#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 0.00 0.03 2.03 0.31 -1.26 -4.38 118.33 115.06 2ksy n VAL 2 Ca 0.00 -0.16 -0.20 0.00 -0.01 0.00 0.00 64.34 63.96 2ksy n VAL 2 Cb 0.00 1.07 -0.14 0.00 -0.91 0.00 0.00 33.84 33.86 2ksy n VAL 2 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2ksy h GLY 3 N 4.07 0.32 1.31 2.92 0.00 -2.02 -3.35 103.07 106.32 2ksy h GLY 3 Ca 0.00 -0.83 -0.06 0.00 0.00 0.00 0.00 47.33 46.44 2ksy h GLY 3 CO 0.00 0.72 0.10 1.41 0.00 0.00 0.00 176.54 178.77 2ksy h LEU 4 N 0.08 0.81 -1.27 3.11 3.38 -2.00 -2.82 115.31 116.60 2ksy h LEU 4 Ca -0.37 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.45 2ksy h LEU 4 Cb 2.05 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 42.55 2ksy h LEU 4 CO 0.12 0.82 0.49 0.71 0.09 0.00 0.00 178.44 180.68 2ksy h THR 5 N 0.82 1.18 -0.87 0.22 1.35 -1.76 -2.35 112.91 111.49 2ksy h THR 5 Ca 0.17 -0.34 0.14 0.00 -0.55 0.00 0.00 66.41 65.83 2ksy h THR 5 Cb 0.35 0.10 -0.07 0.00 -1.73 0.00 0.00 68.15 66.80 2ksy h THR 5 CO 0.00 0.18 0.56 0.71 -0.25 0.00 0.00 175.52 176.73 2ksy h THR 6 N 1.00 0.84 0.28 6.82 1.35 -1.63 -1.75 112.91 119.82 2ksy h THR 6 Ca 0.28 -0.23 -0.01 0.00 -0.55 0.00 0.00 66.41 65.89 2ksy h THR 6 Cb -0.09 0.11 0.00 0.00 -1.73 0.00 0.00 68.15 66.44 2ksy h THR 6 CO -0.06 0.12 -0.14 -0.07 -0.25 0.00 0.00 175.52 175.12 2ksy h LEU 7 N 0.67 -0.32 -2.04 3.87 -0.00 -1.53 -2.01 115.31 113.95 2ksy h LEU 7 Ca 0.43 -0.05 -0.02 0.00 -0.00 0.00 0.00 57.88 58.24 2ksy h LEU 7 Cb 0.71 0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 41.45 2ksy h LEU 7 CO -0.19 -0.15 -0.07 -0.26 -0.00 0.00 0.00 178.44 177.77 2ksy h PHE 8 N -0.47 0.00 -0.22 1.13 0.04 -1.47 -1.40 116.94 114.54 2ksy h PHE 8 Ca -0.04 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.65 2ksy h PHE 8 Cb 0.36 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.50 2ksy h PHE 8 CO -0.03 0.07 -0.20 -1.49 -0.60 0.00 0.00 178.31 176.06 2ksy h TRP 9 N 0.00 0.61 -0.46 -0.55 -0.00 -0.99 -1.61 115.95 112.96 2ksy h TRP 9 Ca -0.00 -0.18 -0.08 0.00 -0.00 0.00 0.00 58.89 58.63 2ksy h TRP 9 Cb 0.16 -0.13 -0.02 0.00 -0.00 0.00 0.00 29.16 29.17 2ksy h TRP 9 CO 0.00 0.85 -0.05 -0.07 -0.00 0.00 0.00 178.44 179.18 2ksy h LEU 10 N 0.20 0.76 -1.17 -4.49 3.38 -0.79 -2.47 115.31 110.74 2ksy h LEU 10 Ca 0.04 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 2ksy h LEU 10 Cb 0.74 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2ksy h LEU 10 CO 0.05 0.86 -0.22 1.23 0.09 0.00 0.00 178.44 180.45 2ksy h GLY 11 N 0.97 0.34 1.35 0.83 0.00 -1.17 -2.59 103.07 102.80 2ksy h GLY 11 Ca 0.13 -0.25 -0.12 0.00 0.00 0.00 0.00 47.33 47.09 2ksy h GLY 11 CO 0.03 0.23 -0.29 0.00 0.00 0.00 0.00 176.54 176.51 2ksy h ALA 12 N 1.49 0.84 0.33 3.60 0.00 -0.86 -2.28 119.26 122.39 2ksy h ALA 12 Ca 0.05 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 2ksy h ALA 12 Cb 0.55 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2ksy h ALA 12 CO 0.04 0.64 -0.18 0.82 0.00 0.00 0.00 179.25 180.56 2ksy h ILE 13 N 0.62 0.63 -0.57 0.00 2.04 -1.08 -0.33 117.51 118.81 2ksy h ILE 13 Ca 0.07 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.98 2ksy h ILE 13 Cb 0.81 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 2ksy h ILE 13 CO 0.07 0.00 0.38 1.23 0.00 0.00 0.00 178.15 179.83 2ksy h GLY 14 N -0.48 0.71 1.04 5.37 0.00 -1.47 -1.61 103.07 106.64 2ksy h GLY 14 Ca -0.04 -0.24 -0.09 0.00 0.00 0.00 0.00 47.33 46.97 2ksy h GLY 14 CO 0.05 0.19 0.00 -0.33 0.00 0.00 0.00 176.54 176.46 2ksy h MET 15 N 0.60 0.96 -0.94 4.80 2.86 -0.92 -2.70 114.93 119.58 2ksy h MET 15 Ca 0.24 -0.30 0.07 0.00 -2.06 0.00 0.00 59.70 57.65 2ksy h MET 15 Cb 0.20 -0.09 -0.07 0.00 0.06 0.00 0.00 31.60 31.70 2ksy h MET 15 CO -0.07 0.96 0.60 1.25 1.06 0.00 0.00 176.91 180.72 2ksy h LEU 16 N 0.83 0.95 -0.11 1.22 7.12 -0.09 0.13 115.31 125.36 2ksy h LEU 16 Ca 0.15 0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.18 2ksy h LEU 16 Cb 0.53 -0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 40.47 2ksy h LEU 16 CO 0.03 0.60 0.07 0.58 -0.13 0.00 0.00 178.44 179.59 2ksy h VAL 17 N 1.08 1.04 -0.12 1.05 2.07 -1.19 -2.10 116.25 118.08 2ksy h VAL 17 Ca 0.41 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.84 2ksy h VAL 17 Cb 0.19 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 2ksy h VAL 17 CO -0.18 0.04 0.04 1.23 0.02 0.00 0.00 177.57 178.72 2ksy h GLY 18 N 0.14 0.19 0.02 2.17 0.00 -1.08 -1.94 103.07 102.57 2ksy h GLY 18 Ca 0.04 -0.10 0.18 0.00 0.00 0.00 0.00 47.33 47.44 2ksy h GLY 18 CO -0.01 0.10 0.37 -0.84 0.00 0.00 0.00 176.54 176.16 2ksy h THR 19 N 0.03 0.60 -0.16 4.70 2.02 -0.64 0.26 112.91 119.72 2ksy h THR 19 Ca 0.04 -0.16 -0.11 0.00 0.77 0.00 0.00 66.41 66.95 2ksy h THR 19 Cb 0.18 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.67 2ksy h THR 19 CO -0.00 0.09 -0.32 -0.07 0.37 0.00 0.00 175.52 175.58 2ksy h LEU 20 N 0.47 0.55 -1.70 2.58 3.38 -1.25 0.14 115.31 119.48 2ksy h LEU 20 Ca 0.49 -0.56 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2ksy h LEU 20 Cb 0.81 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 2ksy h LEU 20 CO -0.45 1.01 0.02 0.00 0.09 0.00 0.00 178.44 179.11 2ksy h ALA 21 N 0.56 1.76 0.06 1.53 0.00 -0.48 -1.13 119.26 121.57 2ksy h ALA 21 Ca 0.00 -0.08 -0.34 0.00 0.00 0.00 0.00 54.91 54.50 2ksy h ALA 21 Cb 0.92 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2ksy h ALA 21 CO 0.07 0.19 -1.91 1.19 0.00 0.00 0.00 179.25 178.79 2ksy n PHE 22 N -4.43 1.06 0.05 0.00 3.72 -0.02 -3.44 117.46 114.40 2ksy n PHE 22 Ca -0.01 0.29 -0.13 0.00 -0.05 0.00 0.00 57.45 57.55 2ksy n PHE 22 Cb 0.14 -1.16 -0.09 0.00 -0.94 0.00 0.00 39.48 37.43 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 0.50 -0.12 0.06 4.37 0.00 -0.54 0.26 119.26 123.80 2ksy h ALA 23 Ca -0.38 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.36 2ksy h ALA 23 Cb 2.03 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.86 2ksy h ALA 23 CO 0.08 -0.39 -0.03 2.35 0.00 0.00 0.00 179.25 181.25 2ksy h TRP 24 N -0.46 -0.07 0.00 0.00 2.91 -1.41 -1.87 115.95 115.05 2ksy h TRP 24 Ca -0.01 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.01 2ksy h TRP 24 Cb 0.39 0.02 0.00 0.00 -0.51 0.00 0.00 29.16 29.06 2ksy h TRP 24 CO 0.04 0.09 0.00 0.00 -1.03 0.00 0.00 178.44 177.54 2ksy h ALA 25 N 0.71 1.00 -0.03 2.65 0.00 -1.62 -3.11 119.26 118.86 2ksy h ALA 25 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2ksy h ALA 25 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2ksy h ALA 25 CO 0.01 0.00 -0.14 0.78 0.00 0.00 0.00 179.25 179.91 2ksy h GLY 26 N 1.79 0.16 2.00 0.00 0.00 0.07 -3.12 103.07 103.97 2ksy h GLY 26 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.11 2ksy h GLY 26 CO 0.00 0.20 0.00 3.21 0.00 0.00 0.00 176.54 179.95 2ksy h ARG 27 N -0.45 0.00 -4.25 4.80 3.08 -1.28 -3.34 114.38 112.93 2ksy h ARG 27 Ca -0.01 0.00 -0.71 0.00 0.07 0.00 0.00 59.98 59.33 2ksy h ARG 27 Cb 0.80 0.00 -0.32 0.00 0.08 0.00 0.00 29.97 30.53 2ksy h ARG 27 CO 0.03 0.00 -0.42 0.34 -1.07 0.00 0.00 179.97 178.85 2ksy s ASP 28 N -4.88 5.54 0.22 7.04 2.15 -1.18 -5.03 116.67 120.53 2ksy s ASP 28 Ca -0.04 -2.10 -0.19 0.00 0.43 0.00 0.00 52.55 50.65 2ksy s ASP 28 Cb 0.11 -1.94 0.07 0.00 -0.30 0.00 0.00 42.92 40.86 2ksy s ASP 28 CO 0.36 -0.60 0.92 0.00 -0.17 0.00 0.00 175.17 175.68 2ksy n ALA 29 N 4.59 -2.32 -1.00 3.66 0.00 -1.26 -4.87 120.51 119.32 2ksy n ALA 29 Ca -0.03 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.38 2ksy n ALA 29 Cb 0.41 0.65 0.00 0.00 0.00 0.00 0.00 19.45 20.50 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 -0.64 -0.47 0.00 0.00 0.00 -1.26 -5.00 105.19 97.81 2ksy n GLY 30 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2ksy n GLY 30 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ksy n SER 31 N 0.00 0.00 -0.04 1.61 2.88 -1.26 -4.94 113.62 111.87 2ksy n SER 31 Ca 0.00 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.32 2ksy n SER 31 Cb 0.00 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.33 2ksy n SER 31 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ksy n GLY 32 N -0.25 -0.64 0.31 0.46 0.00 -1.26 -4.10 105.19 99.71 2ksy n GLY 32 Ca 0.00 -0.13 0.20 0.00 0.00 0.00 0.00 46.02 46.08 2ksy n GLY 32 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ksy h GLU 33 N -0.35 0.00 -1.00 1.61 5.08 -1.97 -2.73 114.58 115.23 2ksy h GLU 33 Ca -0.42 0.00 0.22 0.00 -1.00 0.00 0.00 59.36 58.16 2ksy h GLU 33 Cb 1.76 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.91 2ksy h GLU 33 CO -0.04 0.02 0.62 -0.09 -1.00 0.00 0.00 179.01 178.51 2ksy h ARG 34 N 0.00 0.57 -0.37 2.33 1.12 -1.89 0.17 114.38 116.30 2ksy h ARG 34 Ca -0.00 -0.03 -0.04 0.00 -1.11 0.00 0.00 59.98 58.80 2ksy h ARG 34 Cb 0.17 -0.13 -0.02 0.00 -0.01 0.00 0.00 29.97 29.98 2ksy h ARG 34 CO 0.00 0.38 0.09 0.00 -3.11 0.00 0.00 179.97 177.33 2ksy h ARG 35 N 0.59 0.59 -0.06 0.20 2.47 -1.73 -1.56 114.38 114.87 2ksy h ARG 35 Ca 0.57 -0.14 -0.08 0.00 -1.26 0.00 0.00 59.98 59.08 2ksy h ARG 35 Cb 1.14 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 29.37 2ksy h ARG 35 CO -0.34 0.63 -0.31 1.88 0.56 0.00 0.00 179.97 182.39 2ksy h TYR 36 N 0.45 0.12 0.11 3.04 -1.99 -1.21 -2.33 116.97 115.16 2ksy h TYR 36 Ca 0.12 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.82 2ksy h TYR 36 Cb 0.30 -0.03 0.00 0.00 2.00 0.00 0.00 36.73 39.00 2ksy h TYR 36 CO 0.02 0.42 -0.05 1.88 -0.00 0.00 0.00 178.16 180.42 2ksy h TYR 37 N 0.10 -0.13 -0.78 4.88 0.05 -0.84 -2.17 116.97 118.07 2ksy h TYR 37 Ca 0.01 -0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.87 2ksy h TYR 37 Cb 0.60 0.04 -0.05 0.00 1.01 0.00 0.00 36.73 38.34 2ksy h TYR 37 CO 0.00 0.34 0.51 0.28 -1.05 0.00 0.00 178.16 178.24 2ksy h VAL 38 N -0.69 1.00 0.03 -2.88 2.07 -1.26 0.50 116.25 115.01 2ksy h VAL 38 Ca -0.01 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 2ksy h VAL 38 Cb 0.53 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2ksy h VAL 38 CO 0.02 0.15 -0.01 0.74 0.02 0.00 0.00 177.57 178.49 2ksy h THR 39 N 0.80 1.05 -0.44 2.57 2.02 -1.40 0.93 112.91 118.45 2ksy h THR 39 Ca 0.35 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 67.25 2ksy h THR 39 Cb 0.31 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 2ksy h THR 39 CO -0.13 0.07 0.18 0.25 0.37 0.00 0.00 175.52 176.26 2ksy h LEU 40 N -0.15 0.59 -1.37 2.58 5.85 -0.70 -2.33 115.31 119.78 2ksy h LEU 40 Ca -0.00 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 2ksy h LEU 40 Cb 0.14 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2ksy h LEU 40 CO 0.01 0.59 0.07 0.58 -0.34 0.00 0.00 178.44 179.35 2ksy h VAL 41 N 0.56 1.16 -0.02 1.05 2.07 -0.84 -2.88 116.25 117.35 2ksy h VAL 41 Ca 0.15 -0.59 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 2ksy h VAL 41 Cb 0.18 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2ksy h VAL 41 CO -0.01 0.21 0.01 1.23 0.02 0.00 0.00 177.57 179.03 2ksy h GLY 42 N 0.73 0.03 0.90 2.17 0.00 -0.27 -1.81 103.07 104.83 2ksy h GLY 42 Ca 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.43 2ksy h GLY 42 CO -0.00 0.01 0.04 0.16 0.00 0.00 0.00 176.54 176.76 2ksy h ILE 43 N -0.01 1.11 -0.05 2.60 3.07 -1.31 -0.58 117.51 122.34 2ksy h ILE 43 Ca 0.01 -0.32 0.01 0.00 1.55 0.00 0.00 64.86 66.11 2ksy h ILE 43 Cb 0.04 1.15 -0.00 0.00 -0.27 0.00 0.00 36.82 37.74 2ksy h ILE 43 CO -0.00 0.10 0.03 0.77 -1.05 0.00 0.00 178.15 178.00 2ksy h SER 44 N 0.03 0.00 0.05 2.16 4.64 -1.50 -1.84 113.55 117.10 2ksy h SER 44 Ca 0.03 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2ksy h SER 44 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2ksy h SER 44 CO -0.00 0.00 -0.03 1.23 -0.87 0.00 0.00 176.83 177.16 2ksy h GLY 45 N 0.00 -0.08 1.16 -0.77 0.00 -0.85 -2.62 103.07 99.90 2ksy h GLY 45 Ca 0.02 0.03 0.05 0.00 0.00 0.00 0.00 47.33 47.43 2ksy h GLY 45 CO -0.00 -0.03 0.46 0.16 0.00 0.00 0.00 176.54 177.13 2ksy h ILE 46 N -0.96 1.07 -0.33 2.60 3.07 -1.02 -1.66 117.51 120.27 2ksy h ILE 46 Ca -0.01 -0.27 -0.09 0.00 1.55 0.00 0.00 64.86 66.04 2ksy h ILE 46 Cb 0.54 0.21 -0.01 0.00 -0.27 0.00 0.00 36.82 37.29 2ksy h ILE 46 CO 0.01 0.14 -0.16 0.00 -1.05 0.00 0.00 178.15 177.10 2ksy h ALA 47 N 1.61 0.47 -0.91 0.16 0.00 -1.45 -2.51 119.26 116.63 2ksy h ALA 47 Ca 0.28 -0.34 0.11 0.00 0.00 0.00 0.00 54.91 54.97 2ksy h ALA 47 Cb 0.14 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.75 2ksy h ALA 47 CO -0.09 0.38 0.59 0.00 0.00 0.00 0.00 179.25 180.13 2ksy h ALA 48 N 0.78 1.67 0.02 0.00 0.00 -0.92 -1.47 119.26 119.34 2ksy h ALA 48 Ca 0.07 0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.77 2ksy h ALA 48 Cb 0.69 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 2ksy h ALA 48 CO 0.05 0.12 -0.96 -0.39 0.00 0.00 0.00 179.25 178.07 2ksy h VAL 49 N 0.85 1.46 -0.66 0.00 -1.51 -1.37 -2.65 116.25 112.37 2ksy h VAL 49 Ca 0.44 -2.62 -0.05 0.00 -1.23 0.00 0.00 66.70 63.24 2ksy h VAL 49 Cb 0.52 2.52 -0.03 0.00 -2.13 0.00 0.00 31.29 32.16 2ksy h VAL 49 CO -0.20 0.77 0.20 0.00 -1.23 0.00 0.00 177.57 177.11 2ksy h ALA 50 N 0.82 1.12 -0.16 5.19 0.00 -0.85 -0.81 119.26 124.58 2ksy h ALA 50 Ca -0.07 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.48 2ksy h ALA 50 Cb 1.61 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2ksy h ALA 50 CO 0.16 0.60 -0.51 1.88 0.00 0.00 0.00 179.25 181.38 2ksy h TYR 51 N 0.97 0.81 0.35 0.00 0.05 -1.35 -1.84 116.97 115.95 2ksy h TYR 51 Ca 0.21 -0.33 -0.02 0.00 0.05 0.00 0.00 58.73 58.65 2ksy h TYR 51 Cb 0.27 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 37.88 2ksy h TYR 51 CO 0.02 1.11 -0.17 0.00 -1.05 0.00 0.00 178.16 178.07 2ksy h ALA 52 N 0.54 -0.48 -0.13 3.88 0.00 -1.27 0.22 119.26 122.02 2ksy h ALA 52 Ca -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2ksy h ALA 52 Cb 1.13 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 2ksy h ALA 52 CO 0.11 -0.77 0.09 -0.39 0.00 0.00 0.00 179.25 178.29 2ksy h VAL 53 N -0.48 1.04 0.00 0.00 -1.51 -1.22 -1.45 116.25 112.63 2ksy h VAL 53 Ca -0.05 -0.09 -0.01 0.00 -1.23 0.00 0.00 66.70 65.33 2ksy h VAL 53 Cb 0.37 0.86 -0.00 0.00 -2.13 0.00 0.00 31.29 30.39 2ksy h VAL 53 CO 0.08 0.04 -0.03 -0.03 -1.23 0.00 0.00 177.57 176.40 2ksy h MET 54 N 0.17 0.00 0.00 5.19 -1.53 -1.24 0.28 114.93 117.80 2ksy h MET 54 Ca 0.05 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.31 2ksy h MET 54 Cb -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.04 2ksy h MET 54 CO -0.01 0.03 0.00 0.00 0.14 0.00 0.00 176.91 177.07 2ksy h ALA 55 N 1.97 1.00 -0.01 0.39 0.00 0.44 -2.98 119.26 120.06 2ksy h ALA 55 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ksy h ALA 55 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2ksy h ALA 55 CO 0.00 0.00 -0.04 1.28 0.00 0.00 0.00 179.25 180.50 2ksy n LEU 56 N -2.97 1.29 0.00 0.00 4.77 0.08 -4.75 117.00 115.42 2ksy n LEU 56 Ca 0.03 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.59 2ksy n LEU 56 Cb 0.42 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2ksy n LEU 56 CO 0.30 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 2ksy n GLY 57 N 1.19 3.37 3.78 -0.72 0.00 -1.13 -5.06 105.19 106.63 2ksy n GLY 57 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2ksy n GLY 57 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ksy s VAL 58 N -2.99 3.50 0.00 1.61 -7.23 -1.18 -3.50 120.40 110.60 2ksy s VAL 58 Ca 0.00 1.08 0.00 0.00 -1.81 0.00 0.00 61.98 61.25 2ksy s VAL 58 Cb 0.00 -3.52 0.00 0.00 0.56 0.00 0.00 36.38 33.42 2ksy s VAL 58 CO 0.00 -0.07 0.00 0.61 -0.31 0.00 0.00 175.10 175.33 2ksy n GLY 59 N 0.23 0.75 3.26 2.32 0.00 -1.26 -3.82 105.19 106.67 2ksy n GLY 59 Ca 0.07 -0.19 -0.44 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.00 3.39 -0.31 1.61 0.52 -1.23 -0.98 118.94 119.94 2ksy s TRP 60 Ca 0.00 -1.68 -0.19 0.00 0.02 0.00 0.00 56.10 54.25 2ksy s TRP 60 Cb 0.00 -3.65 -0.01 0.00 -1.15 0.00 0.00 33.47 28.66 2ksy s TRP 60 CO 0.00 -1.00 0.59 0.08 0.02 0.00 0.00 176.95 176.64 2ksy s VAL 61 N 1.26 4.97 0.20 4.03 1.01 0.22 -4.97 120.40 127.12 2ksy s VAL 61 Ca 0.06 0.73 -0.30 0.00 0.00 0.00 0.00 61.98 62.47 2ksy s VAL 61 Cb -0.26 -3.97 -0.08 0.00 0.00 0.00 0.00 36.38 32.07 2ksy s VAL 61 CO -0.00 -0.14 1.18 -2.16 0.00 0.00 0.00 175.10 173.98 2ksy s PRO 62 N 2.53 4.52 -0.40 2.72 0.04 -1.26 -1.74 135.00 141.41 2ksy s PRO 62 Ca 0.23 1.86 0.01 0.00 0.04 0.00 0.00 61.00 63.14 2ksy s PRO 62 Cb -0.15 -3.23 0.14 0.00 0.04 0.00 0.00 34.50 31.30 2ksy s PRO 62 CO 0.12 -0.03 0.24 0.08 0.04 0.00 0.00 177.00 177.44 2ksy s VAL 63 N -0.25 0.74 0.00 -0.36 1.01 0.40 -4.94 120.40 117.01 2ksy s VAL 63 Ca 0.51 -2.18 0.00 0.00 0.00 0.00 0.00 61.98 60.31 2ksy s VAL 63 Cb -0.32 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.53 2ksy s VAL 63 CO 0.37 -0.97 0.00 0.00 0.00 0.00 0.00 175.10 174.51 2ksy n ALA 64 N 3.71 0.00 0.01 5.51 0.00 -1.26 0.25 120.51 128.73 2ksy n ALA 64 Ca 0.12 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.58 2ksy n ALA 64 Cb 0.37 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.79 2ksy n ALA 64 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ksy n GLU 65 N 0.00 0.54 -3.24 0.00 4.71 -1.26 -5.04 120.64 116.35 2ksy n GLU 65 Ca 0.00 -0.03 -0.20 0.00 -0.01 0.00 0.00 57.16 56.92 2ksy n GLU 65 Cb 0.00 -1.05 0.00 0.00 -1.01 0.00 0.00 31.44 29.38 2ksy n GLU 65 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2ksy s ARG 66 N -2.17 3.02 -0.05 3.49 0.52 0.14 -5.12 118.95 118.78 2ksy s ARG 66 Ca -0.01 -0.93 -0.00 0.00 -0.52 0.00 0.00 55.73 54.27 2ksy s ARG 66 Cb 0.02 -2.74 0.03 0.00 0.52 0.00 0.00 34.95 32.78 2ksy s ARG 66 CO 0.15 -0.11 0.00 0.99 0.02 0.00 0.00 175.30 176.35 2ksy s THR 67 N -2.32 0.26 0.03 0.02 2.01 -1.26 -0.45 115.64 113.93 2ksy s THR 67 Ca 0.48 0.10 0.03 0.00 0.31 0.00 0.00 61.69 62.62 2ksy s THR 67 Cb -0.10 -0.38 -0.04 0.00 0.01 0.00 0.00 72.50 72.00 2ksy s THR 67 CO 0.33 0.20 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.73 2ksy s VAL 68 N 1.41 3.86 -0.29 3.82 1.01 -0.71 -4.97 120.40 124.53 2ksy s VAL 68 Ca -0.04 -0.82 -0.07 0.00 0.00 0.00 0.00 61.98 61.05 2ksy s VAL 68 Cb -0.13 -2.74 0.01 0.00 0.00 0.00 0.00 36.38 33.51 2ksy s VAL 68 CO -0.03 0.29 0.08 -0.36 0.00 0.00 0.00 175.10 175.09 2ksy s PHE 69 N -1.12 3.14 0.24 5.22 0.08 -1.26 -0.61 117.98 123.67 2ksy s PHE 69 Ca 0.20 -0.94 -0.00 0.00 0.12 0.00 0.00 56.93 56.31 2ksy s PHE 69 Cb -0.11 -2.25 0.27 0.00 -0.57 0.00 0.00 43.02 40.35 2ksy s PHE 69 CO 0.12 -0.56 1.62 -0.24 -0.10 0.00 0.00 175.22 176.06 2ksy h VAL 70 N 5.84 1.29 0.00 -0.44 3.04 -1.44 -3.05 116.25 121.49 2ksy h VAL 70 Ca -0.32 -1.51 0.00 0.00 -1.01 0.00 0.00 66.70 63.86 2ksy h VAL 70 Cb 1.13 1.51 0.00 0.00 -2.01 0.00 0.00 31.29 31.92 2ksy h VAL 70 CO 0.60 0.47 0.00 1.55 -1.01 0.00 0.00 177.57 179.19 2ksy h PRO 71 N 0.45 0.00 0.09 4.17 0.13 -1.90 -2.19 132.00 132.75 2ksy h PRO 71 Ca 0.04 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.17 2ksy h PRO 71 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 2ksy h PRO 71 CO 0.07 0.00 -0.05 -0.09 -0.23 0.00 0.00 178.00 177.71 2ksy h ARG 72 N 0.00 -0.12 -0.09 0.86 2.43 -1.86 -2.31 114.38 113.28 2ksy h ARG 72 Ca 0.00 0.01 -0.19 0.00 -0.81 0.00 0.00 59.98 58.99 2ksy h ARG 72 Cb 0.48 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.05 2ksy h ARG 72 CO 0.00 0.36 -0.73 1.88 -1.51 0.00 0.00 179.97 179.97 2ksy h TYR 73 N -0.92 0.62 -0.34 2.20 0.05 -1.61 -2.69 116.97 114.29 2ksy h TYR 73 Ca -0.01 -0.27 -0.07 0.00 0.05 0.00 0.00 58.73 58.43 2ksy h TYR 73 Cb 0.53 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.17 2ksy h TYR 73 CO 0.11 1.03 -0.06 0.97 -1.05 0.00 0.00 178.16 179.16 2ksy h ILE 74 N 0.32 1.27 -0.62 -2.88 -0.00 -1.54 -2.14 117.51 111.92 2ksy h ILE 74 Ca -0.03 -1.10 0.02 0.00 -0.00 0.00 0.00 64.86 63.75 2ksy h ILE 74 Cb 1.31 1.30 -0.03 0.00 -0.00 0.00 0.00 36.82 39.39 2ksy h ILE 74 CO 0.13 0.36 0.41 -0.78 -0.00 0.00 0.00 178.15 178.27 2ksy h ASP 75 N 0.43 0.66 -0.43 2.19 3.58 -1.41 -0.45 116.42 120.99 2ksy h ASP 75 Ca 0.09 -0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.47 2ksy h ASP 75 Cb 0.55 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.42 2ksy h ASP 75 CO 0.03 0.47 0.09 -0.50 -2.88 0.00 0.00 179.24 176.44 2ksy h TRP 76 N 0.77 0.80 0.00 0.28 6.55 -1.12 0.12 115.95 123.35 2ksy h TRP 76 Ca 0.24 -0.08 -0.07 0.00 0.95 0.00 0.00 58.89 59.93 2ksy h TRP 76 Cb 0.02 -0.23 -0.01 0.00 -0.86 0.00 0.00 29.16 28.07 2ksy h TRP 76 CO -0.00 0.70 -0.33 0.82 -1.05 0.00 0.00 178.44 178.58 2ksy h ILE 77 N 0.74 1.13 0.00 1.49 2.04 -0.45 0.23 117.51 122.69 2ksy h ILE 77 Ca 0.16 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.86 2ksy h ILE 77 Cb 0.32 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 2ksy h ILE 77 CO 0.00 0.32 -0.83 0.18 0.00 0.00 0.00 178.15 177.82 2ksy n LEU 78 N -4.00 0.65 -0.09 1.44 4.77 -0.74 -4.30 117.00 114.74 2ksy n LEU 78 Ca -0.02 0.10 -0.18 0.00 -0.03 0.00 0.00 56.01 55.88 2ksy n LEU 78 Cb 0.38 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.27 2ksy n LEU 78 CO 0.37 -0.00 -1.01 0.35 -1.33 0.00 0.00 177.39 175.77 2ksy n THR 79 N -2.03 1.28 0.02 -5.08 -2.24 0.33 -4.47 114.28 102.09 2ksy n THR 79 Ca 0.03 -0.14 -0.11 0.00 -2.27 0.00 0.00 64.05 61.55 2ksy n THR 79 Cb 0.44 -1.92 -0.05 0.00 -2.10 0.00 0.00 70.33 66.70 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 -0.78 0.27 -0.17 4.28 2.02 -0.78 -0.30 112.91 117.44 2ksy h THR 80 Ca -0.37 0.00 0.05 0.00 0.77 0.00 0.00 66.41 66.86 2ksy h THR 80 Cb 1.25 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 2ksy h THR 80 CO -0.23 0.00 0.19 -0.65 0.37 0.00 0.00 175.52 175.20 2ksy h PRO 81 N -0.44 0.00 0.02 6.66 0.11 -1.75 0.36 132.00 136.97 2ksy h PRO 81 Ca 0.08 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.98 2ksy h PRO 81 Cb 0.56 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 2ksy h PRO 81 CO -0.33 0.00 -0.94 1.25 -0.21 0.00 0.00 178.00 177.77 2ksy h LEU 82 N 0.00 0.29 0.20 2.35 5.85 -1.32 -2.15 115.31 120.52 2ksy h LEU 82 Ca 0.08 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 2ksy h LEU 82 Cb 0.46 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.40 2ksy h LEU 82 CO -0.00 1.07 -0.09 0.40 -0.34 0.00 0.00 178.44 179.48 2ksy h ILE 83 N 0.11 0.90 -0.00 4.05 1.08 0.16 -0.73 117.51 123.07 2ksy h ILE 83 Ca -0.06 -0.59 -0.01 0.00 -0.39 0.00 0.00 64.86 63.81 2ksy h ILE 83 Cb 1.59 1.25 -0.00 0.00 -3.07 0.00 0.00 36.82 36.58 2ksy h ILE 83 CO 0.15 0.13 -0.07 -0.37 -0.69 0.00 0.00 178.15 177.30 2ksy h VAL 84 N -0.56 1.05 -0.03 1.67 -1.51 -1.55 0.63 116.25 115.95 2ksy h VAL 84 Ca -0.03 -0.24 -0.08 0.00 -1.23 0.00 0.00 66.70 65.11 2ksy h VAL 84 Cb 0.42 1.13 -0.01 0.00 -2.13 0.00 0.00 31.29 30.70 2ksy h VAL 84 CO 0.04 0.07 -0.37 0.22 -1.23 0.00 0.00 177.57 176.30 2ksy h TYR 85 N 0.00 0.07 -0.01 5.19 3.20 -1.07 -1.34 116.97 123.02 2ksy h TYR 85 Ca -0.00 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 2ksy h TYR 85 Cb 0.13 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 2ksy h TYR 85 CO 0.00 0.43 0.00 0.35 -1.64 0.00 0.00 178.16 177.31 2ksy h PHE 86 N 0.06 0.03 -0.06 -3.82 3.04 0.66 -1.34 116.94 115.51 2ksy h PHE 86 Ca 0.00 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.91 2ksy h PHE 86 Cb 0.69 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.18 2ksy h PHE 86 CO 0.00 0.27 -0.16 -0.07 -2.02 0.00 0.00 178.31 176.34 2ksy h LEU 87 N -0.23 0.09 -1.06 0.59 3.38 -1.33 -1.77 115.31 114.98 2ksy h LEU 87 Ca 0.00 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 2ksy h LEU 87 Cb 0.26 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2ksy h LEU 87 CO 0.00 0.26 -0.45 1.23 0.09 0.00 0.00 178.44 179.57 2ksy h GLY 88 N 0.62 0.00 1.27 0.83 0.00 -0.91 -2.78 103.07 102.10 2ksy h GLY 88 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.12 2ksy h GLY 88 CO 0.02 0.00 -0.83 1.41 0.00 0.00 0.00 176.54 177.14 2ksy h LEU 89 N 0.00 0.85 -1.13 3.11 3.38 -0.36 -0.49 115.31 120.66 2ksy h LEU 89 Ca -0.00 -0.58 -0.05 0.00 0.09 0.00 0.00 57.88 57.33 2ksy h LEU 89 Cb 0.84 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 2ksy h LEU 89 CO 0.06 1.38 0.08 -0.07 0.09 0.00 0.00 178.44 179.97 2ksy h LEU 90 N 0.46 0.64 0.00 1.67 3.38 -1.35 -3.25 115.31 116.86 2ksy h LEU 90 Ca -0.07 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 2ksy h LEU 90 Cb 1.46 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 42.04 2ksy h LEU 90 CO 0.16 0.66 -0.09 0.00 0.09 0.00 0.00 178.44 179.27 2ksy h ALA 91 N 1.42 0.01 0.00 1.53 0.00 -1.48 -3.44 119.26 117.30 2ksy h ALA 91 Ca 0.15 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2ksy h ALA 91 Cb 0.30 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2ksy h ALA 91 CO 0.00 0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.72 2ksy n GLY 92 N 1.67 0.86 3.94 0.00 0.00 -0.20 -4.35 105.19 107.11 2ksy n GLY 92 Ca -0.07 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.84 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 2.73 0.46 0.99 1.02 -1.21 -5.06 118.68 117.61 2ksy s LEU 93 Ca 0.00 0.22 0.04 0.00 0.02 0.00 0.00 54.13 54.41 2ksy s LEU 93 Cb 0.00 -2.25 0.01 0.00 0.02 0.00 0.00 46.19 43.97 2ksy s LEU 93 CO 0.00 -2.75 0.65 -1.81 0.02 0.00 0.00 176.35 172.46 2ksy s ASP 94 N -4.90 5.60 0.40 2.29 1.01 -1.26 -4.91 116.67 114.90 2ksy s ASP 94 Ca 0.74 -0.09 0.12 0.00 0.71 0.00 0.00 52.55 54.03 2ksy s ASP 94 Cb -0.04 -1.01 0.94 0.00 1.01 0.00 0.00 42.92 43.83 2ksy s ASP 94 CO 0.53 -0.84 1.93 0.28 0.21 0.00 0.00 175.17 177.28 2ksy h SER 95 N 0.42 0.49 0.22 0.27 0.02 -1.99 -1.19 113.55 111.79 2ksy h SER 95 Ca -0.43 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.53 2ksy h SER 95 Cb 1.28 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2ksy h SER 95 CO 0.51 0.28 -0.10 -0.09 -1.14 0.00 0.00 176.83 176.28 2ksy h ARG 96 N 0.53 -0.28 -0.34 3.45 9.65 -1.99 -2.54 114.38 122.85 2ksy h ARG 96 Ca 0.35 0.02 0.07 0.00 -1.10 0.00 0.00 59.98 59.32 2ksy h ARG 96 Cb 0.64 0.06 -0.06 0.00 -1.39 0.00 0.00 29.97 29.23 2ksy h ARG 96 CO -0.12 0.09 -0.05 0.93 2.80 0.00 0.00 179.97 183.62 2ksy h GLU 97 N -0.76 0.04 -0.14 0.20 5.08 -1.83 -1.83 114.58 115.33 2ksy h GLU 97 Ca -0.03 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 2ksy h GLU 97 Cb 0.50 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 2ksy h GLU 97 CO 0.05 0.03 -0.11 0.74 -1.00 0.00 0.00 179.01 178.71 2ksy h PHE 98 N 0.04 -0.28 -0.31 4.33 0.04 -1.30 -1.25 116.94 118.22 2ksy h PHE 98 Ca 0.16 0.02 0.09 0.00 2.80 0.00 0.00 57.97 61.04 2ksy h PHE 98 Cb 0.24 0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.53 2ksy h PHE 98 CO -0.28 -0.17 0.22 0.78 -0.60 0.00 0.00 178.31 178.26 2ksy h GLY 99 N -0.12 0.00 0.91 -1.45 0.00 -0.98 -0.95 103.07 100.46 2ksy h GLY 99 Ca 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.28 2ksy h GLY 99 CO -0.22 0.00 -0.48 -2.22 0.00 0.00 0.00 176.54 173.62 2ksy h ILE 100 N 0.00 1.35 -0.01 2.60 2.04 -0.44 -2.67 117.51 120.39 2ksy h ILE 100 Ca 0.15 -1.77 -0.00 0.00 1.00 0.00 0.00 64.86 64.23 2ksy h ILE 100 Cb 0.59 2.09 -0.00 0.00 -0.74 0.00 0.00 36.82 38.76 2ksy h ILE 100 CO -0.00 0.54 -0.00 0.58 0.00 0.00 0.00 178.15 179.26 2ksy h VAL 101 N 0.19 1.33 0.11 1.67 2.07 -0.56 -2.44 116.25 118.61 2ksy h VAL 101 Ca -0.02 -0.98 0.01 0.00 0.82 0.00 0.00 66.70 66.52 2ksy h VAL 101 Cb 1.11 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.85 2ksy h VAL 101 CO 0.10 0.26 -0.13 0.40 0.02 0.00 0.00 177.57 178.22 2ksy h ILE 102 N -0.39 0.70 -0.56 4.57 1.08 -1.32 -2.04 117.51 119.56 2ksy h ILE 102 Ca 0.00 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.52 2ksy h ILE 102 Cb 0.42 0.70 -0.03 0.00 -3.07 0.00 0.00 36.82 34.84 2ksy h ILE 102 CO 0.00 0.00 0.37 0.00 -0.69 0.00 0.00 178.15 177.83 2ksy h THR 103 N -0.28 1.02 -0.38 -0.27 1.03 -1.55 -1.69 112.91 110.80 2ksy h THR 103 Ca 0.01 -0.20 -0.01 0.00 -0.01 0.00 0.00 66.41 66.20 2ksy h THR 103 Cb 0.27 0.39 -0.02 0.00 -1.07 0.00 0.00 68.15 67.73 2ksy h THR 103 CO -0.05 0.11 0.21 0.25 -0.01 0.00 0.00 175.52 176.02 2ksy h LEU 104 N 0.58 0.47 -1.76 0.00 5.85 -0.90 -2.19 115.31 117.37 2ksy h LEU 104 Ca 0.24 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 2ksy h LEU 104 Cb 0.20 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 2ksy h LEU 104 CO -0.07 0.43 -0.17 0.78 -0.34 0.00 0.00 178.44 179.08 2ksy h ASN 105 N 0.48 0.00 0.52 1.25 -0.26 -0.65 -2.57 115.58 114.34 2ksy h ASN 105 Ca 0.13 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.85 2ksy h ASN 105 Cb 0.06 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.32 2ksy h ASN 105 CO -0.02 0.17 -0.25 0.74 -1.06 0.00 0.00 177.43 177.01 2ksy h THR 106 N 0.00 0.33 -0.71 2.81 2.02 -0.80 -0.59 112.91 115.97 2ksy h THR 106 Ca -0.00 -0.43 0.05 0.00 0.77 0.00 0.00 66.41 66.80 2ksy h THR 106 Cb 0.37 0.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.20 2ksy h THR 106 CO 0.02 0.05 0.46 1.62 0.37 0.00 0.00 175.52 178.05 2ksy h VAL 107 N -1.01 1.06 0.26 3.16 3.04 -1.43 0.69 116.25 122.02 2ksy h VAL 107 Ca -0.07 -0.27 -0.01 0.00 -1.01 0.00 0.00 66.70 65.34 2ksy h VAL 107 Cb 0.61 0.20 0.00 0.00 -2.01 0.00 0.00 31.29 30.10 2ksy h VAL 107 CO 0.12 0.14 -0.12 0.58 -1.01 0.00 0.00 177.57 177.28 2ksy h VAL 108 N 0.79 0.80 -0.10 1.51 2.07 -1.43 0.21 116.25 120.10 2ksy h VAL 108 Ca 0.29 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2ksy h VAL 108 Cb 0.17 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 2ksy h VAL 108 CO -0.09 0.10 0.02 -0.03 0.02 0.00 0.00 177.57 177.59 2ksy h MET 109 N -0.58 0.14 -0.00 1.57 4.05 -0.68 -0.72 114.93 118.70 2ksy h MET 109 Ca -0.04 -0.01 -0.15 0.00 -0.28 0.00 0.00 59.70 59.22 2ksy h MET 109 Cb 0.42 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.18 2ksy h MET 109 CO 0.06 0.14 -0.73 -0.07 0.23 0.00 0.00 176.91 176.54 2ksy h LEU 110 N 0.14 0.03 -0.64 3.39 3.38 -0.66 -0.88 115.31 120.07 2ksy h LEU 110 Ca 0.04 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2ksy h LEU 110 Cb 0.06 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2ksy h LEU 110 CO -0.00 0.75 0.31 0.00 0.09 0.00 0.00 178.44 179.58 2ksy h ALA 111 N 1.25 0.83 -0.09 1.53 0.00 0.59 -1.74 119.26 121.62 2ksy h ALA 111 Ca -0.01 -0.14 -0.24 0.00 0.00 0.00 0.00 54.91 54.53 2ksy h ALA 111 Cb 1.29 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.84 2ksy h ALA 111 CO 0.10 0.39 -0.87 0.78 0.00 0.00 0.00 179.25 179.64 2ksy h GLY 112 N 0.88 0.78 0.00 0.00 0.00 -1.40 -0.59 103.07 102.75 2ksy h GLY 112 Ca 0.22 -1.20 0.00 0.00 0.00 0.00 0.00 47.33 46.35 2ksy h GLY 112 CO -0.03 1.07 0.00 0.33 0.00 0.00 0.00 176.54 177.91 2ksy n PHE 113 N -3.89 0.00 0.31 5.60 -0.00 -0.34 -1.63 117.46 117.50 2ksy n PHE 113 Ca -0.08 0.00 0.19 0.00 -0.00 0.00 0.00 57.45 57.56 2ksy n PHE 113 Cb 0.80 -0.45 0.96 0.00 -0.00 0.00 0.00 39.48 40.78 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 -1.58 1.07 -0.42 3.13 0.00 -1.46 -2.96 119.26 117.05 2ksy h ALA 114 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.97 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 0.03 -0.06 0.78 0.00 0.00 0.00 179.25 180.00 2ksy h GLY 115 N 0.80 0.36 2.00 0.00 0.00 -0.13 0.19 103.07 106.30 2ksy h GLY 115 Ca -0.00 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2ksy h GLY 115 CO 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 176.54 176.40 2ksy h ALA 116 N 1.40 1.00 -0.07 3.60 0.00 -1.31 -3.15 119.26 120.73 2ksy h ALA 116 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2ksy h ALA 116 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2ksy h ALA 116 CO -0.40 0.00 0.00 -1.33 0.00 0.00 0.00 179.25 177.52 2ksy n MET 117 N -2.86 1.36 -2.08 0.00 2.00 -0.03 -4.86 117.12 110.65 2ksy n MET 117 Ca 0.04 -0.54 -0.38 0.00 0.00 0.00 0.00 57.70 56.83 2ksy n MET 117 Cb 0.47 -1.36 0.01 0.00 0.00 0.00 0.00 33.22 32.34 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 -1.91 2.72 -0.91 2.03 -7.23 -0.67 -4.93 120.40 109.50 2ksy s VAL 118 Ca 0.31 0.54 0.26 0.00 -1.81 0.00 0.00 61.98 61.28 2ksy s VAL 118 Cb 0.16 -3.27 0.08 0.00 0.56 0.00 0.00 36.38 33.91 2ksy s VAL 118 CO 0.25 -0.01 1.53 -0.81 -0.31 0.00 0.00 175.10 175.75 2ksy n PRO 119 N -0.68 0.08 0.00 4.82 -0.04 -1.26 -4.93 135.00 132.99 2ksy n PRO 119 Ca 0.08 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2ksy n PRO 119 Cb 0.47 -1.56 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 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 1.45 4.66 0.94 0.55 0.00 -1.26 -5.03 105.19 106.50 2ksy n GLY 120 Ca 0.05 -0.63 0.08 0.00 0.00 0.00 0.00 46.02 45.52 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 2.09 0.30 -0.61 -6.64 -1.26 -4.56 119.36 108.69 2ksy n ILE 121 Ca 0.00 -1.68 0.17 0.00 -1.77 0.00 0.00 62.75 59.47 2ksy n ILE 121 Cb 0.00 -0.12 0.79 0.00 -1.44 0.00 0.00 39.64 38.87 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 2.06 0.00 -0.98 6.28 5.08 -1.94 -3.02 114.58 122.06 2ksy h GLU 122 Ca 0.00 0.00 0.24 0.00 -1.00 0.00 0.00 59.36 58.60 2ksy h GLU 122 Cb 1.36 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.54 2ksy h GLU 122 CO 0.20 0.00 0.65 0.07 -1.00 0.00 0.00 179.01 178.94 2ksy h ARG 123 N 0.00 0.32 -0.38 2.33 0.11 -1.80 0.18 114.38 115.14 2ksy h ARG 123 Ca 0.00 -0.02 -0.02 0.00 0.10 0.00 0.00 59.98 60.04 2ksy h ARG 123 Cb 0.30 -0.07 -0.02 0.00 1.11 0.00 0.00 29.97 31.29 2ksy h ARG 123 CO 0.00 0.21 0.17 1.88 0.10 0.00 0.00 179.97 182.33 2ksy h TYR 124 N 0.33 0.52 -0.00 4.08 0.05 -1.87 -1.55 116.97 118.52 2ksy h TYR 124 Ca 0.52 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 59.28 2ksy h TYR 124 Cb 1.44 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 39.01 2ksy h TYR 124 CO -0.00 0.40 -0.03 0.00 -1.05 0.00 0.00 178.16 177.48 2ksy h ALA 125 N 1.66 0.01 -0.39 3.88 0.00 -0.87 -1.70 119.26 121.85 2ksy h ALA 125 Ca 0.13 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 54.74 2ksy h ALA 125 Cb 0.08 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 2ksy h ALA 125 CO -0.02 -0.11 -0.02 -0.07 0.00 0.00 0.00 179.25 179.03 2ksy h LEU 126 N -0.69 -0.21 -0.73 0.00 4.07 -1.28 -1.45 115.31 115.02 2ksy h LEU 126 Ca -0.00 0.10 -0.10 0.00 0.08 0.00 0.00 57.88 57.95 2ksy h LEU 126 Cb 0.75 0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.65 2ksy h LEU 126 CO 0.01 -0.06 -0.15 0.15 -1.08 0.00 0.00 178.44 177.31 2ksy h PHE 127 N 0.08 0.91 -0.90 1.13 3.57 -1.38 -2.59 116.94 117.76 2ksy h PHE 127 Ca 0.19 -0.18 0.24 0.00 3.53 0.00 0.00 57.97 61.75 2ksy h PHE 127 Cb 0.28 -0.23 -0.14 0.00 2.79 0.00 0.00 35.95 38.65 2ksy h PHE 127 CO -0.28 0.91 0.35 0.78 -2.23 0.00 0.00 178.31 177.84 2ksy h GLY 128 N 0.97 1.54 1.24 2.40 0.00 -0.28 0.67 103.07 109.60 2ksy h GLY 128 Ca 0.12 -0.12 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 2ksy h GLY 128 CO 0.05 -0.35 -0.60 1.98 0.00 0.00 0.00 176.54 177.61 2ksy h MET 129 N 0.30 0.79 -0.27 4.80 1.85 -1.24 -2.88 114.93 118.27 2ksy h MET 129 Ca 0.58 -0.53 -0.01 0.00 -0.61 0.00 0.00 59.70 59.13 2ksy h MET 129 Cb 1.18 0.08 -0.01 0.00 0.43 0.00 0.00 31.60 33.27 2ksy h MET 129 CO -0.60 1.16 0.13 0.78 -0.40 0.00 0.00 176.91 177.98 2ksy h GLY 130 N 0.76 0.40 0.26 1.39 0.00 0.55 0.74 103.07 107.17 2ksy h GLY 130 Ca -0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 2ksy h GLY 130 CO 0.13 0.16 -0.05 0.00 0.00 0.00 0.00 176.54 176.78 2ksy h ALA 131 N 1.77 -0.14 -0.98 3.60 0.00 -0.51 0.73 119.26 123.73 2ksy h ALA 131 Ca 0.10 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 54.83 2ksy h ALA 131 Cb 0.05 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 2ksy h ALA 131 CO -0.01 -0.21 0.62 0.28 0.00 0.00 0.00 179.25 179.93 2ksy h VAL 132 N -0.88 1.03 -0.37 0.00 2.07 -1.42 -0.47 116.25 116.21 2ksy h VAL 132 Ca -0.01 -0.37 -0.13 0.00 0.82 0.00 0.00 66.70 67.01 2ksy h VAL 132 Cb 0.56 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 2ksy h VAL 132 CO 0.02 0.20 -0.29 0.00 0.02 0.00 0.00 177.57 177.52 2ksy h ALA 133 N 1.47 0.80 -0.12 1.67 0.00 -0.90 -2.61 119.26 119.57 2ksy h ALA 133 Ca 0.44 -0.40 0.04 0.00 0.00 0.00 0.00 54.91 54.99 2ksy h ALA 133 Cb 0.27 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 2ksy h ALA 133 CO -0.20 0.65 -0.15 0.35 0.00 0.00 0.00 179.25 179.89 2ksy h PHE 134 N 0.66 -0.39 -0.44 0.00 3.57 0.78 0.00 116.94 121.12 2ksy h PHE 134 Ca 0.08 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.64 2ksy h PHE 134 Cb 0.82 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.73 2ksy h PHE 134 CO 0.04 -0.22 0.29 0.82 -2.23 0.00 0.00 178.31 177.01 2ksy h ILE 135 N -0.19 1.02 -0.70 1.41 2.04 -1.28 -0.29 117.51 119.53 2ksy h ILE 135 Ca 0.09 -0.16 0.04 0.00 1.00 0.00 0.00 64.86 65.84 2ksy h ILE 135 Cb 0.33 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 2ksy h ILE 135 CO -0.24 0.08 0.46 1.23 0.00 0.00 0.00 178.15 179.68 2ksy h GLY 136 N 0.46 0.95 0.45 5.37 0.00 -0.62 0.73 103.07 110.40 2ksy h GLY 136 Ca 0.18 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 2ksy h GLY 136 CO -0.04 0.26 -0.07 -2.00 0.00 0.00 0.00 176.54 174.69 2ksy h LEU 137 N 0.80 -0.16 -1.75 3.11 5.85 -0.45 -2.77 115.31 119.93 2ksy h LEU 137 Ca 0.29 -0.37 0.11 0.00 0.84 0.00 0.00 57.88 58.74 2ksy h LEU 137 Cb 0.13 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 2ksy h LEU 137 CO -0.09 0.35 0.38 -0.37 -0.34 0.00 0.00 178.44 178.38 2ksy h VAL 138 N -0.75 0.85 0.01 1.05 -1.51 -1.20 -1.00 116.25 113.71 2ksy h VAL 138 Ca -0.02 -0.10 -0.00 0.00 -1.23 0.00 0.00 66.70 65.35 2ksy h VAL 138 Cb 0.53 0.55 0.00 0.00 -2.13 0.00 0.00 31.29 30.24 2ksy h VAL 138 CO 0.03 0.05 -0.01 0.22 -1.23 0.00 0.00 177.57 176.64 2ksy h TYR 139 N 0.28 -0.02 -0.69 5.19 3.20 -0.79 -2.31 116.97 121.83 2ksy h TYR 139 Ca 0.26 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.21 2ksy h TYR 139 Cb 0.66 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.89 2ksy h TYR 139 CO -0.00 0.00 0.45 1.88 -1.64 0.00 0.00 178.16 178.86 2ksy h TYR 140 N -0.03 0.65 0.07 -3.82 0.05 -0.91 0.22 116.97 113.19 2ksy h TYR 140 Ca -0.00 0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.81 2ksy h TYR 140 Cb 0.03 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 37.54 2ksy h TYR 140 CO -0.07 0.33 -0.12 -0.07 -1.05 0.00 0.00 178.16 177.17 2ksy h LEU 141 N 0.63 -0.34 -0.01 3.88 3.38 -0.99 -1.56 115.31 120.30 2ksy h LEU 141 Ca 0.31 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2ksy h LEU 141 Cb 0.39 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2ksy h LEU 141 CO -0.10 -0.18 0.00 0.52 0.09 0.00 0.00 178.44 178.77 2ksy n VAL 142 N -5.25 0.19 0.00 1.22 0.31 -0.84 -2.86 118.33 111.10 2ksy n VAL 142 Ca -0.06 0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 2ksy n VAL 142 Cb 0.17 -0.58 0.00 0.00 -0.91 0.00 0.00 33.84 32.52 2ksy n VAL 142 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ksy n GLY 143 N 1.26 -0.80 0.25 2.92 0.00 0.70 -4.56 105.19 104.95 2ksy n GLY 143 Ca 0.06 -0.36 0.12 0.00 0.00 0.00 0.00 46.02 45.84 2ksy n GLY 143 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ksy h PRO 144 N 0.00 0.00 -0.71 1.61 0.13 -1.85 -2.94 132.00 128.23 2ksy h PRO 144 Ca 0.00 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 65.25 2ksy h PRO 144 Cb 0.00 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.08 2ksy h PRO 144 CO 0.00 0.16 0.47 0.52 -0.23 0.00 0.00 178.00 178.92 2ksy h MET 145 N 0.00 0.47 -0.14 0.86 2.86 -1.73 0.40 114.93 117.65 2ksy h MET 145 Ca -0.00 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 2ksy h MET 145 Cb 0.52 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.07 2ksy h MET 145 CO 0.02 0.31 -0.21 1.15 1.06 0.00 0.00 176.91 179.25 2ksy h THR 146 N 0.49 1.36 0.00 2.22 2.02 -1.37 -2.72 112.91 114.92 2ksy h THR 146 Ca 0.34 -1.44 -0.12 0.00 0.77 0.00 0.00 66.41 65.96 2ksy h THR 146 Cb 0.65 1.98 -0.02 0.00 -1.74 0.00 0.00 68.15 69.02 2ksy h THR 146 CO -0.11 0.42 -0.58 -0.33 0.37 0.00 0.00 175.52 175.29 2ksy h GLU 147 N -0.02 0.00 -0.18 6.66 5.08 -1.53 -1.17 114.58 123.42 2ksy h GLU 147 Ca 0.01 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 2ksy h GLU 147 Cb 0.77 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.02 2ksy h GLU 147 CO 0.05 0.58 -0.21 0.66 -1.00 0.00 0.00 179.01 179.09 2ksy h SER 148 N 0.00 0.50 0.14 1.42 4.64 -0.96 -3.03 113.55 116.27 2ksy h SER 148 Ca -0.01 -0.49 -0.30 0.00 -0.47 0.00 0.00 61.79 60.52 2ksy h SER 148 Cb 1.06 -0.14 0.03 0.00 -0.31 0.00 0.00 62.40 63.04 2ksy h SER 148 CO 0.08 0.89 -1.27 0.00 -0.87 0.00 0.00 176.83 175.66 2ksy h ALA 149 N 0.62 -0.01 0.00 5.18 0.00 -1.50 -3.06 119.26 120.48 2ksy h ALA 149 Ca 0.02 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.15 2ksy h ALA 149 Cb 0.77 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2ksy h ALA 149 CO 0.05 0.69 0.00 0.45 0.00 0.00 0.00 179.25 180.45 2ksy n SER 150 N -3.78 0.00 -0.17 0.00 2.88 -0.45 -1.58 113.62 110.52 2ksy n SER 150 Ca -0.14 0.11 0.05 0.00 -1.33 0.00 0.00 58.87 57.56 2ksy n SER 150 Cb 1.00 -0.25 0.07 0.00 -0.75 0.00 0.00 64.21 64.27 2ksy n SER 150 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ksy n GLN 151 N -1.25 1.11 -0.11 -1.46 6.02 -1.14 -4.80 117.38 115.74 2ksy n GLN 151 Ca 0.04 -1.80 -0.21 0.00 -0.01 0.00 0.00 57.00 55.03 2ksy n GLN 151 Cb 0.07 -1.06 -0.09 0.00 1.02 0.00 0.00 30.24 30.17 2ksy n GLN 151 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2ksy n ARG 152 N -0.77 0.56 -3.89 -1.09 3.00 -0.62 -5.04 116.66 108.80 2ksy n ARG 152 Ca 0.08 0.45 -0.08 0.00 -0.00 0.00 0.00 57.85 58.29 2ksy n ARG 152 Cb 0.58 -1.64 -0.02 0.00 0.00 0.00 0.00 32.46 31.38 2ksy n ARG 152 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2ksy s SER 153 N -6.84 -0.08 0.14 6.15 0.15 -1.25 -5.02 113.70 106.94 2ksy s SER 153 Ca -0.30 -0.86 -0.11 0.00 0.70 0.00 0.00 55.95 55.38 2ksy s SER 153 Cb 0.08 0.72 -0.05 0.00 -1.71 0.00 0.00 66.02 65.06 2ksy s SER 153 CO 0.50 -1.38 1.45 -1.28 1.20 0.00 0.00 173.24 173.73 2ksy h SER 154 N 2.06 0.98 0.48 5.45 0.87 -1.95 -3.23 113.55 118.22 2ksy h SER 154 Ca -0.24 -0.48 -0.23 0.00 -1.23 0.00 0.00 61.79 59.61 2ksy h SER 154 Cb 1.25 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.93 2ksy h SER 154 CO 0.31 1.28 -0.99 1.23 -0.53 0.00 0.00 176.83 178.12 2ksy h GLY 155 N 0.75 0.35 0.53 5.77 0.00 -1.97 -3.28 103.07 105.23 2ksy h GLY 155 Ca 0.04 -0.68 0.13 0.00 0.00 0.00 0.00 47.33 46.82 2ksy h GLY 155 CO 0.11 0.60 0.59 -2.22 0.00 0.00 0.00 176.54 175.62 2ksy h ILE 156 N 0.16 0.88 -0.10 2.60 1.08 -1.86 -0.10 117.51 120.17 2ksy h ILE 156 Ca -0.08 -0.28 -0.10 0.00 -0.39 0.00 0.00 64.86 64.01 2ksy h ILE 156 Cb 1.65 -0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 35.38 2ksy h ILE 156 CO 0.16 0.15 -0.37 0.50 -0.69 0.00 0.00 178.15 177.90 2ksy h LYS 157 N 0.81 0.20 -0.04 2.37 3.64 -1.61 -0.21 116.57 121.72 2ksy h LYS 157 Ca 0.46 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.73 2ksy h LYS 157 Cb 0.61 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2ksy h LYS 157 CO -0.22 0.55 -0.08 0.77 -2.27 0.00 0.00 179.45 178.19 2ksy h SER 158 N 0.17 0.15 0.09 4.20 0.02 -1.14 -2.64 113.55 114.39 2ksy h SER 158 Ca 0.02 -0.56 -0.15 0.00 -0.84 0.00 0.00 61.79 60.25 2ksy h SER 158 Cb 0.74 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 2ksy h SER 158 CO 0.06 0.69 -0.55 -0.07 -1.14 0.00 0.00 176.83 175.82 2ksy h LEU 159 N -0.38 0.54 -0.36 5.07 3.38 -1.35 -2.84 115.31 119.37 2ksy h LEU 159 Ca 0.00 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.64 2ksy h LEU 159 Cb 0.66 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2ksy h LEU 159 CO 0.02 0.98 0.07 0.22 0.09 0.00 0.00 178.44 179.82 2ksy h TYR 160 N 0.38 0.62 -0.20 1.13 3.20 -1.09 -1.20 116.97 119.81 2ksy h TYR 160 Ca 0.01 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.75 2ksy h TYR 160 Cb 1.07 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 39.17 2ksy h TYR 160 CO 0.04 0.63 -0.05 -0.39 -1.64 0.00 0.00 178.16 176.75 2ksy h VAL 161 N 0.43 1.28 -0.42 1.81 -1.51 -1.50 0.43 116.25 116.78 2ksy h VAL 161 Ca 0.11 -1.02 -0.06 0.00 -1.23 0.00 0.00 66.70 64.49 2ksy h VAL 161 Cb 0.34 1.54 -0.02 0.00 -2.13 0.00 0.00 31.29 31.02 2ksy h VAL 161 CO 0.00 0.31 -0.01 0.03 -1.23 0.00 0.00 177.57 176.68 2ksy h ARG 162 N 0.11 0.67 0.02 5.19 3.08 -1.51 -1.67 114.38 120.28 2ksy h ARG 162 Ca 0.05 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 2ksy h ARG 162 Cb 0.49 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2ksy h ARG 162 CO 0.02 0.70 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.54 2ksy h LEU 163 N 0.64 -0.02 -0.73 3.04 4.07 -1.16 -2.64 115.31 118.50 2ksy h LEU 163 Ca 0.13 -0.73 -0.02 0.00 0.08 0.00 0.00 57.88 57.34 2ksy h LEU 163 Cb 0.41 0.01 -0.03 0.00 1.08 0.00 0.00 40.66 42.12 2ksy h LEU 163 CO 0.02 0.77 0.37 0.08 -1.08 0.00 0.00 178.44 178.59 2ksy h ARG 164 N -0.87 1.04 0.08 1.13 -0.00 -0.93 0.05 114.38 114.87 2ksy h ARG 164 Ca -0.00 -0.14 -0.00 0.00 -0.00 0.00 0.00 59.98 59.83 2ksy h ARG 164 Cb 0.75 -0.19 0.00 0.00 -0.00 0.00 0.00 29.97 30.53 2ksy h ARG 164 CO 0.00 0.80 -0.04 -0.91 -0.00 0.00 0.00 179.97 179.83 2ksy h ASN 165 N 1.02 -0.09 0.13 0.08 2.35 -1.44 -1.86 115.58 115.77 2ksy h ASN 165 Ca 0.25 -0.40 -0.01 0.00 -0.55 0.00 0.00 56.30 55.59 2ksy h ASN 165 Cb 0.09 0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.48 2ksy h ASN 165 CO -0.03 0.38 -0.06 0.25 -1.65 0.00 0.00 177.43 176.31 2ksy h LEU 166 N -0.57 -0.15 0.25 1.61 6.46 -1.44 -2.72 115.31 118.76 2ksy h LEU 166 Ca -0.01 -0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.73 2ksy h LEU 166 Cb 0.48 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.45 2ksy h LEU 166 CO 0.02 -0.09 -0.13 0.74 -0.62 0.00 0.00 178.44 178.36 2ksy h THR 167 N -0.20 0.74 -0.99 1.05 2.02 -1.07 -2.83 112.91 111.64 2ksy h THR 167 Ca -0.02 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.29 2ksy h THR 167 Cb 0.15 0.74 -0.09 0.00 -1.74 0.00 0.00 68.15 67.22 2ksy h THR 167 CO 0.03 0.00 0.61 1.62 0.37 0.00 0.00 175.52 178.15 2ksy h VAL 168 N -0.35 0.90 0.52 3.16 3.04 -1.35 0.16 116.25 122.33 2ksy h VAL 168 Ca -0.03 -0.33 -0.03 0.00 -1.01 0.00 0.00 66.70 65.30 2ksy h VAL 168 Cb 0.27 -0.14 0.01 0.00 -2.01 0.00 0.00 31.29 29.41 2ksy h VAL 168 CO 0.05 0.17 -0.25 0.58 -1.01 0.00 0.00 177.57 177.12 2ksy h VAL 169 N 0.95 0.00 -0.09 1.51 2.07 -1.33 -0.43 116.25 118.93 2ksy h VAL 169 Ca 0.50 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.95 2ksy h VAL 169 Cb 0.52 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2ksy h VAL 169 CO -0.28 0.00 0.03 0.17 0.02 0.00 0.00 177.57 177.52 2ksy h LEU 170 N -0.75 0.11 -0.66 2.57 8.10 -1.37 -1.47 115.31 121.84 2ksy h LEU 170 Ca -0.07 -0.01 -0.14 0.00 0.11 0.00 0.00 57.88 57.77 2ksy h LEU 170 Cb 0.53 -0.03 -0.01 0.00 -0.44 0.00 0.00 40.66 40.71 2ksy h LEU 170 CO 0.12 0.11 -0.48 -0.50 -4.11 0.00 0.00 178.44 173.58 2ksy h TRP 171 N 0.13 0.58 0.00 0.17 4.06 -0.65 -2.49 115.95 117.75 2ksy h TRP 171 Ca 0.03 -0.18 0.00 0.00 2.06 0.00 0.00 58.89 60.80 2ksy h TRP 171 Cb 0.04 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 28.08 2ksy h TRP 171 CO 0.00 0.86 0.00 0.00 -3.56 0.00 0.00 178.44 175.74 2ksy n ALA 172 N -2.50 1.74 0.11 1.49 0.00 -0.18 -1.76 120.51 119.42 2ksy n ALA 172 Ca -0.02 -0.06 0.05 0.00 0.00 0.00 0.00 53.44 53.41 2ksy n ALA 172 Cb 0.55 -1.22 0.01 0.00 0.00 0.00 0.00 19.45 18.79 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 0.46 -0.19 0.00 1.08 -1.35 -3.36 117.51 114.14 2ksy h ILE 173 Ca 0.00 -1.74 0.05 0.00 -0.39 0.00 0.00 64.86 62.78 2ksy h ILE 173 Cb 0.17 2.07 -0.05 0.00 -3.07 0.00 0.00 36.82 35.94 2ksy h ILE 173 CO 0.00 0.26 -0.12 1.88 -0.69 0.00 0.00 178.15 179.48 2ksy h TYR 174 N 0.00 -0.30 -1.19 1.37 0.05 -1.44 -1.51 116.97 113.95 2ksy h TYR 174 Ca -0.05 0.02 0.35 0.00 0.05 0.00 0.00 58.73 59.10 2ksy h TYR 174 Cb 1.31 0.16 -0.05 0.00 1.01 0.00 0.00 36.73 39.17 2ksy h TYR 174 CO 0.00 -0.18 0.92 -1.35 -1.05 0.00 0.00 178.16 176.50 2ksy h PRO 175 N -0.11 0.00 0.00 4.88 0.11 -1.76 -0.17 132.00 134.95 2ksy h PRO 175 Ca 0.11 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.20 2ksy h PRO 175 Cb 0.28 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.39 2ksy h PRO 175 CO -0.27 0.00 -0.10 0.74 -0.21 0.00 0.00 178.00 178.16 2ksy h PHE 176 N 0.00 0.02 -0.67 0.65 0.04 -1.52 -2.91 116.94 112.55 2ksy h PHE 176 Ca 0.57 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 61.31 2ksy h PHE 176 Cb 2.40 -0.00 -0.03 0.00 2.20 0.00 0.00 35.95 40.52 2ksy h PHE 176 CO 0.00 1.04 0.37 0.82 -0.60 0.00 0.00 178.31 179.94 2ksy h ILE 177 N -0.98 1.20 -0.14 -0.55 1.08 -0.72 0.26 117.51 117.66 2ksy h ILE 177 Ca -0.03 -0.49 -0.20 0.00 -0.39 0.00 0.00 64.86 63.75 2ksy h ILE 177 Cb 1.04 0.29 0.01 0.00 -3.07 0.00 0.00 36.82 35.09 2ksy h ILE 177 CO -0.01 0.22 -0.70 -0.25 -0.69 0.00 0.00 178.15 176.72 2ksy h TRP 178 N 0.93 0.97 0.24 1.37 7.01 -1.34 0.16 115.95 125.29 2ksy h TRP 178 Ca 0.24 -0.43 -0.01 0.00 2.11 0.00 0.00 58.89 60.80 2ksy h TRP 178 Cb 0.02 -0.15 0.00 0.00 -2.10 0.00 0.00 29.16 26.93 2ksy h TRP 178 CO 0.01 1.25 -0.11 1.25 -2.79 0.00 0.00 178.44 178.04 2ksy h LEU 179 N 0.42 -0.27 -0.07 0.65 7.12 -1.25 -0.37 115.31 121.53 2ksy h LEU 179 Ca -0.05 -0.24 -0.07 0.00 0.13 0.00 0.00 57.88 57.64 2ksy h LEU 179 Cb 1.33 0.07 0.00 0.00 -0.53 0.00 0.00 40.66 41.54 2ksy h LEU 179 CO 0.14 0.15 -0.24 -0.07 -0.13 0.00 0.00 178.44 178.29 2ksy h LEU 180 N -0.75 0.34 -9.72 2.25 3.38 -0.62 -0.32 115.31 109.87 2ksy h LEU 180 Ca -0.03 -0.62 -0.39 0.00 0.09 0.00 0.00 57.88 56.93 2ksy h LEU 180 Cb 0.50 -0.10 0.21 0.00 0.09 0.00 0.00 40.66 41.36 2ksy h LEU 180 CO 0.05 0.90 -0.52 0.61 0.09 0.00 0.00 178.44 179.57 2ksy n GLY 181 N 0.60 -2.66 0.29 0.83 0.00 0.57 -0.37 105.19 104.45 2ksy n GLY 181 Ca -0.08 -1.07 0.10 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.65 0.28 0.00 1.61 0.11 -1.84 0.12 132.00 129.63 2ksy h PRO 182 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2ksy h PRO 182 Cb 1.25 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2ksy h PRO 182 CO 0.35 0.18 0.27 -2.30 -0.21 0.00 0.00 178.00 176.30 2ksy n PRO 183 N -5.15 0.09 0.00 1.05 -0.02 -1.26 -3.91 135.00 125.80 2ksy n PRO 183 Ca 0.18 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 2ksy n PRO 183 Cb 0.57 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 2ksy n PRO 183 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ksy n GLY 184 N -1.28 0.12 0.00 -1.23 0.00 0.26 -4.47 105.19 98.60 2ksy n GLY 184 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2ksy n GLY 184 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2ksy n VAL 185 N -1.01 0.00 -2.94 1.61 0.24 -0.13 -5.00 118.33 111.11 2ksy n VAL 185 Ca 0.00 -0.20 -0.05 0.00 -2.04 0.00 0.00 64.34 62.05 2ksy n VAL 185 Cb 0.00 1.43 0.01 0.00 -1.47 0.00 0.00 33.84 33.80 2ksy n VAL 185 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ksy n ALA 186 N -0.12 -2.92 -0.11 2.33 0.00 0.51 -4.90 120.51 115.31 2ksy n ALA 186 Ca 0.00 0.48 -0.24 0.00 0.00 0.00 0.00 53.44 53.68 2ksy n ALA 186 Cb 0.11 -1.48 -0.11 0.00 0.00 0.00 0.00 19.45 17.96 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 0.60 1.90 0.00 0.00 4.77 0.13 -4.90 117.00 119.50 2ksy n LEU 187 Ca 0.01 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 2ksy n LEU 187 Cb 0.27 -0.94 0.00 0.00 -2.33 0.00 0.00 43.42 40.42 2ksy n LEU 187 CO 0.35 0.35 0.00 0.18 -1.33 0.00 0.00 177.39 176.94 2ksy n LEU 188 N -4.38 0.04 -3.57 2.23 4.77 -1.26 -5.12 117.00 109.72 2ksy n LEU 188 Ca -0.37 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.48 2ksy n LEU 188 Cb 0.73 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.76 2ksy n LEU 188 CO 0.16 0.00 0.64 0.28 -1.33 0.00 0.00 177.39 177.14 2ksy s THR 189 N 0.00 0.00 0.52 -5.08 -1.32 -1.26 -5.04 115.64 103.46 2ksy s THR 189 Ca 0.00 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 60.71 2ksy s THR 189 Cb 0.00 -1.00 0.37 0.00 -1.51 0.00 0.00 72.50 70.36 2ksy s THR 189 CO 0.00 0.00 2.02 1.55 -2.21 0.00 0.00 174.62 175.98 2ksy h PRO 190 N 3.02 0.03 -0.34 7.08 0.13 -1.99 -0.07 132.00 139.86 2ksy h PRO 190 Ca -0.23 -0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.87 2ksy h PRO 190 Cb 1.16 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 2ksy h PRO 190 CO 0.30 0.02 0.08 1.79 -0.23 0.00 0.00 178.00 179.97 2ksy h THR 191 N 0.03 1.22 -0.11 1.56 1.35 -1.99 -1.26 112.91 113.72 2ksy h THR 191 Ca 0.21 -0.74 -0.22 0.00 -0.55 0.00 0.00 66.41 65.10 2ksy h THR 191 Cb 0.78 1.06 0.01 0.00 -1.73 0.00 0.00 68.15 68.27 2ksy h THR 191 CO -0.01 0.25 -0.81 0.58 -0.25 0.00 0.00 175.52 175.28 2ksy h VAL 192 N 0.40 1.31 0.12 6.82 2.07 -1.71 -2.48 116.25 122.78 2ksy h VAL 192 Ca 0.11 -2.07 -0.00 0.00 0.82 0.00 0.00 66.70 65.55 2ksy h VAL 192 Cb 0.30 2.08 -0.00 0.00 -1.52 0.00 0.00 31.29 32.15 2ksy h VAL 192 CO 0.00 0.65 -0.08 -0.78 0.02 0.00 0.00 177.57 177.38 2ksy h ASP 193 N 0.44 -0.20 -0.39 0.57 3.58 -0.98 -2.20 116.42 117.24 2ksy h ASP 193 Ca -0.06 0.01 -0.06 0.00 0.42 0.00 0.00 57.03 57.35 2ksy h ASP 193 Cb 1.43 0.06 -0.02 0.00 1.72 0.00 0.00 39.33 42.52 2ksy h ASP 193 CO 0.16 -0.13 0.05 0.58 -2.88 0.00 0.00 179.24 177.02 2ksy h VAL 194 N -0.20 1.23 -0.24 2.25 2.07 -1.30 -1.41 116.25 118.65 2ksy h VAL 194 Ca -0.01 -0.88 0.03 0.00 0.82 0.00 0.00 66.70 66.66 2ksy h VAL 194 Cb 0.17 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 2ksy h VAL 194 CO 0.01 0.31 0.06 0.00 0.02 0.00 0.00 177.57 177.97 2ksy h ALA 195 N 1.35 0.25 -0.32 1.67 0.00 -1.12 0.20 119.26 121.30 2ksy h ALA 195 Ca 0.15 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 2ksy h ALA 195 Cb 0.36 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2ksy h ALA 195 CO 0.01 -0.36 -0.16 -0.07 0.00 0.00 0.00 179.25 178.67 2ksy h LEU 196 N 0.16 0.70 0.58 0.00 3.38 -1.24 -1.91 115.31 116.98 2ksy h LEU 196 Ca 0.11 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 2ksy h LEU 196 Cb 0.09 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2ksy h LEU 196 CO -0.13 0.95 -0.48 0.40 0.09 0.00 0.00 178.44 179.28 2ksy h ILE 197 N 0.44 0.05 -0.90 1.22 1.08 -0.96 0.37 117.51 118.82 2ksy h ILE 197 Ca 0.07 0.00 0.19 0.00 -0.39 0.00 0.00 64.86 64.73 2ksy h ILE 197 Cb 0.70 0.05 -0.07 0.00 -3.07 0.00 0.00 36.82 34.43 2ksy h ILE 197 CO 0.05 0.00 0.59 0.58 -0.69 0.00 0.00 178.15 178.68 2ksy h VAL 198 N -1.04 0.70 -0.04 1.67 2.07 -0.65 0.38 116.25 119.35 2ksy h VAL 198 Ca -0.07 -0.16 -0.12 0.00 0.82 0.00 0.00 66.70 67.17 2ksy h VAL 198 Cb 0.88 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 2ksy h VAL 198 CO -0.01 0.08 -0.52 0.22 0.02 0.00 0.00 177.57 177.36 2ksy h TYR 199 N 0.45 0.13 -0.25 1.57 3.20 -0.43 -1.91 116.97 119.74 2ksy h TYR 199 Ca 0.47 -0.04 -0.19 0.00 3.14 0.00 0.00 58.73 62.10 2ksy h TYR 199 Cb 1.09 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.34 2ksy h TYR 199 CO -0.00 0.61 -0.60 -0.07 -1.64 0.00 0.00 178.16 176.46 2ksy h LEU 200 N 0.08 0.96 -0.46 2.82 3.38 0.39 -1.02 115.31 121.45 2ksy h LEU 200 Ca -0.00 -0.56 -0.17 0.00 0.09 0.00 0.00 57.88 57.24 2ksy h LEU 200 Cb 0.95 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2ksy h LEU 200 CO 0.07 1.34 -0.68 0.44 0.09 0.00 0.00 178.44 179.71 2ksy h ASP 201 N 0.62 0.47 0.70 -0.43 3.32 -1.26 -2.71 116.42 117.12 2ksy h ASP 201 Ca -0.00 -0.29 -0.13 0.00 0.02 0.00 0.00 57.03 56.63 2ksy h ASP 201 Cb 1.22 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 2ksy h ASP 201 CO 0.13 1.01 -0.60 -0.07 -1.72 0.00 0.00 179.24 177.99 2ksy h LEU 202 N 0.29 0.00 -0.02 1.55 3.38 -1.32 -3.18 115.31 116.01 2ksy h LEU 202 Ca -0.02 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.69 2ksy h LEU 202 Cb 1.23 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.99 2ksy h LEU 202 CO 0.12 0.60 -1.10 1.62 0.09 0.00 0.00 178.44 179.77 2ksy h VAL 203 N 0.00 1.41 0.00 1.22 3.04 -1.12 -2.19 116.25 118.61 2ksy h VAL 203 Ca -0.01 -2.65 0.00 0.00 -1.01 0.00 0.00 66.70 63.03 2ksy h VAL 203 Cb 1.12 2.65 0.00 0.00 -2.01 0.00 0.00 31.29 33.04 2ksy h VAL 203 CO 0.08 0.79 0.00 0.41 -1.01 0.00 0.00 177.57 177.84 2ksy n THR 204 N -3.68 0.00 0.00 3.17 -1.04 -1.03 0.00 114.28 111.70 2ksy n THR 204 Ca -0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 2ksy n THR 204 Cb 0.93 -0.67 0.00 0.00 -1.82 0.00 0.00 70.33 68.76 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 -0.81 0.00 0.37 12.58 0.31 -0.82 -2.53 118.33 127.43 2ksy n VAL 206 Ca 0.04 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.21 2ksy n VAL 206 Cb 0.02 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.87 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 -1.17 2.00 2.92 0.00 -0.49 -0.92 103.07 105.41 2ksy h GLY 207 Ca 0.00 0.47 -0.10 0.00 0.00 0.00 0.00 47.33 47.70 2ksy h GLY 207 CO 0.00 -0.40 -0.47 0.27 0.00 0.00 0.00 176.54 175.94 2ksy h PHE 208 N -1.02 0.00 -0.19 5.60 -5.15 -1.59 -2.82 116.94 111.76 2ksy h PHE 208 Ca -0.09 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 57.64 2ksy h PHE 208 Cb 0.81 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.97 2ksy h PHE 208 CO -0.05 0.47 -0.04 0.78 -2.00 0.00 0.00 178.31 177.47 2ksy h GLY 209 N 2.21 0.31 0.54 6.09 0.00 -1.73 1.72 103.07 112.22 2ksy h GLY 209 Ca -0.00 -0.17 -0.08 0.00 0.00 0.00 0.00 47.33 47.08 2ksy h GLY 209 CO 0.06 0.16 -0.30 0.74 0.00 0.00 0.00 176.54 177.20 2ksy h PHE 210 N 0.28 0.33 0.00 5.60 0.04 -0.94 -1.87 116.94 120.38 2ksy h PHE 210 Ca 0.06 -0.17 -0.03 0.00 2.80 0.00 0.00 57.97 60.64 2ksy h PHE 210 Cb 0.27 -0.04 -0.00 0.00 2.20 0.00 0.00 35.95 38.37 2ksy h PHE 210 CO 0.00 0.95 -0.13 0.82 -0.60 0.00 0.00 178.31 179.35 2ksy h ILE 211 N -0.38 0.85 -0.68 -0.55 2.04 -1.25 -1.74 117.51 115.81 2ksy h ILE 211 Ca -0.03 -0.48 -0.05 0.00 1.00 0.00 0.00 64.86 65.29 2ksy h ILE 211 Cb 1.02 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 38.35 2ksy h ILE 211 CO 0.06 0.13 0.23 0.00 0.00 0.00 0.00 178.15 178.56 2ksy h ALA 212 N 1.87 0.88 0.01 1.87 0.00 0.28 -2.47 119.26 121.70 2ksy h ALA 212 Ca -0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2ksy h ALA 212 Cb 0.27 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2ksy h ALA 212 CO 0.02 0.54 -0.00 -0.07 0.00 0.00 0.00 179.25 179.73 2ksy h LEU 213 N 0.98 -0.01 -0.21 0.00 3.38 -0.49 -2.01 115.31 116.94 2ksy h LEU 213 Ca 0.22 -0.50 0.05 0.00 0.09 0.00 0.00 57.88 57.75 2ksy h LEU 213 Cb 0.27 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.97 2ksy h LEU 213 CO -0.01 0.49 -0.16 -0.78 0.09 0.00 0.00 178.44 178.07 2ksy h ASP 214 N -0.52 -0.53 0.42 -0.43 3.58 -1.41 0.40 116.42 117.93 2ksy h ASP 214 Ca -0.00 0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.54 2ksy h ASP 214 Cb 0.51 0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.83 2ksy h ASP 214 CO 0.00 -0.21 -0.20 0.00 -2.88 0.00 0.00 179.24 175.96 2ksy h ALA 215 N 0.96 -0.56 -0.95 -0.78 0.00 -1.53 -2.61 119.26 113.79 2ksy h ALA 215 Ca 0.13 -0.18 0.19 0.00 0.00 0.00 0.00 54.91 55.05 2ksy h ALA 215 Cb 0.35 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 18.28 2ksy h ALA 215 CO -0.31 -0.70 0.61 0.00 0.00 0.00 0.00 179.25 178.84 2ksy h ALA 216 N -0.32 1.97 -0.45 0.00 0.00 -1.23 0.82 119.26 120.06 2ksy h ALA 216 Ca -0.06 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2ksy h ALA 216 Cb 0.54 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2ksy h ALA 216 CO 0.09 -0.29 0.16 0.00 0.00 0.00 0.00 179.25 179.21 2ksy h ALA 217 N 1.62 0.58 -0.58 0.00 0.00 -0.81 -2.60 119.26 117.47 2ksy h ALA 217 Ca 0.51 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.21 2ksy h ALA 217 Cb 1.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 2ksy h ALA 217 CO -0.26 0.21 0.16 1.15 0.00 0.00 0.00 179.25 180.51 2ksy h THR 218 N 0.58 1.23 -0.15 0.00 2.02 -0.52 0.18 112.91 116.25 2ksy h THR 218 Ca 0.15 -0.81 0.03 0.00 0.77 0.00 0.00 66.41 66.54 2ksy h THR 218 Cb 0.23 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 2ksy h THR 218 CO -0.01 0.31 -0.05 -0.07 0.37 0.00 0.00 175.52 176.07 2ksy h LEU 219 N 0.85 -0.18 0.00 2.58 3.38 -0.74 -1.29 115.31 119.90 2ksy h LEU 219 Ca 0.19 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2ksy h LEU 219 Cb 0.28 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2ksy h LEU 219 CO -0.00 -0.07 -0.18 -2.11 0.09 0.00 0.00 178.44 176.17 2ksy n ARG 220 N -5.19 0.02 0.19 1.13 1.85 -1.03 -3.46 116.66 110.16 2ksy n ARG 220 Ca -0.03 0.01 0.12 0.00 -1.00 0.00 0.00 57.85 56.94 2ksy n ARG 220 Cb 0.12 -1.52 0.12 0.00 -1.05 0.00 0.00 32.46 30.13 2ksy n ARG 220 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2ksy h ALA 221 N 2.97 0.86 0.02 2.89 0.00 0.40 -3.32 119.26 123.07 2ksy h ALA 221 Ca 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.59 2ksy h ALA 221 Cb 0.52 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2ksy h ALA 221 CO 0.00 0.02 -1.80 -0.85 0.00 0.00 0.00 179.25 176.62 2ksy n GLU 222 N -2.99 0.66 -4.49 0.00 0.28 -0.59 -4.98 120.64 108.53 2ksy n GLU 222 Ca 0.03 0.28 -0.24 0.00 -0.16 0.00 0.00 57.16 57.07 2ksy n GLU 222 Cb 0.54 -1.76 -0.09 0.00 1.43 0.00 0.00 31.44 31.56 2ksy n GLU 222 CO 0.00 0.00 0.00 -3.38 -0.16 0.00 0.00 177.13 173.59 2ksy s HIS 223 N -2.58 1.85 0.01 -1.84 -3.43 -1.24 -5.10 115.29 102.95 2ksy s HIS 223 Ca -0.09 -1.13 -0.05 0.00 -0.80 0.00 0.00 55.06 53.00 2ksy s HIS 223 Cb 0.08 -1.22 -0.02 0.00 -1.43 0.00 0.00 32.58 29.99 2ksy s HIS 223 CO 0.81 -0.15 -0.10 0.41 -2.00 0.00 0.00 174.74 173.71 2ksy n GLY 224 N -0.81 -0.18 2.64 -1.38 0.00 -1.26 -4.68 105.19 99.52 2ksy n GLY 224 Ca -0.05 -0.09 -0.05 0.00 0.00 0.00 0.00 46.02 45.83 2ksy n GLY 224 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2ksy n GLU 225 N -3.74 -4.40 -3.74 1.61 4.07 -1.26 -5.07 120.64 108.11 2ksy n GLU 225 Ca -0.05 3.33 -0.14 0.00 -0.06 0.00 0.00 57.16 60.24 2ksy n GLU 225 Cb 0.19 -4.82 -0.09 0.00 -0.06 0.00 0.00 31.44 26.65 2ksy n GLU 225 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 2ksy s SER 226 N -0.66 -0.26 0.12 4.31 1.04 -1.26 -5.08 113.70 111.92 2ksy s SER 226 Ca -0.27 0.25 -0.20 0.00 0.48 0.00 0.00 55.95 56.21 2ksy s SER 226 Cb 0.02 0.41 -0.07 0.00 0.10 0.00 0.00 66.02 66.48 2ksy s SER 226 CO 0.75 -0.40 0.63 -0.76 0.98 0.00 0.00 173.24 174.44 2ksy s LEU 227 N -1.03 4.50 -0.16 2.42 1.43 -1.26 -4.62 118.68 119.97 2ksy s LEU 227 Ca -0.11 1.35 -0.01 0.00 -1.03 0.00 0.00 54.13 54.33 2ksy s LEU 227 Cb -0.04 -3.10 0.00 0.00 0.03 0.00 0.00 46.19 43.08 2ksy s LEU 227 CO 0.04 0.22 0.01 0.00 0.23 0.00 0.00 176.35 176.85 2ksy n ALA 228 N 1.49 -2.77 -2.77 4.21 0.00 -1.26 -5.00 120.51 114.40 2ksy n ALA 228 Ca -0.08 0.38 -0.32 0.00 0.00 0.00 0.00 53.44 53.43 2ksy n ALA 228 Cb 0.50 -0.99 -0.15 0.00 0.00 0.00 0.00 19.45 18.81 2ksy n ALA 228 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2ksy s GLY 229 N -1.24 1.39 0.03 0.00 0.00 -1.26 -5.13 107.32 101.11 2ksy s GLY 229 Ca -0.02 -1.00 -0.01 0.00 0.00 0.00 0.00 44.72 43.70 2ksy s GLY 229 CO 0.43 -0.57 0.15 -1.34 0.00 0.00 0.00 173.10 171.77 2ksy s VAL 230 N -0.15 5.14 -0.49 1.40 -7.23 -1.26 -5.08 120.40 112.73 2ksy s VAL 230 Ca -0.03 -0.37 -0.14 0.00 -1.81 0.00 0.00 61.98 59.63 2ksy s VAL 230 Cb -0.14 -3.44 0.10 0.00 0.56 0.00 0.00 36.38 33.47 2ksy s VAL 230 CO 0.04 0.24 0.41 -0.62 -0.31 0.00 0.00 175.10 174.86 2ksy s ASP 231 N -2.14 6.06 0.03 4.85 2.15 -1.26 -5.04 116.67 121.32 2ksy s ASP 231 Ca 0.29 -1.57 0.00 0.00 0.43 0.00 0.00 52.55 51.70 2ksy s ASP 231 Cb -0.13 -2.15 -0.03 0.00 -0.30 0.00 0.00 42.92 40.32 2ksy s ASP 231 CO 0.21 -0.72 -0.04 0.42 -0.17 0.00 0.00 175.17 174.88 2ksy s THR 232 N 1.57 0.22 -0.06 1.71 -4.23 -1.26 -5.08 115.64 108.51 2ksy s THR 232 Ca 0.04 -1.18 -0.09 0.00 -1.18 0.00 0.00 61.69 59.27 2ksy s THR 232 Cb -0.26 -0.66 -0.04 0.00 1.34 0.00 0.00 72.50 72.88 2ksy s THR 232 CO 0.04 -0.61 -0.18 0.47 -0.54 0.00 0.00 174.62 173.80 2ksy n ASP 233 N 1.17 1.47 -3.84 3.99 8.00 -1.26 -4.97 116.55 121.11 2ksy n ASP 233 Ca -0.21 0.23 -0.30 0.00 0.71 0.00 0.00 54.79 55.22 2ksy n ASP 233 Cb 0.57 -0.53 -0.15 0.00 -0.02 0.00 0.00 41.12 40.98 2ksy n ASP 233 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2ksy s THR 234 N -2.45 1.33 0.82 -3.53 2.01 -1.26 -5.13 115.64 107.43 2ksy s THR 234 Ca -0.16 -1.59 -0.11 0.00 0.31 0.00 0.00 61.69 60.14 2ksy s THR 234 Cb 0.03 -1.93 0.08 0.00 0.01 0.00 0.00 72.50 70.69 2ksy s THR 234 CO 0.23 -0.55 1.09 -2.16 -0.69 0.00 0.00 174.62 172.54 2ksy s PRO 235 N 1.40 1.92 -0.14 4.92 0.04 -1.26 -5.03 135.00 136.85 2ksy s PRO 235 Ca 0.07 0.82 -0.16 0.00 0.04 0.00 0.00 61.00 61.77 2ksy s PRO 235 Cb -0.18 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 2ksy s PRO 235 CO -0.17 -1.78 0.40 0.00 0.04 0.00 0.00 177.00 175.49 2ksy s ALA 236 N -3.03 3.52 0.14 8.56 0.00 -1.26 -5.08 121.76 124.63 2ksy s ALA 236 Ca 0.61 -0.30 -0.13 0.00 0.00 0.00 0.00 51.96 52.14 2ksy s ALA 236 Cb -0.16 -2.54 -0.07 0.00 0.00 0.00 0.00 23.12 20.35 2ksy s ALA 236 CO 0.56 0.04 0.53 0.54 0.00 0.00 0.00 175.76 177.42 2ksy s VAL 237 N 0.56 4.89 0.30 0.00 0.11 -1.26 -4.95 120.40 120.05 2ksy s VAL 237 Ca 0.22 0.75 0.00 0.00 -2.93 0.00 0.00 61.98 60.02 2ksy s VAL 237 Cb -0.14 -3.71 0.00 0.00 -1.53 0.00 0.00 36.38 30.99 2ksy s VAL 237 CO 0.08 0.23 0.00 0.00 -3.33 0.00 0.00 175.10 172.07 2ksy n ALA 238 N 0.74 -3.37 0.65 1.54 0.00 -1.26 -4.18 120.51 114.63 2ksy n ALA 238 Ca -0.05 0.41 0.08 0.00 0.00 0.00 0.00 53.44 53.87 2ksy n ALA 238 Cb 0.52 -1.16 0.06 0.00 0.00 0.00 0.00 19.45 18.87 2ksy n ALA 238 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2ksy n ASP 239 N -4.14 2.26 -0.09 0.00 5.68 -1.26 -4.33 116.55 114.68 2ksy n ASP 239 Ca 0.01 -1.63 0.13 0.00 -0.50 0.00 0.00 54.79 52.80 2ksy n ASP 239 Cb 0.60 0.02 0.45 0.00 -1.14 0.00 0.00 41.12 41.05 2ksy n ASP 239 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2ksy n LEU 240 N 0.83 0.51 -4.68 -2.12 -0.00 -1.26 -4.87 117.00 105.42 2ksy n LEU 240 Ca 0.09 0.03 -0.42 0.00 -0.00 0.00 0.00 56.01 55.71 2ksy n LEU 240 Cb 0.38 -0.24 -0.03 0.00 -0.00 0.00 0.00 43.42 43.53 2ksy n LEU 240 CO 0.10 0.11 1.40 -0.70 -0.00 0.00 0.00 177.39 178.30 2ksy s GLU 241 N -2.73 4.18 0.55 1.47 2.56 -1.26 -4.96 118.70 118.51 2ksy s GLU 241 Ca 0.20 2.38 -0.20 0.00 0.00 0.00 0.00 54.97 57.35 2ksy s GLU 241 Cb 0.19 -3.80 -0.05 0.00 2.00 0.00 0.00 34.13 32.47 2ksy s GLU 241 CO 0.56 -0.81 1.18 -1.01 -0.56 0.00 0.00 175.26 174.62 2ksy s HIS 242 N 3.33 2.57 0.00 5.30 3.76 -1.26 -4.92 115.29 124.07 2ksy s HIS 242 Ca 0.77 1.52 0.00 0.00 -0.15 0.00 0.00 55.06 57.20 2ksy s HIS 242 Cb -0.39 -3.42 0.00 0.00 1.11 0.00 0.00 32.58 29.88 2ksy s HIS 242 CO 0.34 -1.92 0.00 -2.39 -0.85 0.00 0.00 174.74 169.92 2ksy n HIS 243 N -1.25 0.00 -2.86 1.40 1.44 -1.26 -5.10 115.22 107.59 2ksy n HIS 243 Ca 0.12 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.42 2ksy n HIS 243 Cb 0.49 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.55 2ksy n HIS 243 CO 0.00 0.00 0.00 -3.38 -2.81 0.00 0.00 176.34 170.15 2ksy s HIS 244 N 0.00 3.85 0.20 -1.40 -3.43 -1.26 -4.90 115.29 108.34 2ksy s HIS 244 Ca 0.00 1.69 0.00 0.00 -0.80 0.00 0.00 55.06 55.95 2ksy s HIS 244 Cb 0.00 -2.91 0.00 0.00 -1.43 0.00 0.00 32.58 28.24 2ksy s HIS 244 CO 0.00 0.34 0.00 0.72 -2.00 0.00 0.00 174.74 173.80 2ksy n HIS 245 N 2.28 -2.94 -0.04 0.38 8.25 -1.26 -4.46 115.22 117.42 2ksy n HIS 245 Ca -0.02 1.05 -0.13 0.00 -0.26 0.00 0.00 57.72 58.36 2ksy n HIS 245 Cb 0.49 -1.84 -0.11 0.00 1.12 0.00 0.00 29.99 29.65 2ksy n HIS 245 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2ksy h HIS 246 N -0.78 -0.00 -0.02 4.41 -0.00 -2.03 -3.53 115.15 113.19 2ksy h HIS 246 Ca 0.02 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.39 2ksy h HIS 246 Cb 0.77 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.18 2ksy h HIS 246 CO 0.00 0.73 0.00 -2.39 -0.00 0.00 0.00 177.93 176.27