#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 0.04 2.03 3.14 -1.26 -4.64 118.33 117.64 2ksy n VAL 2 Ca 0.00 -0.24 -0.21 0.00 -2.96 0.00 0.00 64.34 60.93 2ksy n VAL 2 Cb 0.00 0.71 -0.14 0.00 -1.06 0.00 0.00 33.84 33.34 2ksy n VAL 2 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2ksy h GLY 3 N 0.54 0.34 1.36 7.55 0.00 -2.02 -3.32 103.07 107.52 2ksy h GLY 3 Ca 0.00 -0.86 0.02 0.00 0.00 0.00 0.00 47.33 46.49 2ksy h GLY 3 CO 0.00 0.76 0.38 1.41 0.00 0.00 0.00 176.54 179.08 2ksy h LEU 4 N -0.34 0.59 -1.38 3.11 3.38 -1.97 -1.94 115.31 116.75 2ksy h LEU 4 Ca -0.18 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 2ksy h LEU 4 Cb 1.69 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.28 2ksy h LEU 4 CO 0.13 0.41 0.20 0.71 0.09 0.00 0.00 178.44 179.99 2ksy h THR 5 N 0.69 1.16 -0.74 0.22 1.35 -1.82 -2.47 112.91 111.29 2ksy h THR 5 Ca 0.22 -0.46 0.10 0.00 -0.55 0.00 0.00 66.41 65.72 2ksy h THR 5 Cb 0.04 0.60 -0.05 0.00 -1.73 0.00 0.00 68.15 67.01 2ksy h THR 5 CO -0.06 0.18 0.48 0.71 -0.25 0.00 0.00 175.52 176.59 2ksy h THR 6 N 0.62 0.93 0.32 6.82 1.35 -1.45 -2.23 112.91 119.28 2ksy h THR 6 Ca 0.16 -0.21 -0.02 0.00 -0.55 0.00 0.00 66.41 65.79 2ksy h THR 6 Cb 0.09 0.25 0.00 0.00 -1.73 0.00 0.00 68.15 66.76 2ksy h THR 6 CO -0.02 0.11 -0.16 -0.07 -0.25 0.00 0.00 175.52 175.14 2ksy h LEU 7 N 0.62 -0.37 -1.98 3.87 -0.00 -1.54 -1.65 115.31 114.27 2ksy h LEU 7 Ca 0.34 -0.05 0.02 0.00 -0.00 0.00 0.00 57.88 58.20 2ksy h LEU 7 Cb 0.49 0.10 -0.00 0.00 -0.00 0.00 0.00 40.66 41.24 2ksy h LEU 7 CO -0.12 -0.19 0.07 -0.26 -0.00 0.00 0.00 178.44 177.94 2ksy h PHE 8 N -0.53 0.03 -0.14 1.13 0.04 -1.53 -0.75 116.94 115.19 2ksy h PHE 8 Ca -0.04 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.68 2ksy h PHE 8 Cb 0.39 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.53 2ksy h PHE 8 CO -0.03 0.02 -0.11 -1.49 -0.60 0.00 0.00 178.31 176.10 2ksy h TRP 9 N 0.03 0.37 -0.70 -0.55 -0.00 -1.07 -1.69 115.95 112.33 2ksy h TRP 9 Ca 0.05 -0.10 -0.02 0.00 -0.00 0.00 0.00 58.89 58.81 2ksy h TRP 9 Cb 0.15 -0.08 -0.03 0.00 -0.00 0.00 0.00 29.16 29.20 2ksy h TRP 9 CO -0.00 0.69 0.34 -0.07 -0.00 0.00 0.00 178.44 179.40 2ksy h LEU 10 N -0.05 0.92 -1.43 -4.49 3.38 -0.59 -2.09 115.31 110.95 2ksy h LEU 10 Ca 0.03 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2ksy h LEU 10 Cb 0.61 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2ksy h LEU 10 CO 0.03 0.79 0.09 1.23 0.09 0.00 0.00 178.44 180.66 2ksy h GLY 11 N 0.98 0.49 1.60 0.83 0.00 -1.11 -1.93 103.07 103.93 2ksy h GLY 11 Ca 0.24 -0.24 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 2ksy h GLY 11 CO -0.03 0.23 -0.30 0.00 0.00 0.00 0.00 176.54 176.44 2ksy h ALA 12 N 1.64 1.06 0.15 3.60 0.00 -0.64 -2.41 119.26 122.66 2ksy h ALA 12 Ca 0.11 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2ksy h ALA 12 Cb 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2ksy h ALA 12 CO -0.01 0.58 -0.07 0.82 0.00 0.00 0.00 179.25 180.57 2ksy h ILE 13 N 0.40 0.92 -0.32 0.00 1.08 -0.84 -1.49 117.51 117.26 2ksy h ILE 13 Ca 0.05 -0.28 0.00 0.00 -0.39 0.00 0.00 64.86 64.24 2ksy h ILE 13 Cb 0.73 1.10 -0.02 0.00 -3.07 0.00 0.00 36.82 35.56 2ksy h ILE 13 CO 0.06 0.07 0.20 1.23 -0.69 0.00 0.00 178.15 179.02 2ksy h GLY 14 N -0.33 0.45 0.79 5.37 0.00 -1.42 -2.47 103.07 105.45 2ksy h GLY 14 Ca -0.02 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 2ksy h GLY 14 CO 0.03 0.17 -0.02 -0.33 0.00 0.00 0.00 176.54 176.40 2ksy h MET 15 N 0.44 0.31 -0.85 4.80 2.86 -1.15 -2.45 114.93 118.89 2ksy h MET 15 Ca 0.12 -0.11 0.12 0.00 -2.06 0.00 0.00 59.70 57.76 2ksy h MET 15 Cb -0.03 -0.02 -0.08 0.00 0.06 0.00 0.00 31.60 31.52 2ksy h MET 15 CO -0.02 0.55 0.48 1.25 1.06 0.00 0.00 176.91 180.23 2ksy h LEU 16 N 0.04 0.66 -0.18 1.22 7.12 -0.83 0.17 115.31 123.50 2ksy h LEU 16 Ca 0.05 0.06 -0.00 0.00 0.13 0.00 0.00 57.88 58.12 2ksy h LEU 16 Cb 0.42 -0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 40.49 2ksy h LEU 16 CO 0.01 0.34 0.10 0.58 -0.13 0.00 0.00 178.44 179.35 2ksy h VAL 17 N 0.76 1.09 -0.29 1.05 2.07 -1.34 -2.61 116.25 116.97 2ksy h VAL 17 Ca 0.43 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.70 2ksy h VAL 17 Cb 0.48 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 2ksy h VAL 17 CO -0.29 0.09 0.11 1.23 0.02 0.00 0.00 177.57 178.72 2ksy h GLY 18 N 0.20 0.47 -0.00 2.17 0.00 -0.82 -1.88 103.07 103.21 2ksy h GLY 18 Ca 0.06 -0.26 0.18 0.00 0.00 0.00 0.00 47.33 47.31 2ksy h GLY 18 CO -0.01 0.25 0.37 -0.84 0.00 0.00 0.00 176.54 176.31 2ksy h THR 19 N 0.31 0.59 -0.07 4.70 2.02 -0.59 0.09 112.91 119.96 2ksy h THR 19 Ca 0.10 -0.16 -0.06 0.00 0.77 0.00 0.00 66.41 67.06 2ksy h THR 19 Cb 0.20 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.69 2ksy h THR 19 CO -0.01 0.08 -0.18 -0.07 0.37 0.00 0.00 175.52 175.72 2ksy h LEU 20 N 0.46 0.29 -2.01 2.58 3.38 -1.30 -0.78 115.31 117.94 2ksy h LEU 20 Ca 0.49 -0.59 0.07 0.00 0.09 0.00 0.00 57.88 57.95 2ksy h LEU 20 Cb 0.83 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2ksy h LEU 20 CO -0.46 0.82 0.17 0.00 0.09 0.00 0.00 178.44 179.07 2ksy h ALA 21 N 0.47 2.22 0.12 1.53 0.00 -0.45 0.32 119.26 123.47 2ksy h ALA 21 Ca -0.00 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.55 2ksy h ALA 21 Cb 0.78 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2ksy h ALA 21 CO 0.04 -0.29 -1.87 0.74 0.00 0.00 0.00 179.25 177.86 2ksy h PHE 22 N 0.00 0.47 0.03 0.00 0.04 -1.01 -3.24 116.94 113.23 2ksy h PHE 22 Ca 0.11 -0.34 -0.00 0.00 2.80 0.00 0.00 57.97 60.54 2ksy h PHE 22 Cb 0.45 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.59 2ksy h PHE 22 CO 0.00 1.74 -0.01 0.00 -0.60 0.00 0.00 178.31 179.44 2ksy h ALA 23 N 0.02 -0.04 -0.08 2.45 0.00 -0.82 0.16 119.26 120.96 2ksy h ALA 23 Ca -0.40 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.38 2ksy h ALA 23 Cb 1.96 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.75 2ksy h ALA 23 CO 0.07 -0.38 -0.04 2.35 0.00 0.00 0.00 179.25 181.25 2ksy h TRP 24 N -0.32 -0.09 0.00 0.00 2.91 -1.14 -1.01 115.95 116.30 2ksy h TRP 24 Ca -0.00 0.01 -0.04 0.00 1.13 0.00 0.00 58.89 59.99 2ksy h TRP 24 Cb 0.30 0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 29.00 2ksy h TRP 24 CO 0.02 -0.07 -0.17 0.00 -1.03 0.00 0.00 178.44 177.20 2ksy h ALA 25 N 1.04 1.07 -0.12 2.65 0.00 -1.58 -3.10 119.26 119.23 2ksy h ALA 25 Ca 0.05 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.64 2ksy h ALA 25 Cb 0.10 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.87 2ksy h ALA 25 CO -0.10 0.21 -0.57 0.78 0.00 0.00 0.00 179.25 179.57 2ksy h GLY 26 N 1.77 0.65 2.00 0.00 0.00 0.14 -3.12 103.07 104.51 2ksy h GLY 26 Ca -0.00 -0.92 -0.00 0.00 0.00 0.00 0.00 47.33 46.40 2ksy h GLY 26 CO 0.02 0.82 -0.02 3.21 0.00 0.00 0.00 176.54 180.58 2ksy h ARG 27 N 0.23 0.00 -4.28 4.80 2.47 -1.13 -3.35 114.38 113.12 2ksy h ARG 27 Ca -0.04 0.00 -0.67 0.00 -1.26 0.00 0.00 59.98 58.01 2ksy h ARG 27 Cb 1.21 0.00 -0.38 0.00 -1.65 0.00 0.00 29.97 29.16 2ksy h ARG 27 CO 0.12 0.02 -0.60 0.34 0.56 0.00 0.00 179.97 180.40 2ksy s ASP 28 N -5.62 4.94 0.18 7.04 -1.08 -1.18 -4.81 116.67 116.13 2ksy s ASP 28 Ca -0.04 -2.33 0.00 0.00 -0.52 0.00 0.00 52.55 49.66 2ksy s ASP 28 Cb 0.13 -1.73 0.00 0.00 -1.46 0.00 0.00 42.92 39.86 2ksy s ASP 28 CO 0.48 -0.41 0.00 0.00 0.52 0.00 0.00 175.17 175.76 2ksy n ALA 29 N 4.10 0.00 0.00 3.66 0.00 -1.26 -4.85 120.51 122.17 2ksy n ALA 29 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2ksy n ALA 29 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 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 -1.49 -0.51 3.18 0.00 0.00 -1.26 -5.07 105.19 100.04 2ksy n GLY 30 Ca 0.00 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 2ksy n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ksy s SER 31 N -4.00 3.11 0.00 1.61 0.01 -1.26 -4.62 113.70 108.55 2ksy s SER 31 Ca 0.00 -0.60 0.00 0.00 1.31 0.00 0.00 55.95 56.66 2ksy s SER 31 Cb 0.00 -1.44 0.00 0.00 0.21 0.00 0.00 66.02 64.79 2ksy s SER 31 CO 0.00 0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.35 2ksy n GLY 32 N 3.97 2.95 0.28 3.44 0.00 -1.26 -4.79 105.19 109.78 2ksy n GLY 32 Ca -0.20 -0.77 0.14 0.00 0.00 0.00 0.00 46.02 45.19 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 0.00 0.00 -0.95 1.61 4.39 -1.98 -2.67 114.58 114.98 2ksy h GLU 33 Ca 0.00 0.00 0.27 0.00 0.34 0.00 0.00 59.36 59.97 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 0.08 0.68 -0.09 -1.16 0.00 0.00 179.01 178.52 2ksy h ARG 34 N 0.00 0.03 0.22 2.33 2.43 -1.87 -1.54 114.38 115.99 2ksy h ARG 34 Ca -0.00 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2ksy h ARG 34 Cb 0.25 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.78 2ksy h ARG 34 CO 0.01 0.02 -0.14 0.00 -1.51 0.00 0.00 179.97 178.35 2ksy h ARG 35 N 0.03 -0.33 -0.08 0.20 3.08 -1.89 -0.50 114.38 114.89 2ksy h ARG 35 Ca 0.46 0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.55 2ksy h ARG 35 Cb 1.77 0.08 -0.00 0.00 0.08 0.00 0.00 29.97 31.89 2ksy h ARG 35 CO -0.02 -0.22 0.07 1.88 -1.07 0.00 0.00 179.97 180.61 2ksy h TYR 36 N -0.35 0.00 0.04 3.04 -1.99 -1.50 -0.91 116.97 115.30 2ksy h TYR 36 Ca -0.02 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.71 2ksy h TYR 36 Cb 0.29 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.02 2ksy h TYR 36 CO -0.09 0.00 -0.02 1.88 -0.00 0.00 0.00 178.16 179.93 2ksy h TYR 37 N 0.00 -0.05 -0.80 4.88 0.05 -1.35 -2.64 116.97 117.06 2ksy h TYR 37 Ca 0.04 -0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.90 2ksy h TYR 37 Cb 0.19 0.02 -0.05 0.00 1.01 0.00 0.00 36.73 37.89 2ksy h TYR 37 CO 0.00 0.53 0.52 0.28 -1.05 0.00 0.00 178.16 178.43 2ksy h VAL 38 N -0.95 0.99 0.04 -2.88 2.07 -0.86 -0.38 116.25 114.28 2ksy h VAL 38 Ca -0.01 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 2ksy h VAL 38 Cb 0.60 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2ksy h VAL 38 CO 0.01 0.14 -0.02 0.74 0.02 0.00 0.00 177.57 178.46 2ksy h THR 39 N 0.79 1.06 -0.72 2.57 2.02 -1.26 0.18 112.91 117.56 2ksy h THR 39 Ca 0.36 -0.35 0.07 0.00 0.77 0.00 0.00 66.41 67.25 2ksy h THR 39 Cb 0.35 1.30 -0.06 0.00 -1.74 0.00 0.00 68.15 67.99 2ksy h THR 39 CO -0.13 0.09 0.41 0.25 0.37 0.00 0.00 175.52 176.50 2ksy h LEU 40 N -0.21 0.60 -1.25 2.58 5.85 -0.95 0.39 115.31 122.31 2ksy h LEU 40 Ca -0.01 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 2ksy h LEU 40 Cb 0.19 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 2ksy h LEU 40 CO 0.01 0.38 0.01 0.58 -0.34 0.00 0.00 178.44 179.07 2ksy h VAL 41 N 0.73 1.19 -0.52 1.05 2.07 -0.90 -2.30 116.25 117.57 2ksy h VAL 41 Ca 0.33 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 2ksy h VAL 41 Cb 0.23 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 2ksy h VAL 41 CO -0.20 0.26 0.32 1.23 0.02 0.00 0.00 177.57 179.20 2ksy h GLY 42 N 0.82 0.75 0.50 2.17 0.00 0.12 0.18 103.07 107.61 2ksy h GLY 42 Ca 0.11 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 2ksy h GLY 42 CO 0.01 0.29 -0.19 -2.22 0.00 0.00 0.00 176.54 174.43 2ksy h ILE 43 N 0.72 0.31 0.00 2.60 2.04 -0.90 -2.20 117.51 120.07 2ksy h ILE 43 Ca 0.19 -0.66 -0.00 0.00 1.00 0.00 0.00 64.86 65.39 2ksy h ILE 43 Cb -0.04 0.49 -0.00 0.00 -0.74 0.00 0.00 36.82 36.54 2ksy h ILE 43 CO -0.04 0.07 -0.00 0.28 0.00 0.00 0.00 178.15 178.46 2ksy h SER 44 N -1.03 0.00 0.08 1.72 0.02 -1.42 -2.35 113.55 110.57 2ksy h SER 44 Ca -0.05 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2ksy h SER 44 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 2ksy h SER 44 CO 0.09 0.00 -0.04 1.23 -1.14 0.00 0.00 176.83 176.98 2ksy h GLY 45 N 0.57 -0.11 1.24 -3.77 0.00 -0.60 -2.49 103.07 97.90 2ksy h GLY 45 Ca -0.00 0.04 0.03 0.00 0.00 0.00 0.00 47.33 47.40 2ksy h GLY 45 CO 0.00 -0.04 0.44 0.16 0.00 0.00 0.00 176.54 177.10 2ksy h ILE 46 N -1.00 1.09 -0.24 2.60 3.07 -1.33 -2.34 117.51 119.37 2ksy h ILE 46 Ca -0.01 -0.27 -0.06 0.00 1.55 0.00 0.00 64.86 66.07 2ksy h ILE 46 Cb 0.30 0.23 -0.01 0.00 -0.27 0.00 0.00 36.82 37.08 2ksy h ILE 46 CO 0.02 0.14 -0.07 0.00 -1.05 0.00 0.00 178.15 177.19 2ksy h ALA 47 N 1.61 0.33 -0.72 0.16 0.00 -1.55 -1.99 119.26 117.11 2ksy h ALA 47 Ca 0.26 -0.27 0.09 0.00 0.00 0.00 0.00 54.91 54.99 2ksy h ALA 47 Cb 0.07 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 2ksy h ALA 47 CO -0.07 0.14 0.37 0.00 0.00 0.00 0.00 179.25 179.69 2ksy h ALA 48 N 0.75 0.99 -0.07 0.00 0.00 -0.95 -0.86 119.26 119.12 2ksy h ALA 48 Ca 0.06 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 2ksy h ALA 48 Cb 0.54 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2ksy h ALA 48 CO 0.03 -0.01 -0.71 -0.39 0.00 0.00 0.00 179.25 178.16 2ksy h VAL 49 N 0.64 1.39 -0.33 0.00 -1.51 -1.46 -2.58 116.25 112.40 2ksy h VAL 49 Ca 0.35 -2.15 -0.08 0.00 -1.23 0.00 0.00 66.70 63.59 2ksy h VAL 49 Cb 0.33 2.12 -0.02 0.00 -2.13 0.00 0.00 31.29 31.60 2ksy h VAL 49 CO -0.25 0.64 -0.12 0.00 -1.23 0.00 0.00 177.57 176.61 2ksy h ALA 50 N 1.01 1.19 -0.16 5.19 0.00 -0.58 -1.41 119.26 124.49 2ksy h ALA 50 Ca -0.03 -0.28 -0.22 0.00 0.00 0.00 0.00 54.91 54.38 2ksy h ALA 50 Cb 1.28 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.93 2ksy h ALA 50 CO 0.12 0.52 -0.77 1.88 0.00 0.00 0.00 179.25 181.00 2ksy h TYR 51 N 0.52 1.09 -0.41 0.00 0.05 -1.13 -1.65 116.97 115.44 2ksy h TYR 51 Ca 0.09 -0.48 -0.03 0.00 0.05 0.00 0.00 58.73 58.37 2ksy h TYR 51 Cb 0.51 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 38.07 2ksy h TYR 51 CO 0.02 1.31 0.14 0.00 -1.05 0.00 0.00 178.16 178.58 2ksy h ALA 52 N 0.56 0.53 -0.05 3.88 0.00 -1.24 0.19 119.26 123.13 2ksy h ALA 52 Ca -0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2ksy h ALA 52 Cb 1.40 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 2ksy h ALA 52 CO 0.16 0.17 -0.03 -0.39 0.00 0.00 0.00 179.25 179.16 2ksy h VAL 53 N 0.51 1.33 -0.01 0.00 -1.51 -1.31 -2.60 116.25 112.67 2ksy h VAL 53 Ca 0.13 -1.05 -0.03 0.00 -1.23 0.00 0.00 66.70 64.52 2ksy h VAL 53 Cb 0.24 1.94 -0.00 0.00 -2.13 0.00 0.00 31.29 31.34 2ksy h VAL 53 CO -0.01 0.28 -0.13 -0.03 -1.23 0.00 0.00 177.57 176.46 2ksy h MET 54 N -0.30 0.01 -0.65 5.19 -1.53 -1.27 -1.55 114.93 114.83 2ksy h MET 54 Ca 0.01 -0.00 -0.09 0.00 -3.44 0.00 0.00 59.70 56.18 2ksy h MET 54 Cb 0.47 -0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.49 2ksy h MET 54 CO 0.01 0.15 0.07 0.00 0.14 0.00 0.00 176.91 177.27 2ksy h ALA 55 N 1.85 0.87 0.00 0.39 0.00 -0.47 -2.08 119.26 119.83 2ksy h ALA 55 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2ksy h ALA 55 Cb 0.24 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2ksy h ALA 55 CO 0.02 0.67 0.00 1.28 0.00 0.00 0.00 179.25 181.22 2ksy n LEU 56 N -4.20 0.00 0.00 0.00 4.77 -0.79 -4.71 117.00 112.07 2ksy n LEU 56 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2ksy n LEU 56 Cb 0.31 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 2ksy n LEU 56 CO 0.44 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2ksy n GLY 57 N 0.28 0.76 3.74 -0.72 0.00 -0.78 -5.04 105.19 103.42 2ksy n GLY 57 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.24 3.74 0.00 1.61 1.01 -0.65 -2.92 120.40 120.94 2ksy s VAL 58 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 61.98 63.48 2ksy s VAL 58 Cb 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.42 2ksy s VAL 58 CO 0.00 0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.97 2ksy n GLY 59 N 2.03 1.29 3.56 4.51 0.00 -1.26 -4.02 105.19 111.30 2ksy n GLY 59 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.40 1.99 -0.17 1.61 0.52 -1.15 -2.53 118.94 115.80 2ksy s TRP 60 Ca 0.00 0.51 -0.01 0.00 0.02 0.00 0.00 56.10 56.62 2ksy s TRP 60 Cb 0.00 -4.29 -0.00 0.00 -1.15 0.00 0.00 33.47 28.02 2ksy s TRP 60 CO 0.00 -2.21 -0.12 0.54 0.02 0.00 0.00 176.95 175.18 2ksy s VAL 61 N 7.31 2.86 0.72 4.03 0.11 -0.82 -5.02 120.40 129.58 2ksy s VAL 61 Ca 0.57 -0.69 -0.13 0.00 -2.93 0.00 0.00 61.98 58.80 2ksy s VAL 61 Cb -0.12 -2.23 0.03 0.00 -1.53 0.00 0.00 36.38 32.53 2ksy s VAL 61 CO 0.22 0.50 1.10 -2.84 -3.33 0.00 0.00 175.10 170.75 2ksy s PRO 62 N 0.95 2.51 -0.33 1.54 0.02 -1.26 -1.63 135.00 136.81 2ksy s PRO 62 Ca -0.02 1.30 -0.00 0.00 0.02 0.00 0.00 61.00 62.30 2ksy s PRO 62 Cb -0.15 -1.92 0.14 0.00 0.02 0.00 0.00 34.50 32.59 2ksy s PRO 62 CO -0.01 -1.46 0.26 0.08 -0.33 0.00 0.00 177.00 175.54 2ksy s VAL 63 N -2.59 -0.18 0.00 3.83 1.01 0.13 -4.79 120.40 117.82 2ksy s VAL 63 Ca 0.64 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.62 2ksy s VAL 63 Cb -0.19 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.26 2ksy s VAL 63 CO 0.48 -0.69 0.00 0.00 0.00 0.00 0.00 175.10 174.89 2ksy n ALA 64 N 4.66 0.00 -0.01 5.51 0.00 -1.26 -0.91 120.51 128.51 2ksy n ALA 64 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.48 2ksy n ALA 64 Cb 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.86 2ksy n ALA 64 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2ksy n GLU 65 N 0.00 2.56 -4.12 0.00 4.07 -1.26 -5.04 120.64 116.85 2ksy n GLU 65 Ca 0.00 -0.01 -0.27 0.00 -0.06 0.00 0.00 57.16 56.82 2ksy n GLU 65 Cb 0.00 -1.05 -0.07 0.00 -0.06 0.00 0.00 31.44 30.27 2ksy n GLU 65 CO 0.00 0.00 0.00 -0.98 -0.06 0.00 0.00 177.13 176.09 2ksy s ARG 66 N -2.07 2.70 -0.06 5.31 1.70 -0.08 -5.12 118.95 121.31 2ksy s ARG 66 Ca -0.01 -0.92 -0.02 0.00 -0.47 0.00 0.00 55.73 54.31 2ksy s ARG 66 Cb 0.01 -2.55 -0.04 0.00 -0.57 0.00 0.00 34.95 31.80 2ksy s ARG 66 CO 0.08 0.49 0.03 0.99 -1.08 0.00 0.00 175.30 175.81 2ksy s THR 67 N -1.66 4.49 0.08 4.99 2.01 -1.26 0.23 115.64 124.51 2ksy s THR 67 Ca 0.29 -0.27 0.10 0.00 0.31 0.00 0.00 61.69 62.12 2ksy s THR 67 Cb -0.10 -2.94 -0.03 0.00 0.01 0.00 0.00 72.50 69.44 2ksy s THR 67 CO 0.21 0.53 -0.26 0.68 -0.69 0.00 0.00 174.62 175.09 2ksy s VAL 68 N -0.98 2.20 -0.32 3.82 -7.23 -0.65 -4.91 120.40 112.34 2ksy s VAL 68 Ca 0.16 -1.52 -0.07 0.00 -1.81 0.00 0.00 61.98 58.75 2ksy s VAL 68 Cb -0.12 -1.90 0.02 0.00 0.56 0.00 0.00 36.38 34.95 2ksy s VAL 68 CO 0.05 0.27 0.09 -0.36 -0.31 0.00 0.00 175.10 174.84 2ksy s PHE 69 N -0.90 3.20 0.06 2.82 0.08 -1.26 -1.95 117.98 120.03 2ksy s PHE 69 Ca 0.13 -1.20 -0.22 0.00 0.12 0.00 0.00 56.93 55.75 2ksy s PHE 69 Cb -0.10 -2.26 -0.14 0.00 -0.57 0.00 0.00 43.02 39.95 2ksy s PHE 69 CO 0.04 -0.66 1.58 0.28 -0.10 0.00 0.00 175.22 176.36 2ksy h VAL 70 N 6.02 1.16 0.00 -0.44 2.07 -1.85 -2.73 116.25 120.48 2ksy h VAL 70 Ca -0.27 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 66.76 2ksy h VAL 70 Cb 1.10 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 2ksy h VAL 70 CO 0.60 0.14 0.14 -0.65 0.02 0.00 0.00 177.57 177.82 2ksy h PRO 71 N -0.05 0.00 0.27 1.57 0.11 -1.87 -2.03 132.00 129.99 2ksy h PRO 71 Ca 0.03 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 2ksy h PRO 71 Cb 0.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.31 2ksy h PRO 71 CO -0.00 0.00 -0.13 -0.09 -0.21 0.00 0.00 178.00 177.57 2ksy h ARG 72 N 0.00 -0.35 -0.15 1.05 2.43 -1.86 0.02 114.38 115.52 2ksy h ARG 72 Ca 0.00 0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.05 2ksy h ARG 72 Cb 0.28 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 2ksy h ARG 72 CO 0.00 -0.00 -0.51 1.88 -1.51 0.00 0.00 179.97 179.83 2ksy h TYR 73 N -0.91 0.50 -0.40 2.20 0.05 -1.55 -2.81 116.97 114.05 2ksy h TYR 73 Ca -0.04 -0.17 -0.12 0.00 0.05 0.00 0.00 58.73 58.46 2ksy h TYR 73 Cb 0.51 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.13 2ksy h TYR 73 CO 0.05 0.83 -0.24 0.97 -1.05 0.00 0.00 178.16 178.73 2ksy h ILE 74 N 0.32 1.27 -0.97 -2.88 -0.00 -1.46 -2.25 117.51 111.54 2ksy h ILE 74 Ca 0.01 -1.37 0.05 0.00 -0.00 0.00 0.00 64.86 63.56 2ksy h ILE 74 Cb 1.01 1.22 -0.06 0.00 -0.00 0.00 0.00 36.82 38.98 2ksy h ILE 74 CO 0.09 0.46 0.63 -0.78 -0.00 0.00 0.00 178.15 178.55 2ksy h ASP 75 N 0.70 1.03 0.21 2.19 1.82 -0.77 0.30 116.42 121.90 2ksy h ASP 75 Ca 0.09 -0.00 -0.08 0.00 -0.39 0.00 0.00 57.03 56.65 2ksy h ASP 75 Cb 0.76 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 40.54 2ksy h ASP 75 CO 0.06 0.68 -0.31 -0.50 -1.61 0.00 0.00 179.24 177.56 2ksy h TRP 76 N 1.18 0.18 -0.16 0.28 6.55 -1.22 -0.60 115.95 122.16 2ksy h TRP 76 Ca 0.40 -0.04 -0.08 0.00 0.95 0.00 0.00 58.89 60.13 2ksy h TRP 76 Cb 0.09 -0.05 -0.01 0.00 -0.86 0.00 0.00 29.16 28.33 2ksy h TRP 76 CO -0.00 0.46 -0.26 0.82 -1.05 0.00 0.00 178.44 178.42 2ksy h ILE 77 N 0.15 1.25 0.00 1.49 2.04 -0.38 0.20 117.51 122.26 2ksy h ILE 77 Ca 0.02 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.71 2ksy h ILE 77 Cb 0.63 1.41 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 2ksy h ILE 77 CO 0.05 0.36 -0.98 0.18 0.00 0.00 0.00 178.15 177.76 2ksy n LEU 78 N -4.15 0.71 -0.10 1.44 4.77 -0.81 -4.33 117.00 114.53 2ksy n LEU 78 Ca -0.01 0.20 -0.20 0.00 -0.03 0.00 0.00 56.01 55.97 2ksy n LEU 78 Cb 0.38 -0.10 -0.07 0.00 -2.33 0.00 0.00 43.42 41.30 2ksy n LEU 78 CO 0.40 -0.09 -1.10 0.35 -1.33 0.00 0.00 177.39 175.62 2ksy n THR 79 N -2.35 1.32 -0.01 -5.08 -2.24 -0.27 -4.33 114.28 101.33 2ksy n THR 79 Ca 0.01 -0.19 -0.10 0.00 -2.27 0.00 0.00 64.05 61.50 2ksy n THR 79 Cb 0.50 -1.92 -0.04 0.00 -2.10 0.00 0.00 70.33 66.77 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 -0.83 0.29 0.00 4.28 2.02 -0.82 0.95 112.91 118.80 2ksy h THR 80 Ca -0.43 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 2ksy h THR 80 Cb 1.33 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 68.04 2ksy h THR 80 CO -0.26 0.00 -0.00 -0.65 0.37 0.00 0.00 175.52 174.98 2ksy h PRO 81 N -0.38 0.00 0.02 6.66 0.11 -1.75 -0.49 132.00 136.17 2ksy h PRO 81 Ca 0.10 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 66.00 2ksy h PRO 81 Cb 0.54 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 2ksy h PRO 81 CO -0.36 0.00 -0.95 1.25 -0.21 0.00 0.00 178.00 177.73 2ksy h LEU 82 N 0.00 0.30 0.12 2.35 5.85 -1.05 -1.91 115.31 120.98 2ksy h LEU 82 Ca -0.00 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 2ksy h LEU 82 Cb 0.03 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.96 2ksy h LEU 82 CO 0.00 1.09 -0.06 0.40 -0.34 0.00 0.00 178.44 179.53 2ksy h ILE 83 N 0.11 1.06 -0.00 4.05 1.08 0.03 -1.21 117.51 122.64 2ksy h ILE 83 Ca -0.06 -0.87 -0.02 0.00 -0.39 0.00 0.00 64.86 63.52 2ksy h ILE 83 Cb 1.60 1.60 -0.00 0.00 -3.07 0.00 0.00 36.82 36.95 2ksy h ILE 83 CO 0.15 0.20 -0.09 -0.37 -0.69 0.00 0.00 178.15 177.35 2ksy h VAL 84 N -0.58 1.07 -0.18 1.67 -1.51 -1.57 -0.29 116.25 114.86 2ksy h VAL 84 Ca -0.02 -0.32 -0.09 0.00 -1.23 0.00 0.00 66.70 65.04 2ksy h VAL 84 Cb 0.46 1.17 -0.01 0.00 -2.13 0.00 0.00 31.29 30.78 2ksy h VAL 84 CO 0.03 0.09 -0.31 0.22 -1.23 0.00 0.00 177.57 176.37 2ksy h TYR 85 N 0.00 0.39 0.15 5.19 3.20 -1.15 -1.70 116.97 123.05 2ksy h TYR 85 Ca -0.00 -0.09 -0.01 0.00 3.14 0.00 0.00 58.73 61.77 2ksy h TYR 85 Cb 0.16 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.34 2ksy h TYR 85 CO 0.00 0.62 -0.07 0.35 -1.64 0.00 0.00 178.16 177.42 2ksy h PHE 86 N 0.30 -0.19 0.00 -3.82 3.04 0.21 -0.93 116.94 115.55 2ksy h PHE 86 Ca 0.04 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.96 2ksy h PHE 86 Cb 0.69 0.06 -0.00 0.00 2.56 0.00 0.00 35.95 39.26 2ksy h PHE 86 CO 0.02 -0.04 -0.12 -0.07 -2.02 0.00 0.00 178.31 176.09 2ksy h LEU 87 N -0.31 0.00 -0.95 0.59 4.07 -1.37 -0.99 115.31 116.36 2ksy h LEU 87 Ca -0.02 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.85 2ksy h LEU 87 Cb 0.24 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.97 2ksy h LEU 87 CO 0.03 0.12 -0.45 1.23 -1.08 0.00 0.00 178.44 178.29 2ksy h GLY 88 N 0.37 0.00 0.78 0.83 0.00 -0.75 -2.89 103.07 101.41 2ksy h GLY 88 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 2ksy h GLY 88 CO 0.02 0.00 -0.18 1.41 0.00 0.00 0.00 176.54 177.79 2ksy h LEU 89 N 0.00 0.45 -1.94 3.11 3.38 0.19 0.87 115.31 121.37 2ksy h LEU 89 Ca -0.00 -0.49 -0.00 0.00 0.09 0.00 0.00 57.88 57.48 2ksy h LEU 89 Cb 0.92 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 2ksy h LEU 89 CO 0.06 0.84 0.02 -0.07 0.09 0.00 0.00 178.44 179.38 2ksy h LEU 90 N 0.06 0.05 0.00 1.67 3.38 -1.43 -2.00 115.31 117.04 2ksy h LEU 90 Ca 0.03 -0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.75 2ksy h LEU 90 Cb 0.72 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 2ksy h LEU 90 CO 0.04 0.04 -1.39 0.00 0.09 0.00 0.00 178.44 177.22 2ksy h ALA 91 N 1.96 0.62 -2.53 1.53 0.00 -1.36 -3.42 119.26 116.07 2ksy h ALA 91 Ca 0.02 -1.19 -0.09 0.00 0.00 0.00 0.00 54.91 53.65 2ksy h ALA 91 Cb 0.01 0.23 0.04 0.00 0.00 0.00 0.00 17.79 18.07 2ksy h ALA 91 CO -0.00 1.38 -0.18 0.41 0.00 0.00 0.00 179.25 180.86 2ksy n GLY 92 N 1.46 0.42 3.50 0.00 0.00 0.28 -4.40 105.19 106.45 2ksy n GLY 92 Ca -0.10 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.81 1.04 0.78 0.99 1.43 -1.06 -5.04 118.68 114.01 2ksy s LEU 93 Ca 0.08 1.63 -0.02 0.00 -1.03 0.00 0.00 54.13 54.79 2ksy s LEU 93 Cb -0.03 -3.58 0.15 0.00 0.03 0.00 0.00 46.19 42.76 2ksy s LEU 93 CO 0.18 -4.16 1.07 -1.81 0.23 0.00 0.00 176.35 171.86 2ksy s ASP 94 N -2.47 4.03 0.20 2.29 1.11 -1.26 -4.85 116.67 115.71 2ksy s ASP 94 Ca 0.68 -0.41 -0.11 0.00 0.18 0.00 0.00 52.55 52.90 2ksy s ASP 94 Cb -0.25 0.17 0.13 0.00 1.07 0.00 0.00 42.92 44.03 2ksy s ASP 94 CO 0.64 -2.10 1.85 0.77 1.18 0.00 0.00 175.17 177.51 2ksy h SER 95 N -0.75 0.83 -0.01 0.27 4.64 -1.99 -1.01 113.55 115.53 2ksy h SER 95 Ca -0.36 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2ksy h SER 95 Cb 1.26 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2ksy h SER 95 CO 0.37 0.63 -0.01 0.03 -0.87 0.00 0.00 176.83 176.98 2ksy h ARG 96 N 0.95 0.02 -0.45 4.77 3.08 -1.99 -2.21 114.38 118.55 2ksy h ARG 96 Ca 0.25 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.36 2ksy h ARG 96 Cb -0.06 -0.00 -0.06 0.00 0.08 0.00 0.00 29.97 29.93 2ksy h ARG 96 CO -0.05 0.45 0.10 0.93 -1.07 0.00 0.00 179.97 180.33 2ksy h GLU 97 N -0.40 0.23 -0.63 0.04 5.08 -1.91 -1.39 114.58 115.60 2ksy h GLU 97 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2ksy h GLU 97 Cb 0.44 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 2ksy h GLU 97 CO 0.00 0.15 0.41 0.74 -1.00 0.00 0.00 179.01 179.31 2ksy h PHE 98 N 0.24 0.81 0.00 4.33 0.04 -1.20 -1.69 116.94 119.46 2ksy h PHE 98 Ca 0.22 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 61.00 2ksy h PHE 98 Cb 0.27 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 2ksy h PHE 98 CO -0.21 0.52 -0.02 0.78 -0.60 0.00 0.00 178.31 178.78 2ksy h GLY 99 N 0.86 0.00 0.51 -1.45 0.00 -0.66 -1.23 103.07 101.10 2ksy h GLY 99 Ca 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.51 2ksy h GLY 99 CO -0.05 0.00 -0.20 -2.22 0.00 0.00 0.00 176.54 174.08 2ksy h ILE 100 N 0.00 1.49 -0.37 2.60 2.04 -0.36 -2.33 117.51 120.58 2ksy h ILE 100 Ca -0.00 -1.72 -0.15 0.00 1.00 0.00 0.00 64.86 63.99 2ksy h ILE 100 Cb 0.05 2.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.64 2ksy h ILE 100 CO 0.00 0.47 -0.37 -0.37 0.00 0.00 0.00 178.15 177.89 2ksy h VAL 101 N -0.41 1.28 -0.18 1.67 -1.51 -1.18 -2.35 116.25 113.56 2ksy h VAL 101 Ca -0.02 -1.54 -0.04 0.00 -1.23 0.00 0.00 66.70 63.87 2ksy h VAL 101 Cb 0.88 1.38 -0.01 0.00 -2.13 0.00 0.00 31.29 31.41 2ksy h VAL 101 CO 0.04 0.51 -0.05 0.40 -1.23 0.00 0.00 177.57 177.24 2ksy h ILE 102 N 0.71 1.29 -0.28 7.19 1.08 -1.33 -2.74 117.51 123.43 2ksy h ILE 102 Ca 0.06 -1.05 -0.03 0.00 -0.39 0.00 0.00 64.86 63.46 2ksy h ILE 102 Cb 0.94 1.61 -0.02 0.00 -3.07 0.00 0.00 36.82 36.29 2ksy h ILE 102 CO 0.09 0.31 0.05 0.00 -0.69 0.00 0.00 178.15 177.91 2ksy h THR 103 N 0.06 1.14 0.14 -0.27 1.03 -1.44 -2.40 112.91 111.17 2ksy h THR 103 Ca 0.04 -0.52 0.00 0.00 -0.01 0.00 0.00 66.41 65.92 2ksy h THR 103 Cb 0.51 0.88 -0.01 0.00 -1.07 0.00 0.00 68.15 68.46 2ksy h THR 103 CO 0.02 0.18 -0.11 0.25 -0.01 0.00 0.00 175.52 175.85 2ksy h LEU 104 N 0.40 -0.29 -1.46 0.00 7.12 -1.25 -1.92 115.31 117.91 2ksy h LEU 104 Ca 0.10 0.03 0.09 0.00 0.13 0.00 0.00 57.88 58.22 2ksy h LEU 104 Cb 0.18 0.10 -0.04 0.00 -0.53 0.00 0.00 40.66 40.37 2ksy h LEU 104 CO -0.00 -0.18 0.46 0.78 -0.13 0.00 0.00 178.44 179.37 2ksy h ASN 105 N -0.26 0.56 -0.15 1.25 -0.26 -1.17 -2.14 115.58 113.41 2ksy h ASN 105 Ca -0.00 0.01 0.04 0.00 -0.56 0.00 0.00 56.30 55.78 2ksy h ASN 105 Cb 0.24 -0.11 -0.04 0.00 -1.06 0.00 0.00 38.32 37.35 2ksy h ASN 105 CO -0.01 0.34 -0.10 0.74 -1.06 0.00 0.00 177.43 177.34 2ksy h THR 106 N 0.62 0.71 -0.95 2.81 2.02 -0.87 0.15 112.91 117.41 2ksy h THR 106 Ca 0.32 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.50 2ksy h THR 106 Cb 0.41 0.71 -0.05 0.00 -1.74 0.00 0.00 68.15 67.49 2ksy h THR 106 CO -0.11 0.00 0.59 0.58 0.37 0.00 0.00 175.52 176.96 2ksy h VAL 107 N -0.10 1.25 -0.77 3.16 2.07 -1.08 -1.53 116.25 119.25 2ksy h VAL 107 Ca 0.09 -0.51 -0.05 0.00 0.82 0.00 0.00 66.70 67.04 2ksy h VAL 107 Cb 0.23 -0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 29.86 2ksy h VAL 107 CO -0.21 0.26 0.27 0.58 0.02 0.00 0.00 177.57 178.49 2ksy h VAL 108 N 1.30 1.26 0.09 2.57 2.07 -0.93 -1.66 116.25 120.94 2ksy h VAL 108 Ca 0.34 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.98 2ksy h VAL 108 Cb -0.10 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 2ksy h VAL 108 CO -0.07 0.35 -0.04 0.24 0.02 0.00 0.00 177.57 178.07 2ksy h MET 109 N 1.14 -0.11 -0.53 1.57 2.86 -0.20 -2.79 114.93 116.87 2ksy h MET 109 Ca 0.25 0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.93 2ksy h MET 109 Cb 0.27 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.93 2ksy h MET 109 CO -0.01 0.23 0.35 1.25 1.06 0.00 0.00 176.91 179.79 2ksy h LEU 110 N -0.48 0.53 0.68 1.22 5.85 -1.25 0.69 115.31 122.55 2ksy h LEU 110 Ca -0.01 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2ksy h LEU 110 Cb 0.40 -0.12 0.01 0.00 0.37 0.00 0.00 40.66 41.31 2ksy h LEU 110 CO 0.02 0.37 -0.33 0.00 -0.34 0.00 0.00 178.44 178.16 2ksy h ALA 111 N 1.69 -0.92 0.00 1.25 0.00 -1.21 -2.55 119.26 117.52 2ksy h ALA 111 Ca 0.21 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2ksy h ALA 111 Cb 0.09 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2ksy h ALA 111 CO -0.06 -0.99 -0.29 0.78 0.00 0.00 0.00 179.25 178.70 2ksy h GLY 112 N -0.97 0.00 0.00 0.00 0.00 -1.25 -0.84 103.07 100.01 2ksy h GLY 112 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.24 2ksy h GLY 112 CO 0.15 0.00 0.00 0.33 0.00 0.00 0.00 176.54 177.02 2ksy n PHE 113 N -3.91 0.00 0.28 5.60 -0.00 0.21 -2.42 117.46 117.22 2ksy n PHE 113 Ca -0.02 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.56 2ksy n PHE 113 Cb 0.37 -0.25 0.79 0.00 -0.00 0.00 0.00 39.48 40.39 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 -1.94 1.57 -0.34 3.13 0.00 -1.55 -2.84 119.26 117.28 2ksy h ALA 114 Ca 0.00 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.94 2ksy h ALA 114 Cb 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.72 2ksy h ALA 114 CO 0.00 0.06 -0.09 0.78 0.00 0.00 0.00 179.25 180.00 2ksy h GLY 115 N 0.24 0.24 2.00 0.00 0.00 -1.05 -0.32 103.07 104.19 2ksy h GLY 115 Ca -0.00 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2ksy h GLY 115 CO 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 176.54 176.41 2ksy h ALA 116 N 1.33 1.00 -0.54 3.60 0.00 -1.24 -3.12 119.26 120.30 2ksy h ALA 116 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2ksy h ALA 116 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2ksy h ALA 116 CO -0.36 0.00 0.00 -0.12 0.00 0.00 0.00 179.25 178.77 2ksy n MET 117 N -2.53 4.47 -2.28 0.00 0.00 -0.36 -4.80 117.12 111.62 2ksy n MET 117 Ca 0.04 -3.08 -0.37 0.00 0.00 0.00 0.00 57.70 54.29 2ksy n MET 117 Cb 0.41 -2.15 -0.01 0.00 0.00 0.00 0.00 33.22 31.46 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 -2.65 3.14 -1.12 1.12 -7.23 -0.27 -4.94 120.40 108.44 2ksy s VAL 118 Ca 0.52 0.89 0.12 0.00 -1.81 0.00 0.00 61.98 61.71 2ksy s VAL 118 Cb 0.39 -3.47 0.51 0.00 0.56 0.00 0.00 36.38 34.37 2ksy s VAL 118 CO 0.16 0.03 1.35 -0.81 -0.31 0.00 0.00 175.10 175.52 2ksy n PRO 119 N -0.26 3.02 0.00 4.82 -0.04 -1.26 -4.92 135.00 136.36 2ksy n PRO 119 Ca 0.06 -1.99 0.00 0.00 -0.04 0.00 0.00 63.50 61.53 2ksy n PRO 119 Cb 0.47 -1.76 0.00 0.00 -0.04 0.00 0.00 33.50 32.18 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 0.79 1.69 0.37 0.55 0.00 -1.26 -5.02 105.19 102.31 2ksy n GLY 120 Ca 0.18 0.32 0.03 0.00 0.00 0.00 0.00 46.02 46.55 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 0.98 0.27 -0.61 -5.35 -1.26 -4.60 119.36 108.79 2ksy n ILE 121 Ca 0.00 -0.99 0.18 0.00 -0.27 0.00 0.00 62.75 61.66 2ksy n ILE 121 Cb 0.00 0.51 0.94 0.00 -1.74 0.00 0.00 39.64 39.35 2ksy n ILE 121 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2ksy h GLU 122 N 1.16 0.00 -0.97 6.28 5.08 -1.94 -2.37 114.58 121.82 2ksy h GLU 122 Ca 0.00 0.00 0.25 0.00 -1.00 0.00 0.00 59.36 58.61 2ksy h GLU 122 Cb 0.63 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.82 2ksy h GLU 122 CO 0.00 0.00 0.66 0.07 -1.00 0.00 0.00 179.01 178.74 2ksy h ARG 123 N 0.00 0.23 -0.05 2.33 0.11 -1.81 0.19 114.38 115.38 2ksy h ARG 123 Ca 0.00 -0.01 -0.16 0.00 0.10 0.00 0.00 59.98 59.91 2ksy h ARG 123 Cb 0.10 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.12 2ksy h ARG 123 CO 0.00 0.15 -0.68 1.88 0.10 0.00 0.00 179.97 181.42 2ksy h TYR 124 N 0.23 0.29 0.18 4.08 0.05 -1.77 -2.58 116.97 117.45 2ksy h TYR 124 Ca 0.50 -0.12 -0.01 0.00 0.05 0.00 0.00 58.73 59.15 2ksy h TYR 124 Cb 1.55 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 39.24 2ksy h TYR 124 CO -0.00 0.83 -0.09 0.00 -1.05 0.00 0.00 178.16 177.85 2ksy h ALA 125 N 1.14 -0.24 -0.69 3.88 0.00 -0.85 -0.55 119.26 121.95 2ksy h ALA 125 Ca -0.02 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.79 2ksy h ALA 125 Cb 1.22 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 19.03 2ksy h ALA 125 CO 0.10 -0.28 0.35 -0.07 0.00 0.00 0.00 179.25 179.35 2ksy h LEU 126 N -0.95 0.46 -0.48 0.00 3.38 -1.43 -1.50 115.31 114.79 2ksy h LEU 126 Ca -0.02 0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.84 2ksy h LEU 126 Cb 0.46 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2ksy h LEU 126 CO 0.04 0.27 -0.52 0.15 0.09 0.00 0.00 178.44 178.47 2ksy h PHE 127 N 0.60 0.81 -0.77 1.13 3.57 -1.56 -2.55 116.94 118.17 2ksy h PHE 127 Ca 0.33 -0.28 0.18 0.00 3.53 0.00 0.00 57.97 61.73 2ksy h PHE 127 Cb 0.33 -0.16 -0.13 0.00 2.79 0.00 0.00 35.95 38.78 2ksy h PHE 127 CO -0.11 1.03 0.07 0.78 -2.23 0.00 0.00 178.31 177.86 2ksy h GLY 128 N 0.96 0.95 1.23 2.40 0.00 -0.02 0.54 103.07 109.14 2ksy h GLY 128 Ca 0.02 0.06 -0.15 0.00 0.00 0.00 0.00 47.33 47.26 2ksy h GLY 128 CO 0.10 -0.28 -0.39 1.98 0.00 0.00 0.00 176.54 177.95 2ksy h MET 129 N 0.15 0.84 0.00 4.80 1.85 -1.42 -2.86 114.93 118.29 2ksy h MET 129 Ca 0.43 -0.44 -0.03 0.00 -0.61 0.00 0.00 59.70 59.06 2ksy h MET 129 Cb 0.78 0.01 -0.00 0.00 0.43 0.00 0.00 31.60 32.82 2ksy h MET 129 CO -0.63 1.08 -0.13 0.78 -0.40 0.00 0.00 176.91 177.60 2ksy h GLY 130 N 0.86 0.00 0.29 1.39 0.00 0.16 0.68 103.07 106.44 2ksy h GLY 130 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 2ksy h GLY 130 CO 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 176.54 176.58 2ksy h ALA 131 N 1.87 -0.14 -1.00 3.60 0.00 -0.00 0.16 119.26 123.74 2ksy h ALA 131 Ca -0.00 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.70 2ksy h ALA 131 Cb 0.25 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 2ksy h ALA 131 CO 0.02 -0.22 0.65 0.28 0.00 0.00 0.00 179.25 179.98 2ksy h VAL 132 N -0.86 1.13 -0.16 0.00 2.07 -1.39 -0.53 116.25 116.53 2ksy h VAL 132 Ca -0.01 -0.42 -0.11 0.00 0.82 0.00 0.00 66.70 66.98 2ksy h VAL 132 Cb 0.56 -0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 2ksy h VAL 132 CO 0.02 0.22 -0.37 0.00 0.02 0.00 0.00 177.57 177.46 2ksy h ALA 133 N 1.43 1.07 0.35 1.67 0.00 -0.90 -2.44 119.26 120.45 2ksy h ALA 133 Ca 0.41 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2ksy h ALA 133 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2ksy h ALA 133 CO -0.15 0.59 -0.27 0.35 0.00 0.00 0.00 179.25 179.77 2ksy h PHE 134 N 0.29 -0.72 -0.38 0.00 3.57 0.94 -1.04 116.94 119.60 2ksy h PHE 134 Ca 0.03 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.59 2ksy h PHE 134 Cb 0.79 0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.78 2ksy h PHE 134 CO 0.02 -0.41 0.26 0.82 -2.23 0.00 0.00 178.31 176.77 2ksy h ILE 135 N -0.63 0.93 -0.40 1.41 2.04 -1.33 0.13 117.51 119.66 2ksy h ILE 135 Ca -0.03 -0.08 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 2ksy h ILE 135 Cb 0.54 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.28 2ksy h ILE 135 CO -0.00 0.04 0.02 1.23 0.00 0.00 0.00 178.15 179.43 2ksy h GLY 136 N 0.23 0.67 0.33 5.37 0.00 -0.76 0.08 103.07 108.99 2ksy h GLY 136 Ca 0.17 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 2ksy h GLY 136 CO -0.03 0.37 -0.02 -2.00 0.00 0.00 0.00 176.54 174.87 2ksy h LEU 137 N 0.59 -0.04 -1.90 3.11 5.85 0.20 -2.40 115.31 120.72 2ksy h LEU 137 Ca 0.13 -0.59 0.08 0.00 0.84 0.00 0.00 57.88 58.33 2ksy h LEU 137 Cb 0.35 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 2ksy h LEU 137 CO 0.01 0.60 0.23 -0.37 -0.34 0.00 0.00 178.44 178.58 2ksy h VAL 138 N -0.72 0.89 -0.41 1.05 -1.51 -1.26 -0.17 116.25 114.12 2ksy h VAL 138 Ca -0.01 -0.04 -0.07 0.00 -1.23 0.00 0.00 66.70 65.36 2ksy h VAL 138 Cb 0.63 0.77 -0.01 0.00 -2.13 0.00 0.00 31.29 30.55 2ksy h VAL 138 CO 0.01 0.02 0.00 0.22 -1.23 0.00 0.00 177.57 176.59 2ksy h TYR 139 N 0.11 0.79 -0.24 5.19 3.20 -0.92 -2.81 116.97 122.30 2ksy h TYR 139 Ca 0.15 -0.14 0.06 0.00 3.14 0.00 0.00 58.73 61.95 2ksy h TYR 139 Cb 0.47 -0.21 -0.06 0.00 1.54 0.00 0.00 36.73 38.47 2ksy h TYR 139 CO -0.00 0.80 -0.16 1.88 -1.64 0.00 0.00 178.16 179.04 2ksy h TYR 140 N 0.56 -0.39 -0.09 -3.82 0.05 -0.50 0.61 116.97 113.39 2ksy h TYR 140 Ca 0.12 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.97 2ksy h TYR 140 Cb 0.48 0.21 -0.05 0.00 1.01 0.00 0.00 36.73 38.38 2ksy h TYR 140 CO 0.04 -0.23 -0.24 -0.07 -1.05 0.00 0.00 178.16 176.61 2ksy h LEU 141 N -0.14 -0.73 -0.13 3.88 3.38 -1.43 -0.25 115.31 119.89 2ksy h LEU 141 Ca 0.13 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2ksy h LEU 141 Cb 0.35 0.32 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2ksy h LEU 141 CO -0.33 -0.30 0.00 0.52 0.09 0.00 0.00 178.44 178.43 2ksy n VAL 142 N -5.36 0.68 0.00 1.22 0.31 -0.98 -2.77 118.33 111.42 2ksy n VAL 142 Ca -0.03 0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 2ksy n VAL 142 Cb 0.28 -0.87 0.00 0.00 -0.91 0.00 0.00 33.84 32.34 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 0.50 -1.05 0.29 2.92 0.00 0.21 -4.58 105.19 103.49 2ksy n GLY 143 Ca 0.04 -1.13 0.16 0.00 0.00 0.00 0.00 46.02 45.09 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 -0.19 1.61 0.13 -1.85 -2.29 132.00 129.41 2ksy h PRO 144 Ca 0.00 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.18 2ksy h PRO 144 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2ksy h PRO 144 CO 0.00 0.05 0.16 0.52 -0.23 0.00 0.00 178.00 178.50 2ksy h MET 145 N 0.00 0.00 -0.23 0.86 2.86 -1.74 -0.74 114.93 115.93 2ksy h MET 145 Ca -0.00 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.46 2ksy h MET 145 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 2ksy h MET 145 CO 0.01 0.00 -0.57 1.15 1.06 0.00 0.00 176.91 178.56 2ksy h THR 146 N 0.00 1.29 0.00 2.22 2.02 -1.22 -2.68 112.91 114.53 2ksy h THR 146 Ca 0.09 -1.76 -0.11 0.00 0.77 0.00 0.00 66.41 65.39 2ksy h THR 146 Cb 0.41 1.78 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 2ksy h THR 146 CO -0.00 0.57 -0.54 -0.33 0.37 0.00 0.00 175.52 175.59 2ksy h GLU 147 N 0.55 0.00 -0.25 6.66 3.07 -1.39 -1.46 114.58 121.76 2ksy h GLU 147 Ca -0.00 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.74 2ksy h GLU 147 Cb 1.18 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.09 2ksy h GLU 147 CO 0.12 0.54 -0.29 0.77 -1.40 0.00 0.00 179.01 178.75 2ksy h SER 148 N 0.00 0.69 0.07 1.42 0.02 -1.14 -2.45 113.55 112.16 2ksy h SER 148 Ca -0.01 -0.49 -0.18 0.00 -0.84 0.00 0.00 61.79 60.27 2ksy h SER 148 Cb 1.13 -0.19 0.02 0.00 0.14 0.00 0.00 62.40 63.49 2ksy h SER 148 CO 0.07 1.04 -0.74 0.00 -1.14 0.00 0.00 176.83 176.06 2ksy h ALA 149 N 0.67 -0.01 0.00 3.77 0.00 -1.48 -2.53 119.26 119.67 2ksy h ALA 149 Ca 0.03 -0.64 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 2ksy h ALA 149 Cb 0.87 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 2ksy h ALA 149 CO 0.07 0.39 -0.04 0.77 0.00 0.00 0.00 179.25 180.44 2ksy h SER 150 N -0.20 0.00 -0.33 0.00 0.02 -1.35 -1.44 113.55 110.26 2ksy h SER 150 Ca -0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2ksy h SER 150 Cb 1.50 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.04 2ksy h SER 150 CO 0.14 0.04 0.00 0.00 -1.14 0.00 0.00 176.83 175.87 2ksy n GLN 151 N -3.33 2.25 -0.08 3.45 6.02 -0.92 -4.53 117.38 120.24 2ksy n GLN 151 Ca -0.02 -1.99 -0.16 0.00 -0.01 0.00 0.00 57.00 54.83 2ksy n GLN 151 Cb 0.17 -1.35 -0.12 0.00 1.02 0.00 0.00 30.24 29.96 2ksy n GLN 151 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2ksy h ARG 152 N 2.95 0.00 -2.54 -1.09 9.65 -0.80 -3.49 114.38 119.06 2ksy h ARG 152 Ca 0.00 0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 58.79 2ksy h ARG 152 Cb 0.77 0.00 -0.20 0.00 -1.39 0.00 0.00 29.97 29.15 2ksy h ARG 152 CO 0.00 0.97 -0.06 -1.12 2.80 0.00 0.00 179.97 182.56 2ksy s SER 153 N -6.36 -0.42 0.27 -3.80 0.01 -1.24 -5.02 113.70 97.14 2ksy s SER 153 Ca -0.21 0.43 -0.00 0.00 1.31 0.00 0.00 55.95 57.48 2ksy s SER 153 Cb -0.01 0.46 0.50 0.00 0.21 0.00 0.00 66.02 67.19 2ksy s SER 153 CO 0.65 -0.50 1.84 -1.28 0.41 0.00 0.00 173.24 174.35 2ksy h SER 154 N 3.57 0.92 0.27 2.44 0.87 -1.92 -1.75 113.55 117.95 2ksy h SER 154 Ca -0.28 0.04 -0.21 0.00 -1.23 0.00 0.00 61.79 60.10 2ksy h SER 154 Cb 1.16 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.98 2ksy h SER 154 CO 0.38 0.51 -0.87 1.23 -0.53 0.00 0.00 176.83 177.55 2ksy h GLY 155 N 1.01 0.49 1.39 5.77 0.00 -1.96 -3.23 103.07 106.53 2ksy h GLY 155 Ca 0.47 -0.79 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 2ksy h GLY 155 CO -0.24 0.70 0.33 -2.22 0.00 0.00 0.00 176.54 175.11 2ksy h ILE 156 N 0.27 1.18 -0.64 2.60 2.04 -1.65 -2.63 117.51 118.68 2ksy h ILE 156 Ca -0.06 -0.42 0.11 0.00 1.00 0.00 0.00 64.86 65.48 2ksy h ILE 156 Cb 1.49 0.37 -0.08 0.00 -0.74 0.00 0.00 36.82 37.85 2ksy h ILE 156 CO 0.15 0.19 0.22 0.50 0.00 0.00 0.00 178.15 179.21 2ksy h LYS 157 N 0.82 0.37 -0.19 2.37 3.64 -1.39 0.14 116.57 122.33 2ksy h LYS 157 Ca 0.21 -0.02 -0.18 0.00 -1.27 0.00 0.00 60.65 59.39 2ksy h LYS 157 Cb 0.00 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.74 2ksy h LYS 157 CO -0.04 0.25 -0.60 1.03 -2.27 0.00 0.00 179.45 177.82 2ksy h SER 158 N 0.38 0.73 -0.56 4.20 0.87 -1.62 -2.46 113.55 115.10 2ksy h SER 158 Ca 0.33 -0.41 -0.09 0.00 -1.23 0.00 0.00 61.79 60.39 2ksy h SER 158 Cb 0.45 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 2ksy h SER 158 CO -0.35 1.16 0.01 -0.07 -0.53 0.00 0.00 176.83 177.05 2ksy h LEU 159 N 0.48 0.98 -0.07 2.23 3.38 -1.01 -2.78 115.31 118.53 2ksy h LEU 159 Ca -0.00 -0.27 -0.13 0.00 0.09 0.00 0.00 57.88 57.57 2ksy h LEU 159 Cb 1.18 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.67 2ksy h LEU 159 CO 0.12 1.03 -0.47 0.22 0.09 0.00 0.00 178.44 179.43 2ksy h TYR 160 N 0.93 0.61 -0.61 1.13 3.20 -0.75 -2.73 116.97 118.75 2ksy h TYR 160 Ca 0.17 -0.28 0.01 0.00 3.14 0.00 0.00 58.73 61.77 2ksy h TYR 160 Cb 0.52 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 2ksy h TYR 160 CO 0.03 1.06 0.40 -0.39 -1.64 0.00 0.00 178.16 177.63 2ksy h VAL 161 N -0.01 1.15 0.04 1.81 -1.51 -1.45 0.18 116.25 116.46 2ksy h VAL 161 Ca -0.04 -0.28 -0.00 0.00 -1.23 0.00 0.00 66.70 65.15 2ksy h VAL 161 Cb 1.13 0.26 0.00 0.00 -2.13 0.00 0.00 31.29 30.55 2ksy h VAL 161 CO 0.10 0.15 -0.02 0.03 -1.23 0.00 0.00 177.57 176.60 2ksy h ARG 162 N 0.82 -0.05 -0.40 5.19 3.08 -1.58 -2.62 114.38 118.82 2ksy h ARG 162 Ca 0.23 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.22 2ksy h ARG 162 Cb -0.08 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2ksy h ARG 162 CO -0.05 0.39 0.03 -0.07 -1.07 0.00 0.00 179.97 179.20 2ksy h LEU 163 N -0.51 0.66 -0.04 3.04 4.07 -1.44 -2.80 115.31 118.29 2ksy h LEU 163 Ca -0.01 -0.28 0.02 0.00 0.08 0.00 0.00 57.88 57.69 2ksy h LEU 163 Cb 0.47 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.01 2ksy h LEU 163 CO 0.01 0.78 -0.08 -0.09 -1.08 0.00 0.00 178.44 177.98 2ksy h ARG 164 N 0.52 -0.11 -0.68 1.13 1.12 -0.71 -0.82 114.38 114.83 2ksy h ARG 164 Ca 0.12 0.01 0.11 0.00 -1.11 0.00 0.00 59.98 59.11 2ksy h ARG 164 Cb 0.42 0.03 -0.08 0.00 -0.01 0.00 0.00 29.97 30.33 2ksy h ARG 164 CO 0.01 -0.07 0.27 -0.91 -3.11 0.00 0.00 179.97 176.16 2ksy h ASN 165 N -0.12 0.27 -0.14 -3.80 -0.26 -1.43 -1.58 115.58 108.53 2ksy h ASN 165 Ca 0.05 0.09 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 2ksy h ASN 165 Cb 0.18 0.06 -0.01 0.00 -1.06 0.00 0.00 38.32 37.49 2ksy h ASN 165 CO -0.11 0.14 0.09 -0.07 -1.06 0.00 0.00 177.43 176.42 2ksy h LEU 166 N 0.45 0.16 -0.25 1.61 3.38 -1.15 -2.72 115.31 116.78 2ksy h LEU 166 Ca 0.35 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.37 2ksy h LEU 166 Cb 0.47 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.12 2ksy h LEU 166 CO -0.34 0.12 -0.12 0.74 0.09 0.00 0.00 178.44 178.92 2ksy h THR 167 N 0.18 0.62 -0.95 0.22 2.02 -0.21 -2.02 112.91 112.76 2ksy h THR 167 Ca 0.05 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.25 2ksy h THR 167 Cb -0.02 0.62 -0.05 0.00 -1.74 0.00 0.00 68.15 66.95 2ksy h THR 167 CO -0.01 0.00 0.62 0.58 0.37 0.00 0.00 175.52 177.08 2ksy h VAL 168 N -0.09 1.20 0.23 3.16 2.07 -1.32 -1.83 116.25 119.66 2ksy h VAL 168 Ca 0.13 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 2ksy h VAL 168 Cb 0.29 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 29.91 2ksy h VAL 168 CO -0.31 0.23 -0.11 0.58 0.02 0.00 0.00 177.57 177.98 2ksy h VAL 169 N 1.24 0.00 -0.20 2.57 2.07 -1.06 -2.18 116.25 118.69 2ksy h VAL 169 Ca 0.37 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.77 2ksy h VAL 169 Cb -0.06 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.69 2ksy h VAL 169 CO -0.10 0.00 0.04 0.17 0.02 0.00 0.00 177.57 177.70 2ksy h LEU 170 N -0.40 0.25 -0.66 2.57 8.10 -1.48 -1.91 115.31 121.77 2ksy h LEU 170 Ca -0.03 -0.02 -0.14 0.00 0.11 0.00 0.00 57.88 57.80 2ksy h LEU 170 Cb 0.23 -0.06 -0.02 0.00 -0.44 0.00 0.00 40.66 40.37 2ksy h LEU 170 CO 0.05 0.26 -0.65 -0.50 -4.11 0.00 0.00 178.44 173.50 2ksy h TRP 171 N 0.28 0.00 0.00 0.17 4.06 -1.42 -2.55 115.95 116.49 2ksy h TRP 171 Ca 0.07 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.02 2ksy h TRP 171 Cb 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.28 2ksy h TRP 171 CO 0.00 0.65 0.00 0.00 -3.56 0.00 0.00 178.44 175.53 2ksy n ALA 172 N -2.40 1.90 0.05 1.49 0.00 -0.73 -2.13 120.51 118.70 2ksy n ALA 172 Ca -0.01 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.36 2ksy n ALA 172 Cb 0.65 -1.29 -0.07 0.00 0.00 0.00 0.00 19.45 18.74 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 0.52 -0.38 0.00 1.08 -1.39 -3.38 117.51 113.96 2ksy h ILE 173 Ca 0.00 -1.97 0.06 0.00 -0.39 0.00 0.00 64.86 62.56 2ksy h ILE 173 Cb 0.24 2.05 -0.06 0.00 -3.07 0.00 0.00 36.82 35.99 2ksy h ILE 173 CO 0.00 0.29 0.04 1.88 -0.69 0.00 0.00 178.15 179.67 2ksy h TYR 174 N 0.00 0.05 -1.29 1.37 -1.99 -1.47 -1.19 116.97 112.45 2ksy h TYR 174 Ca -0.14 0.03 0.37 0.00 2.00 0.00 0.00 58.73 60.99 2ksy h TYR 174 Cb 1.53 0.04 -0.05 0.00 2.00 0.00 0.00 36.73 40.25 2ksy h TYR 174 CO 0.00 -0.03 0.93 -1.35 -0.00 0.00 0.00 178.16 177.71 2ksy h PRO 175 N 0.15 0.00 0.00 4.88 0.11 -1.74 0.43 132.00 135.83 2ksy h PRO 175 Ca 0.18 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.28 2ksy h PRO 175 Cb 0.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.35 2ksy h PRO 175 CO -0.28 0.00 -0.06 0.74 -0.21 0.00 0.00 178.00 178.19 2ksy h PHE 176 N 0.00 0.01 -0.66 0.65 0.04 -1.48 -2.77 116.94 112.73 2ksy h PHE 176 Ca 0.61 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 61.40 2ksy h PHE 176 Cb 2.47 -0.00 -0.04 0.00 2.20 0.00 0.00 35.95 40.58 2ksy h PHE 176 CO 0.00 1.02 0.44 0.82 -0.60 0.00 0.00 178.31 179.99 2ksy h ILE 177 N -0.99 1.12 0.06 -0.55 1.08 -0.57 0.23 117.51 117.90 2ksy h ILE 177 Ca -0.02 -0.28 -0.00 0.00 -0.39 0.00 0.00 64.86 64.17 2ksy h ILE 177 Cb 1.02 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 2ksy h ILE 177 CO -0.00 0.15 -0.03 -0.25 -0.69 0.00 0.00 178.15 177.33 2ksy h TRP 178 N 0.83 -0.08 0.33 1.37 7.01 -1.14 0.11 115.95 124.37 2ksy h TRP 178 Ca 0.26 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.24 2ksy h TRP 178 Cb 0.01 0.03 0.00 0.00 -2.10 0.00 0.00 29.16 27.10 2ksy h TRP 178 CO -0.00 0.50 -0.16 1.25 -2.79 0.00 0.00 178.44 177.24 2ksy h LEU 179 N -0.75 -0.37 -0.54 0.65 7.12 -1.25 -2.94 115.31 117.23 2ksy h LEU 179 Ca -0.01 -0.02 -0.15 0.00 0.13 0.00 0.00 57.88 57.83 2ksy h LEU 179 Cb 0.61 0.10 -0.02 0.00 -0.53 0.00 0.00 40.66 40.81 2ksy h LEU 179 CO 0.01 -0.22 -0.70 -0.07 -0.13 0.00 0.00 178.44 177.33 2ksy h LEU 180 N -0.49 0.00 0.00 2.25 3.38 -0.68 0.23 115.31 120.00 2ksy h LEU 180 Ca -0.05 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.61 2ksy h LEU 180 Cb 0.37 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.27 2ksy h LEU 180 CO 0.07 0.70 0.13 0.61 0.09 0.00 0.00 178.44 180.04 2ksy n GLY 181 N 0.59 -2.50 0.31 0.83 0.00 0.37 -1.34 105.19 103.44 2ksy n GLY 181 Ca -0.01 -1.52 0.12 0.00 0.00 0.00 0.00 46.02 44.61 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 0.00 0.35 -1.69 1.61 0.11 -1.82 -1.89 132.00 128.67 2ksy h PRO 182 Ca -0.32 -0.02 0.51 0.00 0.11 0.00 0.00 66.00 66.27 2ksy h PRO 182 Cb 0.97 -0.08 -0.09 0.00 0.11 0.00 0.00 31.00 31.91 2ksy h PRO 182 CO 0.21 0.23 1.18 -1.35 -0.21 0.00 0.00 178.00 178.07 2ksy h PRO 183 N 0.36 0.02 0.00 1.05 0.11 -1.87 -3.41 132.00 128.26 2ksy h PRO 183 Ca 0.54 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.64 2ksy h PRO 183 Cb 1.01 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2ksy h PRO 183 CO -0.54 0.01 0.00 0.41 -0.21 0.00 0.00 178.00 177.67 2ksy n GLY 184 N -1.78 2.11 3.42 -0.55 0.00 -0.72 -4.26 105.19 103.40 2ksy n GLY 184 Ca 0.40 -0.21 -0.45 0.00 0.00 0.00 0.00 46.02 45.77 2ksy n GLY 184 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ksy s VAL 185 N 1.77 4.98 -0.86 1.61 -7.23 0.82 -4.96 120.40 116.53 2ksy s VAL 185 Ca 0.00 -1.84 -0.23 0.00 -1.81 0.00 0.00 61.98 58.10 2ksy s VAL 185 Cb 0.00 -4.70 -0.18 0.00 0.56 0.00 0.00 36.38 32.06 2ksy s VAL 185 CO 0.00 -1.38 2.24 0.00 -0.31 0.00 0.00 175.10 175.65 2ksy n ALA 186 N 5.82 0.38 -0.04 1.32 0.00 -1.20 -4.24 120.51 122.55 2ksy n ALA 186 Ca 0.21 -1.55 -0.14 0.00 0.00 0.00 0.00 53.44 51.96 2ksy n ALA 186 Cb 0.48 -3.07 -0.11 0.00 0.00 0.00 0.00 19.45 16.75 2ksy n ALA 186 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2ksy h LEU 187 N 20.81 0.10 0.00 0.00 3.38 -1.48 -3.47 115.31 134.65 2ksy h LEU 187 Ca 0.00 -0.73 0.00 0.00 0.09 0.00 0.00 57.88 57.24 2ksy h LEU 187 Cb 1.01 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.73 2ksy h LEU 187 CO 1.06 0.82 0.00 0.18 0.09 0.00 0.00 178.44 180.60 2ksy n LEU 188 N -4.64 0.00 -4.60 1.67 4.77 -1.26 -5.12 117.00 107.82 2ksy n LEU 188 Ca -0.09 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.58 2ksy n LEU 188 Cb 0.41 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.41 2ksy n LEU 188 CO 0.36 0.00 -0.40 0.28 -1.33 0.00 0.00 177.39 176.30 2ksy s THR 189 N 3.03 3.53 0.29 -5.08 -1.32 -1.26 -4.97 115.64 109.86 2ksy s THR 189 Ca 0.00 -1.10 0.04 0.00 -1.21 0.00 0.00 61.69 59.41 2ksy s THR 189 Cb 0.00 -2.63 0.28 0.00 -1.51 0.00 0.00 72.50 68.64 2ksy s THR 189 CO 0.00 0.19 1.72 1.55 -2.21 0.00 0.00 174.62 175.86 2ksy h PRO 190 N 3.82 0.48 -0.92 7.08 0.13 -1.99 -0.61 132.00 139.98 2ksy h PRO 190 Ca -0.48 -0.03 0.02 0.00 -0.87 0.00 0.00 66.00 64.64 2ksy h PRO 190 Cb 1.17 -0.11 -0.05 0.00 0.13 0.00 0.00 31.00 32.14 2ksy h PRO 190 CO 0.54 0.32 0.61 0.00 -0.23 0.00 0.00 178.00 179.23 2ksy h THR 191 N 0.49 1.21 -0.05 1.56 1.03 -1.97 -0.40 112.91 114.78 2ksy h THR 191 Ca 0.55 -0.42 -0.04 0.00 -0.01 0.00 0.00 66.41 66.49 2ksy h THR 191 Cb 0.99 -0.12 0.00 0.00 -1.07 0.00 0.00 68.15 67.95 2ksy h THR 191 CO -0.48 0.22 -0.13 0.58 -0.01 0.00 0.00 175.52 175.71 2ksy h VAL 192 N 1.22 1.43 0.01 0.00 2.07 -1.57 -2.32 116.25 117.11 2ksy h VAL 192 Ca 0.35 -1.49 0.01 0.00 0.82 0.00 0.00 66.70 66.40 2ksy h VAL 192 Cb -0.09 2.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 2ksy h VAL 192 CO -0.09 0.41 -0.08 -0.78 0.02 0.00 0.00 177.57 177.05 2ksy h ASP 193 N -0.34 -0.23 -0.63 0.57 3.58 -1.13 -2.17 116.42 116.07 2ksy h ASP 193 Ca -0.00 0.03 0.01 0.00 0.42 0.00 0.00 57.03 57.49 2ksy h ASP 193 Cb 0.73 0.10 -0.03 0.00 1.72 0.00 0.00 39.33 41.85 2ksy h ASP 193 CO 0.03 -0.12 0.41 0.58 -2.88 0.00 0.00 179.24 177.26 2ksy h VAL 194 N -0.15 1.15 -0.45 2.25 2.07 -1.16 -1.95 116.25 118.01 2ksy h VAL 194 Ca 0.03 -0.29 0.03 0.00 0.82 0.00 0.00 66.70 67.29 2ksy h VAL 194 Cb 0.18 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 2ksy h VAL 194 CO -0.08 0.15 0.24 0.00 0.02 0.00 0.00 177.57 177.91 2ksy h ALA 195 N 1.61 0.57 -0.56 1.67 0.00 -0.81 0.61 119.26 122.35 2ksy h ALA 195 Ca 0.23 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 2ksy h ALA 195 Cb -0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2ksy h ALA 195 CO -0.05 -0.10 0.05 -0.07 0.00 0.00 0.00 179.25 179.08 2ksy h LEU 196 N 0.48 0.93 0.71 0.00 3.38 -0.95 -0.91 115.31 118.95 2ksy h LEU 196 Ca 0.19 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2ksy h LEU 196 Cb 0.07 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2ksy h LEU 196 CO -0.12 0.98 -0.41 0.40 0.09 0.00 0.00 178.44 179.38 2ksy h ILE 197 N 0.85 0.16 -0.82 1.22 1.08 -0.87 0.39 117.51 119.52 2ksy h ILE 197 Ca 0.17 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 64.81 2ksy h ILE 197 Cb 0.48 0.16 -0.06 0.00 -3.07 0.00 0.00 36.82 34.33 2ksy h ILE 197 CO 0.02 0.00 0.55 0.58 -0.69 0.00 0.00 178.15 178.61 2ksy h VAL 198 N -1.05 0.74 -0.14 1.67 2.07 -0.88 0.34 116.25 119.00 2ksy h VAL 198 Ca -0.09 -0.14 -0.12 0.00 0.82 0.00 0.00 66.70 67.16 2ksy h VAL 198 Cb 0.84 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2ksy h VAL 198 CO 0.11 0.08 -0.45 0.22 0.02 0.00 0.00 177.57 177.55 2ksy h TYR 199 N 0.41 0.42 -0.39 1.57 3.20 -0.28 -1.62 116.97 120.28 2ksy h TYR 199 Ca 0.42 -0.12 -0.16 0.00 3.14 0.00 0.00 58.73 62.01 2ksy h TYR 199 Cb 1.00 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.17 2ksy h TYR 199 CO -0.00 0.74 -0.37 -0.07 -1.64 0.00 0.00 178.16 176.81 2ksy h LEU 200 N 0.28 0.98 -0.60 2.82 3.38 0.37 -1.60 115.31 120.95 2ksy h LEU 200 Ca 0.02 -0.44 -0.15 0.00 0.09 0.00 0.00 57.88 57.40 2ksy h LEU 200 Cb 0.90 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2ksy h LEU 200 CO 0.07 1.23 -0.66 0.44 0.09 0.00 0.00 178.44 179.62 2ksy h ASP 201 N 0.75 0.22 0.39 -0.43 3.32 -1.16 -2.72 116.42 116.80 2ksy h ASP 201 Ca 0.06 -0.13 -0.16 0.00 0.02 0.00 0.00 57.03 56.82 2ksy h ASP 201 Cb 0.96 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.44 2ksy h ASP 201 CO 0.09 0.81 -0.68 -0.07 -1.72 0.00 0.00 179.24 177.68 2ksy h LEU 202 N 0.13 0.30 0.01 1.55 3.38 -1.17 -3.26 115.31 116.26 2ksy h LEU 202 Ca -0.01 -0.19 -0.26 0.00 0.09 0.00 0.00 57.88 57.50 2ksy h LEU 202 Cb 1.18 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.86 2ksy h LEU 202 CO 0.10 0.89 -1.14 1.62 0.09 0.00 0.00 178.44 180.00 2ksy h VAL 203 N 0.18 1.40 0.00 1.22 3.04 -1.26 -1.83 116.25 119.00 2ksy h VAL 203 Ca -0.02 -2.67 0.00 0.00 -1.01 0.00 0.00 66.70 63.01 2ksy h VAL 203 Cb 1.22 2.69 0.00 0.00 -2.01 0.00 0.00 31.29 33.19 2ksy h VAL 203 CO 0.11 0.79 0.00 0.41 -1.01 0.00 0.00 177.57 177.87 2ksy n THR 204 N -3.68 0.00 0.00 3.17 -1.04 -1.03 -0.61 114.28 111.08 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 0.95 -0.62 0.00 0.00 -1.82 0.00 0.00 70.33 68.84 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 -0.84 0.00 0.38 12.58 0.31 -0.70 -2.20 118.33 127.86 2ksy n VAL 206 Ca 0.07 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.25 2ksy n VAL 206 Cb 0.03 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 32.89 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 -1.03 0.42 2.92 0.00 -0.76 -0.71 103.07 103.90 2ksy h GLY 207 Ca 0.00 0.38 0.09 0.00 0.00 0.00 0.00 47.33 47.81 2ksy h GLY 207 CO 0.00 -0.38 0.27 0.74 0.00 0.00 0.00 176.54 177.17 2ksy h PHE 208 N -1.26 0.47 -0.48 5.60 -1.00 -1.30 -0.08 116.94 118.89 2ksy h PHE 208 Ca -0.10 0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.74 2ksy h PHE 208 Cb 0.76 -0.12 -0.03 0.00 3.61 0.00 0.00 35.95 40.18 2ksy h PHE 208 CO 0.00 0.14 0.32 0.78 -1.61 0.00 0.00 178.31 177.94 2ksy h GLY 209 N 0.47 0.62 0.70 -1.45 0.00 -1.73 1.82 103.07 103.49 2ksy h GLY 209 Ca 0.32 -0.22 -0.05 0.00 0.00 0.00 0.00 47.33 47.38 2ksy h GLY 209 CO -0.29 0.19 -0.14 0.74 0.00 0.00 0.00 176.54 177.04 2ksy h PHE 210 N 0.55 0.36 0.00 5.60 0.04 0.53 0.26 116.94 124.28 2ksy h PHE 210 Ca 0.19 -0.12 -0.06 0.00 2.80 0.00 0.00 57.97 60.79 2ksy h PHE 210 Cb 0.08 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.15 2ksy h PHE 210 CO -0.00 0.73 -0.27 0.82 -0.60 0.00 0.00 178.31 178.99 2ksy h ILE 211 N -0.11 0.94 -0.57 -0.55 2.04 -0.70 -1.93 117.51 116.63 2ksy h ILE 211 Ca 0.02 -1.04 -0.11 0.00 1.00 0.00 0.00 64.86 64.73 2ksy h ILE 211 Cb 0.68 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.35 2ksy h ILE 211 CO 0.03 0.27 -0.07 0.00 0.00 0.00 0.00 178.15 178.38 2ksy h ALA 212 N 1.73 0.78 0.23 1.87 0.00 0.33 -2.10 119.26 122.09 2ksy h ALA 212 Ca -0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2ksy h ALA 212 Cb 0.58 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2ksy h ALA 212 CO 0.04 0.67 -0.11 -0.07 0.00 0.00 0.00 179.25 179.77 2ksy h LEU 213 N 0.94 -0.26 -0.48 0.00 3.38 0.03 -1.84 115.31 117.08 2ksy h LEU 213 Ca 0.15 -0.27 0.08 0.00 0.09 0.00 0.00 57.88 57.93 2ksy h LEU 213 Cb 0.64 0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 2ksy h LEU 213 CO 0.04 0.22 0.13 -0.78 0.09 0.00 0.00 178.44 178.14 2ksy h ASP 214 N -0.84 0.07 0.51 -0.43 3.58 -1.42 0.24 116.42 118.13 2ksy h ASP 214 Ca -0.03 0.08 -0.03 0.00 0.42 0.00 0.00 57.03 57.47 2ksy h ASP 214 Cb 0.51 0.09 0.01 0.00 1.72 0.00 0.00 39.33 41.66 2ksy h ASP 214 CO 0.05 0.07 -0.25 0.00 -2.88 0.00 0.00 179.24 176.23 2ksy h ALA 215 N 1.36 -0.69 -0.45 -0.78 0.00 -1.47 -2.30 119.26 114.92 2ksy h ALA 215 Ca 0.24 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 55.07 2ksy h ALA 215 Cb 0.29 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2ksy h ALA 215 CO -0.29 -0.79 0.32 0.00 0.00 0.00 0.00 179.25 178.49 2ksy h ALA 216 N -0.49 2.25 -0.60 0.00 0.00 -1.13 -0.37 119.26 118.92 2ksy h ALA 216 Ca -0.07 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 2ksy h ALA 216 Cb 0.60 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2ksy h ALA 216 CO 0.12 -0.36 0.02 0.00 0.00 0.00 0.00 179.25 179.03 2ksy h ALA 217 N 1.77 0.80 -0.57 0.00 0.00 -0.30 -1.74 119.26 119.23 2ksy h ALA 217 Ca 0.21 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2ksy h ALA 217 Cb 0.67 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2ksy h ALA 217 CO -0.03 0.62 0.20 1.15 0.00 0.00 0.00 179.25 181.19 2ksy h THR 218 N 0.93 1.21 -0.11 0.00 2.02 -0.50 0.28 112.91 116.74 2ksy h THR 218 Ca 0.17 -0.70 -0.12 0.00 0.77 0.00 0.00 66.41 66.53 2ksy h THR 218 Cb 0.52 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 2ksy h THR 218 CO 0.03 0.27 -0.47 -0.07 0.37 0.00 0.00 175.52 175.65 2ksy h LEU 219 N 0.82 0.28 0.00 2.58 3.38 -1.13 -1.70 115.31 119.54 2ksy h LEU 219 Ca 0.19 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 2ksy h LEU 219 Cb 0.21 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2ksy h LEU 219 CO -0.01 0.71 -0.62 0.03 0.09 0.00 0.00 178.44 178.64 2ksy h ARG 220 N 0.21 0.00 0.00 1.13 3.08 -0.67 -1.89 114.38 116.25 2ksy h ARG 220 Ca 0.01 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.87 2ksy h ARG 220 Cb 0.91 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.93 2ksy h ARG 220 CO 0.07 0.27 -1.01 0.00 -1.07 0.00 0.00 179.97 178.24 2ksy h ALA 221 N 1.68 0.52 0.01 0.04 0.00 -0.27 -3.32 119.26 117.92 2ksy h ALA 221 Ca -0.03 -0.86 -0.31 0.00 0.00 0.00 0.00 54.91 53.71 2ksy h ALA 221 Cb 1.27 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 2ksy h ALA 221 CO 0.04 1.11 -1.84 -0.85 0.00 0.00 0.00 179.25 177.71 2ksy n GLU 222 N -3.23 0.65 -1.46 0.00 0.28 -0.66 -5.08 120.64 111.14 2ksy n GLU 222 Ca -0.03 0.25 0.00 0.00 -0.16 0.00 0.00 57.16 57.22 2ksy n GLU 222 Cb 0.89 -1.75 0.00 0.00 1.43 0.00 0.00 31.44 32.02 2ksy n GLU 222 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2ksy n HIS 223 N -3.03 -3.81 -0.41 -1.84 8.25 -0.71 -4.85 115.22 108.83 2ksy n HIS 223 Ca -0.20 1.98 0.11 0.00 -0.26 0.00 0.00 57.72 59.35 2ksy n HIS 223 Cb 1.07 -3.22 0.33 0.00 1.12 0.00 0.00 29.99 29.29 2ksy n HIS 223 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ksy n GLY 224 N 0.14 2.52 3.52 -1.41 0.00 -1.26 -4.96 105.19 103.74 2ksy n GLY 224 Ca 0.00 -0.81 -0.09 0.00 0.00 0.00 0.00 46.02 45.12 2ksy n GLY 224 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2ksy s GLU 225 N -1.17 0.74 0.00 1.61 -1.05 -1.26 -5.06 118.70 112.51 2ksy s GLU 225 Ca 0.50 -0.18 0.00 0.00 -0.15 0.00 0.00 54.97 55.14 2ksy s GLU 225 Cb 0.27 0.34 0.00 0.00 -0.44 0.00 0.00 34.13 34.31 2ksy s GLU 225 CO 0.32 -0.31 0.00 -1.13 0.95 0.00 0.00 175.26 175.09 2ksy n SER 226 N -0.01 0.00 -4.72 0.83 3.41 -1.26 -5.11 113.62 106.76 2ksy n SER 226 Ca -0.09 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.17 2ksy n SER 226 Cb 0.61 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.64 2ksy n SER 226 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 2ksy s LEU 227 N -1.00 3.43 -0.19 1.04 2.34 -1.26 -4.97 118.68 118.07 2ksy s LEU 227 Ca 0.00 2.53 -0.14 0.00 0.06 0.00 0.00 54.13 56.57 2ksy s LEU 227 Cb 0.00 -4.61 -0.21 0.00 -0.56 0.00 0.00 46.19 40.81 2ksy s LEU 227 CO 0.00 -2.21 0.19 0.00 -1.06 0.00 0.00 176.35 173.27 2ksy n ALA 228 N -2.37 0.89 -2.03 1.48 0.00 -1.26 -5.07 120.51 112.15 2ksy n ALA 228 Ca 0.15 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.98 2ksy n ALA 228 Cb 0.49 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 19.42 2ksy n ALA 228 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ksy n GLY 229 N 1.66 2.69 3.13 0.00 0.00 -1.26 -5.16 105.19 106.25 2ksy n GLY 229 Ca -0.35 0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.54 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 1.92 1.22 -0.23 1.61 1.01 -1.26 -5.12 120.40 119.54 2ksy s VAL 230 Ca 0.00 -0.68 -0.18 0.00 0.00 0.00 0.00 61.98 61.12 2ksy s VAL 230 Cb 0.00 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 2ksy s VAL 230 CO 0.00 0.33 0.52 1.51 0.00 0.00 0.00 175.10 177.46 2ksy s ASP 231 N -0.40 6.49 0.00 3.32 -4.77 -1.26 -4.92 116.67 115.13 2ksy s ASP 231 Ca 0.06 0.59 0.11 0.00 -3.30 0.00 0.00 52.55 50.02 2ksy s ASP 231 Cb -0.06 -2.29 0.29 0.00 -1.09 0.00 0.00 42.92 39.78 2ksy s ASP 231 CO -0.00 -0.24 1.21 1.07 0.70 0.00 0.00 175.17 177.91 2ksy n THR 232 N 4.88 0.85 0.10 2.11 5.66 -1.26 -4.47 114.28 122.15 2ksy n THR 232 Ca -0.04 -0.93 -0.02 0.00 -3.05 0.00 0.00 64.05 60.01 2ksy n THR 232 Cb 0.50 0.61 -0.02 0.00 -1.55 0.00 0.00 70.33 69.87 2ksy n THR 232 CO 0.00 0.00 0.00 -0.78 -3.05 0.00 0.00 175.07 171.24 2ksy h ASP 233 N 2.19 0.00 -3.86 1.09 3.58 -2.06 -3.45 116.42 113.90 2ksy h ASP 233 Ca 0.00 0.00 -0.50 0.00 0.42 0.00 0.00 57.03 56.95 2ksy h ASP 233 Cb 0.71 0.00 0.03 0.00 1.72 0.00 0.00 39.33 41.79 2ksy h ASP 233 CO 0.00 0.75 0.50 0.28 -2.88 0.00 0.00 179.24 177.88 2ksy s THR 234 N -2.91 3.34 -0.46 2.25 -1.32 -1.26 -4.97 115.64 110.32 2ksy s THR 234 Ca 0.02 1.27 -0.28 0.00 -1.21 0.00 0.00 61.69 61.49 2ksy s THR 234 Cb 0.09 -3.77 0.01 0.00 -1.51 0.00 0.00 72.50 67.32 2ksy s THR 234 CO 0.78 0.24 1.46 -2.16 -2.21 0.00 0.00 174.62 172.73 2ksy s PRO 235 N -1.78 3.44 -0.32 7.08 0.04 -1.26 -4.99 135.00 137.21 2ksy s PRO 235 Ca 0.49 0.82 -0.08 0.00 0.04 0.00 0.00 61.00 62.28 2ksy s PRO 235 Cb -0.32 -4.08 0.02 0.00 0.04 0.00 0.00 34.50 30.16 2ksy s PRO 235 CO 0.41 -1.74 0.11 0.00 0.04 0.00 0.00 177.00 175.82 2ksy s ALA 236 N 5.85 3.11 0.07 8.56 0.00 -1.26 -5.09 121.76 133.00 2ksy s ALA 236 Ca 0.60 -1.56 0.01 0.00 0.00 0.00 0.00 51.96 51.01 2ksy s ALA 236 Cb -0.13 -2.26 -0.04 0.00 0.00 0.00 0.00 23.12 20.69 2ksy s ALA 236 CO 0.30 -1.09 0.20 0.14 0.00 0.00 0.00 175.76 175.32 2ksy s VAL 237 N 1.49 5.29 -0.19 0.00 -7.23 -1.26 -4.84 120.40 113.66 2ksy s VAL 237 Ca 0.02 -0.45 -0.12 0.00 -1.81 0.00 0.00 61.98 59.61 2ksy s VAL 237 Cb -0.18 -3.59 0.05 0.00 0.56 0.00 0.00 36.38 33.22 2ksy s VAL 237 CO 0.03 0.12 0.24 0.00 -0.31 0.00 0.00 175.10 175.19 2ksy n ALA 238 N 0.25 -3.66 -0.80 1.32 0.00 -1.26 -5.01 120.51 111.35 2ksy n ALA 238 Ca -0.06 2.36 0.00 0.00 0.00 0.00 0.00 53.44 55.74 2ksy n ALA 238 Cb 0.51 -4.62 0.00 0.00 0.00 0.00 0.00 19.45 15.34 2ksy n ALA 238 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ksy n ASP 239 N 1.71 0.00 -0.63 0.00 8.00 -1.26 -4.81 116.55 119.56 2ksy n ASP 239 Ca -0.41 -0.65 0.11 0.00 0.71 0.00 0.00 54.79 54.56 2ksy n ASP 239 Cb 0.63 0.00 0.36 0.00 -0.02 0.00 0.00 41.12 42.10 2ksy n ASP 239 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2ksy n LEU 240 N 0.00 1.91 -1.69 0.64 4.77 -1.26 -4.91 117.00 116.45 2ksy n LEU 240 Ca 0.00 -0.78 -0.19 0.00 -0.03 0.00 0.00 56.01 55.01 2ksy n LEU 240 Cb 0.16 -0.11 -0.07 0.00 -2.33 0.00 0.00 43.42 41.07 2ksy n LEU 240 CO 0.00 0.39 -0.19 -0.62 -1.33 0.00 0.00 177.39 175.63 2ksy n GLU 241 N 0.48 -1.48 -3.71 3.23 -0.58 -1.26 -4.94 120.64 112.38 2ksy n GLU 241 Ca 0.17 1.11 -0.22 0.00 -0.42 0.00 0.00 57.16 57.79 2ksy n GLU 241 Cb 0.38 -5.51 -0.18 0.00 -0.57 0.00 0.00 31.44 25.56 2ksy n GLU 241 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2ksy s HIS 242 N -2.68 0.38 -0.11 -0.32 2.46 -1.26 -5.12 115.29 108.62 2ksy s HIS 242 Ca 0.00 -0.02 -0.29 0.00 0.47 0.00 0.00 55.06 55.22 2ksy s HIS 242 Cb 0.00 -0.66 -0.01 0.00 -0.13 0.00 0.00 32.58 31.78 2ksy s HIS 242 CO 0.00 -0.29 0.99 -1.58 -2.47 0.00 0.00 174.74 171.39 2ksy s HIS 243 N 2.07 3.50 -0.24 3.88 2.46 -1.26 -4.96 115.29 120.74 2ksy s HIS 243 Ca 0.04 1.56 -0.23 0.00 0.47 0.00 0.00 55.06 56.91 2ksy s HIS 243 Cb -0.13 -3.18 -0.01 0.00 -0.13 0.00 0.00 32.58 29.14 2ksy s HIS 243 CO -0.05 -0.23 0.73 -1.01 -2.47 0.00 0.00 174.74 171.72 2ksy s HIS 244 N 2.05 3.31 -0.12 3.88 3.76 -1.26 -4.96 115.29 121.96 2ksy s HIS 244 Ca 0.47 1.00 -0.09 0.00 -0.15 0.00 0.00 55.06 56.30 2ksy s HIS 244 Cb -0.18 -2.94 -0.03 0.00 1.11 0.00 0.00 32.58 30.54 2ksy s HIS 244 CO 0.17 -0.34 -0.17 1.58 -0.85 0.00 0.00 174.74 175.13 2ksy n HIS 245 N 5.74 0.55 -3.29 1.40 -0.00 -1.26 -4.94 115.22 113.41 2ksy n HIS 245 Ca 0.02 0.24 -0.39 0.00 0.46 0.00 0.00 57.72 58.06 2ksy n HIS 245 Cb 0.48 -0.59 -0.06 0.00 -0.12 0.00 0.00 29.99 29.70 2ksy n HIS 245 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 2ksy s HIS 246 N -2.09 3.75 -2.72 1.57 -3.43 -1.26 -5.37 115.29 105.73 2ksy s HIS 246 Ca -0.14 1.20 0.26 0.00 -0.80 0.00 0.00 55.06 55.58 2ksy s HIS 246 Cb 0.02 -2.50 0.67 0.00 -1.43 0.00 0.00 32.58 29.34 2ksy s HIS 246 CO 0.21 0.52 1.53 0.72 -2.00 0.00 0.00 174.74 175.72