#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ksy n VAL 2 N 0.00 0.02 0.09 2.03 0.24 -1.26 -4.57 118.33 114.88 2ksy n VAL 2 Ca 0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.29 2ksy n VAL 2 Cb 0.00 -0.93 -0.04 0.00 -1.47 0.00 0.00 33.84 31.41 2ksy n VAL 2 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2ksy h GLY 3 N 0.07 0.00 1.53 7.63 0.00 -2.02 -3.32 103.07 106.96 2ksy h GLY 3 Ca -0.01 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.12 2ksy h GLY 3 CO 0.00 0.00 -0.80 -2.00 0.00 0.00 0.00 176.54 173.74 2ksy h LEU 4 N 0.00 0.55 -1.60 3.11 5.85 -1.98 -3.16 115.31 118.07 2ksy h LEU 4 Ca -0.07 -0.39 -0.04 0.00 0.84 0.00 0.00 57.88 58.21 2ksy h LEU 4 Cb 1.51 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.37 2ksy h LEU 4 CO 0.06 1.15 -0.20 0.71 -0.34 0.00 0.00 178.44 179.82 2ksy h THR 5 N 0.29 1.11 -0.95 1.05 1.35 -1.81 -2.81 112.91 111.15 2ksy h THR 5 Ca -0.05 -0.71 0.17 0.00 -0.55 0.00 0.00 66.41 65.27 2ksy h THR 5 Cb 1.41 1.38 -0.08 0.00 -1.73 0.00 0.00 68.15 69.13 2ksy h THR 5 CO 0.14 0.20 0.60 0.71 -0.25 0.00 0.00 175.52 176.92 2ksy h THR 6 N 0.00 0.77 0.29 6.82 1.35 -1.64 -1.64 112.91 118.87 2ksy h THR 6 Ca -0.00 -0.24 -0.01 0.00 -0.55 0.00 0.00 66.41 65.60 2ksy h THR 6 Cb 0.37 0.00 -0.00 0.00 -1.73 0.00 0.00 68.15 66.79 2ksy h THR 6 CO 0.03 0.13 -0.17 -0.07 -0.25 0.00 0.00 175.52 175.19 2ksy h LEU 7 N 0.71 -0.41 -1.39 3.87 -0.00 -1.67 -0.42 115.31 116.01 2ksy h LEU 7 Ca 0.50 0.02 0.04 0.00 -0.00 0.00 0.00 57.88 58.45 2ksy h LEU 7 Cb 0.84 0.12 -0.04 0.00 -0.00 0.00 0.00 40.66 41.57 2ksy h LEU 7 CO -0.27 -0.27 0.45 -0.26 -0.00 0.00 0.00 178.44 178.09 2ksy h PHE 8 N -0.43 0.77 -0.62 1.13 0.04 -1.51 -1.18 116.94 115.13 2ksy h PHE 8 Ca -0.03 0.02 -0.07 0.00 2.80 0.00 0.00 57.97 60.69 2ksy h PHE 8 Cb 0.35 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.22 2ksy h PHE 8 CO -0.08 0.43 0.12 -1.49 -0.60 0.00 0.00 178.31 176.70 2ksy h TRP 9 N 0.78 1.08 -0.04 -0.55 -0.00 -0.85 -2.37 115.95 114.00 2ksy h TRP 9 Ca 0.28 -0.14 -0.00 0.00 -0.00 0.00 0.00 58.89 59.03 2ksy h TRP 9 Cb 0.13 -0.30 -0.00 0.00 -0.00 0.00 0.00 29.16 28.99 2ksy h TRP 9 CO -0.00 0.91 0.02 -0.07 -0.00 0.00 0.00 178.44 179.30 2ksy h LEU 10 N 0.93 0.06 -1.52 -4.49 3.38 0.04 -2.34 115.31 111.37 2ksy h LEU 10 Ca 0.19 -0.12 0.12 0.00 0.09 0.00 0.00 57.88 58.17 2ksy h LEU 10 Cb 0.40 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 2ksy h LEU 10 CO 0.01 0.16 0.49 1.23 0.09 0.00 0.00 178.44 180.41 2ksy h GLY 11 N -0.05 0.78 1.44 0.83 0.00 -1.14 -0.26 103.07 104.68 2ksy h GLY 11 Ca 0.01 -0.21 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 2ksy h GLY 11 CO -0.00 0.10 -0.26 0.00 0.00 0.00 0.00 176.54 176.38 2ksy h ALA 12 N 1.65 0.95 0.42 3.60 0.00 -1.01 -1.85 119.26 123.02 2ksy h ALA 12 Ca 0.35 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2ksy h ALA 12 Cb 0.68 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2ksy h ALA 12 CO -0.12 0.61 -0.20 0.82 0.00 0.00 0.00 179.25 180.36 2ksy h ILE 13 N 0.56 0.59 -0.05 0.00 2.04 -0.53 -1.17 117.51 118.94 2ksy h ILE 13 Ca 0.07 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.88 2ksy h ILE 13 Cb 0.74 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 2ksy h ILE 13 CO 0.06 0.00 -0.12 1.23 0.00 0.00 0.00 178.15 179.32 2ksy h GLY 14 N -0.58 0.08 0.81 5.37 0.00 -1.46 -2.70 103.07 104.60 2ksy h GLY 14 Ca -0.06 -0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 2ksy h GLY 14 CO 0.09 0.04 0.02 -0.33 0.00 0.00 0.00 176.54 176.37 2ksy h MET 15 N 0.08 0.12 -0.89 4.80 2.86 -0.94 -2.37 114.93 118.59 2ksy h MET 15 Ca 0.02 -0.03 0.05 0.00 -2.06 0.00 0.00 59.70 57.68 2ksy h MET 15 Cb 0.26 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 31.85 2ksy h MET 15 CO 0.02 0.31 0.57 -0.07 1.06 0.00 0.00 176.91 178.79 2ksy h LEU 16 N -0.08 0.91 -0.76 1.22 4.07 -0.94 0.11 115.31 119.84 2ksy h LEU 16 Ca 0.02 0.01 0.02 0.00 0.08 0.00 0.00 57.88 58.01 2ksy h LEU 16 Cb 0.24 -0.19 -0.04 0.00 1.08 0.00 0.00 40.66 41.75 2ksy h LEU 16 CO 0.00 0.60 0.49 0.58 -1.08 0.00 0.00 178.44 179.03 2ksy h VAL 17 N 1.05 1.15 -0.11 1.22 2.07 -1.34 -2.25 116.25 118.05 2ksy h VAL 17 Ca 0.38 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 2ksy h VAL 17 Cb 0.11 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 29.96 2ksy h VAL 17 CO -0.15 0.18 -0.15 1.23 0.02 0.00 0.00 177.57 178.70 2ksy h GLY 18 N 0.98 0.33 -0.05 2.17 0.00 -0.80 -2.32 103.07 103.38 2ksy h GLY 18 Ca 0.29 -0.36 0.16 0.00 0.00 0.00 0.00 47.33 47.42 2ksy h GLY 18 CO -0.09 0.32 0.21 -0.84 0.00 0.00 0.00 176.54 176.14 2ksy h THR 19 N -0.11 0.53 -0.19 4.70 2.02 -0.61 0.97 112.91 120.22 2ksy h THR 19 Ca 0.01 -0.10 -0.17 0.00 0.77 0.00 0.00 66.41 66.92 2ksy h THR 19 Cb 0.70 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.31 2ksy h THR 19 CO 0.04 0.05 -0.57 -0.07 0.37 0.00 0.00 175.52 175.34 2ksy h LEU 20 N 0.30 0.67 -1.44 2.58 3.38 -1.44 -0.48 115.31 118.89 2ksy h LEU 20 Ca 0.42 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 2ksy h LEU 20 Cb 0.72 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2ksy h LEU 20 CO -0.50 1.10 -0.12 0.00 0.09 0.00 0.00 178.44 179.01 2ksy h ALA 21 N 0.91 1.54 0.00 1.53 0.00 -0.33 -0.44 119.26 122.47 2ksy h ALA 21 Ca 0.00 -0.19 -0.25 0.00 0.00 0.00 0.00 54.91 54.47 2ksy h ALA 21 Cb 1.13 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 2ksy h ALA 21 CO 0.11 0.33 -1.60 1.19 0.00 0.00 0.00 179.25 179.28 2ksy n PHE 22 N -4.29 0.99 -0.02 0.00 3.72 0.09 -3.30 117.46 114.66 2ksy n PHE 22 Ca -0.01 0.35 -0.13 0.00 -0.05 0.00 0.00 57.45 57.61 2ksy n PHE 22 Cb 0.26 -1.15 -0.10 0.00 -0.94 0.00 0.00 39.48 37.55 2ksy n PHE 22 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2ksy h ALA 23 N 1.16 -0.03 -0.70 4.37 0.00 -0.82 0.22 119.26 123.46 2ksy h ALA 23 Ca -0.24 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 2ksy h ALA 23 Cb 1.85 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.63 2ksy h ALA 23 CO 0.07 -0.21 0.16 2.35 0.00 0.00 0.00 179.25 181.61 2ksy h TRP 24 N -0.64 1.20 0.00 0.00 2.91 -1.27 -1.73 115.95 116.42 2ksy h TRP 24 Ca -0.00 -0.15 -0.05 0.00 1.13 0.00 0.00 58.89 59.82 2ksy h TRP 24 Cb 0.60 -0.34 -0.01 0.00 -0.51 0.00 0.00 29.16 28.91 2ksy h TRP 24 CO 0.13 0.98 -0.27 0.00 -1.03 0.00 0.00 178.44 178.25 2ksy h ALA 25 N 1.08 0.84 -0.09 2.65 0.00 -1.63 -3.31 119.26 118.79 2ksy h ALA 25 Ca 0.22 -0.22 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 2ksy h ALA 25 Cb 0.39 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.16 2ksy h ALA 25 CO 0.01 0.29 -0.51 0.78 0.00 0.00 0.00 179.25 179.82 2ksy h GLY 26 N 3.77 0.56 2.00 0.00 0.00 -0.17 -3.10 103.07 106.13 2ksy h GLY 26 Ca -0.00 -0.80 -0.00 0.00 0.00 0.00 0.00 47.33 46.52 2ksy h GLY 26 CO 0.03 0.72 -0.00 3.21 0.00 0.00 0.00 176.54 180.49 2ksy h ARG 27 N 0.09 0.00 -3.77 4.80 3.08 -1.42 -3.32 114.38 113.85 2ksy h ARG 27 Ca -0.04 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 59.33 2ksy h ARG 27 Cb 1.16 0.00 -0.36 0.00 0.08 0.00 0.00 29.97 30.85 2ksy h ARG 27 CO 0.11 0.00 -0.47 0.34 -1.07 0.00 0.00 179.97 178.88 2ksy s ASP 28 N -5.34 5.04 0.05 7.04 2.15 -1.17 -5.04 116.67 119.40 2ksy s ASP 28 Ca -0.05 -2.71 -0.03 0.00 0.43 0.00 0.00 52.55 50.20 2ksy s ASP 28 Cb 0.13 -1.80 0.01 0.00 -0.30 0.00 0.00 42.92 40.96 2ksy s ASP 28 CO 0.44 -0.37 0.13 0.00 -0.17 0.00 0.00 175.17 175.20 2ksy n ALA 29 N 3.65 -0.31 -1.00 3.66 0.00 -1.25 -4.87 120.51 120.38 2ksy n ALA 29 Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2ksy n ALA 29 Cb 0.38 0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2ksy n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ksy n GLY 30 N -0.09 -0.61 1.49 0.00 0.00 -1.26 -5.02 105.19 99.70 2ksy n GLY 30 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2ksy n GLY 30 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ksy n SER 31 N 0.00 0.15 0.06 1.61 7.64 -1.26 -4.79 113.62 117.04 2ksy n SER 31 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 2ksy n SER 31 Cb 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 2ksy n SER 31 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2ksy h GLY 32 N 0.00 0.47 2.00 0.23 0.00 -2.04 -3.17 103.07 100.56 2ksy h GLY 32 Ca 0.00 -0.82 -0.02 0.00 0.00 0.00 0.00 47.33 46.49 2ksy h GLY 32 CO 0.00 0.73 -0.09 0.83 0.00 0.00 0.00 176.54 178.01 2ksy h GLU 33 N 0.24 0.00 -0.92 4.80 4.39 -1.98 -2.78 114.58 118.33 2ksy h GLU 33 Ca -0.08 0.00 0.26 0.00 0.34 0.00 0.00 59.36 59.88 2ksy h GLU 33 Cb 1.57 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 30.18 2ksy h GLU 33 CO 0.16 0.09 0.65 -0.09 -1.16 0.00 0.00 179.01 178.67 2ksy h ARG 34 N 0.00 0.05 0.07 2.33 2.43 -1.85 -0.70 114.38 116.71 2ksy h ARG 34 Ca -0.00 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2ksy h ARG 34 Cb 0.32 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2ksy h ARG 34 CO 0.01 0.04 -0.03 -0.09 -1.51 0.00 0.00 179.97 178.38 2ksy h ARG 35 N 0.06 -0.09 -0.04 0.20 2.43 -1.70 -1.10 114.38 114.13 2ksy h ARG 35 Ca 0.45 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.60 2ksy h ARG 35 Cb 1.69 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 31.25 2ksy h ARG 35 CO -0.03 -0.05 -0.06 1.88 -1.51 0.00 0.00 179.97 180.19 2ksy h TYR 36 N -0.10 0.06 0.19 2.20 0.05 -1.34 -1.83 116.97 116.19 2ksy h TYR 36 Ca -0.01 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 2ksy h TYR 36 Cb 0.08 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 37.80 2ksy h TYR 36 CO -0.07 0.12 -0.09 1.88 -1.05 0.00 0.00 178.16 178.95 2ksy h TYR 37 N 0.06 -0.24 -0.90 4.88 0.05 -1.18 -1.42 116.97 118.22 2ksy h TYR 37 Ca 0.01 -0.01 0.07 0.00 0.05 0.00 0.00 58.73 58.86 2ksy h TYR 37 Cb 0.15 0.08 -0.06 0.00 1.01 0.00 0.00 36.73 37.91 2ksy h TYR 37 CO 0.00 0.18 0.58 0.28 -1.05 0.00 0.00 178.16 178.15 2ksy h VAL 38 N -0.80 1.04 0.09 -2.88 2.07 -1.06 -0.01 116.25 114.69 2ksy h VAL 38 Ca -0.03 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 2ksy h VAL 38 Cb 0.52 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 2ksy h VAL 38 CO 0.04 0.18 -0.04 0.74 0.02 0.00 0.00 177.57 178.51 2ksy h THR 39 N 0.98 1.07 -0.42 2.57 2.02 -1.36 -1.24 112.91 116.53 2ksy h THR 39 Ca 0.40 -0.59 0.04 0.00 0.77 0.00 0.00 66.41 67.03 2ksy h THR 39 Cb 0.26 1.45 -0.04 0.00 -1.74 0.00 0.00 68.15 68.08 2ksy h THR 39 CO -0.16 0.15 0.18 0.25 0.37 0.00 0.00 175.52 176.31 2ksy h LEU 40 N -0.39 0.23 -1.55 2.58 5.85 -0.75 -0.93 115.31 120.35 2ksy h LEU 40 Ca -0.01 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2ksy h LEU 40 Cb 0.33 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 2ksy h LEU 40 CO 0.02 0.17 0.27 0.58 -0.34 0.00 0.00 178.44 179.14 2ksy h VAL 41 N 0.37 1.12 -0.86 1.05 2.07 -0.98 -2.02 116.25 116.99 2ksy h VAL 41 Ca 0.19 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 2ksy h VAL 41 Cb 0.14 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 2ksy h VAL 41 CO -0.16 0.12 0.49 1.23 0.02 0.00 0.00 177.57 179.26 2ksy h GLY 42 N 0.60 1.27 0.75 2.17 0.00 0.08 -1.11 103.07 106.84 2ksy h GLY 42 Ca 0.15 -0.56 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 2ksy h GLY 42 CO -0.03 0.54 -0.24 -2.22 0.00 0.00 0.00 176.54 174.58 2ksy h ILE 43 N 1.20 0.41 -0.21 2.60 2.04 -0.97 -1.62 117.51 120.96 2ksy h ILE 43 Ca 0.31 -0.37 0.06 0.00 1.00 0.00 0.00 64.86 65.85 2ksy h ILE 43 Cb -0.00 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 2ksy h ILE 43 CO -0.05 0.05 0.18 -1.28 0.00 0.00 0.00 178.15 177.06 2ksy h SER 44 N -0.93 0.00 0.07 1.72 0.87 -1.43 -2.26 113.55 111.59 2ksy h SER 44 Ca -0.07 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.49 2ksy h SER 44 Cb 0.60 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2ksy h SER 44 CO 0.11 0.00 -0.03 1.23 -0.53 0.00 0.00 176.83 177.61 2ksy h GLY 45 N 0.00 -0.10 0.84 5.77 0.00 -1.03 -2.55 103.07 106.00 2ksy h GLY 45 Ca 0.10 0.04 0.04 0.00 0.00 0.00 0.00 47.33 47.51 2ksy h GLY 45 CO -0.00 -0.04 0.66 0.16 0.00 0.00 0.00 176.54 177.32 2ksy h ILE 46 N -0.90 1.15 -0.34 2.60 3.07 -1.08 -2.37 117.51 119.64 2ksy h ILE 46 Ca -0.01 -0.43 -0.08 0.00 1.55 0.00 0.00 64.86 65.89 2ksy h ILE 46 Cb 0.59 -0.21 -0.01 0.00 -0.27 0.00 0.00 36.82 36.92 2ksy h ILE 46 CO 0.02 0.23 -0.08 0.00 -1.05 0.00 0.00 178.15 177.26 2ksy h ALA 47 N 1.42 0.47 -0.72 0.16 0.00 -1.53 -2.24 119.26 116.82 2ksy h ALA 47 Ca 0.41 -0.30 0.09 0.00 0.00 0.00 0.00 54.91 55.11 2ksy h ALA 47 Cb 0.04 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 2ksy h ALA 47 CO -0.14 0.31 0.37 0.00 0.00 0.00 0.00 179.25 179.80 2ksy h ALA 48 N 0.81 0.99 -0.05 0.00 0.00 -0.99 -0.83 119.26 119.19 2ksy h ALA 48 Ca 0.09 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.86 2ksy h ALA 48 Cb 0.59 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2ksy h ALA 48 CO 0.03 -0.01 -0.74 -0.39 0.00 0.00 0.00 179.25 178.15 2ksy h VAL 49 N 0.65 1.41 -0.57 0.00 -1.51 -1.43 -2.57 116.25 112.22 2ksy h VAL 49 Ca 0.35 -2.23 -0.08 0.00 -1.23 0.00 0.00 66.70 63.51 2ksy h VAL 49 Cb 0.34 2.18 -0.02 0.00 -2.13 0.00 0.00 31.29 31.65 2ksy h VAL 49 CO -0.25 0.66 0.04 0.00 -1.23 0.00 0.00 177.57 176.79 2ksy h ALA 50 N 1.01 0.99 -0.10 5.19 0.00 -0.73 -2.01 119.26 123.60 2ksy h ALA 50 Ca -0.03 -0.28 -0.18 0.00 0.00 0.00 0.00 54.91 54.42 2ksy h ALA 50 Cb 1.31 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 2ksy h ALA 50 CO 0.12 0.63 -0.70 1.88 0.00 0.00 0.00 179.25 181.17 2ksy h TYR 51 N 0.89 0.61 -0.59 0.00 0.05 -1.16 -0.82 116.97 115.94 2ksy h TYR 51 Ca 0.17 -0.26 -0.05 0.00 0.05 0.00 0.00 58.73 58.65 2ksy h TYR 51 Cb 0.47 -0.10 -0.03 0.00 1.01 0.00 0.00 36.73 38.08 2ksy h TYR 51 CO 0.03 1.01 0.19 0.00 -1.05 0.00 0.00 178.16 178.35 2ksy h ALA 52 N 0.92 0.78 -0.03 3.88 0.00 -1.25 0.61 119.26 124.16 2ksy h ALA 52 Ca -0.03 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.57 2ksy h ALA 52 Cb 1.27 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.84 2ksy h ALA 52 CO 0.12 0.43 -0.46 -0.39 0.00 0.00 0.00 179.25 178.96 2ksy h VAL 53 N 0.84 1.44 -0.17 0.00 -1.51 -1.35 -3.22 116.25 112.28 2ksy h VAL 53 Ca 0.19 -1.93 -0.03 0.00 -1.23 0.00 0.00 66.70 63.70 2ksy h VAL 53 Cb 0.27 2.50 -0.01 0.00 -2.13 0.00 0.00 31.29 31.93 2ksy h VAL 53 CO -0.01 0.56 -0.03 0.24 -1.23 0.00 0.00 177.57 177.10 2ksy h MET 54 N -0.15 0.25 0.00 5.19 2.07 -1.12 -0.75 114.93 120.42 2ksy h MET 54 Ca -0.05 -0.04 0.00 0.00 -2.07 0.00 0.00 59.70 57.54 2ksy h MET 54 Cb 1.15 -0.04 0.00 0.00 -1.87 0.00 0.00 31.60 30.84 2ksy h MET 54 CO 0.09 0.30 0.00 0.00 1.07 0.00 0.00 176.91 178.37 2ksy h ALA 55 N 1.73 1.00 -0.00 6.32 0.00 -0.88 -0.20 119.26 127.23 2ksy h ALA 55 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2ksy h ALA 55 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2ksy h ALA 55 CO 0.01 0.00 -0.88 1.28 0.00 0.00 0.00 179.25 179.66 2ksy n LEU 56 N -2.77 1.12 -0.85 0.00 4.77 -0.30 -4.73 117.00 114.23 2ksy n LEU 56 Ca -0.01 -0.50 -0.07 0.00 -0.03 0.00 0.00 56.01 55.40 2ksy n LEU 56 Cb 0.12 -0.02 -0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2ksy n LEU 56 CO 0.19 0.26 -0.07 0.61 -1.33 0.00 0.00 177.39 177.05 2ksy n GLY 57 N 1.49 0.13 0.31 -0.72 0.00 -0.09 -4.91 105.19 101.41 2ksy n GLY 57 Ca 0.05 -0.58 0.01 0.00 0.00 0.00 0.00 46.02 45.50 2ksy n GLY 57 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2ksy n VAL 58 N -3.93 0.11 -1.60 1.61 0.24 -1.20 -3.34 118.33 110.22 2ksy n VAL 58 Ca -0.07 -0.07 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 2ksy n VAL 58 Cb 0.56 -0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.72 2ksy n VAL 58 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ksy n GLY 59 N 0.33 -0.59 3.60 7.63 0.00 -1.26 -5.04 105.19 109.86 2ksy n GLY 59 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 2ksy n GLY 59 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ksy s TRP 60 N 0.00 2.65 -0.18 1.61 0.52 -1.21 -2.39 118.94 119.93 2ksy s TRP 60 Ca 0.00 0.67 -0.08 0.00 0.02 0.00 0.00 56.10 56.71 2ksy s TRP 60 Cb 0.00 -4.41 -0.04 0.00 -1.15 0.00 0.00 33.47 27.86 2ksy s TRP 60 CO 0.00 -1.54 0.09 0.54 0.02 0.00 0.00 176.95 176.05 2ksy s VAL 61 N 4.87 5.03 0.38 4.03 0.11 -0.31 -4.99 120.40 129.52 2ksy s VAL 61 Ca 0.52 0.05 -0.25 0.00 -2.93 0.00 0.00 61.98 59.36 2ksy s VAL 61 Cb -0.09 -3.27 -0.09 0.00 -1.53 0.00 0.00 36.38 31.40 2ksy s VAL 61 CO 0.31 0.47 1.11 -2.84 -3.33 0.00 0.00 175.10 170.82 2ksy s PRO 62 N 0.26 4.19 -0.32 1.54 0.02 -1.26 -1.17 135.00 138.25 2ksy s PRO 62 Ca 0.06 1.71 -0.01 0.00 0.02 0.00 0.00 61.00 62.78 2ksy s PRO 62 Cb -0.12 -2.71 0.13 0.00 0.02 0.00 0.00 34.50 31.82 2ksy s PRO 62 CO -0.00 -0.17 0.25 0.08 -0.33 0.00 0.00 177.00 176.82 2ksy s VAL 63 N -1.46 -0.19 0.00 3.83 1.01 0.85 -4.84 120.40 119.59 2ksy s VAL 63 Ca 0.55 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.64 2ksy s VAL 63 Cb -0.28 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.15 2ksy s VAL 63 CO 0.35 -0.67 0.00 0.00 0.00 0.00 0.00 175.10 174.78 2ksy n ALA 64 N 4.85 0.00 0.00 5.51 0.00 -1.26 -0.72 120.51 128.89 2ksy n ALA 64 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2ksy n ALA 64 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 2ksy n ALA 64 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2ksy n GLU 65 N 0.00 2.05 -4.01 0.00 4.07 -1.26 -5.06 120.64 116.44 2ksy n GLU 65 Ca 0.00 0.00 -0.28 0.00 -0.06 0.00 0.00 57.16 56.82 2ksy n GLU 65 Cb 0.00 -0.88 -0.05 0.00 -0.06 0.00 0.00 31.44 30.45 2ksy n GLU 65 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 2ksy s ARG 66 N -1.63 3.14 -0.23 5.31 0.52 0.10 -5.10 118.95 121.06 2ksy s ARG 66 Ca 0.00 -0.70 -0.04 0.00 -0.52 0.00 0.00 55.73 54.47 2ksy s ARG 66 Cb 0.00 -2.81 -0.00 0.00 0.52 0.00 0.00 34.95 32.65 2ksy s ARG 66 CO 0.00 0.53 -0.04 0.99 0.02 0.00 0.00 175.30 176.80 2ksy s THR 67 N -1.65 3.37 0.18 0.02 2.01 -1.26 -0.11 115.64 118.20 2ksy s THR 67 Ca 0.32 -0.54 -0.12 0.00 0.31 0.00 0.00 61.69 61.66 2ksy s THR 67 Cb -0.11 -2.56 -0.07 0.00 0.01 0.00 0.00 72.50 69.77 2ksy s THR 67 CO 0.25 0.39 0.55 -0.69 -0.69 0.00 0.00 174.62 174.43 2ksy s VAL 68 N 1.47 4.89 -0.32 3.82 1.01 -0.32 -4.91 120.40 126.04 2ksy s VAL 68 Ca 0.05 0.68 -0.09 0.00 0.00 0.00 0.00 61.98 62.62 2ksy s VAL 68 Cb -0.15 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.55 2ksy s VAL 68 CO -0.03 0.11 0.15 -0.36 0.00 0.00 0.00 175.10 174.97 2ksy s PHE 69 N -1.61 3.18 -0.01 5.22 0.08 -1.26 -1.16 117.98 122.42 2ksy s PHE 69 Ca 0.42 -0.71 -0.26 0.00 0.12 0.00 0.00 56.93 56.50 2ksy s PHE 69 Cb -0.13 -2.35 -0.20 0.00 -0.57 0.00 0.00 43.02 39.77 2ksy s PHE 69 CO 0.20 -0.51 1.31 0.28 -0.10 0.00 0.00 175.22 176.40 2ksy h VAL 70 N 5.74 1.34 0.00 -0.44 2.07 -1.85 -3.15 116.25 119.95 2ksy h VAL 70 Ca -0.31 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.18 2ksy h VAL 70 Cb 1.13 2.04 0.00 0.00 -1.52 0.00 0.00 31.29 32.95 2ksy h VAL 70 CO 0.62 0.27 0.00 -0.65 0.02 0.00 0.00 177.57 177.83 2ksy h PRO 71 N -0.45 0.00 0.37 1.57 0.11 -1.95 -2.79 132.00 128.87 2ksy h PRO 71 Ca -0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 2ksy h PRO 71 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.56 2ksy h PRO 71 CO 0.00 0.00 -0.18 -0.09 -0.21 0.00 0.00 178.00 177.52 2ksy h ARG 72 N 0.00 -0.48 -0.10 1.05 2.43 -1.92 0.12 114.38 115.48 2ksy h ARG 72 Ca 0.00 0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.05 2ksy h ARG 72 Cb 0.29 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 2ksy h ARG 72 CO 0.00 -0.17 -0.58 1.88 -1.51 0.00 0.00 179.97 179.59 2ksy h TYR 73 N -0.81 0.42 -0.36 2.20 0.05 -1.62 -2.74 116.97 114.10 2ksy h TYR 73 Ca -0.05 -0.15 -0.11 0.00 0.05 0.00 0.00 58.73 58.47 2ksy h TYR 73 Cb 0.53 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 38.18 2ksy h TYR 73 CO 0.02 0.83 -0.22 0.97 -1.05 0.00 0.00 178.16 178.71 2ksy h ILE 74 N 0.25 1.27 -0.83 -2.88 -0.00 -1.52 -2.07 117.51 111.73 2ksy h ILE 74 Ca -0.00 -1.30 -0.00 0.00 -0.00 0.00 0.00 64.86 63.56 2ksy h ILE 74 Cb 1.09 1.22 -0.04 0.00 -0.00 0.00 0.00 36.82 39.09 2ksy h ILE 74 CO 0.10 0.43 0.52 -0.78 -0.00 0.00 0.00 178.15 178.42 2ksy h ASP 75 N 0.62 0.98 0.26 2.19 3.58 -0.55 -0.66 116.42 122.84 2ksy h ASP 75 Ca 0.09 -0.05 -0.07 0.00 0.42 0.00 0.00 57.03 57.42 2ksy h ASP 75 Cb 0.70 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.49 2ksy h ASP 75 CO 0.05 0.74 -0.31 -0.50 -2.88 0.00 0.00 179.24 176.34 2ksy h TRP 76 N 1.14 0.10 -0.05 0.28 6.55 -1.14 0.15 115.95 122.98 2ksy h TRP 76 Ca 0.30 -0.02 -0.10 0.00 0.95 0.00 0.00 58.89 60.03 2ksy h TRP 76 Cb -0.08 -0.03 -0.01 0.00 -0.86 0.00 0.00 29.16 28.18 2ksy h TRP 76 CO 0.00 0.40 -0.41 0.82 -1.05 0.00 0.00 178.44 178.20 2ksy h ILE 77 N 0.08 1.30 0.00 1.49 2.04 -0.47 0.16 117.51 122.12 2ksy h ILE 77 Ca 0.01 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.40 2ksy h ILE 77 Cb 0.60 1.72 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 2ksy h ILE 77 CO 0.04 0.43 -1.01 0.18 0.00 0.00 0.00 178.15 177.79 2ksy n LEU 78 N -4.04 0.69 -0.11 1.44 4.77 -0.87 -4.30 117.00 114.58 2ksy n LEU 78 Ca -0.02 0.19 -0.21 0.00 -0.03 0.00 0.00 56.01 55.94 2ksy n LEU 78 Cb 0.46 -0.09 -0.07 0.00 -2.33 0.00 0.00 43.42 41.39 2ksy n LEU 78 CO 0.40 -0.09 -1.14 0.35 -1.33 0.00 0.00 177.39 175.59 2ksy n THR 79 N -2.34 1.38 0.06 -5.08 -2.24 -0.01 -4.36 114.28 101.69 2ksy n THR 79 Ca 0.01 -0.20 -0.12 0.00 -2.27 0.00 0.00 64.05 61.46 2ksy n THR 79 Cb 0.50 -1.95 -0.06 0.00 -2.10 0.00 0.00 70.33 66.72 2ksy n THR 79 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2ksy h THR 80 N -0.88 0.25 -0.01 4.28 2.02 -0.90 0.04 112.91 117.71 2ksy h THR 80 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.73 2ksy h THR 80 Cb 1.36 0.25 -0.00 0.00 -1.74 0.00 0.00 68.15 68.02 2ksy h THR 80 CO -0.27 0.00 0.05 -0.65 0.37 0.00 0.00 175.52 175.02 2ksy h PRO 81 N -0.51 0.00 0.02 6.66 0.11 -1.75 0.36 132.00 136.90 2ksy h PRO 81 Ca 0.06 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.95 2ksy h PRO 81 Cb 0.60 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.70 2ksy h PRO 81 CO -0.29 0.00 -0.95 1.25 -0.21 0.00 0.00 178.00 177.80 2ksy h LEU 82 N 0.00 0.28 0.10 2.35 5.85 -1.23 -2.00 115.31 120.67 2ksy h LEU 82 Ca 0.01 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 2ksy h LEU 82 Cb 0.11 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.06 2ksy h LEU 82 CO -0.00 1.08 -0.05 0.40 -0.34 0.00 0.00 178.44 179.53 2ksy h ILE 83 N 0.10 1.13 -0.10 4.05 1.08 0.06 -1.92 117.51 121.90 2ksy h ILE 83 Ca -0.06 -1.01 -0.01 0.00 -0.39 0.00 0.00 64.86 63.39 2ksy h ILE 83 Cb 1.61 1.76 -0.01 0.00 -3.07 0.00 0.00 36.82 37.11 2ksy h ILE 83 CO 0.15 0.24 0.01 -0.37 -0.69 0.00 0.00 178.15 177.49 2ksy h VAL 84 N -0.61 1.06 -0.34 1.67 -1.51 -1.55 0.16 116.25 115.12 2ksy h VAL 84 Ca -0.01 -0.23 -0.06 0.00 -1.23 0.00 0.00 66.70 65.17 2ksy h VAL 84 Cb 0.49 0.98 -0.02 0.00 -2.13 0.00 0.00 31.29 30.62 2ksy h VAL 84 CO 0.02 0.08 -0.03 0.22 -1.23 0.00 0.00 177.57 176.63 2ksy h TYR 85 N 0.14 0.57 -0.03 5.19 3.20 -1.22 -0.41 116.97 124.40 2ksy h TYR 85 Ca 0.03 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.84 2ksy h TYR 85 Cb 0.08 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.19 2ksy h TYR 85 CO 0.00 0.57 0.01 0.35 -1.64 0.00 0.00 178.16 177.46 2ksy h PHE 86 N 0.52 0.05 -0.24 -3.82 3.04 -0.15 -1.57 116.94 114.77 2ksy h PHE 86 Ca 0.11 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.01 2ksy h PHE 86 Cb 0.38 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 38.86 2ksy h PHE 86 CO 0.01 0.18 -0.04 -0.07 -2.02 0.00 0.00 178.31 176.37 2ksy h LEU 87 N -0.10 0.34 -1.50 0.59 3.38 -1.20 -1.32 115.31 115.50 2ksy h LEU 87 Ca 0.01 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2ksy h LEU 87 Cb 0.15 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2ksy h LEU 87 CO -0.00 0.43 -0.25 1.23 0.09 0.00 0.00 178.44 179.94 2ksy h GLY 88 N 0.73 0.00 0.84 0.83 0.00 -0.67 -2.81 103.07 101.99 2ksy h GLY 88 Ca 0.08 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.25 2ksy h GLY 88 CO 0.01 0.00 -0.56 1.41 0.00 0.00 0.00 176.54 177.40 2ksy h LEU 89 N 0.00 0.59 -1.73 3.11 3.38 -0.25 -0.89 115.31 119.52 2ksy h LEU 89 Ca -0.00 -0.70 -0.00 0.00 0.09 0.00 0.00 57.88 57.27 2ksy h LEU 89 Cb 0.53 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2ksy h LEU 89 CO 0.03 1.20 0.13 -0.07 0.09 0.00 0.00 178.44 179.82 2ksy h LEU 90 N 0.02 0.27 0.00 1.67 3.38 -1.30 -3.15 115.31 116.20 2ksy h LEU 90 Ca -0.06 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 2ksy h LEU 90 Cb 1.24 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2ksy h LEU 90 CO 0.11 0.22 -0.37 0.00 0.09 0.00 0.00 178.44 178.50 2ksy h ALA 91 N 1.83 0.06 0.00 1.53 0.00 -1.51 -3.45 119.26 117.72 2ksy h ALA 91 Ca 0.08 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2ksy h ALA 91 Cb 0.01 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2ksy h ALA 91 CO -0.01 0.24 0.00 0.41 0.00 0.00 0.00 179.25 179.89 2ksy n GLY 92 N 1.61 0.78 3.94 0.00 0.00 -0.34 -4.40 105.19 106.78 2ksy n GLY 92 Ca -0.12 -0.75 -0.24 0.00 0.00 0.00 0.00 46.02 44.91 2ksy n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ksy s LEU 93 N 0.00 3.51 0.80 0.99 1.02 -1.19 -5.06 118.68 118.74 2ksy s LEU 93 Ca 0.00 0.40 -0.06 0.00 0.02 0.00 0.00 54.13 54.49 2ksy s LEU 93 Cb 0.00 -3.26 0.15 0.00 0.02 0.00 0.00 46.19 43.10 2ksy s LEU 93 CO 0.00 -0.82 1.10 1.51 0.02 0.00 0.00 176.35 178.15 2ksy s ASP 94 N -4.25 3.98 0.45 2.29 1.47 -1.26 -4.88 116.67 114.47 2ksy s ASP 94 Ca 0.50 -0.12 0.11 0.00 1.18 0.00 0.00 52.55 54.22 2ksy s ASP 94 Cb -0.10 -0.16 1.03 0.00 -0.34 0.00 0.00 42.92 43.34 2ksy s ASP 94 CO 0.40 -2.12 2.09 -1.28 0.68 0.00 0.00 175.17 174.93 2ksy h SER 95 N -0.88 0.25 0.11 2.11 0.87 -2.00 -2.39 113.55 111.63 2ksy h SER 95 Ca -0.39 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.15 2ksy h SER 95 Cb 1.26 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2ksy h SER 95 CO 0.41 0.20 -0.05 0.03 -0.53 0.00 0.00 176.83 176.88 2ksy h ARG 96 N 0.29 -0.15 -0.52 2.24 2.47 -1.99 -2.82 114.38 113.90 2ksy h ARG 96 Ca 0.08 0.01 0.09 0.00 -1.26 0.00 0.00 59.98 58.90 2ksy h ARG 96 Cb 0.00 0.03 -0.07 0.00 -1.65 0.00 0.00 29.97 28.28 2ksy h ARG 96 CO -0.01 0.35 0.11 0.93 0.56 0.00 0.00 179.97 181.91 2ksy h GLU 97 N -0.82 0.24 -0.10 0.04 5.08 -1.91 -2.07 114.58 115.05 2ksy h GLU 97 Ca -0.02 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2ksy h GLU 97 Cb 0.56 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2ksy h GLU 97 CO 0.03 0.16 -0.01 0.74 -1.00 0.00 0.00 179.01 178.92 2ksy h PHE 98 N 0.25 -0.03 -0.53 4.33 0.04 -1.53 -1.90 116.94 117.57 2ksy h PHE 98 Ca 0.26 0.01 0.15 0.00 2.80 0.00 0.00 57.97 61.19 2ksy h PHE 98 Cb 0.36 0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.51 2ksy h PHE 98 CO -0.23 -0.03 0.38 0.78 -0.60 0.00 0.00 178.31 178.62 2ksy h GLY 99 N 0.02 0.07 0.70 -1.45 0.00 -1.13 -1.04 103.07 100.24 2ksy h GLY 99 Ca 0.05 -0.02 -0.10 0.00 0.00 0.00 0.00 47.33 47.25 2ksy h GLY 99 CO -0.09 0.01 -0.37 -2.22 0.00 0.00 0.00 176.54 173.86 2ksy h ILE 100 N 0.05 1.43 -0.21 2.60 2.04 -0.74 -2.66 117.51 120.02 2ksy h ILE 100 Ca 0.25 -1.81 -0.03 0.00 1.00 0.00 0.00 64.86 64.27 2ksy h ILE 100 Cb 0.96 2.40 -0.01 0.00 -0.74 0.00 0.00 36.82 39.43 2ksy h ILE 100 CO -0.01 0.52 0.01 0.58 0.00 0.00 0.00 178.15 179.25 2ksy h VAL 101 N -0.15 1.25 0.15 1.67 2.07 -0.82 -2.55 116.25 117.87 2ksy h VAL 101 Ca -0.03 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 2ksy h VAL 101 Cb 1.04 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 2ksy h VAL 101 CO 0.08 0.26 -0.07 0.40 0.02 0.00 0.00 177.57 178.25 2ksy h ILE 102 N 0.13 0.93 -0.81 4.57 1.08 -1.33 -2.53 117.51 119.54 2ksy h ILE 102 Ca 0.06 -0.33 0.10 0.00 -0.39 0.00 0.00 64.86 64.30 2ksy h ILE 102 Cb 0.38 1.14 -0.06 0.00 -3.07 0.00 0.00 36.82 35.20 2ksy h ILE 102 CO 0.01 0.08 0.53 0.00 -0.69 0.00 0.00 178.15 178.08 2ksy h THR 103 N -0.36 0.94 -0.21 -0.27 1.03 -1.53 -1.50 112.91 111.00 2ksy h THR 103 Ca -0.02 -0.25 -0.00 0.00 -0.01 0.00 0.00 66.41 66.12 2ksy h THR 103 Cb 0.29 0.14 -0.01 0.00 -1.07 0.00 0.00 68.15 67.50 2ksy h THR 103 CO 0.03 0.13 0.12 0.25 -0.01 0.00 0.00 175.52 176.05 2ksy h LEU 104 N 0.73 0.26 -2.18 0.00 5.85 -1.24 -1.96 115.31 116.76 2ksy h LEU 104 Ca 0.38 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 59.01 2ksy h LEU 104 Cb 0.47 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 2ksy h LEU 104 CO -0.15 0.26 -0.05 0.78 -0.34 0.00 0.00 178.44 178.94 2ksy h ASN 105 N 0.24 0.00 0.50 1.25 -0.26 -0.87 -2.50 115.58 113.94 2ksy h ASN 105 Ca 0.07 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.79 2ksy h ASN 105 Cb 0.05 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.32 2ksy h ASN 105 CO -0.01 0.05 -0.24 0.74 -1.06 0.00 0.00 177.43 176.90 2ksy h THR 106 N 0.00 0.34 -0.72 2.81 2.02 -0.71 -2.51 112.91 114.13 2ksy h THR 106 Ca -0.00 -0.44 0.05 0.00 0.77 0.00 0.00 66.41 66.79 2ksy h THR 106 Cb 0.12 0.48 -0.04 0.00 -1.74 0.00 0.00 68.15 66.96 2ksy h THR 106 CO 0.01 0.05 0.48 1.62 0.37 0.00 0.00 175.52 178.05 2ksy h VAL 107 N -1.00 1.07 -0.15 3.16 3.04 -1.33 -1.70 116.25 119.35 2ksy h VAL 107 Ca -0.07 -0.28 0.02 0.00 -1.01 0.00 0.00 66.70 65.36 2ksy h VAL 107 Cb 0.61 0.18 -0.02 0.00 -2.01 0.00 0.00 31.29 30.04 2ksy h VAL 107 CO 0.11 0.15 0.00 0.58 -1.01 0.00 0.00 177.57 177.41 2ksy h VAL 108 N 0.82 0.90 -0.03 1.51 2.07 -1.43 -1.34 116.25 118.75 2ksy h VAL 108 Ca 0.30 -0.02 -0.05 0.00 0.82 0.00 0.00 66.70 67.75 2ksy h VAL 108 Cb 0.15 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 2ksy h VAL 108 CO -0.09 0.01 -0.20 0.24 0.02 0.00 0.00 177.57 177.55 2ksy h MET 109 N 0.05 0.05 -0.34 1.57 2.86 -0.95 -1.96 114.93 116.21 2ksy h MET 109 Ca 0.07 -0.01 -0.09 0.00 -2.06 0.00 0.00 59.70 57.61 2ksy h MET 109 Cb 0.08 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 2ksy h MET 109 CO -0.11 0.25 -0.15 1.25 1.06 0.00 0.00 176.91 179.21 2ksy h LEU 110 N 0.04 0.60 0.11 1.22 5.85 -0.44 0.12 115.31 122.81 2ksy h LEU 110 Ca 0.01 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 2ksy h LEU 110 Cb 0.38 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.25 2ksy h LEU 110 CO 0.03 0.77 -0.05 0.00 -0.34 0.00 0.00 178.44 178.84 2ksy h ALA 111 N 1.29 -0.15 -0.42 1.25 0.00 -0.49 -2.60 119.26 118.14 2ksy h ALA 111 Ca 0.09 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2ksy h ALA 111 Cb 0.57 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2ksy h ALA 111 CO 0.04 -0.48 -0.15 0.78 0.00 0.00 0.00 179.25 179.44 2ksy h GLY 112 N -0.36 0.84 0.00 0.00 0.00 -1.40 0.15 103.07 102.29 2ksy h GLY 112 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 47.33 46.65 2ksy h GLY 112 CO 0.02 0.61 0.00 0.33 0.00 0.00 0.00 176.54 177.50 2ksy n PHE 113 N -4.14 0.00 0.30 5.60 -0.00 0.40 -1.78 117.46 117.82 2ksy n PHE 113 Ca 0.01 0.00 0.19 0.00 -0.00 0.00 0.00 57.45 57.65 2ksy n PHE 113 Cb 0.39 -0.50 0.83 0.00 -0.00 0.00 0.00 39.48 40.20 2ksy n PHE 113 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2ksy h ALA 114 N -1.55 1.00 -0.70 3.13 0.00 -1.54 -2.99 119.26 116.61 2ksy h ALA 114 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.02 2ksy h ALA 114 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.71 2ksy h ALA 114 CO 0.00 0.00 0.32 0.78 0.00 0.00 0.00 179.25 180.35 2ksy h GLY 115 N 1.49 1.04 2.00 0.00 0.00 0.12 -1.02 103.07 106.71 2ksy h GLY 115 Ca 0.00 -0.18 -0.16 0.00 0.00 0.00 0.00 47.33 46.98 2ksy h GLY 115 CO 0.00 0.00 -0.78 0.00 0.00 0.00 0.00 176.54 175.76 2ksy h ALA 116 N 1.46 0.56 -0.22 3.60 0.00 -1.31 -3.22 119.26 120.12 2ksy h ALA 116 Ca 0.36 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2ksy h ALA 116 Cb 0.44 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2ksy h ALA 116 CO -0.31 0.98 0.00 -1.33 0.00 0.00 0.00 179.25 178.59 2ksy n MET 117 N -3.39 1.62 -1.94 0.00 2.00 -0.53 -4.87 117.12 110.01 2ksy n MET 117 Ca 0.00 -0.84 -0.38 0.00 0.00 0.00 0.00 57.70 56.48 2ksy n MET 117 Cb 0.82 -1.25 0.02 0.00 0.00 0.00 0.00 33.22 32.81 2ksy n MET 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 175.97 176.11 2ksy s VAL 118 N -1.67 2.41 -1.59 2.03 -7.23 -0.50 -4.91 120.40 108.93 2ksy s VAL 118 Ca 0.15 0.31 0.30 0.00 -1.81 0.00 0.00 61.98 60.94 2ksy s VAL 118 Cb 0.09 -3.16 0.54 0.00 0.56 0.00 0.00 36.38 34.41 2ksy s VAL 118 CO 0.10 0.00 1.99 -0.81 -0.31 0.00 0.00 175.10 176.07 2ksy n PRO 119 N -0.78 0.61 0.00 4.82 -0.04 -1.26 -4.92 135.00 133.43 2ksy n PRO 119 Ca 0.09 -0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 2ksy n PRO 119 Cb 0.46 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 2ksy n PRO 119 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ksy n GLY 120 N 1.25 3.51 1.96 0.55 0.00 -1.26 -5.01 105.19 106.19 2ksy n GLY 120 Ca 0.16 -0.13 -0.00 0.00 0.00 0.00 0.00 46.02 46.04 2ksy n GLY 120 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2ksy n ILE 121 N 0.00 2.88 0.29 -0.61 -6.64 -1.26 -4.39 119.36 109.64 2ksy n ILE 121 Ca 0.00 -1.55 0.16 0.00 -1.77 0.00 0.00 62.75 59.59 2ksy n ILE 121 Cb 0.00 -0.33 0.64 0.00 -1.44 0.00 0.00 39.64 38.51 2ksy n ILE 121 CO 0.00 0.00 0.00 -0.33 -1.77 0.00 0.00 176.55 174.45 2ksy h GLU 122 N 3.24 0.00 -0.95 6.28 4.39 -1.94 -3.13 114.58 122.47 2ksy h GLU 122 Ca 0.16 0.00 0.27 0.00 0.34 0.00 0.00 59.36 60.12 2ksy h GLU 122 Cb 2.20 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 30.80 2ksy h GLU 122 CO 0.64 0.00 0.67 0.07 -1.16 0.00 0.00 179.01 179.23 2ksy h ARG 123 N 0.00 0.07 -0.38 2.33 0.11 -1.76 0.21 114.38 114.95 2ksy h ARG 123 Ca 0.00 -0.00 -0.07 0.00 0.10 0.00 0.00 59.98 60.01 2ksy h ARG 123 Cb 0.52 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 31.56 2ksy h ARG 123 CO 0.00 0.05 -0.05 1.88 0.10 0.00 0.00 179.97 181.95 2ksy h TYR 124 N 0.07 0.67 0.04 4.08 0.05 -1.89 -1.48 116.97 118.52 2ksy h TYR 124 Ca 0.46 -0.09 -0.00 0.00 0.05 0.00 0.00 58.73 59.15 2ksy h TYR 124 Cb 1.72 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 39.28 2ksy h TYR 124 CO -0.00 0.67 -0.02 0.00 -1.05 0.00 0.00 178.16 177.76 2ksy h ALA 125 N 1.36 -0.05 -0.28 3.88 0.00 -0.83 -0.94 119.26 122.40 2ksy h ALA 125 Ca 0.12 -0.30 0.07 0.00 0.00 0.00 0.00 54.91 54.80 2ksy h ALA 125 Cb 0.45 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 2ksy h ALA 125 CO 0.02 -0.21 -0.21 -0.07 0.00 0.00 0.00 179.25 178.78 2ksy h LEU 126 N -0.69 -0.68 -1.12 0.00 4.07 -1.39 -0.23 115.31 115.27 2ksy h LEU 126 Ca -0.01 0.14 -0.05 0.00 0.08 0.00 0.00 57.88 58.04 2ksy h LEU 126 Cb 0.61 0.34 -0.02 0.00 1.08 0.00 0.00 40.66 42.67 2ksy h LEU 126 CO 0.01 -0.24 0.06 0.15 -1.08 0.00 0.00 178.44 177.33 2ksy h PHE 127 N -0.19 0.70 -0.83 1.13 3.57 -1.35 -2.56 116.94 117.41 2ksy h PHE 127 Ca 0.15 -0.07 0.21 0.00 3.53 0.00 0.00 57.97 61.79 2ksy h PHE 127 Cb 0.42 -0.20 -0.13 0.00 2.79 0.00 0.00 35.95 38.82 2ksy h PHE 127 CO -0.39 0.63 0.17 0.78 -2.23 0.00 0.00 178.31 177.27 2ksy h GLY 128 N 0.90 1.18 1.18 2.40 0.00 0.41 0.68 103.07 109.83 2ksy h GLY 128 Ca 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.32 2ksy h GLY 128 CO 0.01 -0.32 -0.36 1.98 0.00 0.00 0.00 176.54 177.84 2ksy h MET 129 N 0.19 0.90 0.00 4.80 1.85 -1.15 -2.86 114.93 118.66 2ksy h MET 129 Ca 0.50 -0.46 -0.04 0.00 -0.61 0.00 0.00 59.70 59.09 2ksy h MET 129 Cb 0.95 0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.98 2ksy h MET 129 CO -0.64 1.11 -0.20 0.78 -0.40 0.00 0.00 176.91 177.55 2ksy h GLY 130 N 0.83 0.00 0.27 1.39 0.00 0.33 -1.18 103.07 104.72 2ksy h GLY 130 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 2ksy h GLY 130 CO 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 176.54 176.58 2ksy h ALA 131 N 1.80 -0.15 -0.96 3.60 0.00 0.21 0.19 119.26 123.95 2ksy h ALA 131 Ca -0.00 -0.25 0.09 0.00 0.00 0.00 0.00 54.91 54.75 2ksy h ALA 131 Cb 0.41 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.19 2ksy h ALA 131 CO 0.03 -0.22 0.61 0.28 0.00 0.00 0.00 179.25 179.94 2ksy h VAL 132 N -0.88 0.99 -0.34 0.00 2.07 -1.46 -0.45 116.25 116.18 2ksy h VAL 132 Ca -0.02 -0.35 -0.14 0.00 0.82 0.00 0.00 66.70 67.02 2ksy h VAL 132 Cb 0.55 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 2ksy h VAL 132 CO 0.02 0.19 -0.34 0.00 0.02 0.00 0.00 177.57 177.46 2ksy h ALA 133 N 1.49 0.76 -0.01 1.67 0.00 -1.25 -2.61 119.26 119.30 2ksy h ALA 133 Ca 0.45 -0.43 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2ksy h ALA 133 Cb 0.33 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 2ksy h ALA 133 CO -0.22 0.65 -0.18 0.35 0.00 0.00 0.00 179.25 179.85 2ksy h PHE 134 N 0.64 -0.47 -0.31 0.00 3.57 0.10 -0.42 116.94 120.05 2ksy h PHE 134 Ca 0.06 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.59 2ksy h PHE 134 Cb 0.88 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.82 2ksy h PHE 134 CO 0.05 -0.26 0.21 0.82 -2.23 0.00 0.00 178.31 176.89 2ksy h ILE 135 N -0.29 1.05 -0.97 1.41 2.04 -1.31 -1.20 117.51 118.24 2ksy h ILE 135 Ca 0.06 -0.13 0.02 0.00 1.00 0.00 0.00 64.86 65.81 2ksy h ILE 135 Cb 0.37 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 2ksy h ILE 135 CO -0.18 0.07 0.64 1.23 0.00 0.00 0.00 178.15 179.90 2ksy h GLY 136 N 0.37 1.38 0.71 5.37 0.00 -0.70 0.11 103.07 110.30 2ksy h GLY 136 Ca 0.12 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 2ksy h GLY 136 CO -0.03 0.46 -0.11 -2.00 0.00 0.00 0.00 176.54 174.87 2ksy h LEU 137 N 1.27 -0.25 -1.26 3.11 5.85 -0.40 -2.51 115.31 121.12 2ksy h LEU 137 Ca 0.37 -0.19 0.11 0.00 0.84 0.00 0.00 57.88 59.00 2ksy h LEU 137 Cb -0.09 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 40.95 2ksy h LEU 137 CO -0.10 0.07 0.56 0.58 -0.34 0.00 0.00 178.44 179.21 2ksy h VAL 138 N -0.59 0.92 -0.72 1.05 2.07 -1.27 -0.63 116.25 117.08 2ksy h VAL 138 Ca -0.03 -0.27 0.04 0.00 0.82 0.00 0.00 66.70 67.26 2ksy h VAL 138 Cb 0.43 0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.21 2ksy h VAL 138 CO 0.05 0.14 0.44 0.22 0.02 0.00 0.00 177.57 178.44 2ksy h TYR 139 N 0.79 0.81 -0.63 1.57 3.20 -0.60 -2.35 116.97 119.77 2ksy h TYR 139 Ca 0.41 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.25 2ksy h TYR 139 Cb 0.51 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.49 2ksy h TYR 139 CO -0.00 0.43 0.18 1.88 -1.64 0.00 0.00 178.16 179.02 2ksy h TYR 140 N 0.83 1.02 -0.16 -3.82 0.05 -0.68 0.38 116.97 114.58 2ksy h TYR 140 Ca 0.30 -0.11 0.04 0.00 0.05 0.00 0.00 58.73 59.01 2ksy h TYR 140 Cb 0.09 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 37.51 2ksy h TYR 140 CO -0.05 0.84 -0.06 -0.07 -1.05 0.00 0.00 178.16 177.77 2ksy h LEU 141 N 0.90 -0.21 -0.04 3.88 3.38 -0.97 -1.43 115.31 120.83 2ksy h LEU 141 Ca 0.20 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2ksy h LEU 141 Cb 0.31 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2ksy h LEU 141 CO -0.00 -0.08 -0.17 0.55 0.09 0.00 0.00 178.44 178.82 2ksy n VAL 142 N -5.21 0.00 0.00 1.22 3.14 -0.98 -3.00 118.33 113.51 2ksy n VAL 142 Ca -0.03 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.34 2ksy n VAL 142 Cb 0.13 -0.21 0.00 0.00 -1.06 0.00 0.00 33.84 32.70 2ksy n VAL 142 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2ksy n GLY 143 N 1.46 -0.61 0.35 7.55 0.00 0.13 -4.57 105.19 109.49 2ksy n GLY 143 Ca 0.08 -1.19 0.18 0.00 0.00 0.00 0.00 46.02 45.09 2ksy n GLY 143 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ksy h PRO 144 N 0.00 0.00 0.24 1.61 0.11 -1.85 -2.88 132.00 129.23 2ksy h PRO 144 Ca 0.00 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.12 2ksy h PRO 144 Cb 0.00 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.07 2ksy h PRO 144 CO 0.00 0.00 -0.49 0.52 -0.21 0.00 0.00 178.00 177.82 2ksy h MET 145 N 0.00 -0.78 -0.16 1.05 2.86 -1.76 -0.63 114.93 115.51 2ksy h MET 145 Ca 0.08 0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 2ksy h MET 145 Cb 0.69 0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.52 2ksy h MET 145 CO -0.00 -0.52 0.05 0.00 1.06 0.00 0.00 176.91 177.50 2ksy h THR 146 N -0.81 1.08 -0.41 2.22 1.03 -1.41 -1.76 112.91 112.85 2ksy h THR 146 Ca -0.02 -0.25 -0.05 0.00 -0.01 0.00 0.00 66.41 66.09 2ksy h THR 146 Cb 0.78 0.90 -0.02 0.00 -1.07 0.00 0.00 68.15 68.74 2ksy h THR 146 CO -0.20 0.09 0.07 -0.33 -0.01 0.00 0.00 175.52 175.14 2ksy h GLU 147 N 0.22 0.68 -0.28 0.00 4.39 -1.44 -0.51 114.58 117.65 2ksy h GLU 147 Ca 0.06 -0.18 -0.13 0.00 0.34 0.00 0.00 59.36 59.45 2ksy h GLU 147 Cb 0.07 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2ksy h GLU 147 CO -0.00 0.72 -0.34 0.66 -1.16 0.00 0.00 179.01 178.89 2ksy h SER 148 N 0.53 0.78 -0.64 1.42 4.64 -0.68 -3.08 113.55 116.52 2ksy h SER 148 Ca 0.13 -0.49 -0.08 0.00 -0.47 0.00 0.00 61.79 60.87 2ksy h SER 148 Cb 0.37 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.21 2ksy h SER 148 CO 0.01 1.11 0.09 0.00 -0.87 0.00 0.00 176.83 177.17 2ksy h ALA 149 N 0.69 0.86 0.00 5.18 0.00 -1.30 -1.76 119.26 122.92 2ksy h ALA 149 Ca 0.04 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2ksy h ALA 149 Cb 0.92 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2ksy h ALA 149 CO 0.08 0.63 0.00 -1.13 0.00 0.00 0.00 179.25 178.83 2ksy n SER 150 N -4.24 0.00 -0.11 0.00 3.41 -0.20 -1.48 113.62 111.00 2ksy n SER 150 Ca 0.04 0.21 0.05 0.00 -0.26 0.00 0.00 58.87 58.91 2ksy n SER 150 Cb 0.30 -0.34 -0.03 0.00 -0.26 0.00 0.00 64.21 63.88 2ksy n SER 150 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ksy n GLN 151 N -1.34 2.91 -0.01 4.33 6.02 -0.73 -4.62 117.38 123.94 2ksy n GLN 151 Ca 0.05 -0.29 -0.11 0.00 -0.01 0.00 0.00 57.00 56.64 2ksy n GLN 151 Cb 0.11 -1.04 -0.09 0.00 1.02 0.00 0.00 30.24 30.24 2ksy n GLN 151 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2ksy h ARG 152 N 0.55 -0.08 -3.16 -1.09 2.43 -0.56 -3.49 114.38 108.99 2ksy h ARG 152 Ca 0.00 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 2ksy h ARG 152 Cb 0.30 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.81 2ksy h ARG 152 CO 0.00 0.51 0.15 0.45 -1.51 0.00 0.00 179.97 179.57 2ksy s SER 153 N -5.77 -0.19 0.18 -3.80 0.15 -1.24 -5.01 113.70 98.02 2ksy s SER 153 Ca -0.14 -0.72 -0.06 0.00 0.70 0.00 0.00 55.95 55.73 2ksy s SER 153 Cb -0.00 0.70 0.08 0.00 -1.71 0.00 0.00 66.02 65.09 2ksy s SER 153 CO 0.55 -1.32 1.51 0.28 1.20 0.00 0.00 173.24 175.46 2ksy h SER 154 N 2.06 0.77 0.15 5.45 0.02 -1.91 -3.17 113.55 116.91 2ksy h SER 154 Ca -0.21 -0.37 -0.28 0.00 -0.84 0.00 0.00 61.79 60.09 2ksy h SER 154 Cb 1.25 -0.22 0.02 0.00 0.14 0.00 0.00 62.40 63.59 2ksy h SER 154 CO 0.27 1.10 -1.13 1.23 -1.14 0.00 0.00 176.83 177.16 2ksy h GLY 155 N 0.93 0.67 0.42 -3.77 0.00 -1.96 -3.27 103.07 96.09 2ksy h GLY 155 Ca 0.04 -1.30 0.18 0.00 0.00 0.00 0.00 47.33 46.24 2ksy h GLY 155 CO 0.09 1.15 0.58 -2.22 0.00 0.00 0.00 176.54 176.14 2ksy h ILE 156 N 0.30 0.74 -0.28 2.60 1.08 -1.84 -0.39 117.51 119.72 2ksy h ILE 156 Ca -0.15 -0.17 -0.15 0.00 -0.39 0.00 0.00 64.86 64.00 2ksy h ILE 156 Cb 1.80 0.20 -0.01 0.00 -3.07 0.00 0.00 36.82 35.73 2ksy h ILE 156 CO 0.21 0.09 -0.42 0.50 -0.69 0.00 0.00 178.15 177.85 2ksy h LYS 157 N 0.50 0.68 -0.12 2.37 3.64 -1.60 -1.98 116.57 120.06 2ksy h LYS 157 Ca 0.45 -0.36 -0.10 0.00 -1.27 0.00 0.00 60.65 59.37 2ksy h LYS 157 Cb 0.99 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 2ksy h LYS 157 CO -0.19 0.97 -0.32 0.66 -2.27 0.00 0.00 179.45 178.31 2ksy h SER 158 N 0.56 0.49 -0.21 4.20 4.64 -1.18 -2.52 113.55 119.53 2ksy h SER 158 Ca 0.04 -0.58 -0.04 0.00 -0.47 0.00 0.00 61.79 60.74 2ksy h SER 158 Cb 0.96 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.90 2ksy h SER 158 CO 0.09 0.99 -0.03 -0.07 -0.87 0.00 0.00 176.83 176.93 2ksy h LEU 159 N 0.02 0.39 -1.11 5.97 3.38 -1.36 -2.64 115.31 119.96 2ksy h LEU 159 Ca -0.00 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.60 2ksy h LEU 159 Cb 0.93 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 2ksy h LEU 159 CO 0.07 0.65 0.37 0.22 0.09 0.00 0.00 178.44 179.84 2ksy h TYR 160 N 0.13 0.98 0.04 1.13 5.03 -1.44 0.05 116.97 122.89 2ksy h TYR 160 Ca 0.06 -0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.34 2ksy h TYR 160 Cb 0.47 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.44 2ksy h TYR 160 CO 0.05 0.69 -0.02 0.28 -1.32 0.00 0.00 178.16 177.84 2ksy h VAL 161 N 1.00 1.07 -0.21 1.81 2.07 -1.37 -0.09 116.25 120.53 2ksy h VAL 161 Ca 0.25 -0.37 -0.12 0.00 0.82 0.00 0.00 66.70 67.28 2ksy h VAL 161 Cb 0.05 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2ksy h VAL 161 CO -0.04 0.09 -0.39 -0.09 0.02 0.00 0.00 177.57 177.17 2ksy h ARG 162 N -0.22 0.47 -0.20 1.57 9.65 -1.30 -1.34 114.38 123.02 2ksy h ARG 162 Ca -0.01 -0.23 -0.08 0.00 -1.10 0.00 0.00 59.98 58.57 2ksy h ARG 162 Cb 0.20 -0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.77 2ksy h ARG 162 CO 0.01 0.79 -0.18 -0.07 2.80 0.00 0.00 179.97 183.32 2ksy h LEU 163 N 0.40 0.51 -0.22 3.80 4.07 -0.90 -2.66 115.31 120.30 2ksy h LEU 163 Ca 0.04 -0.46 -0.18 0.00 0.08 0.00 0.00 57.88 57.36 2ksy h LEU 163 Cb 0.85 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.45 2ksy h LEU 163 CO 0.07 0.86 -0.55 0.08 -1.08 0.00 0.00 178.44 177.82 2ksy h ARG 164 N 0.15 0.77 -0.06 1.13 -0.00 -1.00 -2.17 114.38 113.21 2ksy h ARG 164 Ca 0.04 -0.53 0.02 0.00 -0.00 0.00 0.00 59.98 59.51 2ksy h ARG 164 Cb 0.71 0.08 -0.02 0.00 -0.00 0.00 0.00 29.97 30.74 2ksy h ARG 164 CO 0.05 1.15 -0.08 -0.91 -0.00 0.00 0.00 179.97 180.18 2ksy h ASN 165 N 0.51 -0.23 0.37 0.08 -0.26 -1.29 0.29 115.58 115.04 2ksy h ASN 165 Ca -0.01 0.04 -0.02 0.00 -0.56 0.00 0.00 56.30 55.76 2ksy h ASN 165 Cb 1.17 0.11 0.00 0.00 -1.06 0.00 0.00 38.32 38.55 2ksy h ASN 165 CO 0.12 -0.11 -0.18 0.25 -1.06 0.00 0.00 177.43 176.46 2ksy h LEU 166 N -0.10 -0.42 -0.02 1.61 6.46 -1.52 -2.58 115.31 118.73 2ksy h LEU 166 Ca 0.05 -0.10 0.03 0.00 -0.12 0.00 0.00 57.88 57.74 2ksy h LEU 166 Cb 0.18 0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 40.17 2ksy h LEU 166 CO -0.12 -0.14 -0.21 0.74 -0.62 0.00 0.00 178.44 178.09 2ksy h THR 167 N -0.71 0.51 -0.63 1.05 2.02 -1.34 -2.70 112.91 111.11 2ksy h THR 167 Ca -0.05 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.21 2ksy h THR 167 Cb 0.49 0.51 -0.06 0.00 -1.74 0.00 0.00 68.15 67.35 2ksy h THR 167 CO 0.08 0.00 0.29 0.58 0.37 0.00 0.00 175.52 176.85 2ksy h VAL 168 N -0.32 0.85 0.34 3.16 2.07 -0.99 0.22 116.25 121.59 2ksy h VAL 168 Ca 0.07 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 2ksy h VAL 168 Cb 0.41 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 2ksy h VAL 168 CO -0.21 0.10 -0.29 0.58 0.02 0.00 0.00 177.57 177.77 2ksy h VAL 169 N 0.52 0.00 0.00 2.57 2.07 -1.15 0.18 116.25 120.44 2ksy h VAL 169 Ca 0.31 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.80 2ksy h VAL 169 Cb 0.31 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.08 2ksy h VAL 169 CO -0.25 0.00 -0.15 0.17 0.02 0.00 0.00 177.57 177.36 2ksy h LEU 170 N -0.62 0.00 -0.82 2.57 8.10 -1.41 -1.82 115.31 121.31 2ksy h LEU 170 Ca -0.04 0.00 -0.12 0.00 0.11 0.00 0.00 57.88 57.82 2ksy h LEU 170 Cb 0.52 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.73 2ksy h LEU 170 CO -0.01 0.15 -0.51 -0.50 -4.11 0.00 0.00 178.44 173.46 2ksy h TRP 171 N 0.00 0.24 0.00 0.17 4.06 -0.26 -2.53 115.95 117.63 2ksy h TRP 171 Ca -0.00 -0.08 0.00 0.00 2.06 0.00 0.00 58.89 60.87 2ksy h TRP 171 Cb 0.28 -0.05 0.00 0.00 -1.00 0.00 0.00 29.16 28.40 2ksy h TRP 171 CO 0.00 0.67 0.00 0.00 -3.56 0.00 0.00 178.44 175.55 2ksy n ALA 172 N -2.47 1.95 0.10 1.49 0.00 0.61 -2.30 120.51 119.89 2ksy n ALA 172 Ca -0.02 -0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.41 2ksy n ALA 172 Cb 0.55 -1.30 -0.00 0.00 0.00 0.00 0.00 19.45 18.70 2ksy n ALA 172 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2ksy h ILE 173 N 0.00 0.28 -0.36 0.00 1.08 -1.43 -3.37 117.51 113.70 2ksy h ILE 173 Ca 0.00 -1.49 0.07 0.00 -0.39 0.00 0.00 64.86 63.05 2ksy h ILE 173 Cb 0.20 1.86 -0.06 0.00 -3.07 0.00 0.00 36.82 35.75 2ksy h ILE 173 CO 0.00 0.16 -0.02 1.88 -0.69 0.00 0.00 178.15 179.47 2ksy h TYR 174 N 0.00 -0.07 -1.16 1.37 0.05 -1.56 -0.92 116.97 114.69 2ksy h TYR 174 Ca -0.05 0.03 0.33 0.00 0.05 0.00 0.00 58.73 59.08 2ksy h TYR 174 Cb 1.24 0.09 -0.07 0.00 1.01 0.00 0.00 36.73 39.00 2ksy h TYR 174 CO 0.00 -0.09 0.80 -1.35 -1.05 0.00 0.00 178.16 176.46 2ksy h PRO 175 N 0.07 0.15 0.00 4.88 0.11 -1.77 -0.55 132.00 134.89 2ksy h PRO 175 Ca 0.18 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.26 2ksy h PRO 175 Cb 0.25 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.33 2ksy h PRO 175 CO -0.32 0.10 -0.08 0.74 -0.21 0.00 0.00 178.00 178.24 2ksy h PHE 176 N 0.16 0.00 -0.95 0.65 0.04 -1.44 -3.21 116.94 112.18 2ksy h PHE 176 Ca 0.61 0.00 0.01 0.00 2.80 0.00 0.00 57.97 61.38 2ksy h PHE 176 Cb 2.04 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 40.14 2ksy h PHE 176 CO -0.00 0.99 0.62 0.82 -0.60 0.00 0.00 178.31 180.14 2ksy h ILE 177 N -1.00 1.25 -0.50 -0.55 1.08 -0.55 0.30 117.51 117.54 2ksy h ILE 177 Ca -0.02 -0.48 -0.12 0.00 -0.39 0.00 0.00 64.86 63.86 2ksy h ILE 177 Cb 0.98 -0.14 -0.02 0.00 -3.07 0.00 0.00 36.82 34.57 2ksy h ILE 177 CO -0.01 0.25 -0.14 -0.25 -0.69 0.00 0.00 178.15 177.30 2ksy h TRP 178 N 1.30 1.09 0.03 1.37 7.01 -1.30 -1.13 115.95 124.32 2ksy h TRP 178 Ca 0.35 -0.23 -0.00 0.00 2.11 0.00 0.00 58.89 61.11 2ksy h TRP 178 Cb -0.13 -0.27 0.00 0.00 -2.10 0.00 0.00 29.16 26.67 2ksy h TRP 178 CO 0.00 1.03 -0.02 1.25 -2.79 0.00 0.00 178.44 177.92 2ksy h LEU 179 N 0.86 -0.04 0.16 0.65 5.85 -1.45 -2.53 115.31 118.81 2ksy h LEU 179 Ca 0.13 -0.63 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 2ksy h LEU 179 Cb 0.70 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2ksy h LEU 179 CO 0.05 0.74 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.75 2ksy h LEU 180 N -0.94 -0.18 -9.68 2.25 3.38 -0.51 0.40 115.31 110.03 2ksy h LEU 180 Ca -0.00 -0.06 -0.33 0.00 0.09 0.00 0.00 57.88 57.58 2ksy h LEU 180 Cb 0.67 0.05 0.19 0.00 0.09 0.00 0.00 40.66 41.65 2ksy h LEU 180 CO 0.01 -0.05 -0.18 0.61 0.09 0.00 0.00 178.44 178.92 2ksy n GLY 181 N -0.96 -3.44 0.31 0.83 0.00 -0.43 0.43 105.19 101.93 2ksy n GLY 181 Ca -0.09 -1.44 0.10 0.00 0.00 0.00 0.00 46.02 44.60 2ksy n GLY 181 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ksy h PRO 182 N -3.36 0.09 -1.55 1.61 0.11 -1.85 -0.50 132.00 126.55 2ksy h PRO 182 Ca -0.36 -0.01 0.45 0.00 0.11 0.00 0.00 66.00 66.19 2ksy h PRO 182 Cb 1.17 -0.02 -0.07 0.00 0.11 0.00 0.00 31.00 32.19 2ksy h PRO 182 CO 0.23 0.06 1.11 -1.00 -0.21 0.00 0.00 178.00 178.18 2ksy h PRO 183 N 0.10 0.01 0.00 1.05 0.13 -1.86 -3.37 132.00 128.06 2ksy h PRO 183 Ca 0.51 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.64 2ksy h PRO 183 Cb 0.99 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2ksy h PRO 183 CO -0.76 0.01 0.00 0.41 -0.23 0.00 0.00 178.00 177.43 2ksy n GLY 184 N -1.82 1.66 0.21 1.56 0.00 -0.31 -4.62 105.19 101.86 2ksy n GLY 184 Ca 0.35 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.51 2ksy n GLY 184 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2ksy h VAL 185 N 0.00 0.00 -5.44 1.61 -1.51 -0.30 -3.48 116.25 107.14 2ksy h VAL 185 Ca 0.00 -0.17 -0.01 0.00 -1.23 0.00 0.00 66.70 65.29 2ksy h VAL 185 Cb 0.00 0.92 0.00 0.00 -2.13 0.00 0.00 31.29 30.08 2ksy h VAL 185 CO 0.00 0.00 -0.96 0.00 -1.23 0.00 0.00 177.57 175.38 2ksy n ALA 186 N -1.90 -3.12 -0.03 5.19 0.00 0.24 -4.96 120.51 115.93 2ksy n ALA 186 Ca -0.00 0.46 -0.12 0.00 0.00 0.00 0.00 53.44 53.78 2ksy n ALA 186 Cb 0.15 -1.21 -0.14 0.00 0.00 0.00 0.00 19.45 18.25 2ksy n ALA 186 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2ksy n LEU 187 N 0.70 1.33 0.00 0.00 4.77 0.17 -4.88 117.00 119.10 2ksy n LEU 187 Ca 0.01 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 2ksy n LEU 187 Cb 0.16 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2ksy n LEU 187 CO 0.37 0.55 0.00 0.00 -1.33 0.00 0.00 177.39 176.98 2ksy n LEU 188 N -3.13 0.00 -4.84 2.23 -0.00 -1.26 -5.09 117.00 104.91 2ksy n LEU 188 Ca -0.24 0.00 -0.34 0.00 -0.00 0.00 0.00 56.01 55.43 2ksy n LEU 188 Cb 1.06 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 44.42 2ksy n LEU 188 CO 0.43 0.00 0.40 0.28 -0.00 0.00 0.00 177.39 178.50 2ksy s THR 189 N -0.69 4.66 0.40 1.47 -1.32 -1.26 -4.56 115.64 114.33 2ksy s THR 189 Ca 0.00 1.05 0.17 0.00 -1.21 0.00 0.00 61.69 61.70 2ksy s THR 189 Cb 0.00 -3.72 0.38 0.00 -1.51 0.00 0.00 72.50 67.65 2ksy s THR 189 CO 0.00 0.00 1.82 -0.65 -2.21 0.00 0.00 174.62 173.58 2ksy h PRO 190 N 2.81 0.43 -0.94 7.08 0.11 -2.00 0.21 132.00 139.72 2ksy h PRO 190 Ca -0.48 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.66 2ksy h PRO 190 Cb 1.18 -0.10 -0.06 0.00 0.11 0.00 0.00 31.00 32.13 2ksy h PRO 190 CO 0.65 0.29 0.60 1.79 -0.21 0.00 0.00 178.00 181.12 2ksy h THR 191 N 0.45 1.11 0.07 -1.15 1.35 -1.94 0.99 112.91 113.78 2ksy h THR 191 Ca 0.52 -0.39 -0.00 0.00 -0.55 0.00 0.00 66.41 65.99 2ksy h THR 191 Cb 1.25 -0.12 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 2ksy h THR 191 CO -0.23 0.21 -0.03 0.58 -0.25 0.00 0.00 175.52 175.79 2ksy h VAL 192 N 1.13 1.15 -0.11 6.82 2.07 -1.38 -2.36 116.25 123.58 2ksy h VAL 192 Ca 0.39 -1.47 0.04 0.00 0.82 0.00 0.00 66.70 66.47 2ksy h VAL 192 Cb 0.09 2.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.83 2ksy h VAL 192 CO -0.15 0.33 -0.15 -0.78 0.02 0.00 0.00 177.57 176.84 2ksy h ASP 193 N -0.84 -0.46 -0.62 0.57 3.58 -1.22 -1.87 116.42 115.55 2ksy h ASP 193 Ca -0.01 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.51 2ksy h ASP 193 Cb 0.61 0.22 -0.03 0.00 1.72 0.00 0.00 39.33 41.85 2ksy h ASP 193 CO 0.02 -0.20 0.34 0.58 -2.88 0.00 0.00 179.24 177.10 2ksy h VAL 194 N -0.20 1.20 -0.47 2.25 2.07 -0.93 -2.19 116.25 117.98 2ksy h VAL 194 Ca 0.09 -0.51 0.09 0.00 0.82 0.00 0.00 66.70 67.18 2ksy h VAL 194 Cb 0.32 0.34 -0.08 0.00 -1.52 0.00 0.00 31.29 30.36 2ksy h VAL 194 CO -0.22 0.22 0.01 0.00 0.02 0.00 0.00 177.57 177.60 2ksy h ALA 195 N 1.48 0.45 -0.46 1.67 0.00 -0.77 0.61 119.26 122.23 2ksy h ALA 195 Ca 0.23 0.14 -0.13 0.00 0.00 0.00 0.00 54.91 55.14 2ksy h ALA 195 Cb 0.04 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2ksy h ALA 195 CO -0.04 -0.38 -0.24 -0.07 0.00 0.00 0.00 179.25 178.53 2ksy h LEU 196 N 0.12 0.98 0.55 0.00 3.38 -1.18 -2.65 115.31 116.52 2ksy h LEU 196 Ca 0.24 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2ksy h LEU 196 Cb 0.35 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2ksy h LEU 196 CO -0.38 1.16 -0.49 0.40 0.09 0.00 0.00 178.44 179.21 2ksy h ILE 197 N 0.82 0.00 -0.91 1.22 1.08 -0.60 0.16 117.51 119.27 2ksy h ILE 197 Ca 0.10 0.00 0.19 0.00 -0.39 0.00 0.00 64.86 64.77 2ksy h ILE 197 Cb 0.81 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 34.48 2ksy h ILE 197 CO 0.07 0.00 0.60 -0.37 -0.69 0.00 0.00 178.15 177.75 2ksy h VAL 198 N -1.03 0.70 -0.26 1.67 -1.51 -0.98 0.11 116.25 114.95 2ksy h VAL 198 Ca -0.07 -0.17 -0.01 0.00 -1.23 0.00 0.00 66.70 65.22 2ksy h VAL 198 Cb 0.88 0.16 -0.01 0.00 -2.13 0.00 0.00 31.29 30.19 2ksy h VAL 198 CO -0.03 0.09 0.13 0.22 -1.23 0.00 0.00 177.57 176.75 2ksy h TYR 199 N 0.49 0.37 -0.95 5.19 3.20 -0.91 0.35 116.97 124.71 2ksy h TYR 199 Ca 0.48 -0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.44 2ksy h TYR 199 Cb 1.07 -0.12 -0.07 0.00 1.54 0.00 0.00 36.73 39.15 2ksy h TYR 199 CO -0.00 0.34 0.61 -0.07 -1.64 0.00 0.00 178.16 177.39 2ksy h LEU 200 N 0.29 0.88 -0.09 2.82 4.07 0.19 0.43 115.31 123.91 2ksy h LEU 200 Ca 0.09 0.03 -0.19 0.00 0.08 0.00 0.00 57.88 57.88 2ksy h LEU 200 Cb 0.10 -0.15 0.01 0.00 1.08 0.00 0.00 40.66 41.70 2ksy h LEU 200 CO -0.01 0.51 -0.70 0.44 -1.08 0.00 0.00 178.44 177.60 2ksy h ASP 201 N 0.97 0.77 -0.16 -0.43 3.32 -1.04 -2.69 116.42 117.16 2ksy h ASP 201 Ca 0.44 -0.67 -0.04 0.00 0.02 0.00 0.00 57.03 56.79 2ksy h ASP 201 Cb 0.39 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 2ksy h ASP 201 CO -0.20 1.32 0.00 -0.07 -1.72 0.00 0.00 179.24 178.57 2ksy h LEU 202 N 0.28 0.37 0.03 1.55 3.38 -0.30 -2.88 115.31 117.73 2ksy h LEU 202 Ca -0.06 -0.06 -0.27 0.00 0.09 0.00 0.00 57.88 57.58 2ksy h LEU 202 Cb 1.35 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 42.02 2ksy h LEU 202 CO 0.14 0.43 -1.16 1.62 0.09 0.00 0.00 178.44 179.57 2ksy h VAL 203 N 0.39 1.42 0.00 1.22 3.04 -0.95 -2.13 116.25 119.24 2ksy h VAL 203 Ca 0.09 -2.74 0.00 0.00 -1.01 0.00 0.00 66.70 63.04 2ksy h VAL 203 Cb 0.26 2.74 0.00 0.00 -2.01 0.00 0.00 31.29 32.27 2ksy h VAL 203 CO 0.01 0.81 0.00 0.41 -1.01 0.00 0.00 177.57 177.79 2ksy n THR 204 N -3.66 0.19 0.00 3.17 -1.04 -1.02 -0.19 114.28 111.74 2ksy n THR 204 Ca -0.09 0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 2ksy n THR 204 Cb 0.96 -0.99 0.00 0.00 -1.82 0.00 0.00 70.33 68.48 2ksy n THR 204 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2ksy n VAL 206 N -1.05 0.00 0.47 12.58 0.31 -0.80 -2.62 118.33 127.22 2ksy n VAL 206 Ca 0.03 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.17 2ksy n VAL 206 Cb 0.02 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.86 2ksy n VAL 206 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2ksy h GLY 207 N 0.00 -1.25 2.00 2.92 0.00 -0.60 -0.91 103.07 105.23 2ksy h GLY 207 Ca 0.00 0.46 -0.07 0.00 0.00 0.00 0.00 47.33 47.72 2ksy h GLY 207 CO 0.00 -0.46 -0.35 0.27 0.00 0.00 0.00 176.54 176.01 2ksy h PHE 208 N -1.28 0.00 -0.11 5.60 -0.00 -1.55 -2.74 116.94 116.86 2ksy h PHE 208 Ca -0.12 0.00 -0.10 0.00 -0.00 0.00 0.00 57.97 57.75 2ksy h PHE 208 Cb 0.92 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.86 2ksy h PHE 208 CO 0.01 0.35 -0.39 0.78 -0.00 0.00 0.00 178.31 179.06 2ksy h GLY 209 N 1.97 0.26 0.57 6.09 0.00 -1.75 1.19 103.07 111.40 2ksy h GLY 209 Ca -0.00 -0.24 -0.06 0.00 0.00 0.00 0.00 47.33 47.03 2ksy h GLY 209 CO 0.04 0.22 -0.19 0.74 0.00 0.00 0.00 176.54 177.35 2ksy h PHE 210 N 0.20 0.29 0.00 5.60 0.04 -0.91 -1.37 116.94 120.79 2ksy h PHE 210 Ca 0.02 -0.12 -0.04 0.00 2.80 0.00 0.00 57.97 60.63 2ksy h PHE 210 Cb 0.78 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.87 2ksy h PHE 210 CO 0.01 0.81 -0.19 0.82 -0.60 0.00 0.00 178.31 179.17 2ksy h ILE 211 N -0.32 0.91 -0.75 -0.55 2.04 -1.36 -1.90 117.51 115.57 2ksy h ILE 211 Ca -0.01 -0.70 -0.06 0.00 1.00 0.00 0.00 64.86 65.10 2ksy h ILE 211 Cb 0.83 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 38.28 2ksy h ILE 211 CO 0.04 0.18 0.25 0.00 0.00 0.00 0.00 178.15 178.62 2ksy h ALA 212 N 1.81 1.01 0.23 1.87 0.00 0.18 -0.66 119.26 123.70 2ksy h ALA 212 Ca -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2ksy h ALA 212 Cb 0.39 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2ksy h ALA 212 CO 0.02 0.67 -0.11 -0.07 0.00 0.00 0.00 179.25 179.76 2ksy h LEU 213 N 1.12 -0.26 -0.59 0.00 3.38 -0.47 -1.79 115.31 116.69 2ksy h LEU 213 Ca 0.24 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 58.01 2ksy h LEU 213 Cb 0.29 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 2ksy h LEU 213 CO -0.01 0.19 0.31 0.44 0.09 0.00 0.00 178.44 179.46 2ksy h ASP 214 N -0.80 0.44 0.79 -0.43 3.32 -1.43 0.68 116.42 118.99 2ksy h ASP 214 Ca -0.03 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 2ksy h ASP 214 Cb 0.51 -0.05 0.01 0.00 0.22 0.00 0.00 39.33 40.02 2ksy h ASP 214 CO 0.05 0.29 -0.38 0.00 -1.72 0.00 0.00 179.24 177.48 2ksy h ALA 215 N 1.33 -1.07 -0.47 3.45 0.00 -1.17 -2.51 119.26 118.82 2ksy h ALA 215 Ca 0.27 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 55.07 2ksy h ALA 215 Cb 0.19 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2ksy h ALA 215 CO -0.19 -1.07 0.34 0.00 0.00 0.00 0.00 179.25 178.32 2ksy h ALA 216 N -0.93 2.38 -0.78 0.00 0.00 -1.15 0.86 119.26 119.64 2ksy h ALA 216 Ca -0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2ksy h ALA 216 Cb 0.83 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 2ksy h ALA 216 CO 0.18 -0.52 0.44 0.00 0.00 0.00 0.00 179.25 179.35 2ksy h ALA 217 N 1.77 0.99 0.00 0.00 0.00 -0.47 -0.99 119.26 120.56 2ksy h ALA 217 Ca 0.22 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2ksy h ALA 217 Cb 0.83 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2ksy h ALA 217 CO -0.01 0.49 -0.40 1.15 0.00 0.00 0.00 179.25 180.48 2ksy h THR 218 N 1.07 1.26 0.12 0.00 2.02 -0.43 -1.53 112.91 115.42 2ksy h THR 218 Ca 0.28 -1.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.06 2ksy h THR 218 Cb 0.01 1.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 2ksy h THR 218 CO -0.05 0.39 -0.06 -0.07 0.37 0.00 0.00 175.52 176.11 2ksy h LEU 219 N 0.00 -0.14 -1.12 2.58 -0.00 -0.63 -1.45 115.31 114.55 2ksy h LEU 219 Ca -0.00 -0.28 0.00 0.00 -0.00 0.00 0.00 57.88 57.60 2ksy h LEU 219 Cb 0.72 0.04 0.00 0.00 -0.00 0.00 0.00 40.66 41.42 2ksy h LEU 219 CO 0.05 0.21 0.00 0.08 -0.00 0.00 0.00 178.44 178.79 2ksy h ARG 220 N -0.50 0.00 0.02 1.13 -0.00 -1.22 -2.09 114.38 111.72 2ksy h ARG 220 Ca -0.02 0.00 -0.21 0.00 -0.00 0.00 0.00 59.98 59.75 2ksy h ARG 220 Cb 0.40 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.36 2ksy h ARG 220 CO 0.03 0.00 -0.95 0.00 -0.00 0.00 0.00 179.97 179.05 2ksy h ALA 221 N 2.07 0.43 -0.01 0.08 0.00 -1.04 -3.15 119.26 117.64 2ksy h ALA 221 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.14 2ksy h ALA 221 Cb 0.54 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2ksy h ALA 221 CO 0.00 0.96 -0.29 -0.85 0.00 0.00 0.00 179.25 179.07 2ksy n GLU 222 N -3.60 0.87 -0.97 0.00 0.28 -0.57 -4.99 120.64 111.66 2ksy n GLU 222 Ca -0.04 -0.55 -0.31 0.00 -0.16 0.00 0.00 57.16 56.11 2ksy n GLU 222 Cb 0.86 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 32.24 2ksy n GLU 222 CO 0.00 0.00 0.00 -2.39 -0.16 0.00 0.00 177.13 174.58 2ksy n HIS 223 N -0.59 -1.75 0.00 -1.84 1.44 -0.81 -4.89 115.22 106.78 2ksy n HIS 223 Ca 0.12 0.44 0.00 0.00 -2.01 0.00 0.00 57.72 56.26 2ksy n HIS 223 Cb 0.36 -1.32 0.00 0.00 0.12 0.00 0.00 29.99 29.15 2ksy n HIS 223 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2ksy n GLY 224 N 1.79 0.00 3.76 -1.39 0.00 -1.26 -5.08 105.19 103.01 2ksy n GLY 224 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2ksy n GLY 224 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ksy s GLU 225 N 0.00 4.74 1.52 1.61 8.01 -1.26 -4.90 118.70 128.42 2ksy s GLU 225 Ca 0.00 1.35 0.00 0.00 0.01 0.00 0.00 54.97 56.33 2ksy s GLU 225 Cb 0.00 -3.28 0.00 0.00 -4.31 0.00 0.00 34.13 26.54 2ksy s GLU 225 CO 0.00 0.53 0.00 0.43 0.01 0.00 0.00 175.26 176.23 2ksy n SER 226 N 1.57 -5.73 -4.56 -0.19 7.64 -1.26 -4.40 113.62 106.69 2ksy n SER 226 Ca -0.03 0.24 -0.42 0.00 1.01 0.00 0.00 58.87 59.67 2ksy n SER 226 Cb 0.48 -0.68 -0.03 0.00 -1.01 0.00 0.00 64.21 62.97 2ksy n SER 226 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2ksy s LEU 227 N 0.00 3.37 -0.41 -3.43 2.96 -1.26 -4.92 118.68 115.00 2ksy s LEU 227 Ca 0.00 -0.17 0.04 0.00 -0.22 0.00 0.00 54.13 53.78 2ksy s LEU 227 Cb 0.00 -2.88 0.17 0.00 0.50 0.00 0.00 46.19 43.97 2ksy s LEU 227 CO 0.00 -1.62 0.36 0.00 -1.32 0.00 0.00 176.35 173.77 2ksy s ALA 228 N 5.23 0.78 -0.27 5.97 0.00 -1.26 -5.11 121.76 127.10 2ksy s ALA 228 Ca 0.39 -2.01 -0.22 0.00 0.00 0.00 0.00 51.96 50.11 2ksy s ALA 228 Cb -0.08 -1.75 0.08 0.00 0.00 0.00 0.00 23.12 21.37 2ksy s ALA 228 CO 0.20 -2.04 0.73 0.20 0.00 0.00 0.00 175.76 174.86 2ksy s GLY 229 N 0.44 -0.54 0.11 0.00 0.00 -1.26 -5.03 107.32 101.03 2ksy s GLY 229 Ca 0.29 2.20 -0.30 0.00 0.00 0.00 0.00 44.72 46.90 2ksy s GLY 229 CO -0.13 1.96 0.96 0.14 0.00 0.00 0.00 173.10 176.03 2ksy s VAL 230 N 0.76 4.51 -0.73 1.40 1.01 -1.26 -4.99 120.40 121.10 2ksy s VAL 230 Ca -0.03 2.06 -0.24 0.00 0.00 0.00 0.00 61.98 63.77 2ksy s VAL 230 Cb -0.05 -4.32 0.06 0.00 0.00 0.00 0.00 36.38 32.07 2ksy s VAL 230 CO -0.06 0.32 1.12 -1.81 0.00 0.00 0.00 175.10 174.66 2ksy s ASP 231 N 0.01 6.22 0.04 3.32 1.01 -1.26 -4.98 116.67 121.02 2ksy s ASP 231 Ca 0.47 -0.90 0.01 0.00 0.71 0.00 0.00 52.55 52.84 2ksy s ASP 231 Cb -0.23 -2.48 -0.03 0.00 1.01 0.00 0.00 42.92 41.20 2ksy s ASP 231 CO 0.30 -1.56 -0.05 0.28 0.21 0.00 0.00 175.17 174.35 2ksy s THR 232 N 4.62 0.31 -0.60 -1.27 -1.32 -1.26 -5.04 115.64 111.08 2ksy s THR 232 Ca 0.29 -1.14 0.22 0.00 -1.21 0.00 0.00 61.69 59.84 2ksy s THR 232 Cb -0.12 -0.62 -0.22 0.00 -1.51 0.00 0.00 72.50 70.03 2ksy s THR 232 CO 0.09 -0.55 0.82 0.47 -2.21 0.00 0.00 174.62 173.25 2ksy n ASP 233 N 1.26 0.59 -3.73 8.08 9.92 -1.26 -4.77 116.55 126.64 2ksy n ASP 233 Ca -0.22 -0.46 -0.30 0.00 -0.53 0.00 0.00 54.79 53.29 2ksy n ASP 233 Cb 0.56 1.21 -0.15 0.00 -0.64 0.00 0.00 41.12 42.11 2ksy n ASP 233 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2ksy s THR 234 N -3.21 0.94 0.63 -3.53 -4.23 -1.26 -4.98 115.64 100.00 2ksy s THR 234 Ca 0.02 -1.56 0.43 0.00 -1.18 0.00 0.00 61.69 59.41 2ksy s THR 234 Cb 0.15 -1.71 0.44 0.00 1.34 0.00 0.00 72.50 72.72 2ksy s THR 234 CO 0.86 -0.71 2.35 -0.65 -0.54 0.00 0.00 174.62 175.93 2ksy h PRO 235 N 7.90 0.00 -6.65 3.99 0.11 -2.02 -3.43 132.00 131.90 2ksy h PRO 235 Ca -0.11 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.47 2ksy h PRO 235 Cb 1.00 0.00 0.05 0.00 0.11 0.00 0.00 31.00 32.17 2ksy h PRO 235 CO 0.47 0.00 0.94 0.00 -0.21 0.00 0.00 178.00 179.20 2ksy s ALA 236 N -4.17 3.85 0.01 -0.75 0.00 -1.26 -4.99 121.76 114.46 2ksy s ALA 236 Ca -0.05 1.48 -0.16 0.00 0.00 0.00 0.00 51.96 53.23 2ksy s ALA 236 Cb 0.13 -3.66 -0.06 0.00 0.00 0.00 0.00 23.12 19.53 2ksy s ALA 236 CO 0.43 -0.86 0.46 0.08 0.00 0.00 0.00 175.76 175.87 2ksy s VAL 237 N 1.05 4.95 0.01 0.00 1.01 -1.26 -4.95 120.40 121.21 2ksy s VAL 237 Ca 0.71 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.66 2ksy s VAL 237 Cb -0.47 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.14 2ksy s VAL 237 CO 0.33 0.55 0.00 0.00 0.00 0.00 0.00 175.10 175.98 2ksy n ALA 238 N 1.94 -0.13 -3.71 5.51 0.00 -1.26 -4.75 120.51 118.10 2ksy n ALA 238 Ca -0.12 0.02 -0.33 0.00 0.00 0.00 0.00 53.44 53.00 2ksy n ALA 238 Cb 0.52 -0.05 -0.16 0.00 0.00 0.00 0.00 19.45 19.76 2ksy n ALA 238 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ksy s ASP 239 N -4.10 3.30 -0.21 0.00 1.11 -1.26 -4.99 116.67 110.54 2ksy s ASP 239 Ca 0.00 -0.57 0.05 0.00 0.18 0.00 0.00 52.55 52.21 2ksy s ASP 239 Cb 0.00 -1.50 -0.16 0.00 1.07 0.00 0.00 42.92 42.33 2ksy s ASP 239 CO 0.00 0.06 -0.13 0.18 1.18 0.00 0.00 175.17 176.46 2ksy n LEU 240 N 4.23 2.23 -1.25 1.23 4.32 -1.26 -5.12 117.00 121.38 2ksy n LEU 240 Ca -0.20 -0.09 0.00 0.00 -0.02 0.00 0.00 56.01 55.70 2ksy n LEU 240 Cb 0.51 -0.47 0.00 0.00 -1.62 0.00 0.00 43.42 41.84 2ksy n LEU 240 CO 0.27 0.76 -0.37 -0.62 -1.22 0.00 0.00 177.39 176.21 2ksy n GLU 241 N -3.01 -3.47 -4.09 3.23 -0.58 -1.26 -5.05 120.64 106.41 2ksy n GLU 241 Ca -0.36 2.63 -0.13 0.00 -0.42 0.00 0.00 57.16 58.87 2ksy n GLU 241 Cb 0.95 -3.08 -0.11 0.00 -0.57 0.00 0.00 31.44 28.63 2ksy n GLU 241 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 2ksy s HIS 242 N -3.95 0.77 0.01 -0.32 3.76 -1.26 -5.05 115.29 109.24 2ksy s HIS 242 Ca 0.00 -0.56 0.00 0.00 -0.15 0.00 0.00 55.06 54.35 2ksy s HIS 242 Cb 0.00 -0.45 0.00 0.00 1.11 0.00 0.00 32.58 33.24 2ksy s HIS 242 CO 0.00 -0.08 0.00 1.58 -0.85 0.00 0.00 174.74 175.39 2ksy n HIS 243 N 1.21 -0.41 -3.28 1.40 -0.00 -1.26 -5.06 115.22 107.81 2ksy n HIS 243 Ca -0.21 0.02 -0.42 0.00 0.46 0.00 0.00 57.72 57.57 2ksy n HIS 243 Cb 0.55 0.52 -0.08 0.00 -0.12 0.00 0.00 29.99 30.86 2ksy n HIS 243 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2ksy s HIS 244 N -2.00 3.18 -0.39 1.57 5.65 -1.26 -5.04 115.29 117.00 2ksy s HIS 244 Ca 0.00 0.01 -0.23 0.00 0.25 0.00 0.00 55.06 55.09 2ksy s HIS 244 Cb 0.00 -2.89 0.01 0.00 -1.18 0.00 0.00 32.58 28.52 2ksy s HIS 244 CO 0.00 -0.57 0.76 -1.58 -0.65 0.00 0.00 174.74 172.70 2ksy s HIS 245 N 2.29 3.08 0.01 3.88 2.46 -1.26 -5.04 115.29 120.72 2ksy s HIS 245 Ca 0.16 0.41 -0.14 0.00 0.47 0.00 0.00 55.06 55.96 2ksy s HIS 245 Cb -0.16 -3.43 -0.06 0.00 -0.13 0.00 0.00 32.58 28.80 2ksy s HIS 245 CO 0.13 -0.79 0.41 -1.58 -2.47 0.00 0.00 174.74 170.45 2ksy s HIS 246 N 3.09 3.71 0.00 3.88 5.04 -1.26 -5.33 115.29 124.43 2ksy s HIS 246 Ca 0.30 0.98 0.00 0.00 -1.54 0.00 0.00 55.06 54.80 2ksy s HIS 246 Cb -0.13 -2.28 0.00 0.00 0.04 0.00 0.00 32.58 30.21 2ksy s HIS 246 CO 0.18 0.63 0.35 1.58 -2.34 0.00 0.00 174.74 175.14