05 0.00 0.00 32.46 30.58 3kvm n ARG 164 CO 0.00 0.00 0.00 0.37 -0.01 0.00 0.00 177.63 177.99 3kvm h GLN 165 N 0.04 0.96 0.01 2.89 4.15 -0.99 -0.97 115.11 121.20 3kvm h GLN 165 Ca -0.00 -0.06 -0.19 0.00 0.77 0.00 0.00 58.65 59.17 3kvm h GLN 165 Cb 1.14 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 28.59 3kvm h GLN 165 CO 0.00 0.63 -0.88 1.96 -1.93 0.00 0.00 178.83 178.62 3kvm h GLN 166 N 0.99 0.14 -0.66 1.69 1.08 -1.88 -1.75 115.11 114.72 3kvm h GLN 166 Ca 0.30 -0.16 -0.06 0.00 -1.45 0.00 0.00 58.65 57.28 3kvm h GLN 166 Cb -0.03 0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.42 3kvm h GLN 166 CO -0.10 0.93 0.18 -0.22 -0.95 0.00 0.00 178.83 178.67 3kvm h LYS 167 N 0.08 1.05 -0.57 1.46 3.64 -1.81 -2.54 116.57 117.87 3kvm h LYS 167 Ca -0.04 -0.24 -0.06 0.00 -1.27 0.00 0.00 60.65 59.04 3kvm h LYS 167 Cb 1.51 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 33.16 3kvm h LYS 167 CO 0.13 0.93 0.12 0.37 -2.27 0.00 0.00 179.45 178.73 3kvm h GLN 168 N 0.98 0.90 -1.00 1.90 5.75 -1.01 -1.40 115.11 121.22 3kvm h GLN 168 Ca 0.21 -0.20 0.03 0.00 -0.15 0.00 0.00 58.65 58.54 3kvm h GLN 168 Cb 0.34 -0.13 -0.06 0.00 1.07 0.00 0.00 27.48 28.70 3kvm h GLN 168 CO -0.00 0.81 0.66 0.00 -2.65 0.00 0.00 178.83 177.65 3kvm h ALA 169 N 1.28 1.33 -0.19 3.38 0.00 -0.94 0.25 119.26 124.37 3kvm h ALA 169 Ca 0.18 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.85 3kvm h ALA 169 Cb 0.33 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 17.76 3kvm h ALA 169 CO 0.00 0.58 -0.64 0.87 0.00 0.00 0.00 179.25 180.06 3kvm h LYS 170 N 1.29 0.78 -0.26 0.00 1.57 -1.15 -1.75 116.57 117.04 3kvm h LYS 170 Ca 0.39 -0.58 0.04 0.00 -1.87 0.00 0.00 60.65 58.63 3kvm h LYS 170 Cb -0.04 0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 3kvm h LYS 170 CO -0.11 1.20 0.01 -0.07 -0.57 0.00 0.00 179.45 179.91 3kvm h LEU 171 N 0.51 -0.07 -0.11 2.94 3.38 -0.59 0.02 115.31 121.40 3kvm h LEU 171 Ca -0.03 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.01 3kvm h LEU 171 Cb 1.27 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 3kvm h LEU 171 CO 0.14 -0.00 0.02 0.74 0.09 0.00 0.00 178.44 179.42 3kvm h THR 172 N 0.10 0.95 -0.48 0.22 2.02 -0.49 0.03 112.91 115.25 3kvm h THR 172 Ca 0.12 -0.02 0.12 0.00 0.77 0.00 0.00 66.41 67.40 3kvm h THR 172 Cb 0.15 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 3kvm h THR 172 CO -0.19 0.01 0.34 -0.08 0.37 0.00 0.00 175.52 175.96 3kvm h GLU 173 N 0.06 0.12 -0.06 6.66 4.57 -1.04 0.20 114.58 125.10 3kvm h GLU 173 Ca 0.05 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 3kvm h GLU 173 Cb 0.04 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 3kvm h GLU 173 CO -0.07 0.08 0.00 -0.25 -1.18 0.00 0.00 179.01 177.60 3kvm n ASP 174 N -4.43 0.43 0.00 1.04 8.00 -0.03 -4.88 116.55 116.68 3kvm n ASP 174 Ca 0.08 -1.66 0.00 0.00 0.71 0.00 0.00 54.79 53.92 3kvm n ASP 174 Cb 0.46 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 3kvm n ASP 174 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kvm n GLY 175 N 0.80 0.79 2.59 0.44 0.00 0.72 -4.77 105.19 105.75 3kvm n GLY 175 Ca 0.11 -0.60 -0.27 0.00 0.00 0.00 0.00 46.02 45.25 3kvm n GLY 175 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kvm n LEU 176 N 0.00 2.25 -4.75 0.99 4.77 -0.16 -0.71 117.00 119.39 3kvm n LEU 176 Ca 0.00 -5.06 -0.31 0.00 -0.03 0.00 0.00 56.01 50.61 3kvm n LEU 176 Cb 0.11 -0.32 0.11 0.00 -2.33 0.00 0.00 43.42 40.99 3kvm n LEU 176 CO 0.00 1.90 0.69 -2.84 -1.33 0.00 0.00 177.39 175.81 3kvm s PRO 177 N -1.45 1.94 -0.10 3.23 0.02 -1.25 -3.41 135.00 133.98 3kvm s PRO 177 Ca 0.32 1.05 0.03 0.00 0.02 0.00 0.00 61.00 62.42 3kvm s PRO 177 Cb 0.05 -1.87 0.01 0.00 0.02 0.00 0.00 34.50 32.71 3kvm s PRO 177 CO -0.12 -1.83 -0.21 -1.17 -0.33 0.00 0.00 177.00 173.34 3kvm s LEU 178 N -6.02 1.97 0.12 -5.54 2.96 -1.26 -2.47 118.68 108.43 3kvm s LEU 178 Ca 0.62 -0.50 0.07 0.00 -0.22 0.00 0.00 54.13 54.09 3kvm s LEU 178 Cb -0.17 -1.27 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 3kvm s LEU 178 CO 0.56 0.11 -0.06 -0.83 -1.32 0.00 0.00 176.35 174.81 3kvm s GLY 179 N 0.54 1.81 -0.10 7.98 0.00 0.13 -0.78 107.32 116.91 3kvm s GLY 179 Ca -0.15 -1.25 0.01 0.00 0.00 0.00 0.00 44.72 43.33 3kvm s GLY 179 CO 0.05 -1.24 -0.11 0.14 0.00 0.00 0.00 173.10 171.94 3kvm s VAL 180 N -1.34 1.20 -0.25 1.40 1.01 -0.18 -1.19 120.40 121.05 3kvm s VAL 180 Ca 0.23 -0.45 -0.10 0.00 0.00 0.00 0.00 61.98 61.65 3kvm s VAL 180 Cb -0.11 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.09 3kvm s VAL 180 CO 0.15 0.38 0.16 0.21 0.00 0.00 0.00 175.10 176.01 3kvm s ASN 181 N 1.15 6.07 -0.20 3.32 3.84 0.60 -0.77 114.94 128.94 3kvm s ASN 181 Ca -0.05 0.08 -0.08 0.00 0.21 0.00 0.00 52.86 53.02 3kvm s ASN 181 Cb -0.14 -2.10 -0.04 0.00 -0.55 0.00 0.00 41.25 38.41 3kvm s ASN 181 CO -0.02 0.04 0.09 -0.76 -2.79 0.00 0.00 177.10 173.66 3kvm s LEU 182 N 1.21 3.90 0.00 3.21 1.43 0.09 -0.96 118.68 127.56 3kvm s LEU 182 Ca 0.07 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 3kvm s LEU 182 Cb -0.14 -2.01 0.00 0.00 0.03 0.00 0.00 46.19 44.07 3kvm s LEU 182 CO 0.06 0.14 0.00 0.61 0.23 0.00 0.00 176.35 177.38 3kvm n GLY 183 N 3.80 3.44 3.07 -3.19 0.00 0.11 -3.13 105.19 109.28 3kvm n GLY 183 Ca -0.16 -2.18 -0.13 0.00 0.00 0.00 0.00 46.02 43.55 3kvm n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kvm s LYS 184 N -1.87 0.56 0.52 1.61 -2.85 -1.26 -4.48 119.74 111.96 3kvm s LYS 184 Ca 0.00 -0.79 -0.21 0.00 -1.00 0.00 0.00 55.97 53.97 3kvm s LYS 184 Cb 0.00 -0.32 -0.06 0.00 -2.06 0.00 0.00 37.83 35.40 3kvm s LYS 184 CO 0.00 0.05 1.19 -0.80 0.10 0.00 0.00 175.35 175.90 3kvm s ASN 185 N -1.65 5.72 0.24 0.03 -0.87 -1.26 -4.93 114.94 112.22 3kvm s ASN 185 Ca -0.09 2.36 -0.04 0.00 -1.57 0.00 0.00 52.86 53.52 3kvm s ASN 185 Cb -0.09 -2.60 0.39 0.00 -0.02 0.00 0.00 41.25 38.92 3kvm s ASN 185 CO 0.00 -1.23 1.81 0.50 -2.57 0.00 0.00 177.10 175.62 3kvm h LYS 186 N 1.52 0.78 -0.05 -0.60 3.64 -1.95 -2.05 116.57 117.85 3kvm h LYS 186 Ca -0.50 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 3kvm h LYS 186 Cb 1.27 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 3kvm h LYS 186 CO 0.58 0.52 0.00 0.25 -2.27 0.00 0.00 179.45 178.52 3kvm n THR 187 N -4.73 0.05 -1.68 1.00 -2.24 -1.26 -4.94 114.28 100.48 3kvm n THR 187 Ca 0.13 -0.28 -0.46 0.00 -2.27 0.00 0.00 64.05 61.18 3kvm n THR 187 Cb 0.27 0.47 -0.04 0.00 -2.10 0.00 0.00 70.33 68.92 3kvm n THR 187 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3kvm n SER 188 N 0.21 3.33 0.10 3.42 2.88 -0.77 -4.88 113.62 117.90 3kvm n SER 188 Ca 0.18 1.04 -0.15 0.00 -1.33 0.00 0.00 58.87 58.61 3kvm n SER 188 Cb 0.35 -1.43 -0.11 0.00 -0.75 0.00 0.00 64.21 62.27 3kvm n SER 188 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 3kvm h VAL 189 N 4.25 1.47 -3.55 2.46 2.07 -1.92 -3.43 116.25 117.60 3kvm h VAL 189 Ca -0.46 -2.88 -0.64 0.00 0.82 0.00 0.00 66.70 63.55 3kvm h VAL 189 Cb 1.25 2.79 -0.40 0.00 -1.52 0.00 0.00 31.29 33.41 3kvm h VAL 189 CO 0.91 0.84 -0.73 -0.62 0.02 0.00 0.00 177.57 177.99 3kvm s ASP 190 N -7.13 4.53 0.17 0.57 2.15 -1.26 -5.00 116.67 110.69 3kvm s ASP 190 Ca -0.04 -1.96 -0.12 0.00 0.43 0.00 0.00 52.55 50.86 3kvm s ASP 190 Cb 0.08 -1.41 0.06 0.00 -0.30 0.00 0.00 42.92 41.35 3kvm s ASP 190 CO 0.88 -0.38 1.70 0.00 -0.17 0.00 0.00 175.17 177.20 3kvm h ALA 191 N 7.75 0.74 -0.40 3.66 0.00 -1.99 -2.47 119.26 126.56 3kvm h ALA 191 Ca -0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3kvm h ALA 191 Cb 1.02 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 3kvm h ALA 191 CO 0.50 0.39 0.15 0.00 0.00 0.00 0.00 179.25 180.29 3kvm h ALA 192 N 1.05 1.52 -0.17 0.00 0.00 -1.94 -2.17 119.26 117.56 3kvm h ALA 192 Ca 0.18 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 3kvm h ALA 192 Cb 0.27 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3kvm h ALA 192 CO -0.01 0.37 -0.59 1.49 0.00 0.00 0.00 179.25 180.51 3kvm h GLU 193 N 0.56 0.54 -0.36 0.00 4.57 -1.88 0.19 114.58 118.20 3kvm h GLU 193 Ca 0.14 -0.36 0.04 0.00 -1.18 0.00 0.00 59.36 58.00 3kvm h GLU 193 Cb 0.13 0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.73 3kvm h GLU 193 CO -0.01 0.97 0.13 -0.44 -1.18 0.00 0.00 179.01 178.48 3kvm h ASP 194 N 0.41 0.14 -0.38 1.04 5.19 -1.02 -1.32 116.42 120.48 3kvm h ASP 194 Ca -0.00 0.04 -0.14 0.00 -0.62 0.00 0.00 57.03 56.31 3kvm h ASP 194 Cb 1.14 0.02 -0.01 0.00 0.18 0.00 0.00 39.33 40.67 3kvm h ASP 194 CO 0.11 0.12 -0.27 1.88 -3.12 0.00 0.00 179.24 177.95 3kvm h TYR 195 N 0.28 1.04 -0.96 4.55 -1.99 -1.24 -2.57 116.97 116.07 3kvm h TYR 195 Ca 0.17 -0.27 0.01 0.00 2.00 0.00 0.00 58.73 60.64 3kvm h TYR 195 Cb 0.14 -0.24 -0.05 0.00 2.00 0.00 0.00 36.73 38.59 3kvm h TYR 195 CO -0.14 1.06 0.64 0.00 -0.00 0.00 0.00 178.16 179.72 3kvm h ALA 196 N 0.92 1.22 -0.53 3.88 0.00 -0.79 -0.73 119.26 123.23 3kvm h ALA 196 Ca 0.09 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3kvm h ALA 196 Cb 0.84 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3kvm h ALA 196 CO 0.07 0.61 0.34 0.93 0.00 0.00 0.00 179.25 181.20 3kvm h GLU 197 N 1.31 0.66 -0.72 0.00 5.08 -1.05 -1.44 114.58 118.41 3kvm h GLU 197 Ca 0.35 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.65 3kvm h GLU 197 Cb -0.15 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 28.92 3kvm h GLU 197 CO -0.08 0.43 0.34 0.78 -1.00 0.00 0.00 179.01 179.49 3kvm h GLY 198 N 0.68 1.10 0.97 -3.84 0.00 -0.96 -0.58 103.07 100.44 3kvm h GLY 198 Ca 0.20 -0.53 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 3kvm h GLY 198 CO -0.06 0.50 0.22 -2.08 0.00 0.00 0.00 176.54 175.12 3kvm h VAL 199 N 1.02 1.20 -0.44 4.60 2.07 -0.74 -0.35 116.25 123.60 3kvm h VAL 199 Ca 0.25 -0.57 -0.12 0.00 0.82 0.00 0.00 66.70 67.08 3kvm h VAL 199 Cb 0.10 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 3kvm h VAL 199 CO -0.03 0.22 -0.20 0.03 0.02 0.00 0.00 177.57 177.61 3kvm h ARG 200 N 0.64 0.88 0.09 1.57 3.08 -0.75 -1.15 114.38 118.73 3kvm h ARG 200 Ca 0.16 -0.35 -0.26 0.00 0.07 0.00 0.00 59.98 59.60 3kvm h ARG 200 Cb 0.14 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3kvm h ARG 200 CO -0.02 1.00 -1.35 0.28 -1.07 0.00 0.00 179.97 178.80 3kvm h VAL 201 N 0.77 1.01 0.00 2.04 2.07 -1.06 -3.41 116.25 117.67 3kvm h VAL 201 Ca 0.11 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.28 3kvm h VAL 201 Cb 0.74 2.63 0.00 0.00 -1.52 0.00 0.00 31.29 33.14 3kvm h VAL 201 CO 0.06 0.64 -1.34 0.18 0.02 0.00 0.00 177.57 177.12 3kvm n LEU 202 N -4.02 0.33 -0.27 2.57 4.77 -0.15 -4.45 117.00 115.77 3kvm n LEU 202 Ca -0.26 -0.21 0.05 0.00 -0.03 0.00 0.00 56.01 55.56 3kvm n LEU 202 Cb 0.85 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 42.13 3kvm n LEU 202 CO 0.36 0.08 1.07 1.23 -1.33 0.00 0.00 177.39 178.80 3kvm h GLY 203 N 3.42 1.25 2.00 -0.72 0.00 -1.12 -0.07 103.07 107.83 3kvm h GLY 203 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.12 3kvm h GLY 203 CO 0.00 -0.04 0.00 -1.05 0.00 0.00 0.00 176.54 175.45 3kvm n PRO 204 N -4.91 0.14 -0.02 4.80 -0.02 -1.25 -2.50 135.00 131.24 3kvm n PRO 204 Ca 0.15 0.50 0.07 0.00 -2.02 0.00 0.00 63.50 62.20 3kvm n PRO 204 Cb 0.40 -1.83 0.07 0.00 -0.02 0.00 0.00 33.50 32.12 3kvm n PRO 204 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3kvm n LEU 205 N -2.10 2.26 -4.41 2.45 4.77 -0.07 -4.84 117.00 115.05 3kvm n LEU 205 Ca 0.01 -1.08 -0.30 0.00 -0.03 0.00 0.00 56.01 54.61 3kvm n LEU 205 Cb 0.13 -0.02 -0.13 0.00 -2.33 0.00 0.00 43.42 41.06 3kvm n LEU 205 CO 0.13 0.43 -0.54 0.00 -1.33 0.00 0.00 177.39 176.08 3kvm s ALA 206 N -1.16 2.44 0.08 -1.18 0.00 -1.01 -5.01 121.76 115.91 3kvm s ALA 206 Ca 0.18 -1.36 -0.07 0.00 0.00 0.00 0.00 51.96 50.71 3kvm s ALA 206 Cb 0.12 -0.51 -0.24 0.00 0.00 0.00 0.00 23.12 22.49 3kvm s ALA 206 CO 0.18 0.55 1.16 -0.44 0.00 0.00 0.00 175.76 177.21 3kvm h ASP 207 N 4.17 0.55 -5.02 0.00 3.32 -1.26 -3.38 116.42 114.80 3kvm h ASP 207 Ca -0.49 -0.54 -0.16 0.00 0.02 0.00 0.00 57.03 55.86 3kvm h ASP 207 Cb 1.16 -0.18 -0.20 0.00 0.22 0.00 0.00 39.33 40.33 3kvm h ASP 207 CO 0.43 1.39 -0.65 -0.72 -1.72 0.00 0.00 179.24 177.97 3kvm s TYR 208 N -2.84 0.25 0.07 4.55 1.13 -1.08 -2.16 117.35 117.26 3kvm s TYR 208 Ca -0.06 -0.52 0.05 0.00 -1.41 0.00 0.00 57.07 55.14 3kvm s TYR 208 Cb 0.07 -0.18 -0.04 0.00 -1.10 0.00 0.00 41.96 40.71 3kvm s TYR 208 CO 0.89 -0.24 -0.05 -0.51 -2.51 0.00 0.00 175.55 173.13 3kvm s LEU 209 N -1.66 3.23 -0.13 -3.49 1.43 0.55 -1.02 118.68 117.60 3kvm s LEU 209 Ca -0.12 -0.25 0.02 0.00 -1.03 0.00 0.00 54.13 52.75 3kvm s LEU 209 Cb -0.07 -1.96 0.01 0.00 0.03 0.00 0.00 46.19 44.20 3kvm s LEU 209 CO -0.02 0.20 -0.21 -0.69 0.23 0.00 0.00 176.35 175.87 3kvm s VAL 210 N -1.19 1.93 -0.45 -1.59 1.01 0.05 -0.62 120.40 119.54 3kvm s VAL 210 Ca 0.22 -0.90 -0.21 0.00 0.00 0.00 0.00 61.98 61.09 3kvm s VAL 210 Cb -0.11 -1.72 0.03 0.00 0.00 0.00 0.00 36.38 34.58 3kvm s VAL 210 CO 0.14 0.53 0.66 -0.69 0.00 0.00 0.00 175.10 175.73 3kvm s VAL 211 N 0.84 4.81 -0.66 2.92 1.01 0.31 -0.73 120.40 128.89 3kvm s VAL 211 Ca -0.07 0.10 -0.19 0.00 0.00 0.00 0.00 61.98 61.82 3kvm s VAL 211 Cb -0.15 -4.23 0.11 0.00 0.00 0.00 0.00 36.38 32.11 3kvm s VAL 211 CO -0.02 -0.63 0.79 0.21 0.00 0.00 0.00 175.10 175.45 3kvm s ASN 212 N 2.07 6.28 -0.31 3.32 2.47 -1.19 -1.90 114.94 125.69 3kvm s ASN 212 Ca 0.23 -1.57 0.09 0.00 0.42 0.00 0.00 52.86 52.03 3kvm s ASN 212 Cb -0.14 -2.32 0.59 0.00 -1.45 0.00 0.00 41.25 37.93 3kvm s ASN 212 CO 0.19 -1.10 1.61 1.33 -3.72 0.00 0.00 177.10 175.42 3kvm n VAL 213 N 5.44 2.71 -0.72 -5.21 0.24 -1.21 -4.57 118.33 115.02 3kvm n VAL 213 Ca -0.03 -2.22 0.00 0.00 -2.04 0.00 0.00 64.34 60.05 3kvm n VAL 213 Cb 0.44 -0.35 0.00 0.00 -1.47 0.00 0.00 33.84 32.46 3kvm n VAL 213 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3kvm n SER 214 N -0.84 0.55 -4.72 -1.34 3.41 -1.25 -3.88 113.62 105.56 3kvm n SER 214 Ca 0.38 -1.27 -0.42 0.00 -0.26 0.00 0.00 58.87 57.30 3kvm n SER 214 Cb 1.21 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 65.13 3kvm n SER 214 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3kvm s SER 215 N -0.27 6.66 0.15 4.04 0.15 -1.26 -4.62 113.70 118.54 3kvm s SER 215 Ca 0.00 2.54 0.22 0.00 0.70 0.00 0.00 55.95 59.41 3kvm s SER 215 Cb 0.00 -2.59 0.88 0.00 -1.71 0.00 0.00 66.02 62.60 3kvm s SER 215 CO 0.00 -0.76 1.69 -2.65 1.20 0.00 0.00 173.24 172.71 3kvm n PRO 216 N 3.80 0.13 -0.17 5.44 -0.02 -1.26 -4.11 135.00 138.81 3kvm n PRO 216 Ca 0.12 0.28 0.05 0.00 -2.02 0.00 0.00 63.50 61.94 3kvm n PRO 216 Cb 0.40 -1.71 0.13 0.00 -0.02 0.00 0.00 33.50 32.30 3kvm n PRO 216 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3kvm n ASN 217 N -1.95 2.83 -3.96 2.55 3.02 -1.26 -4.82 115.26 111.67 3kvm n ASN 217 Ca 0.04 -2.16 -0.29 0.00 -0.03 0.00 0.00 54.58 52.14 3kvm n ASN 217 Cb 0.27 -0.23 -0.17 0.00 -0.61 0.00 0.00 39.78 39.04 3kvm n ASN 217 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3kvm s THR 218 N -1.28 1.34 0.15 3.41 2.01 -1.26 -4.50 115.64 115.51 3kvm s THR 218 Ca 0.21 -0.58 -0.33 0.00 0.31 0.00 0.00 61.69 61.30 3kvm s THR 218 Cb 0.13 -1.35 -0.12 0.00 0.01 0.00 0.00 72.50 71.17 3kvm s THR 218 CO 0.11 0.34 1.72 0.00 -0.69 0.00 0.00 174.62 176.11 3kvm n ALA 219 N 4.83 2.04 0.00 7.40 0.00 -1.26 -2.06 120.51 131.46 3kvm n ALA 219 Ca -0.14 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.68 3kvm n ALA 219 Cb 0.49 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.45 3kvm n ALA 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kvm n GLY 220 N 3.91 2.82 0.17 0.00 0.00 -1.26 -4.93 105.19 105.88 3kvm n GLY 220 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 3kvm n GLY 220 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3kvm h LEU 221 N 0.00 0.45 -1.65 0.99 5.85 -1.72 -2.98 115.31 116.24 3kvm h LEU 221 Ca 0.00 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3kvm h LEU 221 Cb 0.00 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 40.91 3kvm h LEU 221 CO 0.00 0.48 0.00 0.03 -0.34 0.00 0.00 178.44 178.61 3kvm h ARG 222 N 0.38 0.00 0.00 1.25 3.08 -1.77 -1.09 114.38 116.23 3kvm h ARG 222 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 3kvm h ARG 222 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 3kvm h ARG 222 CO -0.01 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.76 3kvm n SER 223 N -3.08 0.00 0.00 7.04 3.41 -1.13 -1.46 113.62 118.40 3kvm n SER 223 Ca 0.00 -0.19 0.06 0.00 -0.26 0.00 0.00 58.87 58.48 3kvm n SER 223 Cb 0.27 -0.25 0.34 0.00 -0.26 0.00 0.00 64.21 64.31 3kvm n SER 223 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3kvm n LEU 224 N -1.25 0.00 0.00 1.04 4.77 -0.41 -2.57 117.00 118.58 3kvm n LEU 224 Ca 0.14 0.20 0.12 0.00 -0.03 0.00 0.00 56.01 56.44 3kvm n LEU 224 Cb 0.20 -0.20 0.30 0.00 -2.33 0.00 0.00 43.42 41.39 3kvm n LEU 224 CO 0.20 -0.12 0.52 0.00 -1.33 0.00 0.00 177.39 176.66 3kvm n GLN 225 N -1.20 0.02 -1.05 3.23 6.02 -0.54 -3.84 117.38 120.02 3kvm n GLN 225 Ca 0.07 0.01 -0.29 0.00 -0.01 0.00 0.00 57.00 56.78 3kvm n GLN 225 Cb 0.08 -1.51 0.18 0.00 1.02 0.00 0.00 30.24 30.01 3kvm n GLN 225 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 3kvm s GLY 226 N -3.04 1.58 -0.02 1.08 0.00 -1.06 -4.74 107.32 101.13 3kvm s GLY 226 Ca 0.11 -0.19 -0.05 0.00 0.00 0.00 0.00 44.72 44.59 3kvm s GLY 226 CO 0.68 0.40 0.44 1.70 0.00 0.00 0.00 173.10 176.31 3kvm h LYS 227 N -1.93 -0.18 0.00 2.90 3.64 -1.90 -0.34 116.57 118.76 3kvm h LYS 227 Ca -0.54 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 58.81 3kvm h LYS 227 Cb 1.31 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.17 3kvm h LYS 227 CO 0.55 -0.12 -0.21 0.00 -2.27 0.00 0.00 179.45 177.40 3kvm h ALA 228 N -1.67 1.18 0.11 5.00 0.00 -1.98 0.18 119.26 122.07 3kvm h ALA 228 Ca -0.02 -0.19 -0.28 0.00 0.00 0.00 0.00 54.91 54.42 3kvm h ALA 228 Cb 0.14 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.92 3kvm h ALA 228 CO 0.03 0.26 -1.20 1.49 0.00 0.00 0.00 179.25 179.84 3kvm h GLU 229 N 0.00 0.46 -0.21 0.00 4.81 -1.92 -2.62 114.58 115.11 3kvm h GLU 229 Ca -0.00 -0.64 -0.17 0.00 -0.13 0.00 0.00 59.36 58.42 3kvm h GLU 229 Cb 0.56 0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.16 3kvm h GLU 229 CO 0.03 1.27 -0.57 1.25 -0.73 0.00 0.00 179.01 180.26 3kvm h LEU 230 N 0.19 0.72 -0.54 1.64 5.85 -0.33 -1.60 115.31 121.24 3kvm h LEU 230 Ca -0.15 -0.39 -0.09 0.00 0.84 0.00 0.00 57.88 58.09 3kvm h LEU 230 Cb 1.88 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.68 3kvm h LEU 230 CO 0.21 1.13 -0.00 -0.09 -0.34 0.00 0.00 178.44 179.35 3kvm h ARG 231 N 0.49 0.95 -0.32 1.25 2.43 -0.71 0.12 114.38 118.58 3kvm h ARG 231 Ca 0.01 -0.30 -0.05 0.00 -0.81 0.00 0.00 59.98 58.83 3kvm h ARG 231 Cb 1.13 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.58 3kvm h ARG 231 CO 0.11 0.96 0.02 -0.09 -1.51 0.00 0.00 179.97 179.46 3kvm h ARG 232 N 0.82 0.56 -0.07 0.20 2.43 -1.46 -0.35 114.38 116.51 3kvm h ARG 232 Ca 0.15 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3kvm h ARG 232 Cb 0.53 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.02 3kvm h ARG 232 CO 0.03 0.67 0.05 1.25 -1.51 0.00 0.00 179.97 180.46 3kvm h LEU 233 N 0.37 0.09 -0.24 3.80 5.85 -1.09 -2.70 115.31 121.38 3kvm h LEU 233 Ca 0.09 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.67 3kvm h LEU 233 Cb 0.41 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 3kvm h LEU 233 CO 0.01 0.07 -0.64 -0.07 -0.34 0.00 0.00 178.44 177.47 3kvm h LEU 234 N 0.10 0.00 -0.62 2.25 3.38 -0.75 -2.04 115.31 117.63 3kvm h LEU 234 Ca 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3kvm h LEU 234 Cb -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 3kvm h LEU 234 CO -0.01 0.64 0.31 0.74 0.09 0.00 0.00 178.44 180.21 3kvm h THR 235 N 0.00 1.21 -0.34 0.22 2.02 -1.02 -0.92 112.91 114.08 3kvm h THR 235 Ca -0.01 -0.59 -0.10 0.00 0.77 0.00 0.00 66.41 66.48 3kvm h THR 235 Cb 1.38 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 3kvm h THR 235 CO 0.08 0.24 -0.18 0.50 0.37 0.00 0.00 175.52 176.54 3kvm h LYS 236 N 0.85 0.72 -0.38 6.66 3.64 -1.28 -1.72 116.57 125.08 3kvm h LYS 236 Ca 0.21 -0.32 0.03 0.00 -1.27 0.00 0.00 60.65 59.31 3kvm h LYS 236 Cb 0.11 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.87 3kvm h LYS 236 CO -0.03 0.93 0.17 0.28 -2.27 0.00 0.00 179.45 178.53 3kvm h VAL 237 N 0.50 0.94 -0.19 2.00 2.07 -1.25 -1.47 116.25 118.86 3kvm h VAL 237 Ca 0.08 -0.12 -0.11 0.00 0.82 0.00 0.00 66.70 67.37 3kvm h VAL 237 Cb 0.72 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 3kvm h VAL 237 CO 0.05 0.06 -0.34 -0.07 0.02 0.00 0.00 177.57 177.29 3kvm h LEU 238 N 0.35 0.41 -0.30 2.57 3.38 -1.11 -1.00 115.31 119.61 3kvm h LEU 238 Ca 0.16 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3kvm h LEU 238 Cb 0.10 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3kvm h LEU 238 CO -0.14 0.73 -0.00 -0.61 0.09 0.00 0.00 178.44 178.52 3kvm h GLN 239 N 0.34 0.53 -0.86 1.13 4.15 -1.04 0.02 115.11 119.39 3kvm h GLN 239 Ca 0.04 -0.17 0.01 0.00 0.77 0.00 0.00 58.65 59.30 3kvm h GLN 239 Cb 0.77 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 28.37 3kvm h GLN 239 CO 0.06 0.68 0.57 0.93 -1.93 0.00 0.00 178.83 179.13 3kvm h GLU 240 N 0.33 1.12 -0.38 1.69 4.39 -1.08 -2.01 114.58 118.63 3kvm h GLU 240 Ca 0.09 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 3kvm h GLU 240 Cb 0.44 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 3kvm h GLU 240 CO 0.02 0.74 0.15 -0.09 -1.16 0.00 0.00 179.01 178.66 3kvm h ARG 241 N 1.15 0.58 0.00 2.33 1.12 -0.96 -2.48 114.38 116.12 3kvm h ARG 241 Ca 0.32 -0.11 0.00 0.00 -1.11 0.00 0.00 59.98 59.08 3kvm h ARG 241 Cb -0.11 -0.09 0.00 0.00 -0.01 0.00 0.00 29.97 29.76 3kvm h ARG 241 CO -0.08 0.55 0.00 -0.44 -3.11 0.00 0.00 179.97 176.90 3kvm h ASP 242 N 0.47 0.00 0.50 -3.80 3.32 -0.69 -1.88 116.42 114.34 3kvm h ASP 242 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3kvm h ASP 242 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 3kvm h ASP 242 CO -0.01 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.12 3kvm n GLY 243 N -0.33 -1.23 3.84 2.75 0.00 -0.78 -4.83 105.19 104.61 3kvm n GLY 243 Ca -0.00 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 3kvm n GLY 243 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kvm s LEU 244 N -2.52 3.98 0.51 0.99 1.43 -0.71 -5.03 118.68 117.34 3kvm s LEU 244 Ca 0.30 1.41 -0.22 0.00 -1.03 0.00 0.00 54.13 54.58 3kvm s LEU 244 Cb 0.20 -4.24 -0.06 0.00 0.03 0.00 0.00 46.19 42.12 3kvm s LEU 244 CO 0.44 -0.29 1.33 -0.13 0.23 0.00 0.00 176.35 177.93 3kvm s ARG 245 N -3.17 3.34 0.19 1.70 0.52 -1.26 -4.76 118.95 115.51 3kvm s ARG 245 Ca 0.57 2.16 -0.14 0.00 -0.52 0.00 0.00 55.73 57.80 3kvm s ARG 245 Cb -0.10 -2.35 0.19 0.00 0.52 0.00 0.00 34.95 33.22 3kvm s ARG 245 CO 0.18 -1.00 1.67 -0.09 0.02 0.00 0.00 175.30 176.08 3kvm h ARG 246 N 1.71 0.08 0.00 3.54 2.43 -1.95 0.20 114.38 120.38 3kvm h ARG 246 Ca -0.51 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 3kvm h ARG 246 Cb 1.28 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.82 3kvm h ARG 246 CO 0.58 0.05 0.00 1.33 -1.51 0.00 0.00 179.97 180.43 3kvm n VAL 247 N -5.27 1.05 -1.38 0.20 0.24 -1.26 -2.14 118.33 109.77 3kvm n VAL 247 Ca 0.06 0.41 0.04 0.00 -2.04 0.00 0.00 64.34 62.80 3kvm n VAL 247 Cb 0.28 -1.34 0.20 0.00 -1.47 0.00 0.00 33.84 31.51 3kvm n VAL 247 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 3kvm n HIS 248 N -2.04 0.43 -3.53 6.34 8.25 0.67 -4.98 115.22 120.36 3kvm n HIS 248 Ca 0.01 -1.36 -0.42 0.00 -0.26 0.00 0.00 57.72 55.69 3kvm n HIS 248 Cb 0.14 -0.31 -0.09 0.00 1.12 0.00 0.00 29.99 30.85 3kvm n HIS 248 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 3kvm s ARG 249 N -3.13 2.75 0.58 -0.41 3.52 -0.91 -3.90 118.95 117.46 3kvm s ARG 249 Ca 0.39 -1.38 -0.15 0.00 -0.13 0.00 0.00 55.73 54.46 3kvm s ARG 249 Cb 0.36 -3.90 -0.04 0.00 -1.56 0.00 0.00 34.95 29.81 3kvm s ARG 249 CO -0.01 -0.95 1.04 -1.25 -0.81 0.00 0.00 175.30 173.31 3kvm s PRO 250 N 1.51 3.47 0.60 5.12 0.04 -1.26 -5.03 135.00 139.45 3kvm s PRO 250 Ca 0.03 1.08 -0.18 0.00 0.04 0.00 0.00 61.00 61.97 3kvm s PRO 250 Cb -0.23 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.22 3kvm s PRO 250 CO 0.04 -0.68 1.17 0.00 0.04 0.00 0.00 177.00 177.58 3kvm s ALA 251 N -2.60 2.55 -0.16 8.56 0.00 -0.92 -4.85 121.76 124.35 3kvm s ALA 251 Ca 0.61 0.89 0.01 0.00 0.00 0.00 0.00 51.96 53.47 3kvm s ALA 251 Cb -0.14 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.57 3kvm s ALA 251 CO 0.38 -1.11 -0.17 0.08 0.00 0.00 0.00 175.76 174.94 3kvm s VAL 252 N -1.76 2.51 0.18 0.00 1.01 -1.26 -0.33 120.40 120.74 3kvm s VAL 252 Ca 0.75 -0.82 0.10 0.00 0.00 0.00 0.00 61.98 62.01 3kvm s VAL 252 Cb -0.27 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 3kvm s VAL 252 CO 0.33 0.52 -0.18 -0.76 0.00 0.00 0.00 175.10 175.01 3kvm s LEU 253 N 0.89 2.67 -0.13 3.92 1.02 0.21 -1.53 118.68 125.73 3kvm s LEU 253 Ca -0.04 -0.72 -0.03 0.00 0.02 0.00 0.00 54.13 53.37 3kvm s LEU 253 Cb -0.15 -1.40 -0.03 0.00 0.02 0.00 0.00 46.19 44.63 3kvm s LEU 253 CO -0.02 0.12 -0.05 -0.69 0.02 0.00 0.00 176.35 175.73 3kvm s VAL 254 N -1.61 3.81 -0.20 -1.59 1.01 -0.69 -0.53 120.40 120.60 3kvm s VAL 254 Ca 0.22 -0.40 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 3kvm s VAL 254 Cb -0.09 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 3kvm s VAL 254 CO 0.12 0.52 0.03 -0.75 0.00 0.00 0.00 175.10 175.02 3kvm s LYS 255 N 0.09 3.74 0.30 2.72 2.20 -0.80 -0.08 119.74 127.92 3kvm s LYS 255 Ca -0.01 -0.46 0.10 0.00 -0.36 0.00 0.00 55.97 55.24 3kvm s LYS 255 Cb -0.14 -3.16 -0.05 0.00 -1.51 0.00 0.00 37.83 32.98 3kvm s LYS 255 CO 0.03 0.07 -0.08 0.96 -0.36 0.00 0.00 175.35 175.98 3kvm s ILE 256 N 0.87 2.75 0.64 5.43 -4.36 -0.57 -3.29 121.20 122.67 3kvm s ILE 256 Ca 0.02 -2.13 -0.11 0.00 -0.26 0.00 0.00 60.65 58.17 3kvm s ILE 256 Cb -0.14 -2.62 -0.03 0.00 1.25 0.00 0.00 42.46 40.92 3kvm s ILE 256 CO 0.02 -0.32 1.04 0.00 0.24 0.00 0.00 174.94 175.93 3kvm s ALA 257 N -2.47 3.02 -1.68 2.27 0.00 -1.26 -0.77 121.76 120.87 3kvm s ALA 257 Ca 0.32 -0.10 0.31 0.00 0.00 0.00 0.00 51.96 52.49 3kvm s ALA 257 Cb -0.03 -3.09 1.62 0.00 0.00 0.00 0.00 23.12 21.63 3kvm s ALA 257 CO 0.18 -0.81 2.09 -0.35 0.00 0.00 0.00 175.76 176.87 3kvm n PRO 258 N -2.83 0.69 -1.09 0.00 -0.04 -1.26 -4.31 135.00 126.16 3kvm n PRO 258 Ca 0.06 -0.04 -0.17 0.00 -0.04 0.00 0.00 63.50 63.31 3kvm n PRO 258 Cb 0.54 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.69 3kvm n PRO 258 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3kvm n ASP 259 N -1.12 3.38 -4.84 3.54 8.00 -1.26 -4.99 116.55 119.26 3kvm n ASP 259 Ca 0.18 -3.69 -0.35 0.00 0.71 0.00 0.00 54.79 51.64 3kvm n ASP 259 Cb 0.20 -0.77 -0.06 0.00 -0.02 0.00 0.00 41.12 40.48 3kvm n ASP 259 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3kvm s LEU 260 N -3.30 4.35 0.88 0.64 1.43 -1.26 -5.08 118.68 116.34 3kvm s LEU 260 Ca 0.53 1.06 -0.11 0.00 -1.03 0.00 0.00 54.13 54.58 3kvm s LEU 260 Cb 0.45 -3.21 0.12 0.00 0.03 0.00 0.00 46.19 43.58 3kvm s LEU 260 CO 0.06 0.12 1.09 0.42 0.23 0.00 0.00 176.35 178.28 3kvm s THR 261 N -1.43 2.75 0.35 5.49 -4.23 -1.26 -4.86 115.64 112.45 3kvm s THR 261 Ca 0.37 0.24 0.06 0.00 -1.18 0.00 0.00 61.69 61.18 3kvm s THR 261 Cb -0.15 -2.74 0.30 0.00 1.34 0.00 0.00 72.50 71.24 3kvm s THR 261 CO 0.19 -0.32 1.93 0.28 -0.54 0.00 0.00 174.62 176.16 3kvm h SER 262 N -1.48 0.70 -0.59 3.99 0.02 -2.00 -1.97 113.55 112.24 3kvm h SER 262 Ca -0.49 0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 60.38 3kvm h SER 262 Cb 1.28 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.66 3kvm h SER 262 CO 0.54 0.44 0.02 -0.61 -1.14 0.00 0.00 176.83 176.08 3kvm h GLN 263 N 0.79 1.03 -0.13 3.45 5.75 -1.99 -1.36 115.11 122.65 3kvm h GLN 263 Ca 0.35 -0.32 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 3kvm h GLN 263 Cb 0.34 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.79 3kvm h GLN 263 CO -0.13 1.01 0.09 -0.44 -2.65 0.00 0.00 178.83 176.70 3kvm h ASP 264 N 0.92 0.15 -0.48 -0.69 3.32 -1.74 -0.79 116.42 117.12 3kvm h ASP 264 Ca 0.17 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.16 3kvm h ASP 264 Cb 0.53 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 3kvm h ASP 264 CO 0.03 0.11 0.08 0.11 -1.72 0.00 0.00 179.24 177.85 3kvm h LYS 265 N 0.17 0.79 -0.74 3.56 1.57 -1.28 0.70 116.57 121.34 3kvm h LYS 265 Ca 0.05 -0.21 0.04 0.00 -1.87 0.00 0.00 60.65 58.66 3kvm h LYS 265 Cb -0.02 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.15 3kvm h LYS 265 CO -0.01 0.79 0.45 1.49 -0.57 0.00 0.00 179.45 181.60 3kvm h GLU 266 N 0.66 0.83 -0.32 3.15 4.81 -1.16 -0.28 114.58 122.27 3kvm h GLU 266 Ca 0.15 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 59.17 3kvm h GLU 266 Cb 0.38 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 3kvm h GLU 266 CO 0.01 0.55 -0.41 -0.44 -0.73 0.00 0.00 179.01 177.99 3kvm h ASP 267 N 0.86 0.91 -0.55 1.04 3.32 -0.66 -2.53 116.42 118.81 3kvm h ASP 267 Ca 0.31 -0.49 -0.05 0.00 0.02 0.00 0.00 57.03 56.81 3kvm h ASP 267 Cb 0.09 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 3kvm h ASP 267 CO -0.14 1.22 0.13 0.40 -1.72 0.00 0.00 179.24 179.13 3kvm h ILE 268 N 0.61 1.25 -0.72 0.35 2.04 -0.59 -1.59 117.51 118.86 3kvm h ILE 268 Ca 0.04 -0.89 0.03 0.00 1.00 0.00 0.00 64.86 65.04 3kvm h ILE 268 Cb 1.00 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.80 3kvm h ILE 268 CO 0.10 0.33 0.46 0.00 0.00 0.00 0.00 178.15 179.03 3kvm h ALA 269 N 1.01 0.95 -0.26 1.87 0.00 -1.02 -0.23 119.26 121.58 3kvm h ALA 269 Ca 0.17 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3kvm h ALA 269 Cb 0.35 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3kvm h ALA 269 CO 0.00 0.24 0.05 1.03 0.00 0.00 0.00 179.25 180.57 3kvm h SER 270 N 0.89 0.41 -0.52 0.00 0.87 -1.14 -2.20 113.55 111.86 3kvm h SER 270 Ca 0.29 -0.25 -0.09 0.00 -1.23 0.00 0.00 61.79 60.50 3kvm h SER 270 Cb 0.02 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 3kvm h SER 270 CO -0.11 0.56 -0.04 0.58 -0.53 0.00 0.00 176.83 177.30 3kvm h VAL 271 N 0.24 1.27 -0.78 2.23 2.07 -1.09 -0.73 116.25 119.46 3kvm h VAL 271 Ca 0.08 -1.15 0.05 0.00 0.82 0.00 0.00 66.70 66.50 3kvm h VAL 271 Cb 0.32 0.96 -0.06 0.00 -1.52 0.00 0.00 31.29 30.99 3kvm h VAL 271 CO 0.00 0.41 0.47 0.58 0.02 0.00 0.00 177.57 179.06 3kvm h VAL 272 N 0.82 1.03 0.05 2.57 2.07 -0.96 -0.60 116.25 121.22 3kvm h VAL 272 Ca 0.14 -0.30 -0.24 0.00 0.82 0.00 0.00 66.70 67.12 3kvm h VAL 272 Cb 0.58 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 3kvm h VAL 272 CO 0.03 0.16 -1.04 0.11 0.02 0.00 0.00 177.57 176.86 3kvm h LYS 273 N 0.88 0.33 -0.56 1.57 1.57 -1.26 -1.31 116.57 117.79 3kvm h LYS 273 Ca 0.34 -0.42 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 3kvm h LYS 273 Cb 0.14 0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 3kvm h LYS 273 CO -0.16 1.13 0.28 1.49 -0.57 0.00 0.00 179.45 181.61 3kvm h GLU 274 N 0.16 0.81 0.00 3.15 4.81 -0.81 -3.20 114.58 119.50 3kvm h GLU 274 Ca -0.09 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 3kvm h GLU 274 Cb 1.71 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.94 3kvm h GLU 274 CO 0.17 0.65 -0.68 1.28 -0.73 0.00 0.00 179.01 179.70 3kvm n LEU 275 N -4.56 0.62 -1.31 1.64 4.77 -0.26 -4.96 117.00 112.94 3kvm n LEU 275 Ca 0.03 -0.08 -0.07 0.00 -0.03 0.00 0.00 56.01 55.86 3kvm n LEU 275 Cb 0.11 -0.18 0.02 0.00 -2.33 0.00 0.00 43.42 41.05 3kvm n LEU 275 CO 0.37 0.12 0.05 0.61 -1.33 0.00 0.00 177.39 177.21 3kvm n GLY 276 N 1.47 0.43 3.78 -0.72 0.00 -0.74 -5.00 105.19 104.41 3kvm n GLY 276 Ca 0.05 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.22 3kvm n GLY 276 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3kvm n ILE 277 N -3.40 2.06 0.18 -0.61 2.08 -0.57 -4.91 119.36 114.19 3kvm n ILE 277 Ca -0.01 -0.50 0.07 0.00 0.56 0.00 0.00 62.75 62.87 3kvm n ILE 277 Cb 0.53 -1.98 0.17 0.00 -0.75 0.00 0.00 39.64 37.61 3kvm n ILE 277 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 3kvm h ASP 278 N 2.92 0.00 -5.87 4.38 3.32 -1.61 -3.47 116.42 116.08 3kvm h ASP 278 Ca -0.51 0.00 0.36 0.00 0.02 0.00 0.00 57.03 56.90 3kvm h ASP 278 Cb 1.24 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.68 3kvm h ASP 278 CO 0.64 0.31 0.91 -0.83 -1.72 0.00 0.00 179.24 178.55 3kvm s GLY 279 N -4.36 -0.39 0.04 2.75 0.00 -1.21 -4.03 107.32 100.13 3kvm s GLY 279 Ca 0.04 0.66 0.07 0.00 0.00 0.00 0.00 44.72 45.49 3kvm s GLY 279 CO 0.70 1.35 -0.21 1.08 0.00 0.00 0.00 173.10 176.03 3kvm s LEU 280 N -3.17 2.16 -0.17 0.66 1.43 -0.14 -1.70 118.68 117.76 3kvm s LEU 280 Ca 0.18 -0.51 -0.03 0.00 -1.03 0.00 0.00 54.13 52.73 3kvm s LEU 280 Cb 0.05 -0.97 -0.02 0.00 0.03 0.00 0.00 46.19 45.28 3kvm s LEU 280 CO -0.04 0.16 -0.06 -0.63 0.23 0.00 0.00 176.35 176.01 3kvm s ILE 281 N -0.79 3.57 -0.22 -0.59 1.01 0.89 -0.47 121.20 124.58 3kvm s ILE 281 Ca 0.07 -0.46 -0.04 0.00 0.00 0.00 0.00 60.65 60.22 3kvm s ILE 281 Cb -0.09 -2.57 0.08 0.00 0.01 0.00 0.00 42.46 39.89 3kvm s ILE 281 CO 0.02 0.47 0.12 -0.69 0.00 0.00 0.00 174.94 174.85 3kvm s VAL 282 N 0.74 -0.10 0.26 2.92 1.01 -0.03 -1.51 120.40 123.70 3kvm s VAL 282 Ca -0.02 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.57 3kvm s VAL 282 Cb -0.15 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 3kvm s VAL 282 CO 0.02 -0.47 0.18 0.42 0.00 0.00 0.00 175.10 175.25 3kvm s THR 283 N 2.13 0.08 0.00 3.92 -4.23 -0.29 -0.19 115.64 117.07 3kvm s THR 283 Ca 0.05 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.56 3kvm s THR 283 Cb -0.16 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.17 3kvm s THR 283 CO -0.21 0.00 0.00 -3.20 -0.54 0.00 0.00 174.62 170.67 3kvm n ASN 284 N -0.82 -0.54 -4.77 3.99 2.85 0.05 -4.56 115.26 111.45 3kvm n ASN 284 Ca 0.03 -0.73 -0.30 0.00 -0.11 0.00 0.00 54.58 53.47 3kvm n ASN 284 Cb 0.65 -0.00 0.10 0.00 1.24 0.00 0.00 39.78 41.77 3kvm n ASN 284 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 3kvm s THR 285 N -1.00 3.11 -0.08 -0.44 -4.23 -1.26 -4.43 115.64 107.31 3kvm s THR 285 Ca 0.00 0.36 -0.02 0.00 -1.18 0.00 0.00 61.69 60.85 3kvm s THR 285 Cb -0.00 -2.97 -0.03 0.00 1.34 0.00 0.00 72.50 70.83 3kvm s THR 285 CO 0.00 -0.47 0.02 0.28 -0.54 0.00 0.00 174.62 173.91 3kvm s THR 286 N -3.02 4.44 -2.27 3.99 -1.32 -0.77 -4.44 115.64 112.26 3kvm s THR 286 Ca 0.61 -0.23 0.28 0.00 -1.21 0.00 0.00 61.69 61.15 3kvm s THR 286 Cb -0.16 -2.89 0.56 0.00 -1.51 0.00 0.00 72.50 68.50 3kvm s THR 286 CO 0.56 0.58 1.81 1.33 -2.21 0.00 0.00 174.62 176.68 3kvm n VAL 287 N 2.03 0.00 -1.92 5.08 0.24 -1.26 -0.25 118.33 122.26 3kvm n VAL 287 Ca -0.18 -0.18 -0.31 0.00 -2.04 0.00 0.00 64.34 61.63 3kvm n VAL 287 Cb 0.54 0.29 0.01 0.00 -1.47 0.00 0.00 33.84 33.20 3kvm n VAL 287 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3kvm s SER 288 N -2.10 6.26 -0.38 -1.34 1.04 -1.26 -4.99 113.70 110.92 3kvm s SER 288 Ca 0.37 1.42 0.02 0.00 0.48 0.00 0.00 55.95 58.25 3kvm s SER 288 Cb 0.21 -2.47 0.11 0.00 0.10 0.00 0.00 66.02 63.97 3kvm s SER 288 CO 0.37 -0.85 0.13 -0.13 0.98 0.00 0.00 173.24 173.75 3kvm s ARG 289 N -5.10 1.31 0.51 4.02 1.81 -1.26 -4.76 118.95 115.48 3kvm s ARG 289 Ca 0.55 -1.80 -0.21 0.00 -1.72 0.00 0.00 55.73 52.55 3kvm s ARG 289 Cb -0.11 -2.72 -0.07 0.00 -0.45 0.00 0.00 34.95 31.60 3kvm s ARG 289 CO 0.52 -1.02 1.03 -2.30 -0.68 0.00 0.00 175.30 172.85 3kvm n PRO 290 N 4.10 1.23 -1.75 3.54 -0.02 -1.26 -4.90 135.00 135.94 3kvm n PRO 290 Ca 0.03 0.45 -0.41 0.00 -2.02 0.00 0.00 63.50 61.56 3kvm n PRO 290 Cb 0.39 -2.17 0.01 0.00 -0.02 0.00 0.00 33.50 31.71 3kvm n PRO 290 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kvm n ALA 291 N -1.07 1.95 0.00 3.55 0.00 -1.26 -3.36 120.51 120.33 3kvm n ALA 291 Ca 0.11 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.83 3kvm n ALA 291 Cb 0.43 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.51 3kvm n ALA 291 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kvm n GLY 292 N 0.60 0.31 3.73 0.00 0.00 -1.26 -5.06 105.19 103.51 3kvm n GLY 292 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3kvm n GLY 292 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kvm n LEU 293 N 0.00 4.16 -0.02 0.99 4.77 -1.21 -4.91 117.00 120.78 3kvm n LEU 293 Ca 0.00 1.13 0.03 0.00 -0.03 0.00 0.00 56.01 57.14 3kvm n LEU 293 Cb 0.00 -1.57 -0.11 0.00 -2.33 0.00 0.00 43.42 39.41 3kvm n LEU 293 CO 0.00 0.09 -0.74 0.00 -1.33 0.00 0.00 177.39 175.40 3kvm n GLN 294 N 2.44 0.85 -1.71 3.23 1.13 -1.26 -5.02 117.38 117.04 3kvm n GLN 294 Ca 0.10 -0.09 -0.42 0.00 -1.94 0.00 0.00 57.00 54.65 3kvm n GLN 294 Cb 0.36 -1.33 -0.00 0.00 0.11 0.00 0.00 30.24 29.37 3kvm n GLN 294 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3kvm n GLY 295 N 1.85 0.64 0.29 1.08 0.00 -1.26 -4.85 105.19 102.94 3kvm n GLY 295 Ca -0.08 0.31 0.13 0.00 0.00 0.00 0.00 46.02 46.38 3kvm n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kvm h ALA 296 N 2.56 1.72 -0.52 4.61 0.00 -1.95 -2.62 119.26 123.06 3kvm h ALA 296 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3kvm h ALA 296 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3kvm h ALA 296 CO 0.62 -0.03 0.00 1.28 0.00 0.00 0.00 179.25 181.12 3kvm n LEU 297 N -4.08 5.21 0.30 0.00 4.77 -1.26 -4.55 117.00 117.39 3kvm n LEU 297 Ca -0.02 -2.65 0.20 0.00 -0.03 0.00 0.00 56.01 53.51 3kvm n LEU 297 Cb 0.11 -0.66 0.95 0.00 -2.33 0.00 0.00 43.42 41.49 3kvm n LEU 297 CO 0.30 0.60 1.08 0.08 -1.33 0.00 0.00 177.39 178.12 3kvm h ARG 298 N 3.60 0.00 -0.41 3.23 0.11 -1.83 -2.21 114.38 116.87 3kvm h ARG 298 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3kvm h ARG 298 Cb 1.81 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.89 3kvm h ARG 298 CO 0.43 0.00 0.00 0.43 0.10 0.00 0.00 179.97 180.93 3kvm n SER 299 N -3.05 3.03 -4.77 0.08 7.64 -1.26 -4.92 113.62 110.37 3kvm n SER 299 Ca -0.01 -1.94 -0.41 0.00 1.01 0.00 0.00 58.87 57.52 3kvm n SER 299 Cb 0.18 -0.26 -0.01 0.00 -1.01 0.00 0.00 64.21 63.11 3kvm n SER 299 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 3kvm s GLU 300 N -1.47 4.21 0.38 1.43 0.41 -0.83 -4.99 118.70 117.84 3kvm s GLU 300 Ca 0.38 2.36 -0.27 0.00 -0.41 0.00 0.00 54.97 57.04 3kvm s GLU 300 Cb 0.21 -2.99 -0.09 0.00 -1.78 0.00 0.00 34.13 29.48 3kvm s GLU 300 CO 0.29 -0.37 1.27 0.99 -0.49 0.00 0.00 175.26 176.95 3kvm s THR 301 N -1.14 2.79 -5.00 3.63 2.01 -1.26 -4.93 115.64 111.73 3kvm s THR 301 Ca 0.51 0.72 0.00 0.00 0.31 0.00 0.00 61.69 63.23 3kvm s THR 301 Cb -0.42 -3.43 0.00 0.00 0.01 0.00 0.00 72.50 68.66 3kvm s THR 301 CO 0.57 0.12 0.00 0.61 -0.69 0.00 0.00 174.62 175.22 3kvm n GLY 302 N 0.71 0.89 3.75 4.40 0.00 -1.26 -4.45 105.19 109.22 3kvm n GLY 302 Ca 0.03 -1.90 -0.37 0.00 0.00 0.00 0.00 46.02 43.78 3kvm n GLY 302 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kvm s GLY 303 N 0.00 2.34 -0.07 -0.02 0.00 -0.27 -4.53 107.32 104.77 3kvm s GLY 303 Ca 0.00 -0.30 -0.18 0.00 0.00 0.00 0.00 44.72 44.24 3kvm s GLY 303 CO 0.00 0.49 0.47 -2.27 0.00 0.00 0.00 173.10 171.79 3kvm s LEU 304 N 0.17 4.35 0.37 0.66 2.96 0.66 -2.01 118.68 125.84 3kvm s LEU 304 Ca 0.22 0.91 0.04 0.00 -0.22 0.00 0.00 54.13 55.07 3kvm s LEU 304 Cb -0.15 -2.70 -0.05 0.00 0.50 0.00 0.00 46.19 43.80 3kvm s LEU 304 CO 0.08 0.11 0.07 -0.94 -1.32 0.00 0.00 176.35 174.35 3kvm s SER 305 N 0.02 2.76 0.00 3.68 1.04 0.25 -1.85 113.70 119.60 3kvm s SER 305 Ca 0.26 -1.47 0.00 0.00 0.48 0.00 0.00 55.95 55.22 3kvm s SER 305 Cb -0.16 0.07 0.00 0.00 0.10 0.00 0.00 66.02 66.03 3kvm s SER 305 CO 0.12 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.26 3kvm n GLY 306 N -0.81 -0.81 0.25 7.32 0.00 -1.26 -2.60 105.19 107.27 3kvm n GLY 306 Ca -0.05 -1.59 -0.00 0.00 0.00 0.00 0.00 46.02 44.38 3kvm n GLY 306 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3kvm h LYS 307 N 0.00 0.58 0.00 1.61 3.11 -1.58 0.09 116.57 120.38 3kvm h LYS 307 Ca 0.00 -0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.81 3kvm h LYS 307 Cb 0.00 -0.13 0.00 0.00 -1.00 0.00 0.00 32.23 31.10 3kvm h LYS 307 CO 0.00 0.38 0.00 -1.35 -2.81 0.00 0.00 179.45 175.67 3kvm h PRO 308 N 0.59 0.00 0.00 1.90 0.11 -1.81 -1.07 132.00 131.72 3kvm h PRO 308 Ca 0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.43 3kvm h PRO 308 Cb 0.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.40 3kvm h PRO 308 CO -0.23 0.00 -0.85 1.25 -0.21 0.00 0.00 178.00 177.96 3kvm h LEU 309 N 0.00 0.00 0.14 2.35 5.85 -1.24 -3.43 115.31 118.97 3kvm h LEU 309 Ca 0.00 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.68 3kvm h LEU 309 Cb 0.07 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.06 3kvm h LEU 309 CO 0.00 0.03 -0.53 -0.09 -0.34 0.00 0.00 178.44 177.51 3kvm h ARG 310 N 0.00 -0.74 0.00 1.25 2.43 -1.02 -1.47 114.38 114.84 3kvm h ARG 310 Ca 0.00 0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.13 3kvm h ARG 310 Cb 0.94 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.64 3kvm h ARG 310 CO 0.00 -0.49 -0.43 -0.44 -1.51 0.00 0.00 179.97 177.09 3kvm h ASP 311 N -0.77 0.00 -0.47 -3.80 5.19 -1.83 -1.58 116.42 113.16 3kvm h ASP 311 Ca -0.01 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.41 3kvm h ASP 311 Cb 0.77 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.25 3kvm h ASP 311 CO -0.28 0.43 0.30 0.25 -3.12 0.00 0.00 179.24 176.83 3kvm h LEU 312 N 0.00 0.51 -0.34 1.55 5.85 -1.76 -0.52 115.31 120.59 3kvm h LEU 312 Ca -0.00 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 3kvm h LEU 312 Cb 1.19 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 3kvm h LEU 312 CO 0.06 0.37 0.15 -1.28 -0.34 0.00 0.00 178.44 177.39 3kvm h SER 313 N 0.61 0.46 -0.72 1.25 0.87 -0.92 -2.14 113.55 112.96 3kvm h SER 313 Ca 0.18 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 3kvm h SER 313 Cb -0.04 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 61.76 3kvm h SER 313 CO -0.05 0.49 0.45 0.74 -0.53 0.00 0.00 176.83 177.93 3kvm h THR 314 N 0.41 1.19 -0.32 2.23 2.02 -1.07 -0.98 112.91 116.40 3kvm h THR 314 Ca 0.12 -0.39 -0.06 0.00 0.77 0.00 0.00 66.41 66.84 3kvm h THR 314 Cb 0.16 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.72 3kvm h THR 314 CO -0.01 0.19 -0.08 1.56 0.37 0.00 0.00 175.52 177.56 3kvm h GLN 315 N 0.97 0.52 -0.25 6.66 1.08 -0.98 -0.68 115.11 122.43 3kvm h GLN 315 Ca 0.26 -0.14 -0.13 0.00 -1.45 0.00 0.00 58.65 57.19 3kvm h GLN 315 Cb -0.07 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.28 3kvm h GLN 315 CO -0.05 0.61 -0.40 1.15 -0.95 0.00 0.00 178.83 179.18 3kvm h THR 316 N 0.49 1.30 -0.27 -0.54 2.02 -0.75 -1.27 112.91 113.89 3kvm h THR 316 Ca 0.10 -1.56 -0.01 0.00 0.77 0.00 0.00 66.41 65.70 3kvm h THR 316 Cb 0.44 1.54 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 3kvm h THR 316 CO 0.02 0.49 0.13 0.40 0.37 0.00 0.00 175.52 176.94 3kvm h ILE 317 N 0.48 1.15 -0.54 3.11 2.04 -0.71 -0.77 117.51 122.27 3kvm h ILE 317 Ca 0.04 -0.43 0.06 0.00 1.00 0.00 0.00 64.86 65.53 3kvm h ILE 317 Cb 0.90 0.94 -0.05 0.00 -0.74 0.00 0.00 36.82 37.87 3kvm h ILE 317 CO 0.08 0.15 0.25 -0.09 0.00 0.00 0.00 178.15 178.54 3kvm h ARG 318 N 0.30 0.47 -0.15 2.37 2.43 -0.90 -0.45 114.38 118.45 3kvm h ARG 318 Ca 0.09 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.20 3kvm h ARG 318 Cb 0.12 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 3kvm h ARG 318 CO -0.01 0.31 -0.03 1.49 -1.51 0.00 0.00 179.97 180.22 3kvm h GLU 319 N 0.48 0.28 -0.38 0.20 4.81 -1.08 -2.62 114.58 116.27 3kvm h GLU 319 Ca 0.25 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 59.28 3kvm h GLU 319 Cb 0.19 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 3kvm h GLU 319 CO -0.19 0.56 -0.12 0.52 -0.73 0.00 0.00 179.01 179.04 3kvm h MET 320 N -0.02 0.68 -0.67 1.92 2.86 -0.94 -0.80 114.93 117.97 3kvm h MET 320 Ca 0.04 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 3kvm h MET 320 Cb 0.45 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.02 3kvm h MET 320 CO 0.01 0.78 0.40 -0.92 1.06 0.00 0.00 176.91 178.24 3kvm h TYR 321 N 0.62 0.89 -0.28 -0.22 3.20 -1.07 -1.59 116.97 118.51 3kvm h TYR 321 Ca 0.11 -0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.86 3kvm h TYR 321 Cb 0.56 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 3kvm h TYR 321 CO 0.03 0.61 -0.24 0.00 -1.64 0.00 0.00 178.16 176.91 3kvm h ALA 322 N 1.20 0.41 0.00 1.82 0.00 -1.14 0.17 119.26 121.72 3kvm h ALA 322 Ca 0.24 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3kvm h ALA 322 Cb -0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3kvm h ALA 322 CO -0.04 0.39 -0.07 -0.07 0.00 0.00 0.00 179.25 179.46 3kvm h LEU 323 N 0.40 0.00 -2.65 0.00 3.38 -0.99 -2.15 115.31 113.31 3kvm h LEU 323 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3kvm h LEU 323 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3kvm h LEU 323 CO 0.06 0.07 0.00 0.35 0.09 0.00 0.00 178.44 179.01 3kvm n THR 324 N -3.42 0.85 -2.24 0.22 -2.24 -0.61 -4.86 114.28 101.98 3kvm n THR 324 Ca -0.02 -0.93 -0.20 0.00 -2.27 0.00 0.00 64.05 60.64 3kvm n THR 324 Cb 0.21 0.63 -0.02 0.00 -2.10 0.00 0.00 70.33 69.05 3kvm n THR 324 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kvm n GLN 325 N 1.10 -1.57 -1.13 -0.78 3.00 -0.76 -1.63 117.38 115.61 3kvm n GLN 325 Ca 0.17 1.02 -0.04 0.00 -0.01 0.00 0.00 57.00 58.14 3kvm n GLN 325 Cb 0.52 -5.59 -0.02 0.00 0.00 0.00 0.00 30.24 25.15 3kvm n GLN 325 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3kvm n GLY 326 N -0.92 0.56 0.01 1.08 0.00 0.54 -4.84 105.19 101.60 3kvm n GLY 326 Ca -0.23 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 45.79 3kvm n GLY 326 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kvm n ARG 327 N -0.96 0.06 -3.89 1.61 1.74 -0.65 -4.83 116.66 109.74 3kvm n ARG 327 Ca -0.04 -0.01 -0.35 0.00 -0.77 0.00 0.00 57.85 56.68 3kvm n ARG 327 Cb 0.38 -1.51 -0.14 0.00 -1.02 0.00 0.00 32.46 30.17 3kvm n ARG 327 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3kvm s VAL 328 N -3.04 3.34 0.26 1.55 1.01 -1.26 -5.08 120.40 117.17 3kvm s VAL 328 Ca 0.08 -0.75 -0.31 0.00 0.00 0.00 0.00 61.98 61.01 3kvm s VAL 328 Cb 0.16 -2.64 -0.13 0.00 0.00 0.00 0.00 36.38 33.77 3kvm s VAL 328 CO 0.80 0.25 1.39 -2.65 0.00 0.00 0.00 175.10 174.89 3kvm n PRO 329 N 4.77 2.05 -5.18 2.72 -0.02 -1.26 -4.78 135.00 133.31 3kvm n PRO 329 Ca -0.17 0.73 -0.31 0.00 -2.02 0.00 0.00 63.50 61.73 3kvm n PRO 329 Cb 0.49 -2.37 -0.17 0.00 -0.02 0.00 0.00 33.50 31.43 3kvm n PRO 329 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3kvm s ILE 330 N -0.24 1.97 -0.29 4.25 1.01 -1.26 -0.96 121.20 125.68 3kvm s ILE 330 Ca 0.66 -0.99 -0.12 0.00 0.00 0.00 0.00 60.65 60.20 3kvm s ILE 330 Cb -0.63 -1.69 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 3kvm s ILE 330 CO 0.52 0.54 0.23 -0.63 0.00 0.00 0.00 174.94 175.60 3kvm s ILE 331 N 0.13 5.28 -0.14 2.92 1.01 0.37 -0.70 121.20 130.08 3kvm s ILE 331 Ca -0.11 0.20 -0.14 0.00 0.00 0.00 0.00 60.65 60.59 3kvm s ILE 331 Cb -0.16 -3.58 -0.05 0.00 0.01 0.00 0.00 42.46 38.68 3kvm s ILE 331 CO 0.06 0.20 0.33 -0.83 0.00 0.00 0.00 174.94 174.71 3kvm s GLY 332 N 1.74 2.26 -0.05 6.18 0.00 0.74 -0.85 107.32 117.34 3kvm s GLY 332 Ca 0.08 -0.39 -0.04 0.00 0.00 0.00 0.00 44.72 44.38 3kvm s GLY 332 CO 0.11 0.45 0.12 0.14 0.00 0.00 0.00 173.10 173.92 3kvm s VAL 333 N 0.32 -0.01 0.00 1.40 1.01 0.74 -1.02 120.40 122.84 3kvm s VAL 333 Ca 0.19 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.20 3kvm s VAL 333 Cb -0.14 -0.19 0.00 0.00 0.00 0.00 0.00 36.38 36.06 3kvm s VAL 333 CO 0.06 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.78 3kvm n GLY 334 N 3.23 2.36 2.26 4.51 0.00 -1.26 -1.14 105.19 115.15 3kvm n GLY 334 Ca -0.15 -0.23 -0.11 0.00 0.00 0.00 0.00 46.02 45.53 3kvm n GLY 334 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kvm n GLY 335 N 0.00 0.65 3.65 -0.02 0.00 -1.22 -3.98 105.19 104.27 3kvm n GLY 335 Ca 0.00 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 3kvm n GLY 335 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kvm s VAL 336 N -2.46 4.78 -0.00 1.61 1.01 -1.26 -4.65 120.40 119.43 3kvm s VAL 336 Ca 0.00 1.76 0.00 0.00 0.00 0.00 0.00 61.98 63.74 3kvm s VAL 336 Cb 0.00 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.18 3kvm s VAL 336 CO 0.00 -0.11 0.52 -1.54 0.00 0.00 0.00 175.10 173.97 3kvm n SER 337 N 6.05 0.03 -3.97 3.32 3.41 -1.26 -4.50 113.62 116.70 3kvm n SER 337 Ca 0.08 -1.04 -0.09 0.00 -0.26 0.00 0.00 58.87 57.56 3kvm n SER 337 Cb 0.47 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.36 3kvm n SER 337 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3kvm s SER 338 N -0.04 -0.07 0.30 4.04 1.04 -1.26 -4.81 113.70 112.90 3kvm s SER 338 Ca 0.00 -0.89 -0.01 0.00 0.48 0.00 0.00 55.95 55.53 3kvm s SER 338 Cb 0.00 0.54 0.46 0.00 0.10 0.00 0.00 66.02 67.13 3kvm s SER 338 CO 0.00 -1.06 1.93 1.23 0.98 0.00 0.00 173.24 176.32 3kvm h GLY 339 N 2.33 1.03 0.95 7.32 0.00 -1.82 -2.09 103.07 110.79 3kvm h GLY 339 Ca -0.28 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 46.59 3kvm h GLY 339 CO 0.39 0.43 0.18 -1.61 0.00 0.00 0.00 176.54 175.93 3kvm h GLN 340 N 0.98 0.60 -0.59 4.80 4.15 -1.91 0.37 115.11 123.51 3kvm h GLN 340 Ca 0.25 -0.10 0.06 0.00 0.77 0.00 0.00 58.65 59.64 3kvm h GLN 340 Cb 0.00 -0.10 -0.06 0.00 0.21 0.00 0.00 27.48 27.54 3kvm h GLN 340 CO -0.04 0.54 0.28 -0.44 -1.93 0.00 0.00 178.83 177.24 3kvm h ASP 341 N 0.51 0.38 -0.14 -0.69 3.32 -1.87 -0.01 116.42 117.93 3kvm h ASP 341 Ca 0.14 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 3kvm h ASP 341 Cb 0.16 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 3kvm h ASP 341 CO -0.01 0.24 -0.01 0.00 -1.72 0.00 0.00 179.24 177.74 3kvm h ALA 342 N 1.34 0.19 -0.57 3.45 0.00 -1.06 -2.93 119.26 119.68 3kvm h ALA 342 Ca 0.27 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3kvm h ALA 342 Cb 0.23 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3kvm h ALA 342 CO -0.21 -0.10 0.22 1.25 0.00 0.00 0.00 179.25 180.41 3kvm h LEU 343 N -0.02 0.76 -1.01 0.00 5.85 -0.65 -1.17 115.31 119.08 3kvm h LEU 343 Ca 0.04 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 3kvm h LEU 343 Cb 0.39 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 3kvm h LEU 343 CO 0.01 0.69 0.40 -0.33 -0.34 0.00 0.00 178.44 178.87 3kvm h GLU 344 N 0.82 1.10 -0.22 1.25 5.08 -0.94 0.11 114.58 121.78 3kvm h GLU 344 Ca 0.19 -0.14 -0.18 0.00 -1.00 0.00 0.00 59.36 58.24 3kvm h GLU 344 Cb 0.18 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 3kvm h GLU 344 CO -0.02 0.83 -0.57 0.87 -1.00 0.00 0.00 179.01 179.12 3kvm h LYS 345 N 1.10 0.69 -0.03 2.33 1.57 -1.23 -1.51 116.57 119.48 3kvm h LYS 345 Ca 0.27 -0.45 -0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3kvm h LYS 345 Cb 0.07 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 3kvm h LYS 345 CO -0.04 1.07 0.01 0.82 -0.57 0.00 0.00 179.45 180.74 3kvm h ILE 346 N 0.52 1.17 0.00 1.86 2.04 -0.86 0.46 117.51 122.69 3kvm h ILE 346 Ca 0.01 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 3kvm h ILE 346 Cb 1.15 1.45 -0.00 0.00 -0.74 0.00 0.00 36.82 38.68 3kvm h ILE 346 CO 0.12 0.13 -0.00 0.03 0.00 0.00 0.00 178.15 178.43 3kvm h ARG 347 N -0.15 0.00 0.00 2.37 3.08 -0.81 0.11 114.38 118.97 3kvm h ARG 347 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3kvm h ARG 347 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 3kvm h ARG 347 CO -0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 3kvm h ALA 348 N 2.00 1.00 0.00 0.04 0.00 -0.79 -1.71 119.26 119.80 3kvm h ALA 348 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3kvm h ALA 348 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3kvm h ALA 348 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3kvm n GLY 349 N 0.68 -0.63 3.72 0.00 0.00 -0.28 -3.86 105.19 104.82 3kvm n GLY 349 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3kvm n GLY 349 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kvm s ALA 350 N -0.29 3.27 -0.08 4.61 0.00 0.07 -4.38 121.76 124.96 3kvm s ALA 350 Ca 0.00 0.68 0.13 0.00 0.00 0.00 0.00 51.96 52.77 3kvm s ALA 350 Cb 0.00 -3.37 -0.07 0.00 0.00 0.00 0.00 23.12 19.69 3kvm s ALA 350 CO 0.00 -0.26 1.21 0.77 0.00 0.00 0.00 175.76 177.48 3kvm h SER 351 N 6.41 0.00 -5.20 0.00 0.02 -1.22 -3.37 113.55 110.19 3kvm h SER 351 Ca -0.42 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.41 3kvm h SER 351 Cb 1.22 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.60 3kvm h SER 351 CO 0.76 0.67 -0.64 -0.76 -1.14 0.00 0.00 176.83 175.72 3kvm s LEU 352 N -6.34 2.32 0.20 5.07 1.43 -1.16 -4.93 118.68 115.28 3kvm s LEU 352 Ca 0.01 -0.89 0.07 0.00 -1.03 0.00 0.00 54.13 52.29 3kvm s LEU 352 Cb 0.08 0.29 -0.05 0.00 0.03 0.00 0.00 46.19 46.55 3kvm s LEU 352 CO 0.78 -0.57 -0.13 0.68 0.23 0.00 0.00 176.35 177.34 3kvm s VAL 353 N -3.57 1.59 0.15 -1.59 -7.23 0.23 -0.19 120.40 109.80 3kvm s VAL 353 Ca 0.04 -2.17 0.06 0.00 -1.81 0.00 0.00 61.98 58.09 3kvm s VAL 353 Cb 0.05 -2.04 -0.04 0.00 0.56 0.00 0.00 36.38 34.91 3kvm s VAL 353 CO -0.09 -0.60 -0.13 -1.10 -0.31 0.00 0.00 175.10 172.87 3kvm s GLN 354 N -3.68 1.12 0.12 4.82 -0.21 -0.19 -0.52 119.66 121.11 3kvm s GLN 354 Ca 0.22 -1.40 0.01 0.00 0.02 0.00 0.00 55.36 54.21 3kvm s GLN 354 Cb 0.00 -0.88 -0.04 0.00 1.00 0.00 0.00 33.01 33.09 3kvm s GLN 354 CO 0.06 0.15 -0.03 -0.48 -2.12 0.00 0.00 175.29 172.87 3kvm s LEU 355 N -2.90 2.31 0.19 2.90 0.05 -0.78 -4.21 118.68 116.24 3kvm s LEU 355 Ca 0.15 -1.08 0.00 0.00 0.05 0.00 0.00 54.13 53.25 3kvm s LEU 355 Cb -0.02 0.01 0.00 0.00 -2.05 0.00 0.00 46.19 44.14 3kvm s LEU 355 CO 0.03 -0.54 0.00 0.00 -0.55 0.00 0.00 176.35 175.29 3kvm n TYR 356 N -0.08 -2.20 -0.34 3.48 -0.00 -1.26 -1.93 117.16 114.82 3kvm n TYR 356 Ca -0.10 0.47 0.06 0.00 -0.00 0.00 0.00 57.90 58.33 3kvm n TYR 356 Cb 0.62 1.22 0.24 0.00 -0.00 0.00 0.00 39.34 41.42 3kvm n TYR 356 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.86 178.01 3kvm h THR 357 N 0.00 0.97 -0.66 2.97 2.02 -1.97 0.81 112.91 117.05 3kvm h THR 357 Ca 0.00 -0.35 0.10 0.00 0.77 0.00 0.00 66.41 66.94 3kvm h THR 357 Cb 0.00 -0.12 -0.04 0.00 -1.74 0.00 0.00 68.15 66.24 3kvm h THR 357 CO 0.00 0.18 0.44 0.00 0.37 0.00 0.00 175.52 176.52 3kvm h ALA 358 N 1.52 1.96 -0.38 6.16 0.00 -1.93 0.24 119.26 126.84 3kvm h ALA 358 Ca 0.46 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.33 3kvm h ALA 358 Cb 0.40 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3kvm h ALA 358 CO -0.22 -0.11 0.09 1.25 0.00 0.00 0.00 179.25 180.26 3kvm h LEU 359 N 0.49 0.51 -0.95 0.00 5.85 -1.13 -0.92 115.31 119.16 3kvm h LEU 359 Ca 0.31 -0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.90 3kvm h LEU 359 Cb 0.55 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 3kvm h LEU 359 CO -0.10 0.52 -0.25 0.71 -0.34 0.00 0.00 178.44 178.98 3kvm h THR 360 N 0.55 0.58 0.07 1.05 1.35 -0.93 0.48 112.91 116.06 3kvm h THR 360 Ca 0.13 -1.25 -0.37 0.00 -0.55 0.00 0.00 66.41 64.37 3kvm h THR 360 Cb 0.21 1.85 -0.04 0.00 -1.73 0.00 0.00 68.15 68.44 3kvm h THR 360 CO -0.00 0.25 -2.18 0.49 -0.25 0.00 0.00 175.52 173.83 3kvm n PHE 361 N -3.37 0.74 0.36 4.73 3.01 -1.00 -4.63 117.46 117.31 3kvm n PHE 361 Ca 0.00 0.16 0.06 0.00 1.01 0.00 0.00 57.45 58.69 3kvm n PHE 361 Cb 0.47 -1.10 -0.08 0.00 -0.01 0.00 0.00 39.48 38.76 3kvm n PHE 361 CO 0.00 0.00 0.00 0.91 1.01 0.00 0.00 176.76 178.68 3kvm n TRP 362 N -3.44 0.00 -0.45 1.38 5.03 -0.38 -4.75 117.44 114.82 3kvm n TRP 362 Ca -0.38 0.00 0.02 0.00 3.03 0.00 0.00 57.50 60.17 3kvm n TRP 362 Cb 1.01 -0.12 -0.01 0.00 -1.03 0.00 0.00 31.31 31.17 3kvm n TRP 362 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 3kvm n GLY 363 N 1.48 -2.21 0.46 6.99 0.00 0.16 -4.22 105.19 107.85 3kvm n GLY 363 Ca 0.01 -1.49 0.28 0.00 0.00 0.00 0.00 46.02 44.82 3kvm n GLY 363 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3kvm h PRO 364 N 0.00 0.22 0.00 1.61 0.11 -1.95 -1.38 132.00 130.61 3kvm h PRO 364 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3kvm h PRO 364 Cb 0.14 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.20 3kvm h PRO 364 CO 0.00 0.14 0.00 -1.35 -0.21 0.00 0.00 178.00 176.59 3kvm h PRO 365 N 0.23 0.00 0.00 1.05 0.11 -1.91 -2.45 132.00 129.02 3kvm h PRO 365 Ca 0.60 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.68 3kvm h PRO 365 Cb 1.87 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.97 3kvm h PRO 365 CO -0.20 0.00 -0.18 -0.24 -0.21 0.00 0.00 178.00 177.17 3kvm h VAL 366 N 0.00 0.57 -0.02 3.15 3.04 -1.47 -2.28 116.25 119.24 3kvm h VAL 366 Ca 0.00 -0.84 -0.01 0.00 -1.01 0.00 0.00 66.70 64.85 3kvm h VAL 366 Cb 0.01 1.56 -0.00 0.00 -2.01 0.00 0.00 31.29 30.84 3kvm h VAL 366 CO 0.00 0.17 -0.01 0.58 -1.01 0.00 0.00 177.57 177.30 3kvm h VAL 367 N 0.00 1.36 -0.45 1.51 2.07 -1.67 -0.56 116.25 118.51 3kvm h VAL 367 Ca -0.00 -1.09 -0.05 0.00 0.82 0.00 0.00 66.70 66.38 3kvm h VAL 367 Cb 0.54 2.06 -0.02 0.00 -1.52 0.00 0.00 31.29 32.35 3kvm h VAL 367 CO 0.02 0.29 0.09 1.23 0.02 0.00 0.00 177.57 179.23 3kvm h GLY 368 N -0.40 0.74 0.93 2.17 0.00 -1.72 -2.08 103.07 102.71 3kvm h GLY 368 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.92 3kvm h GLY 368 CO 0.00 0.39 -0.06 1.70 0.00 0.00 0.00 176.54 178.57 3kvm h LYS 369 N 0.67 -0.14 -0.57 4.80 3.64 -1.24 -0.18 116.57 123.55 3kvm h LYS 369 Ca 0.15 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 3kvm h LYS 369 Cb 0.28 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 3kvm h LYS 369 CO 0.00 -0.09 0.33 0.28 -2.27 0.00 0.00 179.45 177.70 3kvm h VAL 370 N -0.15 1.18 -0.49 2.00 2.07 -0.90 -1.20 116.25 118.76 3kvm h VAL 370 Ca 0.00 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 3kvm h VAL 370 Cb 0.14 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 3kvm h VAL 370 CO -0.01 0.19 0.17 0.11 0.02 0.00 0.00 177.57 178.05 3kvm h LYS 371 N 0.77 0.75 -0.51 1.57 1.57 -1.23 -0.57 116.57 118.92 3kvm h LYS 371 Ca 0.20 -0.15 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 3kvm h LYS 371 Cb 0.01 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 3kvm h LYS 371 CO -0.04 0.69 0.06 -0.09 -0.57 0.00 0.00 179.45 179.50 3kvm h ARG 372 N 0.65 0.86 -0.25 3.15 2.43 -0.80 -1.82 114.38 118.61 3kvm h ARG 372 Ca 0.16 -0.24 -0.13 0.00 -0.81 0.00 0.00 59.98 58.96 3kvm h ARG 372 Cb 0.24 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3kvm h ARG 372 CO -0.01 0.86 -0.38 0.93 -1.51 0.00 0.00 179.97 179.87 3kvm h GLU 373 N 0.74 0.57 -0.45 0.20 5.08 -1.14 -2.37 114.58 117.21 3kvm h GLU 373 Ca 0.15 -0.28 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 3kvm h GLU 373 Cb 0.44 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 3kvm h GLU 373 CO 0.01 0.86 0.18 1.25 -1.00 0.00 0.00 179.01 180.31 3kvm h LEU 374 N 0.48 0.62 -0.52 1.33 5.85 -0.88 -0.95 115.31 121.24 3kvm h LEU 374 Ca 0.05 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.57 3kvm h LEU 374 Cb 0.87 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 3kvm h LEU 374 CO 0.07 0.62 0.22 -0.08 -0.34 0.00 0.00 178.44 178.94 3kvm h GLU 375 N 0.59 0.77 -0.52 1.25 4.81 -1.24 -0.66 114.58 119.57 3kvm h GLU 375 Ca 0.15 -0.13 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 3kvm h GLU 375 Cb 0.19 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 3kvm h GLU 375 CO -0.01 0.66 0.32 0.00 -0.73 0.00 0.00 179.01 179.25 3kvm h ALA 376 N 1.07 0.66 -0.39 2.92 0.00 -1.26 -2.36 119.26 119.91 3kvm h ALA 376 Ca 0.17 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 3kvm h ALA 376 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3kvm h ALA 376 CO -0.02 0.14 -0.13 -0.07 0.00 0.00 0.00 179.25 179.18 3kvm h LEU 377 N 0.70 0.68 -0.12 0.00 3.38 -0.96 -1.04 115.31 117.95 3kvm h LEU 377 Ca 0.19 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3kvm h LEU 377 Cb -0.02 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3kvm h LEU 377 CO -0.04 0.83 0.08 -0.07 0.09 0.00 0.00 178.44 179.33 3kvm h LEU 378 N 0.63 0.15 -0.37 1.67 3.38 -0.86 -0.77 115.31 119.15 3kvm h LEU 378 Ca 0.11 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.04 3kvm h LEU 378 Cb 0.58 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 3kvm h LEU 378 CO 0.04 0.15 0.23 0.11 0.09 0.00 0.00 178.44 179.06 3kvm h LYS 379 N 0.14 0.46 -0.77 1.13 1.57 -1.29 -0.82 116.57 116.98 3kvm h LYS 379 Ca 0.04 -0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.88 3kvm h LYS 379 Cb 0.03 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.18 3kvm h LYS 379 CO -0.01 0.31 0.51 1.49 -0.57 0.00 0.00 179.45 181.17 3kvm h GLU 380 N 0.48 0.71 -0.70 3.15 4.81 -0.82 -1.31 114.58 120.90 3kvm h GLU 380 Ca 0.14 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3kvm h GLU 380 Cb -0.04 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.18 3kvm h GLU 380 CO -0.04 0.47 0.00 1.04 -0.73 0.00 0.00 179.01 179.75 3kvm n GLN 381 N -4.50 2.81 -0.85 1.92 6.02 -0.33 -4.95 117.38 117.51 3kvm n GLN 381 Ca 0.12 -2.64 0.00 0.00 -0.01 0.00 0.00 57.00 54.47 3kvm n GLN 381 Cb 0.30 -1.57 0.00 0.00 1.02 0.00 0.00 30.24 29.98 3kvm n GLN 381 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kvm n GLY 382 N 1.54 0.51 3.76 1.08 0.00 -0.50 -5.04 105.19 106.54 3kvm n GLY 382 Ca 0.24 -0.62 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 3kvm n GLY 382 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kvm s PHE 383 N -2.00 3.75 0.29 1.61 0.40 -0.36 -4.96 117.98 116.71 3kvm s PHE 383 Ca 0.00 1.40 0.15 0.00 -0.60 0.00 0.00 56.93 57.88 3kvm s PHE 383 Cb 0.00 -2.73 0.64 0.00 0.51 0.00 0.00 43.02 41.45 3kvm s PHE 383 CO 0.00 0.35 1.75 0.78 0.70 0.00 0.00 175.22 178.80 3kvm h GLY 384 N 5.39 0.00 -1.64 4.36 0.00 -1.95 -3.38 103.07 105.84 3kvm h GLY 384 Ca -0.45 0.00 0.19 0.00 0.00 0.00 0.00 47.33 47.07 3kvm h GLY 384 CO 0.69 0.00 0.62 -0.32 0.00 0.00 0.00 176.54 177.54 3kvm s GLY 385 N -4.36 0.05 0.26 4.60 0.00 -1.26 -4.75 107.32 101.85 3kvm s GLY 385 Ca -0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 44.72 44.44 3kvm s GLY 385 CO 0.72 2.62 1.74 -2.08 0.00 0.00 0.00 173.10 176.09 3kvm h VAL 386 N 2.00 0.66 -0.88 1.40 2.07 -1.41 -2.30 116.25 117.79 3kvm h VAL 386 Ca -0.27 -0.17 0.06 0.00 0.82 0.00 0.00 66.70 67.14 3kvm h VAL 386 Cb 1.21 0.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.05 3kvm h VAL 386 CO 0.35 0.09 0.57 0.74 0.02 0.00 0.00 177.57 179.34 3kvm h THR 387 N 0.50 1.07 0.00 2.57 2.02 -1.82 0.02 112.91 117.27 3kvm h THR 387 Ca 0.45 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 3kvm h THR 387 Cb 0.68 -0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 3kvm h THR 387 CO -0.40 0.18 -0.05 0.44 0.37 0.00 0.00 175.52 176.06 3kvm h ASP 388 N 1.00 0.00 0.63 4.18 3.45 -1.81 -3.00 116.42 120.86 3kvm h ASP 388 Ca 0.38 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.84 3kvm h ASP 388 Cb 0.19 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.96 3kvm h ASP 388 CO -0.14 0.05 -1.09 0.00 -1.57 0.00 0.00 179.24 176.50 3kvm n ALA 389 N -2.14 2.96 -1.64 3.45 0.00 -0.03 -4.72 120.51 118.39 3kvm n ALA 389 Ca -0.01 -0.34 -0.44 0.00 0.00 0.00 0.00 53.44 52.65 3kvm n ALA 389 Cb 0.26 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.66 3kvm n ALA 389 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3kvm n ILE 390 N -2.27 0.59 -0.99 0.00 5.41 -1.09 -1.45 119.36 119.57 3kvm n ILE 390 Ca 0.01 -0.22 0.00 0.00 1.00 0.00 0.00 62.75 63.54 3kvm n ILE 390 Cb 0.49 -2.25 0.00 0.00 -0.71 0.00 0.00 39.64 37.17 3kvm n ILE 390 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3kvm n GLY 391 N 4.94 0.66 0.32 7.39 0.00 -0.13 -4.91 105.19 113.46 3kvm n GLY 391 Ca 0.24 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.42 3kvm n GLY 391 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kvm h ALA 392 N 0.00 1.90 0.00 4.61 0.00 -0.95 -0.07 119.26 124.74 3kvm h ALA 392 Ca 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3kvm h ALA 392 Cb 0.03 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3kvm h ALA 392 CO 0.00 -0.24 -0.21 -0.44 0.00 0.00 0.00 179.25 178.36 3kvm h ASP 393 N 0.00 0.00 1.10 0.00 3.32 -1.59 -2.74 116.42 116.51 3kvm h ASP 393 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3kvm h ASP 393 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 3kvm h ASP 393 CO -0.00 0.21 -0.02 1.41 -1.72 0.00 0.00 179.24 179.12 3kvm n HIS 394 N -4.26 0.22 -0.44 4.55 8.25 -0.04 -3.32 115.22 120.19 3kvm n HIS 394 Ca -0.02 0.07 0.08 0.00 -0.26 0.00 0.00 57.72 57.59 3kvm n HIS 394 Cb 0.27 -0.60 0.26 0.00 1.12 0.00 0.00 29.99 31.05 3kvm n HIS 394 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3kvm n ARG 395 N -1.68 3.07 0.00 -0.41 1.74 -1.03 -5.19 116.66 113.15 3kvm n ARG 395 Ca 0.07 -2.51 0.16 0.00 -0.77 0.00 0.00 57.85 54.79 3kvm n ARG 395 Cb 0.36 -1.57 0.94 0.00 -1.02 0.00 0.00 32.46 31.17 3kvm n ARG 395 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65