#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 0.09 3.17 3.14 -1.26 -4.96 118.33 118.50 2ksy n VAL 2 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2ksy n VAL 2 Cb 0.00 0.19 0.00 0.00 -1.06 0.00 0.00 33.84 32.97 2ksy n VAL 2 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2ksy n GLY 3 N 0.00 -0.92 0.35 7.55 0.00 -1.26 -4.92 105.19 106.00 2ksy n GLY 3 Ca 0.00 0.15 0.09 0.00 0.00 0.00 0.00 46.02 46.26 2ksy n GLY 3 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ksy h LEU 4 N 0.00 0.57 -0.88 0.99 3.38 -1.96 -1.75 115.31 115.66 2ksy h LEU 4 Ca 0.00 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 2ksy h LEU 4 Cb 0.00 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 2ksy h LEU 4 CO 0.00 0.35 0.26 0.71 0.09 0.00 0.00 178.44 179.85 2ksy h THR 5 N 0.64 1.25 -0.87 0.22 1.35 -1.92 -2.74 112.91 110.84 2ksy h THR 5 Ca 0.32 -0.82 0.18 0.00 -0.55 0.00 0.00 66.41 65.54 2ksy h THR 5 Cb 0.41 0.43 -0.06 0.00 -1.73 0.00 0.00 68.15 67.19 2ksy h THR 5 CO -0.11 0.33 0.57 0.71 -0.25 0.00 0.00 175.52 176.77 2ksy h THR 6 N 1.05 0.73 0.31 6.82 1.35 -1.65 -1.79 112.91 119.73 2ksy h THR 6 Ca 0.24 -0.16 -0.02 0.00 -0.55 0.00 0.00 66.41 65.92 2ksy h THR 6 Cb 0.24 0.22 0.00 0.00 -1.73 0.00 0.00 68.15 66.89 2ksy h THR 6 CO -0.01 0.09 -0.15 -0.07 -0.25 0.00 0.00 175.52 175.12 2ksy h LEU 7 N 0.47 -0.35 -1.76 3.87 -0.00 -1.55 -1.55 115.31 114.44 2ksy h LEU 7 Ca 0.45 -0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 58.30 2ksy h LEU 7 Cb 1.01 0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 41.76 2ksy h LEU 7 CO -0.18 -0.23 -0.04 -0.26 -0.00 0.00 0.00 178.44 177.74 2ksy h PHE 8 N -0.45 0.10 -0.39 1.13 0.04 -1.45 -1.24 116.94 114.69 2ksy h PHE 8 Ca -0.04 -0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.65 2ksy h PHE 8 Cb 0.34 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.44 2ksy h PHE 8 CO -0.05 0.15 -0.04 -1.49 -0.60 0.00 0.00 178.31 176.28 2ksy h TRP 9 N 0.11 0.79 -0.06 -0.55 -0.00 -1.00 -1.26 115.95 113.97 2ksy h TRP 9 Ca 0.03 -0.15 -0.01 0.00 -0.00 0.00 0.00 58.89 58.75 2ksy h TRP 9 Cb 0.14 -0.20 -0.00 0.00 -0.00 0.00 0.00 29.16 29.10 2ksy h TRP 9 CO 0.00 0.82 0.01 -0.07 -0.00 0.00 0.00 178.44 179.20 2ksy h LEU 10 N 0.53 0.11 -1.78 -4.49 3.38 -0.62 -2.28 115.31 110.16 2ksy h LEU 10 Ca 0.10 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.84 2ksy h LEU 10 Cb 0.54 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 2ksy h LEU 10 CO 0.03 0.35 0.23 1.23 0.09 0.00 0.00 178.44 180.37 2ksy h GLY 11 N -0.15 0.33 1.52 0.83 0.00 -1.21 -0.84 103.07 103.55 2ksy h GLY 11 Ca 0.02 -0.11 -0.12 0.00 0.00 0.00 0.00 47.33 47.12 2ksy h GLY 11 CO 0.00 0.09 -0.34 0.00 0.00 0.00 0.00 176.54 176.29 2ksy h ALA 12 N 1.81 0.94 0.31 3.60 0.00 -0.93 -1.61 119.26 123.37 2ksy h ALA 12 Ca 0.15 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2ksy h ALA 12 Cb 0.23 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2ksy h ALA 12 CO -0.03 0.62 -0.15 0.82 0.00 0.00 0.00 179.25 180.51 2ksy h ILE 13 N 0.46 0.72 -0.27 0.00 1.08 -0.59 -1.51 117.51 117.39 2ksy h ILE 13 Ca 0.05 -0.43 -0.01 0.00 -0.39 0.00 0.00 64.86 64.09 2ksy h ILE 13 Cb 0.82 0.94 -0.01 0.00 -3.07 0.00 0.00 36.82 35.50 2ksy h ILE 13 CO 0.07 0.09 0.14 1.23 -0.69 0.00 0.00 178.15 178.99 2ksy h GLY 14 N -0.65 0.39 0.79 5.37 0.00 -1.44 -2.61 103.07 104.91 2ksy h GLY 14 Ca -0.04 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 2ksy h GLY 14 CO 0.07 0.16 -0.04 1.98 0.00 0.00 0.00 176.54 178.71 2ksy h MET 15 N 0.37 -0.10 -0.97 4.80 1.85 -1.12 -2.55 114.93 117.21 2ksy h MET 15 Ca 0.10 0.01 0.15 0.00 -0.61 0.00 0.00 59.70 59.35 2ksy h MET 15 Cb 0.02 0.02 -0.10 0.00 0.43 0.00 0.00 31.60 31.98 2ksy h MET 15 CO -0.02 0.13 0.58 1.25 -0.40 0.00 0.00 176.91 178.45 2ksy h LEU 16 N -0.32 0.79 -0.72 3.39 7.12 -0.92 0.32 115.31 124.97 2ksy h LEU 16 Ca -0.01 0.08 0.01 0.00 0.13 0.00 0.00 57.88 58.08 2ksy h LEU 16 Cb 0.28 -0.07 -0.04 0.00 -0.53 0.00 0.00 40.66 40.30 2ksy h LEU 16 CO 0.02 0.35 0.48 0.58 -0.13 0.00 0.00 178.44 179.73 2ksy h VAL 17 N 0.82 1.18 -0.41 1.05 2.07 -1.26 -2.57 116.25 117.14 2ksy h VAL 17 Ca 0.52 -0.33 -0.06 0.00 0.82 0.00 0.00 66.70 67.64 2ksy h VAL 17 Cb 0.68 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2ksy h VAL 17 CO -0.33 0.18 0.01 1.23 0.02 0.00 0.00 177.57 178.67 2ksy h GLY 18 N 0.98 0.78 0.03 2.17 0.00 -0.60 -2.34 103.07 104.08 2ksy h GLY 18 Ca 0.27 -0.57 0.14 0.00 0.00 0.00 0.00 47.33 47.16 2ksy h GLY 18 CO -0.06 0.52 0.13 -0.84 0.00 0.00 0.00 176.54 176.29 2ksy h THR 19 N 0.55 0.56 -0.26 4.70 2.02 -0.69 -0.77 112.91 119.02 2ksy h THR 19 Ca 0.12 -0.08 -0.19 0.00 0.77 0.00 0.00 66.41 67.02 2ksy h THR 19 Cb 0.47 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 2ksy h THR 19 CO 0.02 0.04 -0.60 -0.07 0.37 0.00 0.00 175.52 175.28 2ksy h LEU 20 N 0.24 0.97 -1.69 2.58 3.38 -1.41 -1.09 115.31 118.29 2ksy h LEU 20 Ca 0.36 -0.55 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 2ksy h LEU 20 Cb 0.58 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2ksy h LEU 20 CO -0.47 1.35 0.01 0.00 0.09 0.00 0.00 178.44 179.41 2ksy h ALA 21 N 0.66 1.76 0.04 1.53 0.00 -0.72 -0.16 119.26 122.37 2ksy h ALA 21 Ca -0.00 -0.08 -0.32 0.00 0.00 0.00 0.00 54.91 54.51 2ksy h ALA 21 Cb 1.21 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2ksy h ALA 21 CO 0.13 0.19 -1.84 1.19 0.00 0.00 0.00 179.25 178.92 2ksy n PHE 22 N -4.42 1.03 -0.01 0.00 3.72 -0.40 -3.41 117.46 113.96 2ksy n PHE 22 Ca -0.01 0.31 -0.13 0.00 -0.05 0.00 0.00 57.45 57.57 2ksy n PHE 22 Cb 0.15 -1.17 -0.10 0.00 -0.94 0.00 0.00 39.48 37.42 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 0.69 -0.00 -0.22 4.37 0.00 -0.96 0.23 119.26 123.37 2ksy h ALA 23 Ca -0.34 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.33 2ksy h ALA 23 Cb 2.03 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.81 2ksy h ALA 23 CO 0.08 -0.27 0.12 2.35 0.00 0.00 0.00 179.25 181.53 2ksy h TRP 24 N -0.47 0.31 0.00 0.00 2.91 -1.22 -1.47 115.95 116.01 2ksy h TRP 24 Ca -0.00 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.01 2ksy h TRP 24 Cb 0.46 -0.10 0.00 0.00 -0.51 0.00 0.00 29.16 29.02 2ksy h TRP 24 CO 0.09 0.27 0.00 0.00 -1.03 0.00 0.00 178.44 177.77 2ksy h ALA 25 N 1.01 1.00 -0.07 2.65 0.00 -1.62 -3.24 119.26 118.99 2ksy h ALA 25 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2ksy h ALA 25 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2ksy h ALA 25 CO -0.01 0.00 -0.33 0.78 0.00 0.00 0.00 179.25 179.69 2ksy h GLY 26 N 3.07 0.38 1.99 0.00 0.00 0.04 -3.18 103.07 105.36 2ksy h GLY 26 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 47.33 46.80 2ksy h GLY 26 CO 0.00 0.47 0.00 3.21 0.00 0.00 0.00 176.54 180.22 2ksy h ARG 27 N -0.16 0.00 -4.25 4.80 3.08 -1.31 -3.35 114.38 113.19 2ksy h ARG 27 Ca -0.02 0.00 -0.73 0.00 0.07 0.00 0.00 59.98 59.30 2ksy h ARG 27 Cb 0.99 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 30.74 2ksy h ARG 27 CO 0.07 0.00 -0.37 0.34 -1.07 0.00 0.00 179.97 178.94 2ksy s ASP 28 N -6.38 5.72 0.00 7.04 2.15 -1.20 -5.01 116.67 118.99 2ksy s ASP 28 Ca -0.05 -1.98 0.00 0.00 0.43 0.00 0.00 52.55 50.95 2ksy s ASP 28 Cb 0.16 -2.01 0.00 0.00 -0.30 0.00 0.00 42.92 40.76 2ksy s ASP 28 CO 0.58 -0.68 0.00 0.00 -0.17 0.00 0.00 175.17 174.90 2ksy n ALA 29 N 4.82 0.00 -1.48 3.66 0.00 -1.26 -4.86 120.51 121.39 2ksy n ALA 29 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2ksy n ALA 29 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 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 0.00 0.94 3.02 0.00 0.00 -1.26 -5.08 105.19 102.82 2ksy n GLY 30 Ca 0.00 -0.54 -0.27 0.00 0.00 0.00 0.00 46.02 45.21 2ksy n GLY 30 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ksy s SER 31 N -1.00 2.20 0.00 1.61 0.15 -1.26 -4.73 113.70 110.67 2ksy s SER 31 Ca 0.00 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.28 2ksy s SER 31 Cb 0.00 -0.97 0.00 0.00 -1.71 0.00 0.00 66.02 63.34 2ksy s SER 31 CO 0.00 -0.00 0.00 0.61 1.20 0.00 0.00 173.24 175.05 2ksy n GLY 32 N 4.21 2.68 0.14 9.45 0.00 -1.26 -4.87 105.19 115.53 2ksy n GLY 32 Ca -0.19 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.93 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 1.08 0.00 -0.75 1.61 4.39 -2.00 -3.34 114.58 115.57 2ksy h GLU 33 Ca 0.00 0.00 0.19 0.00 0.34 0.00 0.00 59.36 59.89 2ksy h GLU 33 Cb 0.00 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.61 2ksy h GLU 33 CO 0.00 0.06 0.52 -0.09 -1.16 0.00 0.00 179.01 178.34 2ksy h ARG 34 N 0.00 0.17 -0.50 2.33 2.43 -1.89 -0.55 114.38 116.36 2ksy h ARG 34 Ca -0.02 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 2ksy h ARG 34 Cb 1.09 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.58 2ksy h ARG 34 CO 0.01 0.11 0.27 -0.09 -1.51 0.00 0.00 179.97 178.76 2ksy h ARG 35 N 0.18 0.70 -0.05 0.20 9.65 -1.99 -0.62 114.38 122.45 2ksy h ARG 35 Ca 0.37 -0.08 -0.10 0.00 -1.10 0.00 0.00 59.98 59.07 2ksy h ARG 35 Cb 1.19 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.62 2ksy h ARG 35 CO -0.06 0.55 -0.42 1.88 2.80 0.00 0.00 179.97 184.72 2ksy h TYR 36 N 0.67 0.12 0.18 2.20 -1.99 -1.36 -2.44 116.97 114.34 2ksy h TYR 36 Ca 0.18 -0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.87 2ksy h TYR 36 Cb 0.05 -0.03 0.00 0.00 2.00 0.00 0.00 36.73 38.76 2ksy h TYR 36 CO -0.02 0.51 -0.08 1.88 -0.00 0.00 0.00 178.16 180.45 2ksy h TYR 37 N 0.09 -0.22 -0.76 4.88 0.05 -0.93 -1.88 116.97 118.19 2ksy h TYR 37 Ca 0.01 -0.01 0.08 0.00 0.05 0.00 0.00 58.73 58.86 2ksy h TYR 37 Cb 0.78 0.07 -0.05 0.00 1.01 0.00 0.00 36.73 38.54 2ksy h TYR 37 CO 0.01 0.20 0.50 0.28 -1.05 0.00 0.00 178.16 178.09 2ksy h VAL 38 N -0.76 0.98 -0.16 -2.88 2.07 -1.14 -0.31 116.25 114.05 2ksy h VAL 38 Ca -0.02 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 2ksy h VAL 38 Cb 0.51 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2ksy h VAL 38 CO 0.04 0.13 0.05 0.74 0.02 0.00 0.00 177.57 178.56 2ksy h THR 39 N 0.74 1.18 -0.28 2.57 2.02 -1.42 0.05 112.91 117.76 2ksy h THR 39 Ca 0.34 -0.55 0.02 0.00 0.77 0.00 0.00 66.41 66.99 2ksy h THR 39 Cb 0.36 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 2ksy h THR 39 CO -0.12 0.17 0.13 0.25 0.37 0.00 0.00 175.52 176.32 2ksy h LEU 40 N 0.08 0.19 -1.52 2.58 5.85 -0.43 -1.14 115.31 120.92 2ksy h LEU 40 Ca 0.05 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2ksy h LEU 40 Cb 0.22 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 2ksy h LEU 40 CO -0.00 0.14 0.28 0.58 -0.34 0.00 0.00 178.44 179.10 2ksy h VAL 41 N 0.28 1.13 -0.72 1.05 2.07 -0.98 -1.50 116.25 117.57 2ksy h VAL 41 Ca 0.12 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.38 2ksy h VAL 41 Cb 0.05 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 2ksy h VAL 41 CO -0.09 0.13 0.48 1.23 0.02 0.00 0.00 177.57 179.33 2ksy h GLY 42 N 0.64 1.01 0.75 2.17 0.00 0.27 -0.75 103.07 107.16 2ksy h GLY 42 Ca 0.16 -0.38 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 2ksy h GLY 42 CO -0.03 0.37 -0.29 -2.22 0.00 0.00 0.00 176.54 174.37 2ksy h ILE 43 N 0.97 0.24 -0.07 2.60 2.04 -0.76 -2.22 117.51 120.32 2ksy h ILE 43 Ca 0.26 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.81 2ksy h ILE 43 Cb -0.11 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.30 2ksy h ILE 43 CO -0.06 0.03 0.14 0.28 0.00 0.00 0.00 178.15 178.55 2ksy h SER 44 N -1.07 0.00 0.16 1.72 0.02 -1.34 -1.90 113.55 111.14 2ksy h SER 44 Ca -0.08 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 2ksy h SER 44 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 2ksy h SER 44 CO 0.14 0.00 -0.08 1.23 -1.14 0.00 0.00 176.83 176.98 2ksy h GLY 45 N 0.00 -0.22 1.19 -3.77 0.00 -0.95 -2.52 103.07 96.80 2ksy h GLY 45 Ca 0.04 0.08 0.04 0.00 0.00 0.00 0.00 47.33 47.49 2ksy h GLY 45 CO -0.00 -0.08 0.44 0.16 0.00 0.00 0.00 176.54 177.06 2ksy h ILE 46 N -1.04 1.06 -0.23 2.60 3.07 -1.22 -2.29 117.51 119.46 2ksy h ILE 46 Ca -0.02 -0.26 -0.05 0.00 1.55 0.00 0.00 64.86 66.08 2ksy h ILE 46 Cb 0.23 0.25 -0.01 0.00 -0.27 0.00 0.00 36.82 37.03 2ksy h ILE 46 CO 0.04 0.14 -0.06 0.00 -1.05 0.00 0.00 178.15 177.22 2ksy h ALA 47 N 1.63 0.31 -0.66 0.16 0.00 -1.47 -2.13 119.26 117.09 2ksy h ALA 47 Ca 0.27 -0.26 0.09 0.00 0.00 0.00 0.00 54.91 55.01 2ksy h ALA 47 Cb 0.14 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 2ksy h ALA 47 CO -0.08 0.11 0.30 0.00 0.00 0.00 0.00 179.25 179.57 2ksy h ALA 48 N 0.75 0.89 -0.07 0.00 0.00 -0.95 -1.02 119.26 118.86 2ksy h ALA 48 Ca 0.06 0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 2ksy h ALA 48 Cb 0.51 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2ksy h ALA 48 CO 0.02 -0.11 -0.71 -0.39 0.00 0.00 0.00 179.25 178.07 2ksy h VAL 49 N 0.52 1.39 -0.25 0.00 -1.51 -1.49 -2.76 116.25 112.15 2ksy h VAL 49 Ca 0.33 -2.14 -0.07 0.00 -1.23 0.00 0.00 66.70 63.58 2ksy h VAL 49 Cb 0.36 2.11 -0.01 0.00 -2.13 0.00 0.00 31.29 31.62 2ksy h VAL 49 CO -0.28 0.64 -0.17 0.00 -1.23 0.00 0.00 177.57 176.53 2ksy h ALA 50 N 1.01 1.25 -0.05 5.19 0.00 -0.66 -1.96 119.26 124.04 2ksy h ALA 50 Ca -0.02 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 2ksy h ALA 50 Cb 1.27 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2ksy h ALA 50 CO 0.12 0.49 -0.22 1.88 0.00 0.00 0.00 179.25 181.52 2ksy h TYR 51 N 0.40 0.32 -0.60 0.00 -1.99 -1.18 -2.08 116.97 111.85 2ksy h TYR 51 Ca 0.07 -0.14 0.02 0.00 2.00 0.00 0.00 58.73 60.69 2ksy h TYR 51 Cb 0.53 -0.05 -0.04 0.00 2.00 0.00 0.00 36.73 39.17 2ksy h TYR 51 CO 0.02 0.84 0.37 0.00 -0.00 0.00 0.00 178.16 179.39 2ksy h ALA 52 N 0.42 0.77 0.09 3.88 0.00 -1.39 0.10 119.26 123.13 2ksy h ALA 52 Ca -0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2ksy h ALA 52 Cb 0.86 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2ksy h ALA 52 CO 0.05 0.11 -0.04 -0.39 0.00 0.00 0.00 179.25 178.97 2ksy h VAL 53 N 0.73 1.16 -0.08 0.00 -1.51 -1.43 -2.92 116.25 112.20 2ksy h VAL 53 Ca 0.24 -1.05 0.02 0.00 -1.23 0.00 0.00 66.70 64.68 2ksy h VAL 53 Cb 0.01 1.82 -0.00 0.00 -2.13 0.00 0.00 31.29 30.98 2ksy h VAL 53 CO -0.10 0.25 0.06 -0.03 -1.23 0.00 0.00 177.57 176.53 2ksy h MET 54 N -0.62 0.00 -0.11 5.19 -1.53 -1.30 -0.39 114.93 116.17 2ksy h MET 54 Ca -0.01 0.00 -0.09 0.00 -3.44 0.00 0.00 59.70 56.16 2ksy h MET 54 Cb 0.50 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.54 2ksy h MET 54 CO 0.02 0.00 -0.34 0.00 0.14 0.00 0.00 176.91 176.73 2ksy h ALA 55 N 1.95 1.22 0.00 0.39 0.00 -0.71 -2.52 119.26 119.59 2ksy h ALA 55 Ca 0.04 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2ksy h ALA 55 Cb 0.16 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2ksy h ALA 55 CO -0.00 0.53 0.00 1.28 0.00 0.00 0.00 179.25 181.06 2ksy n LEU 56 N -4.09 0.66 0.00 0.00 4.77 -0.18 -4.68 117.00 113.49 2ksy n LEU 56 Ca -0.01 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 2ksy n LEU 56 Cb 0.42 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2ksy n LEU 56 CO 0.41 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 2ksy n GLY 57 N 0.17 1.89 3.77 -0.72 0.00 -0.95 -5.00 105.19 104.34 2ksy n GLY 57 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2ksy n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ksy s VAL 58 N -3.42 2.67 0.00 1.61 1.01 -1.09 -2.54 120.40 118.64 2ksy s VAL 58 Ca 0.00 0.61 0.00 0.00 0.00 0.00 0.00 61.98 62.59 2ksy s VAL 58 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 33.02 2ksy s VAL 58 CO 0.00 0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.81 2ksy n GLY 59 N 0.68 3.07 3.55 4.51 0.00 -1.26 -4.08 105.19 111.66 2ksy n GLY 59 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.59 1.08 -0.18 1.61 0.52 -1.05 -2.38 118.94 116.94 2ksy s TRP 60 Ca 0.00 1.61 -0.12 0.00 0.02 0.00 0.00 56.10 57.61 2ksy s TRP 60 Cb 0.00 -3.57 -0.05 0.00 -1.15 0.00 0.00 33.47 28.70 2ksy s TRP 60 CO 0.00 -2.45 0.20 0.54 0.02 0.00 0.00 176.95 175.26 2ksy s VAL 61 N 12.44 5.36 0.22 4.03 0.11 -0.26 -4.98 120.40 137.32 2ksy s VAL 61 Ca 0.97 0.35 -0.30 0.00 -2.93 0.00 0.00 61.98 60.07 2ksy s VAL 61 Cb -0.17 -3.54 -0.09 0.00 -1.53 0.00 0.00 36.38 31.05 2ksy s VAL 61 CO 0.24 0.41 1.21 -2.84 -3.33 0.00 0.00 175.10 170.79 2ksy s PRO 62 N 0.44 4.49 -0.42 1.54 0.02 -1.26 -2.29 135.00 137.52 2ksy s PRO 62 Ca 0.12 1.92 0.02 0.00 0.02 0.00 0.00 61.00 63.08 2ksy s PRO 62 Cb -0.12 -3.21 0.14 0.00 0.02 0.00 0.00 34.50 31.33 2ksy s PRO 62 CO 0.01 -0.07 0.23 0.08 -0.33 0.00 0.00 177.00 176.92 2ksy s VAL 63 N -0.34 1.10 0.00 3.83 1.01 0.36 -4.94 120.40 121.43 2ksy s VAL 63 Ca 0.51 -2.36 0.00 0.00 0.00 0.00 0.00 61.98 60.13 2ksy s VAL 63 Cb -0.34 -1.78 0.00 0.00 0.00 0.00 0.00 36.38 34.26 2ksy s VAL 63 CO 0.39 -0.92 0.00 0.00 0.00 0.00 0.00 175.10 174.57 2ksy n ALA 64 N 3.65 0.00 0.00 5.51 0.00 -1.26 0.04 120.51 128.45 2ksy n ALA 64 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2ksy n ALA 64 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.80 2ksy n ALA 64 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2ksy n GLU 65 N 0.00 1.41 -3.04 0.00 0.28 -1.26 -5.06 120.64 112.96 2ksy n GLU 65 Ca 0.00 0.00 -0.21 0.00 -0.16 0.00 0.00 57.16 56.79 2ksy n GLU 65 Cb 0.00 -0.88 0.01 0.00 1.43 0.00 0.00 31.44 32.00 2ksy n GLU 65 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2ksy s ARG 66 N -1.53 2.97 -0.10 3.44 0.52 0.11 -5.11 118.95 119.23 2ksy s ARG 66 Ca 0.00 -0.72 0.00 0.00 -0.52 0.00 0.00 55.73 54.49 2ksy s ARG 66 Cb 0.00 -2.62 0.02 0.00 0.52 0.00 0.00 34.95 32.87 2ksy s ARG 66 CO 0.00 -0.27 -0.09 0.99 0.02 0.00 0.00 175.30 175.95 2ksy s THR 67 N -2.48 1.07 0.04 0.02 2.01 -1.26 -0.48 115.64 114.55 2ksy s THR 67 Ca 0.50 -0.34 0.04 0.00 0.31 0.00 0.00 61.69 62.20 2ksy s THR 67 Cb -0.10 -1.06 -0.04 0.00 0.01 0.00 0.00 72.50 71.32 2ksy s THR 67 CO 0.36 0.37 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.90 2ksy s VAL 68 N 1.46 3.62 -0.36 3.82 1.01 -0.97 -4.99 120.40 123.99 2ksy s VAL 68 Ca 0.01 -0.92 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 2ksy s VAL 68 Cb -0.13 -2.62 0.01 0.00 0.00 0.00 0.00 36.38 33.63 2ksy s VAL 68 CO -0.06 0.29 0.23 -0.36 0.00 0.00 0.00 175.10 175.21 2ksy s PHE 69 N -1.09 3.23 0.27 5.22 0.08 -1.26 -1.11 117.98 123.32 2ksy s PHE 69 Ca 0.19 -0.56 0.04 0.00 0.12 0.00 0.00 56.93 56.72 2ksy s PHE 69 Cb -0.11 -2.47 0.38 0.00 -0.57 0.00 0.00 43.02 40.24 2ksy s PHE 69 CO 0.10 -0.51 1.66 -0.24 -0.10 0.00 0.00 175.22 176.14 2ksy h VAL 70 N 5.65 1.31 0.00 -0.44 3.04 -1.81 -3.12 116.25 120.89 2ksy h VAL 70 Ca -0.29 -1.57 -0.02 0.00 -1.01 0.00 0.00 66.70 63.81 2ksy h VAL 70 Cb 1.13 1.67 -0.00 0.00 -2.01 0.00 0.00 31.29 32.08 2ksy h VAL 70 CO 0.66 0.47 -0.11 -0.65 -1.01 0.00 0.00 177.57 176.94 2ksy h PRO 71 N 0.27 0.00 0.29 4.17 0.11 -1.85 -2.28 132.00 132.70 2ksy h PRO 71 Ca 0.02 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 2ksy h PRO 71 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2ksy h PRO 71 CO 0.07 0.11 -0.14 -0.09 -0.21 0.00 0.00 178.00 177.74 2ksy h ARG 72 N 0.00 -0.38 -0.12 1.05 2.43 -1.90 -0.14 114.38 115.32 2ksy h ARG 72 Ca -0.00 0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 59.03 2ksy h ARG 72 Cb 0.56 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 2ksy h ARG 72 CO 0.01 -0.04 -0.62 1.88 -1.51 0.00 0.00 179.97 179.69 2ksy h TYR 73 N -0.82 0.56 -0.54 2.20 0.05 -1.67 -2.70 116.97 114.04 2ksy h TYR 73 Ca -0.04 -0.22 -0.09 0.00 0.05 0.00 0.00 58.73 58.43 2ksy h TYR 73 Cb 0.51 -0.10 -0.02 0.00 1.01 0.00 0.00 36.73 38.14 2ksy h TYR 73 CO 0.04 0.94 -0.02 0.97 -1.05 0.00 0.00 178.16 179.04 2ksy h ILE 74 N 0.32 1.26 -0.76 -2.88 -0.00 -1.47 -1.92 117.51 112.05 2ksy h ILE 74 Ca -0.01 -1.11 0.00 0.00 -0.00 0.00 0.00 64.86 63.75 2ksy h ILE 74 Cb 1.17 0.86 -0.04 0.00 -0.00 0.00 0.00 36.82 38.81 2ksy h ILE 74 CO 0.11 0.39 0.49 -0.78 -0.00 0.00 0.00 178.15 178.37 2ksy h ASP 75 N 0.86 0.88 -0.18 2.19 3.58 -0.86 -0.78 116.42 122.11 2ksy h ASP 75 Ca 0.16 -0.03 -0.07 0.00 0.42 0.00 0.00 57.03 57.50 2ksy h ASP 75 Cb 0.53 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.34 2ksy h ASP 75 CO 0.03 0.65 -0.12 -0.50 -2.88 0.00 0.00 179.24 176.42 2ksy h TRP 76 N 1.04 0.59 -0.11 0.28 6.55 -1.07 0.31 115.95 123.53 2ksy h TRP 76 Ca 0.28 -0.09 -0.07 0.00 0.95 0.00 0.00 58.89 59.95 2ksy h TRP 76 Cb -0.10 -0.16 -0.01 0.00 -0.86 0.00 0.00 29.16 28.03 2ksy h TRP 76 CO 0.00 0.65 -0.26 0.82 -1.05 0.00 0.00 178.44 178.61 2ksy h ILE 77 N 0.51 1.23 0.00 1.49 2.04 -0.42 0.36 117.51 122.72 2ksy h ILE 77 Ca 0.09 -1.09 -0.04 0.00 1.00 0.00 0.00 64.86 64.82 2ksy h ILE 77 Cb 0.51 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 2ksy h ILE 77 CO 0.03 0.33 -1.25 0.18 0.00 0.00 0.00 178.15 177.43 2ksy n LEU 78 N -4.17 0.72 -0.10 1.44 4.77 -0.80 -4.38 117.00 114.49 2ksy n LEU 78 Ca -0.01 0.29 -0.20 0.00 -0.03 0.00 0.00 56.01 56.06 2ksy n LEU 78 Cb 0.36 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.37 2ksy n LEU 78 CO 0.39 -0.08 -1.08 0.35 -1.33 0.00 0.00 177.39 175.64 2ksy n THR 79 N -2.67 1.36 -0.13 -5.08 -2.24 0.10 -4.34 114.28 101.29 2ksy n THR 79 Ca -0.03 -0.17 -0.06 0.00 -2.27 0.00 0.00 64.05 61.52 2ksy n THR 79 Cb 0.63 -1.96 0.00 0.00 -2.10 0.00 0.00 70.33 66.90 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 -0.86 0.29 0.00 4.28 2.02 -0.47 0.31 112.91 118.49 2ksy h THR 80 Ca -0.41 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.77 2ksy h THR 80 Cb 1.31 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 68.01 2ksy h THR 80 CO -0.25 0.00 -0.01 -0.65 0.37 0.00 0.00 175.52 174.98 2ksy h PRO 81 N -0.19 0.00 0.03 6.66 0.11 -1.76 -1.69 132.00 135.15 2ksy h PRO 81 Ca 0.19 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 66.06 2ksy h PRO 81 Cb 0.51 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.62 2ksy h PRO 81 CO -0.54 0.01 -1.03 1.25 -0.21 0.00 0.00 178.00 177.48 2ksy h LEU 82 N 0.00 0.60 0.11 2.35 5.85 -0.61 -1.94 115.31 121.66 2ksy h LEU 82 Ca -0.00 -0.51 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 2ksy h LEU 82 Cb 0.07 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.92 2ksy h LEU 82 CO 0.00 1.32 -0.05 0.40 -0.34 0.00 0.00 178.44 179.76 2ksy h ILE 83 N 0.23 1.08 -0.19 4.05 5.03 -0.38 -1.60 117.51 125.73 2ksy h ILE 83 Ca -0.10 -0.88 -0.00 0.00 -0.12 0.00 0.00 64.86 63.76 2ksy h ILE 83 Cb 1.68 1.62 -0.01 0.00 -3.03 0.00 0.00 36.82 37.08 2ksy h ILE 83 CO 0.18 0.21 0.12 -0.37 -0.68 0.00 0.00 178.15 177.61 2ksy h VAL 84 N -0.57 1.06 -0.07 1.67 -1.51 -1.57 0.13 116.25 115.38 2ksy h VAL 84 Ca -0.02 -0.12 -0.07 0.00 -1.23 0.00 0.00 66.70 65.26 2ksy h VAL 84 Cb 0.46 0.78 -0.01 0.00 -2.13 0.00 0.00 31.29 30.39 2ksy h VAL 84 CO 0.03 0.06 -0.30 0.22 -1.23 0.00 0.00 177.57 176.34 2ksy h TYR 85 N 0.26 0.15 0.16 5.19 3.20 -1.18 -1.42 116.97 123.32 2ksy h TYR 85 Ca 0.07 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 2ksy h TYR 85 Cb -0.01 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.22 2ksy h TYR 85 CO 0.00 0.43 -0.08 0.35 -1.64 0.00 0.00 178.16 177.22 2ksy h PHE 86 N 0.12 -0.20 0.00 -3.82 3.04 0.27 -1.52 116.94 114.83 2ksy h PHE 86 Ca 0.02 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.93 2ksy h PHE 86 Cb 0.59 0.07 -0.01 0.00 2.56 0.00 0.00 35.95 39.16 2ksy h PHE 86 CO 0.01 -0.02 -0.17 -0.07 -2.02 0.00 0.00 178.31 176.04 2ksy h LEU 87 N -0.35 0.00 -1.02 0.59 4.07 -1.29 -1.77 115.31 115.54 2ksy h LEU 87 Ca -0.02 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.84 2ksy h LEU 87 Cb 0.27 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.00 2ksy h LEU 87 CO 0.04 0.17 -0.45 1.23 -1.08 0.00 0.00 178.44 178.35 2ksy h GLY 88 N 0.57 0.00 0.97 0.83 0.00 -0.83 -2.98 103.07 101.62 2ksy h GLY 88 Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.13 2ksy h GLY 88 CO 0.02 0.00 -0.75 1.41 0.00 0.00 0.00 176.54 177.22 2ksy h LEU 89 N 0.00 0.71 -1.74 3.11 3.38 -0.41 -0.05 115.31 120.31 2ksy h LEU 89 Ca -0.00 -0.72 0.06 0.00 0.09 0.00 0.00 57.88 57.30 2ksy h LEU 89 Cb 0.87 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2ksy h LEU 89 CO 0.06 1.34 0.29 -0.07 0.09 0.00 0.00 178.44 180.15 2ksy h LEU 90 N 0.15 0.28 0.06 1.67 3.38 -1.40 -2.18 115.31 117.27 2ksy h LEU 90 Ca -0.09 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.57 2ksy h LEU 90 Cb 1.43 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 2ksy h LEU 90 CO 0.15 0.18 -1.74 0.00 0.09 0.00 0.00 178.44 177.12 2ksy h ALA 91 N 1.77 0.58 -1.87 1.53 0.00 -1.52 -3.42 119.26 116.32 2ksy h ALA 91 Ca 0.19 -1.37 0.00 0.00 0.00 0.00 0.00 54.91 53.73 2ksy h ALA 91 Cb 0.35 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2ksy h ALA 91 CO -0.04 1.42 0.00 0.41 0.00 0.00 0.00 179.25 181.04 2ksy n GLY 92 N 1.70 0.63 3.59 0.00 0.00 -0.08 -4.33 105.19 106.70 2ksy n GLY 92 Ca -0.21 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 2ksy n GLY 92 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ksy n LEU 93 N -0.93 1.56 0.00 0.99 4.77 -0.93 -5.02 117.00 117.44 2ksy n LEU 93 Ca 0.00 0.22 -0.25 0.00 -0.03 0.00 0.00 56.01 55.95 2ksy n LEU 93 Cb 0.39 -1.39 0.19 0.00 -2.33 0.00 0.00 43.42 40.28 2ksy n LEU 93 CO 0.00 -2.61 0.69 0.47 -1.33 0.00 0.00 177.39 174.61 2ksy n ASP 94 N -4.27 -0.48 0.06 -1.43 8.00 -1.26 -4.82 116.55 112.35 2ksy n ASP 94 Ca 0.09 -1.32 -0.13 0.00 0.71 0.00 0.00 54.79 54.14 2ksy n ASP 94 Cb 0.53 -0.87 -0.08 0.00 -0.02 0.00 0.00 41.12 40.68 2ksy n ASP 94 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2ksy h SER 95 N -1.77 -0.09 0.22 -2.24 0.02 -2.01 -2.56 113.55 105.12 2ksy h SER 95 Ca -0.36 -0.16 -0.19 0.00 -0.84 0.00 0.00 61.79 60.23 2ksy h SER 95 Cb 1.03 0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.59 2ksy h SER 95 CO 0.25 0.11 -0.75 0.08 -1.14 0.00 0.00 176.83 175.38 2ksy h ARG 96 N -0.29 0.45 -0.58 3.45 0.11 -2.00 -3.22 114.38 112.31 2ksy h ARG 96 Ca -0.01 -0.38 0.08 0.00 0.10 0.00 0.00 59.98 59.77 2ksy h ARG 96 Cb 0.25 0.08 -0.06 0.00 1.11 0.00 0.00 29.97 31.35 2ksy h ARG 96 CO 0.02 1.01 0.24 0.93 0.10 0.00 0.00 179.97 182.27 2ksy h GLU 97 N 0.30 0.43 -0.58 0.08 4.39 -1.91 -0.15 114.58 117.14 2ksy h GLU 97 Ca -0.04 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 2ksy h GLU 97 Cb 1.34 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.86 2ksy h GLU 97 CO 0.13 0.28 0.33 0.74 -1.16 0.00 0.00 179.01 179.34 2ksy h PHE 98 N 0.44 0.76 0.00 4.33 0.04 -1.48 -1.29 116.94 119.75 2ksy h PHE 98 Ca 0.28 -0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.99 2ksy h PHE 98 Cb 0.30 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 2ksy h PHE 98 CO -0.15 0.52 -0.27 0.78 -0.60 0.00 0.00 178.31 178.60 2ksy h GLY 99 N 0.85 0.00 0.76 -1.45 0.00 -1.07 -2.29 103.07 99.87 2ksy h GLY 99 Ca 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.42 2ksy h GLY 99 CO -0.04 0.00 -0.42 -2.22 0.00 0.00 0.00 176.54 173.86 2ksy h ILE 100 N 0.00 1.41 -0.38 2.60 2.04 -0.31 -2.55 117.51 120.31 2ksy h ILE 100 Ca -0.00 -1.82 -0.14 0.00 1.00 0.00 0.00 64.86 63.89 2ksy h ILE 100 Cb 0.57 2.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.98 2ksy h ILE 100 CO 0.04 0.53 -0.31 -0.37 0.00 0.00 0.00 178.15 178.03 2ksy h VAL 101 N -0.07 1.28 -0.07 1.67 -1.51 -1.38 -2.29 116.25 113.87 2ksy h VAL 101 Ca -0.03 -1.48 -0.02 0.00 -1.23 0.00 0.00 66.70 63.94 2ksy h VAL 101 Cb 1.08 1.37 -0.00 0.00 -2.13 0.00 0.00 31.29 31.61 2ksy h VAL 101 CO 0.09 0.49 -0.04 0.40 -1.23 0.00 0.00 177.57 177.28 2ksy h ILE 102 N 0.70 1.33 -0.37 7.19 1.08 -1.52 -2.76 117.51 123.16 2ksy h ILE 102 Ca 0.07 -1.07 -0.00 0.00 -0.39 0.00 0.00 64.86 63.47 2ksy h ILE 102 Cb 0.90 1.89 -0.02 0.00 -3.07 0.00 0.00 36.82 36.52 2ksy h ILE 102 CO 0.08 0.29 0.22 0.00 -0.69 0.00 0.00 178.15 178.06 2ksy h THR 103 N -0.23 1.11 0.36 -0.27 1.03 -1.51 -2.05 112.91 111.34 2ksy h THR 103 Ca 0.02 -0.24 -0.02 0.00 -0.01 0.00 0.00 66.41 66.16 2ksy h THR 103 Cb 0.49 0.59 0.00 0.00 -1.07 0.00 0.00 68.15 68.16 2ksy h THR 103 CO 0.01 0.11 -0.17 0.25 -0.01 0.00 0.00 175.52 175.71 2ksy h LEU 104 N 0.51 -0.40 -2.33 0.00 5.85 -1.30 -2.10 115.31 115.52 2ksy h LEU 104 Ca 0.13 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 2ksy h LEU 104 Cb -0.02 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 2ksy h LEU 104 CO -0.03 -0.27 -0.03 0.78 -0.34 0.00 0.00 178.44 178.55 2ksy h ASN 105 N -0.50 0.00 0.33 1.25 -0.26 -1.18 -2.41 115.58 112.81 2ksy h ASN 105 Ca -0.05 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.68 2ksy h ASN 105 Cb 0.38 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.64 2ksy h ASN 105 CO 0.08 0.03 -0.16 0.74 -1.06 0.00 0.00 177.43 177.06 2ksy h THR 106 N 0.00 0.69 -0.43 2.81 2.02 -0.70 -0.29 112.91 117.01 2ksy h THR 106 Ca -0.00 -0.39 -0.07 0.00 0.77 0.00 0.00 66.41 66.73 2ksy h THR 106 Cb 0.09 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2ksy h THR 106 CO 0.00 0.08 -0.00 1.62 0.37 0.00 0.00 175.52 177.59 2ksy h VAL 107 N -0.66 1.23 0.21 3.16 3.04 -1.21 -1.61 116.25 120.41 2ksy h VAL 107 Ca -0.05 -0.94 -0.01 0.00 -1.01 0.00 0.00 66.70 64.69 2ksy h VAL 107 Cb 0.47 0.91 0.00 0.00 -2.01 0.00 0.00 31.29 30.66 2ksy h VAL 107 CO 0.07 0.33 -0.10 0.58 -1.01 0.00 0.00 177.57 177.44 2ksy h VAL 108 N 0.66 0.86 -0.21 1.51 2.07 -1.39 0.30 116.25 120.05 2ksy h VAL 108 Ca 0.13 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.18 2ksy h VAL 108 Cb 0.42 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2ksy h VAL 108 CO 0.02 0.11 0.14 -0.03 0.02 0.00 0.00 177.57 177.82 2ksy h MET 109 N -0.53 0.28 -0.00 1.57 4.05 -0.97 -0.70 114.93 118.63 2ksy h MET 109 Ca -0.03 -0.02 -0.16 0.00 -0.28 0.00 0.00 59.70 59.21 2ksy h MET 109 Cb 0.39 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 31.11 2ksy h MET 109 CO 0.05 0.19 -0.76 1.25 0.23 0.00 0.00 176.91 177.86 2ksy h LEU 110 N 0.29 0.02 0.23 3.39 5.85 -1.10 -1.61 115.31 122.38 2ksy h LEU 110 Ca 0.08 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2ksy h LEU 110 Cb -0.03 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.00 2ksy h LEU 110 CO -0.02 0.77 -0.11 0.00 -0.34 0.00 0.00 178.44 178.74 2ksy h ALA 111 N 1.23 -0.31 -0.29 1.25 0.00 0.63 -0.93 119.26 120.84 2ksy h ALA 111 Ca -0.01 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.65 2ksy h ALA 111 Cb 1.35 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.26 2ksy h ALA 111 CO 0.10 -0.65 -0.48 0.78 0.00 0.00 0.00 179.25 179.00 2ksy h GLY 112 N -0.36 0.85 0.27 0.00 0.00 -1.53 0.10 103.07 102.40 2ksy h GLY 112 Ca -0.03 -0.93 -0.00 0.00 0.00 0.00 0.00 47.33 46.36 2ksy h GLY 112 CO 0.05 0.84 -0.35 -2.75 0.00 0.00 0.00 176.54 174.32 2ksy h PHE 113 N 0.61 -0.99 0.00 5.60 3.57 -1.17 -1.29 116.94 123.26 2ksy h PHE 113 Ca 0.03 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2ksy h PHE 113 Cb 1.06 0.40 0.00 0.00 2.79 0.00 0.00 35.95 40.19 2ksy h PHE 113 CO 0.06 -0.45 0.00 0.00 -2.23 0.00 0.00 178.31 175.69 2ksy h ALA 114 N -1.09 1.00 -0.02 2.41 0.00 -1.24 -3.15 119.26 117.17 2ksy h ALA 114 Ca -0.03 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.91 2ksy h ALA 114 Cb 0.58 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 2ksy h ALA 114 CO -0.09 0.00 -0.18 0.78 0.00 0.00 0.00 179.25 179.77 2ksy h GLY 115 N 2.05 -0.22 2.00 0.00 0.00 0.39 -1.57 103.07 105.73 2ksy h GLY 115 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.54 2ksy h GLY 115 CO 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 176.54 176.37 2ksy n ALA 116 N -2.54 2.12 1.29 3.60 0.00 -0.99 -3.01 120.51 120.98 2ksy n ALA 116 Ca -0.05 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.47 2ksy n ALA 116 Cb 0.23 -1.45 0.28 0.00 0.00 0.00 0.00 19.45 18.51 2ksy n ALA 116 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2ksy n MET 117 N -2.25 1.58 -2.81 0.00 2.00 -0.62 -4.90 117.12 110.11 2ksy n MET 117 Ca 0.05 -0.89 -0.36 0.00 0.00 0.00 0.00 57.70 56.50 2ksy n MET 117 Cb 0.38 -1.30 -0.07 0.00 0.00 0.00 0.00 33.22 32.24 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 -1.75 4.27 -1.43 2.03 -7.23 -0.99 -4.96 120.40 110.34 2ksy s VAL 118 Ca 0.25 1.72 0.28 0.00 -1.81 0.00 0.00 61.98 62.42 2ksy s VAL 118 Cb 0.13 -3.92 0.33 0.00 0.56 0.00 0.00 36.38 33.48 2ksy s VAL 118 CO 0.19 0.05 1.77 -0.81 -0.31 0.00 0.00 175.10 176.00 2ksy n PRO 119 N 0.33 0.46 0.00 4.82 -0.04 -1.26 -4.91 135.00 134.40 2ksy n PRO 119 Ca 0.03 -0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 2ksy n PRO 119 Cb 0.51 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 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 1.36 5.47 1.36 0.55 0.00 -1.26 -5.03 105.19 107.64 2ksy n GLY 120 Ca 0.11 -1.21 0.11 0.00 0.00 0.00 0.00 46.02 45.03 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 1.25 0.31 -0.61 -6.64 -1.26 -4.42 119.36 107.99 2ksy n ILE 121 Ca 0.00 -1.07 0.20 0.00 -1.77 0.00 0.00 62.75 60.12 2ksy n ILE 121 Cb 0.00 0.39 1.09 0.00 -1.44 0.00 0.00 39.64 39.67 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 4.04 0.00 -0.89 6.28 4.39 -1.94 -2.40 114.58 124.05 2ksy h GLU 122 Ca 0.00 0.00 0.20 0.00 0.34 0.00 0.00 59.36 59.90 2ksy h GLU 122 Cb 1.11 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.69 2ksy h GLU 122 CO 0.07 0.00 0.59 0.07 -1.16 0.00 0.00 179.01 178.58 2ksy h ARG 123 N 0.00 0.36 -0.29 2.33 0.11 -1.77 0.18 114.38 115.30 2ksy h ARG 123 Ca 0.00 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 60.05 2ksy h ARG 123 Cb 0.05 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 31.03 2ksy h ARG 123 CO 0.00 0.24 0.13 1.88 0.10 0.00 0.00 179.97 182.32 2ksy h TYR 124 N 0.38 0.39 0.02 4.08 0.05 -1.77 -1.02 116.97 119.10 2ksy h TYR 124 Ca 0.46 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.24 2ksy h TYR 124 Cb 1.19 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 38.81 2ksy h TYR 124 CO -0.00 0.31 -0.01 0.00 -1.05 0.00 0.00 178.16 177.40 2ksy h ALA 125 N 1.74 -0.03 0.04 3.88 0.00 -0.85 -0.12 119.26 123.91 2ksy h ALA 125 Ca 0.10 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.74 2ksy h ALA 125 Cb 0.06 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 2ksy h ALA 125 CO -0.01 -0.21 -0.26 -0.07 0.00 0.00 0.00 179.25 178.70 2ksy h LEU 126 N -0.65 -0.75 -1.07 0.00 4.07 -1.23 -1.80 115.31 113.88 2ksy h LEU 126 Ca -0.00 0.10 -0.04 0.00 0.08 0.00 0.00 57.88 58.01 2ksy h LEU 126 Cb 0.61 0.30 -0.03 0.00 1.08 0.00 0.00 40.66 42.62 2ksy h LEU 126 CO 0.01 -0.33 0.19 0.15 -1.08 0.00 0.00 178.44 177.37 2ksy h PHE 127 N -0.42 0.87 -0.85 1.13 3.57 -1.29 -2.50 116.94 117.46 2ksy h PHE 127 Ca 0.05 -0.06 0.22 0.00 3.53 0.00 0.00 57.97 61.70 2ksy h PHE 127 Cb 0.48 -0.26 -0.14 0.00 2.79 0.00 0.00 35.95 38.83 2ksy h PHE 127 CO -0.27 0.70 0.20 0.78 -2.23 0.00 0.00 178.31 177.49 2ksy h GLY 128 N 0.97 1.25 1.33 2.40 0.00 -0.13 0.75 103.07 109.64 2ksy h GLY 128 Ca 0.19 -0.02 -0.15 0.00 0.00 0.00 0.00 47.33 47.35 2ksy h GLY 128 CO -0.01 -0.33 -0.41 1.98 0.00 0.00 0.00 176.54 177.77 2ksy h MET 129 N 0.21 0.73 -0.38 4.80 1.85 -1.15 -2.89 114.93 118.10 2ksy h MET 129 Ca 0.52 -0.39 -0.02 0.00 -0.61 0.00 0.00 59.70 59.19 2ksy h MET 129 Cb 1.00 0.01 -0.02 0.00 0.43 0.00 0.00 31.60 33.03 2ksy h MET 129 CO -0.63 1.01 0.14 0.78 -0.40 0.00 0.00 176.91 177.80 2ksy h GLY 130 N 0.93 0.57 0.43 1.39 0.00 0.68 0.78 103.07 107.85 2ksy h GLY 130 Ca 0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 2ksy h GLY 130 CO 0.09 0.26 -0.08 0.00 0.00 0.00 0.00 176.54 176.81 2ksy h ALA 131 N 1.62 -0.22 -1.01 3.60 0.00 -0.43 0.13 119.26 122.96 2ksy h ALA 131 Ca 0.13 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.89 2ksy h ALA 131 Cb 0.13 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 2ksy h ALA 131 CO -0.01 -0.34 0.65 0.28 0.00 0.00 0.00 179.25 179.83 2ksy h VAL 132 N -0.79 1.06 -0.31 0.00 2.07 -1.42 -0.26 116.25 116.60 2ksy h VAL 132 Ca -0.02 -0.39 -0.09 0.00 0.82 0.00 0.00 66.70 67.01 2ksy h VAL 132 Cb 0.53 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 2ksy h VAL 132 CO 0.04 0.21 -0.20 0.00 0.02 0.00 0.00 177.57 177.64 2ksy h ALA 133 N 1.47 1.08 0.18 1.67 0.00 -0.83 -2.64 119.26 120.20 2ksy h ALA 133 Ca 0.44 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2ksy h ALA 133 Cb 0.22 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2ksy h ALA 133 CO -0.19 0.56 -0.30 0.35 0.00 0.00 0.00 179.25 179.68 2ksy h PHE 134 N 0.51 -0.80 -0.62 0.00 3.57 0.11 -0.47 116.94 119.23 2ksy h PHE 134 Ca 0.08 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.69 2ksy h PHE 134 Cb 0.63 0.33 -0.04 0.00 2.79 0.00 0.00 35.95 39.66 2ksy h PHE 134 CO 0.02 -0.41 0.42 0.82 -2.23 0.00 0.00 178.31 176.93 2ksy h ILE 135 N -0.55 0.90 -0.83 1.41 2.04 -1.37 0.18 117.51 119.29 2ksy h ILE 135 Ca 0.02 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 2ksy h ILE 135 Cb 0.56 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 37.01 2ksy h ILE 135 CO -0.13 0.08 0.43 1.23 0.00 0.00 0.00 178.15 179.75 2ksy h GLY 136 N 0.44 1.25 0.54 5.37 0.00 -0.77 -0.10 103.07 109.80 2ksy h GLY 136 Ca 0.29 -0.59 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 2ksy h GLY 136 CO -0.08 0.57 -0.08 -2.00 0.00 0.00 0.00 176.54 174.94 2ksy h LEU 137 N 1.16 -0.19 -1.54 3.11 5.85 0.43 -2.49 115.31 121.63 2ksy h LEU 137 Ca 0.29 -0.31 0.12 0.00 0.84 0.00 0.00 57.88 58.81 2ksy h LEU 137 Cb 0.07 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 2ksy h LEU 137 CO -0.04 0.26 0.47 -0.37 -0.34 0.00 0.00 178.44 178.42 2ksy h VAL 138 N -0.69 0.86 -0.83 1.05 -1.51 -1.19 0.14 116.25 114.08 2ksy h VAL 138 Ca -0.02 -0.17 -0.02 0.00 -1.23 0.00 0.00 66.70 65.26 2ksy h VAL 138 Cb 0.50 0.33 -0.04 0.00 -2.13 0.00 0.00 31.29 29.95 2ksy h VAL 138 CO 0.04 0.09 0.45 0.22 -1.23 0.00 0.00 177.57 177.14 2ksy h TYR 139 N 0.49 1.14 0.17 5.19 3.20 -0.90 -1.76 116.97 124.49 2ksy h TYR 139 Ca 0.34 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.17 2ksy h TYR 139 Cb 0.65 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.56 2ksy h TYR 139 CO -0.00 0.79 -0.08 1.88 -1.64 0.00 0.00 178.16 179.11 2ksy h TYR 140 N 1.15 -0.21 0.00 -3.82 0.05 -0.27 0.72 116.97 114.59 2ksy h TYR 140 Ca 0.29 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.07 2ksy h TYR 140 Cb 0.03 0.07 0.00 0.00 1.01 0.00 0.00 36.73 37.84 2ksy h TYR 140 CO 0.00 0.06 0.00 1.37 -1.05 0.00 0.00 178.16 178.55 2ksy h LEU 141 N -0.47 0.00 -1.08 3.88 8.10 -1.30 -1.47 115.31 122.97 2ksy h LEU 141 Ca -0.02 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.97 2ksy h LEU 141 Cb 0.36 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.58 2ksy h LEU 141 CO 0.04 0.00 -0.15 0.55 -4.11 0.00 0.00 178.44 174.77 2ksy n VAL 142 N -2.80 0.00 0.00 0.15 3.14 -0.67 -3.91 118.33 114.23 2ksy n VAL 142 Ca -0.01 -0.43 0.00 0.00 -2.96 0.00 0.00 64.34 60.94 2ksy n VAL 142 Cb 0.15 1.19 0.00 0.00 -1.06 0.00 0.00 33.84 34.12 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 0.87 0.01 0.18 7.55 0.00 0.25 -4.68 105.19 109.37 2ksy n GLY 143 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.76 1.61 0.13 -1.79 -3.14 132.00 128.05 2ksy h PRO 144 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 2ksy h PRO 144 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 2ksy h PRO 144 CO 0.00 0.40 0.33 0.52 -0.23 0.00 0.00 178.00 179.02 2ksy h MET 145 N 0.00 1.11 -0.39 0.86 2.86 -1.78 -0.40 114.93 117.19 2ksy h MET 145 Ca -0.00 -0.18 -0.06 0.00 -2.06 0.00 0.00 59.70 57.40 2ksy h MET 145 Cb 0.82 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.27 2ksy h MET 145 CO 0.05 0.88 -0.00 1.79 1.06 0.00 0.00 176.91 180.69 2ksy h THR 146 N 1.09 1.26 -0.13 2.22 1.35 -1.66 -1.35 112.91 115.69 2ksy h THR 146 Ca 0.26 -1.01 -0.13 0.00 -0.55 0.00 0.00 66.41 64.98 2ksy h THR 146 Cb 0.16 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 67.70 2ksy h THR 146 CO -0.03 0.34 -0.50 -0.33 -0.25 0.00 0.00 175.52 174.75 2ksy h GLU 147 N 0.52 0.34 -0.19 4.72 5.08 -1.57 -0.95 114.58 122.53 2ksy h GLU 147 Ca 0.11 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.18 2ksy h GLU 147 Cb 0.47 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 2ksy h GLU 147 CO 0.02 0.76 -0.24 1.03 -1.00 0.00 0.00 179.01 179.58 2ksy h SER 148 N 0.27 0.55 0.36 1.42 0.87 -0.95 -3.13 113.55 112.95 2ksy h SER 148 Ca 0.01 -0.50 -0.18 0.00 -1.23 0.00 0.00 61.79 59.89 2ksy h SER 148 Cb 0.98 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.77 2ksy h SER 148 CO 0.08 0.94 -0.74 0.00 -0.53 0.00 0.00 176.83 176.59 2ksy h ALA 149 N 0.62 0.64 0.00 6.23 0.00 -1.25 -2.85 119.26 122.66 2ksy h ALA 149 Ca 0.02 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2ksy h ALA 149 Cb 0.81 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2ksy h ALA 149 CO 0.06 0.79 0.00 -1.13 0.00 0.00 0.00 179.25 178.97 2ksy n SER 150 N -3.80 0.00 -0.57 0.00 3.41 -0.36 -1.29 113.62 111.00 2ksy n SER 150 Ca -0.04 0.13 0.06 0.00 -0.26 0.00 0.00 58.87 58.76 2ksy n SER 150 Cb 0.71 -0.29 0.11 0.00 -0.26 0.00 0.00 64.21 64.48 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 -1.29 1.80 -0.10 4.33 6.02 -1.08 -4.63 117.38 122.44 2ksy n GLN 151 Ca 0.05 -1.66 -0.19 0.00 -0.01 0.00 0.00 57.00 55.20 2ksy n GLN 151 Cb 0.09 -1.25 -0.09 0.00 1.02 0.00 0.00 30.24 30.01 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 0.61 0.54 -3.89 -1.09 0.63 -0.41 -5.07 116.66 107.99 2ksy n ARG 152 Ca 0.10 0.51 -0.08 0.00 -0.92 0.00 0.00 57.85 57.45 2ksy n ARG 152 Cb 0.37 -1.69 -0.02 0.00 0.45 0.00 0.00 32.46 31.57 2ksy n ARG 152 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2ksy s SER 153 N -6.66 -0.10 0.07 6.15 0.15 -1.25 -5.02 113.70 107.04 2ksy s SER 153 Ca -0.27 -0.84 -0.15 0.00 0.70 0.00 0.00 55.95 55.38 2ksy s SER 153 Cb 0.06 0.72 -0.17 0.00 -1.71 0.00 0.00 66.02 64.93 2ksy s SER 153 CO 0.49 -1.38 1.27 0.77 1.20 0.00 0.00 173.24 175.59 2ksy h SER 154 N 2.06 0.80 0.66 5.45 4.64 -1.92 -3.22 113.55 122.01 2ksy h SER 154 Ca -0.24 -0.63 -0.13 0.00 -0.47 0.00 0.00 61.79 60.32 2ksy h SER 154 Cb 1.25 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 63.09 2ksy h SER 154 CO 0.30 1.30 -0.61 1.23 -0.87 0.00 0.00 176.83 178.19 2ksy h GLY 155 N 0.34 0.00 1.05 -0.77 0.00 -1.97 -3.13 103.07 98.59 2ksy h GLY 155 Ca -0.04 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.32 2ksy h GLY 155 CO 0.13 0.00 0.57 -2.22 0.00 0.00 0.00 176.54 175.03 2ksy h ILE 156 N 0.00 1.16 -0.15 2.60 1.08 -1.87 -1.53 117.51 118.80 2ksy h ILE 156 Ca -0.01 -0.38 -0.02 0.00 -0.39 0.00 0.00 64.86 64.07 2ksy h ILE 156 Cb 1.10 -0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 34.81 2ksy h ILE 156 CO 0.08 0.20 0.03 0.50 -0.69 0.00 0.00 178.15 178.27 2ksy h LYS 157 N 1.10 0.24 -0.65 2.37 3.64 -1.57 -1.28 116.57 120.42 2ksy h LYS 157 Ca 0.34 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.66 2ksy h LYS 157 Cb -0.00 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 2ksy h LYS 157 CO -0.10 0.42 0.40 0.77 -2.27 0.00 0.00 179.45 178.67 2ksy h SER 158 N 0.03 0.77 0.59 4.20 0.02 -1.51 -1.95 113.55 115.70 2ksy h SER 158 Ca 0.04 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2ksy h SER 158 Cb 0.29 -0.19 0.01 0.00 0.14 0.00 0.00 62.40 62.64 2ksy h SER 158 CO 0.00 0.59 -0.28 0.25 -1.14 0.00 0.00 176.83 176.25 2ksy h LEU 159 N 0.88 -0.67 -1.38 5.07 5.85 -1.26 -2.87 115.31 120.93 2ksy h LEU 159 Ca 0.23 -0.02 0.22 0.00 0.84 0.00 0.00 57.88 59.15 2ksy h LEU 159 Cb -0.05 0.17 -0.08 0.00 0.37 0.00 0.00 40.66 41.08 2ksy h LEU 159 CO -0.05 -0.30 0.62 0.22 -0.34 0.00 0.00 178.44 178.60 2ksy h TYR 160 N -1.12 0.67 -0.05 1.25 5.03 -1.20 -1.22 116.97 120.33 2ksy h TYR 160 Ca -0.08 0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.18 2ksy h TYR 160 Cb 0.65 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 38.74 2ksy h TYR 160 CO 0.01 0.14 -0.23 -0.39 -1.32 0.00 0.00 178.16 176.37 2ksy h VAL 161 N 0.48 1.45 -0.68 1.81 -1.51 -1.37 -0.70 116.25 115.73 2ksy h VAL 161 Ca 0.52 -1.67 -0.05 0.00 -1.23 0.00 0.00 66.70 64.27 2ksy h VAL 161 Cb 1.20 2.40 -0.03 0.00 -2.13 0.00 0.00 31.29 32.74 2ksy h VAL 161 CO -0.24 0.47 0.24 -0.09 -1.23 0.00 0.00 177.57 176.72 2ksy h ARG 162 N -0.30 1.04 0.02 5.19 2.43 -1.17 -1.74 114.38 119.85 2ksy h ARG 162 Ca -0.01 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 58.95 2ksy h ARG 162 Cb 0.88 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 2ksy h ARG 162 CO 0.05 0.89 -0.01 -0.07 -1.51 0.00 0.00 179.97 179.32 2ksy h LEU 163 N 0.98 -0.02 -0.92 3.80 3.38 -1.30 -2.85 115.31 118.37 2ksy h LEU 163 Ca 0.22 -0.50 0.05 0.00 0.09 0.00 0.00 57.88 57.74 2ksy h LEU 163 Cb 0.26 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 2ksy h LEU 163 CO -0.01 0.50 0.59 0.08 0.09 0.00 0.00 178.44 179.69 2ksy h ARG 164 N -0.54 1.09 0.05 1.13 -0.00 -1.11 -0.48 114.38 114.53 2ksy h ARG 164 Ca -0.00 -0.07 0.01 0.00 -0.00 0.00 0.00 59.98 59.92 2ksy h ARG 164 Cb 0.52 -0.25 -0.01 0.00 -0.00 0.00 0.00 29.97 30.23 2ksy h ARG 164 CO 0.00 0.72 -0.08 -0.91 -0.00 0.00 0.00 179.97 179.70 2ksy h ASN 165 N 1.12 -0.23 0.44 0.08 -0.26 -1.34 -0.87 115.58 114.52 2ksy h ASN 165 Ca 0.38 0.03 -0.02 0.00 -0.56 0.00 0.00 56.30 56.13 2ksy h ASN 165 Cb 0.06 0.09 -0.00 0.00 -1.06 0.00 0.00 38.32 37.41 2ksy h ASN 165 CO -0.14 -0.13 -0.24 0.25 -1.06 0.00 0.00 177.43 176.12 2ksy h LEU 166 N -0.17 -0.58 -0.01 1.61 6.46 -1.19 -2.74 115.31 118.68 2ksy h LEU 166 Ca 0.02 0.03 0.03 0.00 -0.12 0.00 0.00 57.88 57.83 2ksy h LEU 166 Cb 0.18 0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.23 2ksy h LEU 166 CO -0.05 -0.39 -0.20 0.74 -0.62 0.00 0.00 178.44 177.92 2ksy h THR 167 N -0.63 0.53 -0.85 1.05 2.02 -1.02 -2.60 112.91 111.40 2ksy h THR 167 Ca -0.05 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.24 2ksy h THR 167 Cb 0.50 0.53 -0.08 0.00 -1.74 0.00 0.00 68.15 67.35 2ksy h THR 167 CO 0.08 0.00 0.47 0.58 0.37 0.00 0.00 175.52 177.02 2ksy h VAL 168 N -0.31 0.84 0.51 3.16 2.07 -1.17 0.11 116.25 121.46 2ksy h VAL 168 Ca 0.06 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 2ksy h VAL 168 Cb 0.40 0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.20 2ksy h VAL 168 CO -0.19 0.14 -0.25 0.58 0.02 0.00 0.00 177.57 177.87 2ksy h VAL 169 N 0.74 0.00 -0.37 2.57 2.07 -1.15 -1.06 116.25 119.05 2ksy h VAL 169 Ca 0.43 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.91 2ksy h VAL 169 Cb 0.49 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 2ksy h VAL 169 CO -0.29 0.00 0.13 0.17 0.02 0.00 0.00 177.57 177.60 2ksy h LEU 170 N -0.71 0.47 -1.22 2.57 8.10 -1.41 -1.74 115.31 121.36 2ksy h LEU 170 Ca -0.07 -0.05 -0.08 0.00 0.11 0.00 0.00 57.88 57.79 2ksy h LEU 170 Cb 0.53 -0.12 -0.01 0.00 -0.44 0.00 0.00 40.66 40.62 2ksy h LEU 170 CO 0.12 0.44 -0.39 -0.50 -4.11 0.00 0.00 178.44 174.00 2ksy h TRP 171 N 0.52 0.00 0.00 0.17 4.06 -0.77 -1.86 115.95 118.07 2ksy h TRP 171 Ca 0.13 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.08 2ksy h TRP 171 Cb 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.29 2ksy h TRP 171 CO 0.01 0.39 0.00 0.00 -3.56 0.00 0.00 178.44 175.27 2ksy n ALA 172 N -2.45 2.04 0.11 1.49 0.00 -0.41 -2.25 120.51 119.05 2ksy n ALA 172 Ca -0.02 -0.09 0.09 0.00 0.00 0.00 0.00 53.44 53.42 2ksy n ALA 172 Cb 0.42 -1.34 0.01 0.00 0.00 0.00 0.00 19.45 18.55 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 0.15 -0.42 0.00 1.08 -1.28 -3.37 117.51 113.67 2ksy h ILE 173 Ca 0.00 -1.27 0.07 0.00 -0.39 0.00 0.00 64.86 63.27 2ksy h ILE 173 Cb 0.25 1.75 -0.06 0.00 -3.07 0.00 0.00 36.82 35.68 2ksy h ILE 173 CO 0.00 0.09 0.04 1.88 -0.69 0.00 0.00 178.15 179.47 2ksy h TYR 174 N 0.00 0.05 -1.26 1.37 0.05 -1.51 -0.68 116.97 114.99 2ksy h TYR 174 Ca -0.03 0.03 0.36 0.00 0.05 0.00 0.00 58.73 59.14 2ksy h TYR 174 Cb 1.14 0.04 -0.07 0.00 1.01 0.00 0.00 36.73 38.85 2ksy h TYR 174 CO 0.00 -0.05 0.88 -1.35 -1.05 0.00 0.00 178.16 176.60 2ksy h PRO 175 N 0.15 0.09 0.01 4.88 0.11 -1.77 0.41 132.00 135.89 2ksy h PRO 175 Ca 0.21 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.28 2ksy h PRO 175 Cb 0.28 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.37 2ksy h PRO 175 CO -0.31 0.06 -0.17 0.74 -0.21 0.00 0.00 178.00 178.11 2ksy h PHE 176 N 0.10 0.02 -0.84 0.65 0.04 -1.40 -3.11 116.94 112.40 2ksy h PHE 176 Ca 0.65 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 61.39 2ksy h PHE 176 Cb 2.31 -0.00 -0.04 0.00 2.20 0.00 0.00 35.95 40.42 2ksy h PHE 176 CO -0.00 1.07 0.49 0.82 -0.60 0.00 0.00 178.31 180.08 2ksy h ILE 177 N -0.98 1.23 0.08 -0.55 1.08 -0.44 0.19 117.51 118.13 2ksy h ILE 177 Ca -0.04 -0.53 -0.00 0.00 -0.39 0.00 0.00 64.86 63.89 2ksy h ILE 177 Cb 1.06 0.07 0.00 0.00 -3.07 0.00 0.00 36.82 34.88 2ksy h ILE 177 CO -0.02 0.25 -0.04 -0.25 -0.69 0.00 0.00 178.15 177.40 2ksy h TRP 178 N 1.16 -0.10 0.40 1.37 7.01 -1.15 0.30 115.95 124.94 2ksy h TRP 178 Ca 0.30 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.28 2ksy h TRP 178 Cb -0.03 0.03 0.00 0.00 -2.10 0.00 0.00 29.16 27.07 2ksy h TRP 178 CO 0.01 0.41 -0.19 1.25 -2.79 0.00 0.00 178.44 177.12 2ksy h LEU 179 N -0.69 -0.46 -0.81 0.65 5.85 -1.46 -2.91 115.31 115.48 2ksy h LEU 179 Ca -0.01 -0.10 -0.09 0.00 0.84 0.00 0.00 57.88 58.53 2ksy h LEU 179 Cb 0.55 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 2ksy h LEU 179 CO 0.02 -0.16 -0.05 -0.07 -0.34 0.00 0.00 178.44 177.84 2ksy h LEU 180 N -0.77 0.82-10.03 2.25 3.38 -0.76 0.20 115.31 110.40 2ksy h LEU 180 Ca -0.05 -0.23 -0.39 0.00 0.09 0.00 0.00 57.88 57.29 2ksy h LEU 180 Cb 0.52 -0.22 0.22 0.00 0.09 0.00 0.00 40.66 41.27 2ksy h LEU 180 CO 0.09 0.91 -0.11 -0.83 0.09 0.00 0.00 178.44 178.60 2ksy s GLY 181 N -3.73 1.43 0.27 0.83 0.00 0.09 0.14 107.32 106.37 2ksy s GLY 181 Ca -0.10 -0.61 -0.00 0.00 0.00 0.00 0.00 44.72 44.01 2ksy s GLY 181 CO 0.82 0.33 1.66 -2.55 0.00 0.00 0.00 173.10 173.37 2ksy h PRO 182 N -3.30 0.22 -1.22 2.90 0.11 -1.84 -1.09 132.00 127.78 2ksy h PRO 182 Ca -0.49 -0.01 0.37 0.00 0.11 0.00 0.00 66.00 65.97 2ksy h PRO 182 Cb 1.34 -0.05 -0.10 0.00 0.11 0.00 0.00 31.00 32.30 2ksy h PRO 182 CO 0.34 0.15 0.80 -1.35 -0.21 0.00 0.00 178.00 177.73 2ksy h PRO 183 N 0.23 0.19 0.00 1.05 0.11 -1.87 -3.38 132.00 128.32 2ksy h PRO 183 Ca 0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.61 2ksy h PRO 183 Cb 0.97 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.04 2ksy h PRO 183 CO -0.61 0.12 0.00 0.41 -0.21 0.00 0.00 178.00 177.71 2ksy n GLY 184 N -1.55 1.18 0.26 -0.55 0.00 -0.50 -4.56 105.19 99.47 2ksy n GLY 184 Ca 0.32 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.44 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 0.77 -5.24 1.61 -1.51 -0.72 -3.48 116.25 107.68 2ksy h VAL 185 Ca 0.00 -0.41 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 2ksy h VAL 185 Cb 0.00 1.24 0.00 0.00 -2.13 0.00 0.00 31.29 30.40 2ksy h VAL 185 CO 0.00 0.10 -0.55 0.00 -1.23 0.00 0.00 177.57 175.90 2ksy n ALA 186 N -2.38 -3.07 -0.11 5.19 0.00 -0.34 -4.97 120.51 114.83 2ksy n ALA 186 Ca -0.02 1.10 -0.24 0.00 0.00 0.00 0.00 53.44 54.28 2ksy n ALA 186 Cb 0.19 -3.48 -0.11 0.00 0.00 0.00 0.00 19.45 16.05 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 -0.20 1.91 0.00 0.00 4.77 0.12 -4.91 117.00 118.70 2ksy n LEU 187 Ca 0.11 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 2ksy n LEU 187 Cb 0.41 -0.93 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 2ksy n LEU 187 CO 0.47 0.38 0.00 0.18 -1.33 0.00 0.00 177.39 177.09 2ksy n LEU 188 N -4.36 0.00 -4.80 2.23 4.77 -1.26 -5.08 117.00 108.51 2ksy n LEU 188 Ca -0.39 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.22 2ksy n LEU 188 Cb 0.75 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.78 2ksy n LEU 188 CO 0.15 -0.33 0.07 -0.89 -1.33 0.00 0.00 177.39 175.06 2ksy s THR 189 N 0.26 5.15 0.37 -5.08 2.01 -1.26 -4.81 115.64 112.28 2ksy s THR 189 Ca 0.00 0.76 0.18 0.00 0.31 0.00 0.00 61.69 62.94 2ksy s THR 189 Cb 0.00 -3.69 0.37 0.00 0.01 0.00 0.00 72.50 69.19 2ksy s THR 189 CO 0.00 0.50 1.67 1.55 -0.69 0.00 0.00 174.62 177.65 2ksy h PRO 190 N 5.50 0.28 -0.62 4.92 0.13 -1.98 0.35 132.00 140.57 2ksy h PRO 190 Ca -0.48 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.62 2ksy h PRO 190 Cb 1.20 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 2ksy h PRO 190 CO 0.67 0.19 0.32 1.79 -0.23 0.00 0.00 178.00 180.74 2ksy h THR 191 N 0.29 1.21 0.16 1.56 1.35 -1.98 -0.70 112.91 114.80 2ksy h THR 191 Ca 0.73 -0.56 -0.01 0.00 -0.55 0.00 0.00 66.41 66.02 2ksy h THR 191 Cb 1.82 0.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 2ksy h THR 191 CO -0.51 0.23 -0.08 0.58 -0.25 0.00 0.00 175.52 175.49 2ksy h VAL 192 N 0.85 0.94 -0.13 6.82 2.07 -0.79 -2.40 116.25 123.61 2ksy h VAL 192 Ca 0.22 -1.06 0.04 0.00 0.82 0.00 0.00 66.70 66.72 2ksy h VAL 192 Cb 0.08 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 2ksy h VAL 192 CO -0.03 0.22 -0.16 -0.78 0.02 0.00 0.00 177.57 176.84 2ksy h ASP 193 N -0.78 -0.49 -0.84 0.57 3.58 -1.09 -1.62 116.42 115.75 2ksy h ASP 193 Ca -0.02 0.09 0.03 0.00 0.42 0.00 0.00 57.03 57.54 2ksy h ASP 193 Cb 0.53 0.23 -0.05 0.00 1.72 0.00 0.00 39.33 41.76 2ksy h ASP 193 CO 0.04 -0.21 0.56 0.58 -2.88 0.00 0.00 179.24 177.33 2ksy h VAL 194 N -0.20 1.17 -0.63 2.25 2.07 -1.23 -1.76 116.25 117.92 2ksy h VAL 194 Ca 0.09 -0.37 0.08 0.00 0.82 0.00 0.00 66.70 67.32 2ksy h VAL 194 Cb 0.34 -0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.03 2ksy h VAL 194 CO -0.25 0.20 0.30 0.00 0.02 0.00 0.00 177.57 177.84 2ksy h ALA 195 N 1.50 0.84 -0.28 1.67 0.00 -0.77 -1.00 119.26 121.22 2ksy h ALA 195 Ca 0.33 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.17 2ksy h ALA 195 Cb -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2ksy h ALA 195 CO -0.09 -0.09 -0.31 -0.07 0.00 0.00 0.00 179.25 178.70 2ksy h LEU 196 N 0.54 0.61 0.86 0.00 3.38 -0.83 -1.91 115.31 117.95 2ksy h LEU 196 Ca 0.30 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2ksy h LEU 196 Cb 0.30 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 40.89 2ksy h LEU 196 CO -0.25 0.88 -0.44 0.40 0.09 0.00 0.00 178.44 179.13 2ksy h ILE 197 N 0.50 0.00 -0.72 1.22 1.08 -0.40 0.33 117.51 119.53 2ksy h ILE 197 Ca 0.06 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.64 2ksy h ILE 197 Cb 0.79 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 34.49 2ksy h ILE 197 CO 0.06 0.00 0.47 -0.37 -0.69 0.00 0.00 178.15 177.63 2ksy h VAL 198 N -1.19 0.89 -0.19 1.67 -1.51 -1.30 0.29 116.25 114.91 2ksy h VAL 198 Ca -0.12 -0.18 -0.05 0.00 -1.23 0.00 0.00 66.70 65.12 2ksy h VAL 198 Cb 0.92 0.30 -0.01 0.00 -2.13 0.00 0.00 31.29 30.37 2ksy h VAL 198 CO 0.18 0.10 -0.09 0.22 -1.23 0.00 0.00 177.57 176.74 2ksy h TYR 199 N 0.54 0.30 -0.24 5.19 3.20 -0.81 0.52 116.97 125.67 2ksy h TYR 199 Ca 0.34 -0.03 -0.17 0.00 3.14 0.00 0.00 58.73 62.01 2ksy h TYR 199 Cb 0.58 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.76 2ksy h TYR 199 CO -0.00 0.39 -0.54 -0.07 -1.64 0.00 0.00 178.16 176.30 2ksy h LEU 200 N 0.28 0.77 -0.41 2.82 3.38 0.34 -1.79 115.31 120.71 2ksy h LEU 200 Ca 0.06 -0.41 -0.18 0.00 0.09 0.00 0.00 57.88 57.44 2ksy h LEU 200 Cb 0.35 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2ksy h LEU 200 CO 0.02 1.16 -0.78 0.44 0.09 0.00 0.00 178.44 179.36 2ksy h ASP 201 N 0.54 0.28 0.72 -0.43 3.32 -0.93 -2.81 116.42 117.12 2ksy h ASP 201 Ca 0.01 -0.20 -0.11 0.00 0.02 0.00 0.00 57.03 56.75 2ksy h ASP 201 Cb 1.10 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 2ksy h ASP 201 CO 0.11 0.95 -0.53 -0.07 -1.72 0.00 0.00 179.24 177.98 2ksy h LEU 202 N 0.14 0.00 0.18 1.55 -0.00 -0.82 -3.25 115.31 113.11 2ksy h LEU 202 Ca -0.03 0.00 -0.32 0.00 -0.00 0.00 0.00 57.88 57.53 2ksy h LEU 202 Cb 1.37 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 42.04 2ksy h LEU 202 CO 0.12 0.53 -1.50 1.62 -0.00 0.00 0.00 178.44 179.21 2ksy h VAL 203 N 0.00 1.23 0.00 1.22 3.04 -1.28 -2.26 116.25 118.19 2ksy h VAL 203 Ca -0.01 -2.77 0.00 0.00 -1.01 0.00 0.00 66.70 62.92 2ksy h VAL 203 Cb 1.03 2.90 0.00 0.00 -2.01 0.00 0.00 31.29 33.21 2ksy h VAL 203 CO 0.07 0.84 0.00 0.41 -1.01 0.00 0.00 177.57 177.88 2ksy n THR 204 N -3.58 0.00 0.00 3.17 -1.04 -1.07 -0.11 114.28 111.65 2ksy n THR 204 Ca -0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 2ksy n THR 204 Cb 1.07 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 69.32 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 -0.44 0.00 0.10 12.58 0.31 -0.85 -2.33 118.33 127.71 2ksy n VAL 206 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 2ksy n VAL 206 Cb 0.01 0.00 -0.08 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 -0.27 0.52 2.92 0.00 -0.60 -0.94 103.07 104.70 2ksy h GLY 207 Ca 0.00 0.10 0.05 0.00 0.00 0.00 0.00 47.33 47.48 2ksy h GLY 207 CO 0.00 -0.10 -0.05 -2.75 0.00 0.00 0.00 176.54 173.64 2ksy h PHE 208 N -0.58 -0.11 -0.58 5.60 3.04 -1.51 -0.08 116.94 122.72 2ksy h PHE 208 Ca -0.03 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 61.90 2ksy h PHE 208 Cb 0.43 0.09 -0.03 0.00 2.56 0.00 0.00 35.95 39.00 2ksy h PHE 208 CO 0.03 -0.09 0.16 0.78 -2.02 0.00 0.00 178.31 177.16 2ksy h GLY 209 N 0.01 0.95 0.75 2.40 0.00 -1.78 1.31 103.07 106.72 2ksy h GLY 209 Ca 0.12 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 46.86 2ksy h GLY 209 CO -0.25 0.51 -0.09 0.74 0.00 0.00 0.00 176.54 177.45 2ksy h PHE 210 N 0.86 0.39 0.00 5.60 0.04 -0.78 0.36 116.94 123.40 2ksy h PHE 210 Ca 0.19 -0.10 -0.04 0.00 2.80 0.00 0.00 57.97 60.82 2ksy h PHE 210 Cb 0.28 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.34 2ksy h PHE 210 CO 0.02 0.67 -0.20 0.82 -0.60 0.00 0.00 178.31 179.01 2ksy h ILE 211 N -0.01 0.97 -0.21 -0.55 2.04 -0.80 -1.38 117.51 117.57 2ksy h ILE 211 Ca 0.03 -0.73 -0.06 0.00 1.00 0.00 0.00 64.86 65.10 2ksy h ILE 211 Cb 0.57 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 2ksy h ILE 211 CO 0.03 0.20 -0.10 0.00 0.00 0.00 0.00 178.15 178.28 2ksy h ALA 212 N 1.80 0.29 0.26 1.87 0.00 0.25 -2.63 119.26 121.09 2ksy h ALA 212 Ca -0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2ksy h ALA 212 Cb 0.40 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2ksy h ALA 212 CO 0.03 0.12 -0.12 -0.07 0.00 0.00 0.00 179.25 179.21 2ksy h LEU 213 N 0.13 -0.29 -0.20 0.00 3.38 0.09 -1.95 115.31 116.46 2ksy h LEU 213 Ca 0.05 -0.24 0.05 0.00 0.09 0.00 0.00 57.88 57.83 2ksy h LEU 213 Cb 0.58 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.35 2ksy h LEU 213 CO 0.03 0.18 -0.18 0.44 0.09 0.00 0.00 178.44 179.00 2ksy h ASP 214 N -0.87 -0.57 0.71 -0.43 3.32 -1.38 0.37 116.42 117.56 2ksy h ASP 214 Ca -0.04 0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 2ksy h ASP 214 Cb 0.51 0.28 0.01 0.00 0.22 0.00 0.00 39.33 40.35 2ksy h ASP 214 CO 0.06 -0.22 -0.34 0.00 -1.72 0.00 0.00 179.24 177.02 2ksy h ALA 215 N 0.91 -0.95 -0.67 3.45 0.00 -1.58 -2.57 119.26 117.85 2ksy h ALA 215 Ca 0.12 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 54.91 2ksy h ALA 215 Cb 0.37 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 2ksy h ALA 215 CO -0.32 -0.98 0.45 0.00 0.00 0.00 0.00 179.25 178.40 2ksy h ALA 216 N -0.83 1.91 -0.91 0.00 0.00 -1.24 -0.35 119.26 117.84 2ksy h ALA 216 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2ksy h ALA 216 Cb 0.75 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 2ksy h ALA 216 CO 0.16 -0.05 0.57 0.00 0.00 0.00 0.00 179.25 179.93 2ksy h ALA 217 N 1.66 1.15 -0.26 0.00 0.00 -0.11 -1.94 119.26 119.76 2ksy h ALA 217 Ca 0.31 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.96 2ksy h ALA 217 Cb 0.49 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2ksy h ALA 217 CO -0.10 0.59 -0.53 1.15 0.00 0.00 0.00 179.25 180.36 2ksy h THR 218 N 1.24 1.29 -0.68 0.00 2.02 -0.70 -0.31 112.91 115.76 2ksy h THR 218 Ca 0.33 -1.74 0.07 0.00 0.77 0.00 0.00 66.41 65.84 2ksy h THR 218 Cb -0.09 1.65 -0.06 0.00 -1.74 0.00 0.00 68.15 67.92 2ksy h THR 218 CO -0.07 0.56 0.37 -0.07 0.37 0.00 0.00 175.52 176.69 2ksy h LEU 219 N 0.59 0.54 0.00 2.58 3.38 -0.67 -0.44 115.31 121.29 2ksy h LEU 219 Ca 0.02 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2ksy h LEU 219 Cb 1.11 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2ksy h LEU 219 CO 0.11 0.34 -0.36 0.08 0.09 0.00 0.00 178.44 178.71 2ksy h ARG 220 N 0.68 0.00 -0.25 1.13 0.11 -1.34 -3.31 114.38 111.40 2ksy h ARG 220 Ca 0.31 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.29 2ksy h ARG 220 Cb 0.22 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.29 2ksy h ARG 220 CO -0.20 0.00 -0.29 0.00 0.10 0.00 0.00 179.97 179.58 2ksy h ALA 221 N 2.40 1.04 0.00 0.08 0.00 0.64 -2.34 119.26 121.08 2ksy h ALA 221 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2ksy h ALA 221 Cb 0.80 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2ksy h ALA 221 CO 0.00 0.58 0.00 -0.85 0.00 0.00 0.00 179.25 178.98 2ksy n GLU 222 N -4.10 0.18 0.06 0.00 0.28 -0.91 -2.11 120.64 114.04 2ksy n GLU 222 Ca -0.01 0.47 -0.17 0.00 -0.16 0.00 0.00 57.16 57.29 2ksy n GLU 222 Cb 0.43 -1.89 -0.14 0.00 1.43 0.00 0.00 31.44 31.27 2ksy n GLU 222 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2ksy h HIS 223 N 0.00 0.48 -2.53 -1.84 3.86 -1.62 -3.48 115.15 110.02 2ksy h HIS 223 Ca 0.00 -0.35 -0.42 0.00 -1.16 0.00 0.00 60.37 58.44 2ksy h HIS 223 Cb 0.29 -0.02 -0.05 0.00 1.06 0.00 0.00 27.41 28.69 2ksy h HIS 223 CO 0.00 1.41 -0.50 0.41 0.86 0.00 0.00 177.93 180.11 2ksy n GLY 224 N 1.69 0.05 3.56 2.45 0.00 -0.90 -4.95 105.19 107.09 2ksy n GLY 224 Ca -0.17 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 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 -4.76 3.64 0.18 1.61 2.02 -1.26 -4.82 118.70 115.32 2ksy s GLU 225 Ca 0.00 -0.12 0.00 0.00 0.02 0.00 0.00 54.97 54.87 2ksy s GLU 225 Cb 0.00 -3.80 0.00 0.00 0.10 0.00 0.00 34.13 30.43 2ksy s GLU 225 CO 0.00 -0.64 0.00 -1.13 0.02 0.00 0.00 175.26 173.51 2ksy n SER 226 N 5.76 -0.04 -4.87 -0.19 3.41 -1.26 -5.09 113.62 111.33 2ksy n SER 226 Ca -0.04 0.31 -0.30 0.00 -0.26 0.00 0.00 58.87 58.57 2ksy n SER 226 Cb 0.49 0.23 -0.00 0.00 -0.26 0.00 0.00 64.21 64.67 2ksy n SER 226 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2ksy s LEU 227 N -6.33 3.40 0.17 1.04 1.43 -1.26 -5.08 118.68 112.05 2ksy s LEU 227 Ca 0.00 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.42 2ksy s LEU 227 Cb 0.00 -4.33 -0.04 0.00 0.03 0.00 0.00 46.19 41.85 2ksy s LEU 227 CO 0.00 -0.75 0.34 0.00 0.23 0.00 0.00 176.35 176.18 2ksy s ALA 228 N -2.97 3.88 0.00 4.21 0.00 -1.26 -4.94 121.76 120.68 2ksy s ALA 228 Ca 0.54 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.61 2ksy s ALA 228 Cb -0.11 -1.92 0.00 0.00 0.00 0.00 0.00 23.12 21.09 2ksy s ALA 228 CO 0.48 0.50 0.00 0.41 0.00 0.00 0.00 175.76 177.15 2ksy n GLY 229 N -0.54 0.92 3.69 0.00 0.00 -1.26 -5.11 105.19 102.89 2ksy n GLY 229 Ca -0.05 -0.66 -0.36 0.00 0.00 0.00 0.00 46.02 44.95 2ksy n GLY 229 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ksy s VAL 230 N 0.00 5.35 -0.14 1.61 1.01 -1.26 -5.08 120.40 121.89 2ksy s VAL 230 Ca 0.00 0.29 -0.13 0.00 0.00 0.00 0.00 61.98 62.15 2ksy s VAL 230 Cb 0.00 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 2ksy s VAL 230 CO 0.00 0.37 0.27 -0.62 0.00 0.00 0.00 175.10 175.12 2ksy s ASP 231 N 0.74 6.45 0.00 3.32 2.15 -1.26 -4.84 116.67 123.23 2ksy s ASP 231 Ca 0.10 0.53 0.00 0.00 0.43 0.00 0.00 52.55 53.61 2ksy s ASP 231 Cb -0.13 -2.17 0.00 0.00 -0.30 0.00 0.00 42.92 40.33 2ksy s ASP 231 CO 0.03 0.18 0.00 1.07 -0.17 0.00 0.00 175.17 176.27 2ksy n THR 232 N 3.12 0.00 -3.93 1.71 5.66 -1.26 -5.10 114.28 114.49 2ksy n THR 232 Ca -0.14 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.57 2ksy n THR 232 Cb 0.52 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 69.14 2ksy n THR 232 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2ksy s ASP 233 N -0.95 3.30 0.02 1.09 -1.08 -1.26 -5.12 116.67 112.67 2ksy s ASP 233 Ca 0.00 -0.88 -0.01 0.00 -0.52 0.00 0.00 52.55 51.14 2ksy s ASP 233 Cb 0.00 -1.07 -0.02 0.00 -1.46 0.00 0.00 42.92 40.37 2ksy s ASP 233 CO 0.00 -0.19 -0.02 0.42 0.52 0.00 0.00 175.17 175.90 2ksy s THR 234 N 1.50 0.12 -0.09 1.71 -4.23 -1.26 -5.12 115.64 108.28 2ksy s THR 234 Ca -0.02 -0.99 -0.29 0.00 -1.18 0.00 0.00 61.69 59.21 2ksy s THR 234 Cb -0.17 -0.41 -0.06 0.00 1.34 0.00 0.00 72.50 73.21 2ksy s THR 234 CO -0.07 -0.54 1.84 -2.16 -0.54 0.00 0.00 174.62 173.14 2ksy s PRO 235 N -1.72 3.92 -0.05 3.99 0.04 -1.26 -4.98 135.00 134.94 2ksy s PRO 235 Ca -0.13 2.18 -0.01 0.00 0.04 0.00 0.00 61.00 63.08 2ksy s PRO 235 Cb -0.08 -4.12 0.03 0.00 0.04 0.00 0.00 34.50 30.37 2ksy s PRO 235 CO -0.02 -1.18 0.02 0.00 0.04 0.00 0.00 177.00 175.86 2ksy s ALA 236 N 5.11 0.43 -0.11 8.56 0.00 -1.26 -5.00 121.76 129.48 2ksy s ALA 236 Ca 0.82 0.07 0.16 0.00 0.00 0.00 0.00 51.96 53.01 2ksy s ALA 236 Cb -0.34 -0.58 0.25 0.00 0.00 0.00 0.00 23.12 22.45 2ksy s ALA 236 CO 0.34 -0.36 1.13 1.55 0.00 0.00 0.00 175.76 178.42 2ksy n VAL 237 N 4.92 1.75 1.33 0.00 3.14 -1.26 -4.60 118.33 123.61 2ksy n VAL 237 Ca -0.11 -2.08 0.13 0.00 -2.96 0.00 0.00 64.34 59.32 2ksy n VAL 237 Cb 0.50 -0.14 0.48 0.00 -1.06 0.00 0.00 33.84 33.62 2ksy n VAL 237 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2ksy n ALA 238 N -1.30 2.92 -2.74 1.55 0.00 -1.26 -5.00 120.51 114.67 2ksy n ALA 238 Ca 0.14 -0.36 -0.01 0.00 0.00 0.00 0.00 53.44 53.21 2ksy n ALA 238 Cb 0.59 -1.21 -0.01 0.00 0.00 0.00 0.00 19.45 18.83 2ksy n ALA 238 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2ksy n ASP 239 N -0.69 -6.74 0.00 0.00 2.03 -1.26 -4.99 116.55 104.90 2ksy n ASP 239 Ca 0.14 1.35 0.00 0.00 0.52 0.00 0.00 54.79 56.80 2ksy n ASP 239 Cb 0.32 -5.03 0.00 0.00 -0.72 0.00 0.00 41.12 35.69 2ksy n ASP 239 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ksy n LEU 240 N 0.94 0.00 0.16 -2.67 -0.00 -1.26 -4.90 117.00 109.27 2ksy n LEU 240 Ca -0.07 0.00 0.13 0.00 -0.00 0.00 0.00 56.01 56.07 2ksy n LEU 240 Cb 0.14 0.00 0.53 0.00 -0.00 0.00 0.00 43.42 44.09 2ksy n LEU 240 CO 0.40 0.00 0.89 1.05 -0.00 0.00 0.00 177.39 179.73 2ksy h GLU 241 N 0.00 0.00 -0.12 1.47 4.11 -1.95 -3.06 114.58 115.02 2ksy h GLU 241 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 2ksy h GLU 241 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 2ksy h GLU 241 CO 0.00 0.00 -0.04 1.25 0.07 0.00 0.00 179.01 180.29 2ksy h HIS 242 N 0.00 0.28 -3.69 2.06 2.76 -2.02 -3.44 115.15 111.10 2ksy h HIS 242 Ca 0.00 -0.06 -0.56 0.00 -2.20 0.00 0.00 60.37 57.55 2ksy h HIS 242 Cb 0.41 -0.07 0.12 0.00 1.55 0.00 0.00 27.41 29.42 2ksy h HIS 242 CO 0.00 0.56 0.58 0.72 -1.30 0.00 0.00 177.93 178.50 2ksy n HIS 243 N -4.71 2.40 -0.08 5.26 8.25 -1.16 -4.94 115.22 120.23 2ksy n HIS 243 Ca -0.06 0.48 -0.11 0.00 -0.26 0.00 0.00 57.72 57.77 2ksy n HIS 243 Cb 0.26 -2.42 -0.08 0.00 1.12 0.00 0.00 29.99 28.87 2ksy n HIS 243 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2ksy n HIS 244 N -0.11 0.00 -1.17 4.41 -0.00 -1.26 -5.01 115.22 112.08 2ksy n HIS 244 Ca 0.06 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 57.93 2ksy n HIS 244 Cb 0.40 -0.67 0.13 0.00 -0.12 0.00 0.00 29.99 29.73 2ksy n HIS 244 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2ksy s HIS 245 N -2.34 2.30 0.60 1.57 3.76 -1.26 -5.06 115.29 114.86 2ksy s HIS 245 Ca -0.21 1.35 0.05 0.00 -0.15 0.00 0.00 55.06 56.11 2ksy s HIS 245 Cb 0.06 -3.14 0.09 0.00 1.11 0.00 0.00 32.58 30.69 2ksy s HIS 245 CO 0.42 -2.34 0.83 -3.38 -0.85 0.00 0.00 174.74 169.43 2ksy s HIS 246 N -2.90 1.73 -2.58 1.40 -3.43 -1.26 -5.18 115.29 103.07 2ksy s HIS 246 Ca 0.63 -0.49 0.21 0.00 -0.80 0.00 0.00 55.06 54.61 2ksy s HIS 246 Cb -0.18 -2.53 0.16 0.00 -1.43 0.00 0.00 32.58 28.60 2ksy s HIS 246 CO 0.57 -1.24 1.15 0.72 -2.00 0.00 0.00 174.74 173.95