#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 0.01 2.03 3.14 -1.26 -4.47 118.33 117.79 2ksy n VAL 2 Ca 0.00 -0.31 -0.22 0.00 -2.96 0.00 0.00 64.34 60.86 2ksy n VAL 2 Cb 0.00 0.90 -0.14 0.00 -1.06 0.00 0.00 33.84 33.54 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 1.66 0.30 1.39 7.55 0.00 -2.02 -3.36 103.07 108.59 2ksy h GLY 3 Ca 0.00 -0.76 -0.08 0.00 0.00 0.00 0.00 47.33 46.49 2ksy h GLY 3 CO 0.00 0.67 -0.05 1.41 0.00 0.00 0.00 176.54 178.57 2ksy h LEU 4 N -0.21 0.72 -1.94 3.11 3.38 -1.99 -2.72 115.31 115.66 2ksy h LEU 4 Ca -0.33 -0.19 0.08 0.00 0.09 0.00 0.00 57.88 57.53 2ksy h LEU 4 Cb 1.84 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.38 2ksy h LEU 4 CO 0.07 0.82 0.23 0.71 0.09 0.00 0.00 178.44 180.36 2ksy h THR 5 N 0.68 0.87 -0.86 0.22 1.35 -1.78 -1.68 112.91 111.72 2ksy h THR 5 Ca 0.13 -0.03 0.03 0.00 -0.55 0.00 0.00 66.41 66.00 2ksy h THR 5 Cb 0.50 0.79 -0.05 0.00 -1.73 0.00 0.00 68.15 67.66 2ksy h THR 5 CO 0.03 0.01 0.57 0.71 -0.25 0.00 0.00 175.52 176.59 2ksy h THR 6 N 0.08 1.14 0.12 6.82 1.35 -1.62 -0.94 112.91 119.85 2ksy h THR 6 Ca 0.15 -0.37 -0.01 0.00 -0.55 0.00 0.00 66.41 65.64 2ksy h THR 6 Cb 0.51 -0.02 0.00 0.00 -1.73 0.00 0.00 68.15 66.91 2ksy h THR 6 CO -0.01 0.20 -0.06 -0.07 -0.25 0.00 0.00 175.52 175.32 2ksy h LEU 7 N 1.07 -0.14 -1.57 3.87 -0.00 -1.44 -1.73 115.31 115.37 2ksy h LEU 7 Ca 0.34 -0.14 -0.01 0.00 -0.00 0.00 0.00 57.88 58.06 2ksy h LEU 7 Cb 0.03 0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 40.71 2ksy h LEU 7 CO -0.10 0.06 0.13 -0.26 -0.00 0.00 0.00 178.44 178.28 2ksy h PHE 8 N -0.34 0.41 -0.53 1.13 0.04 -1.52 -1.71 116.94 114.42 2ksy h PHE 8 Ca -0.02 -0.01 -0.09 0.00 2.80 0.00 0.00 57.97 60.66 2ksy h PHE 8 Cb 0.28 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.27 2ksy h PHE 8 CO -0.01 0.31 -0.04 -1.49 -0.60 0.00 0.00 178.31 176.48 2ksy h TRP 9 N 0.42 1.01 -0.17 -0.55 -0.00 -0.92 -1.94 115.95 113.80 2ksy h TRP 9 Ca 0.11 -0.17 -0.07 0.00 -0.00 0.00 0.00 58.89 58.76 2ksy h TRP 9 Cb 0.07 -0.26 -0.01 0.00 -0.00 0.00 0.00 29.16 28.95 2ksy h TRP 9 CO 0.00 0.93 -0.20 -0.07 -0.00 0.00 0.00 178.44 179.11 2ksy h LEU 10 N 0.85 0.28 -0.68 -4.49 3.38 -0.43 -2.24 115.31 111.97 2ksy h LEU 10 Ca 0.15 -0.07 -0.14 0.00 0.09 0.00 0.00 57.88 57.90 2ksy h LEU 10 Cb 0.56 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2ksy h LEU 10 CO 0.03 0.50 -0.54 1.23 0.09 0.00 0.00 178.44 179.75 2ksy h GLY 11 N 0.90 0.36 1.79 0.83 0.00 -0.90 -2.72 103.07 103.33 2ksy h GLY 11 Ca 0.05 -0.41 -0.12 0.00 0.00 0.00 0.00 47.33 46.85 2ksy h GLY 11 CO 0.03 0.37 -0.48 0.00 0.00 0.00 0.00 176.54 176.46 2ksy h ALA 12 N 1.18 1.02 0.25 3.60 0.00 -0.86 -1.85 119.26 122.60 2ksy h ALA 12 Ca 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2ksy h ALA 12 Cb 1.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2ksy h ALA 12 CO 0.09 0.64 -0.12 0.82 0.00 0.00 0.00 179.25 180.68 2ksy h ILE 13 N 0.18 0.79 0.00 0.00 2.04 -1.26 -1.42 117.51 117.85 2ksy h ILE 13 Ca 0.01 -0.64 -0.02 0.00 1.00 0.00 0.00 64.86 65.21 2ksy h ILE 13 Cb 0.92 1.14 -0.00 0.00 -0.74 0.00 0.00 36.82 38.13 2ksy h ILE 13 CO 0.07 0.13 -0.10 1.23 0.00 0.00 0.00 178.15 179.48 2ksy h GLY 14 N -0.69 0.00 0.38 5.37 0.00 -1.50 -2.61 103.07 104.02 2ksy h GLY 14 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 2ksy h GLY 14 CO 0.06 0.00 -0.08 -0.33 0.00 0.00 0.00 176.54 176.19 2ksy h MET 15 N 0.00 -0.22 -0.63 4.80 2.86 -1.19 -2.43 114.93 118.13 2ksy h MET 15 Ca -0.00 0.01 0.10 0.00 -2.06 0.00 0.00 59.70 57.76 2ksy h MET 15 Cb 0.29 0.05 -0.08 0.00 0.06 0.00 0.00 31.60 31.92 2ksy h MET 15 CO 0.01 0.20 0.22 -0.07 1.06 0.00 0.00 176.91 178.33 2ksy h LEU 16 N -0.86 0.19 -0.92 1.22 -0.00 -1.13 0.24 115.31 114.06 2ksy h LEU 16 Ca -0.02 0.09 -0.01 0.00 -0.00 0.00 0.00 57.88 57.94 2ksy h LEU 16 Cb 0.52 0.08 -0.04 0.00 -0.00 0.00 0.00 40.66 41.22 2ksy h LEU 16 CO 0.04 0.11 0.54 0.58 -0.00 0.00 0.00 178.44 179.70 2ksy h VAL 17 N 0.38 1.25 -0.43 1.22 2.07 -1.55 -2.54 116.25 116.66 2ksy h VAL 17 Ca 0.32 -0.57 -0.10 0.00 0.82 0.00 0.00 66.70 67.17 2ksy h VAL 17 Cb 0.43 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 2ksy h VAL 17 CO -0.34 0.27 -0.13 1.23 0.02 0.00 0.00 177.57 178.62 2ksy h GLY 18 N 1.27 0.92 0.12 2.17 0.00 -0.63 -0.42 103.07 106.50 2ksy h GLY 18 Ca 0.33 -0.78 0.06 0.00 0.00 0.00 0.00 47.33 46.94 2ksy h GLY 18 CO -0.06 0.71 -0.27 -0.84 0.00 0.00 0.00 176.54 176.08 2ksy h THR 19 N 0.68 0.35 -0.06 4.70 2.02 -0.19 -0.30 112.91 120.10 2ksy h THR 19 Ca 0.11 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 67.15 2ksy h THR 19 Cb 0.68 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 2ksy h THR 19 CO 0.05 0.00 -0.59 -0.07 0.37 0.00 0.00 175.52 175.28 2ksy h LEU 20 N -0.29 0.22 0.54 2.58 3.38 -1.48 -2.37 115.31 117.89 2ksy h LEU 20 Ca 0.13 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2ksy h LEU 20 Cb 0.49 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2ksy h LEU 20 CO -0.39 0.76 -0.34 0.00 0.09 0.00 0.00 178.44 178.55 2ksy h ALA 21 N 1.25 -0.85 -0.02 1.53 0.00 0.08 -0.95 119.26 120.30 2ksy h ALA 21 Ca -0.00 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 2ksy h ALA 21 Cb 1.08 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 2ksy h ALA 21 CO 0.09 -0.99 -0.55 0.74 0.00 0.00 0.00 179.25 178.53 2ksy h PHE 22 N -0.84 0.08 0.10 0.00 0.04 -1.17 -0.04 116.94 115.12 2ksy h PHE 22 Ca -0.06 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.67 2ksy h PHE 22 Cb 0.68 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.82 2ksy h PHE 22 CO -0.10 0.61 -0.05 0.00 -0.60 0.00 0.00 178.31 178.16 2ksy h ALA 23 N 1.39 -0.14 0.00 2.45 0.00 -1.26 -3.29 119.26 118.41 2ksy h ALA 23 Ca -0.00 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 2ksy h ALA 23 Cb 1.00 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2ksy h ALA 23 CO 0.08 -0.48 -1.21 2.35 0.00 0.00 0.00 179.25 179.99 2ksy h TRP 24 N -0.34 0.00 -0.71 0.00 -0.00 -1.21 -3.26 115.95 110.43 2ksy h TRP 24 Ca -0.01 0.00 0.15 0.00 -0.00 0.00 0.00 58.89 59.03 2ksy h TRP 24 Cb 0.28 0.00 -0.13 0.00 -0.00 0.00 0.00 29.16 29.31 2ksy h TRP 24 CO -0.01 0.68 -0.06 0.00 -0.00 0.00 0.00 178.44 179.05 2ksy h ALA 25 N 1.32 0.63 0.00 2.65 0.00 -1.06 1.29 119.26 124.10 2ksy h ALA 25 Ca -0.13 0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2ksy h ALA 25 Cb 1.63 0.44 -0.00 0.00 0.00 0.00 0.00 17.79 19.86 2ksy h ALA 25 CO 0.07 -0.42 -0.09 0.78 0.00 0.00 0.00 179.25 179.58 2ksy h GLY 26 N 0.07 0.00 -5.31 0.00 0.00 -1.69 -3.48 103.07 92.65 2ksy h GLY 26 Ca 0.37 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.69 2ksy h GLY 26 CO -0.66 0.00 -0.38 0.54 0.00 0.00 0.00 176.54 176.04 2ksy n ARG 27 N -3.17 -2.12 -3.00 4.80 1.74 0.44 -4.45 116.66 110.90 2ksy n ARG 27 Ca 0.02 1.97 -0.07 0.00 -0.77 0.00 0.00 57.85 58.99 2ksy n ARG 27 Cb 0.44 -5.69 0.01 0.00 -1.02 0.00 0.00 32.46 26.20 2ksy n ARG 27 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2ksy n ASP 28 N -0.67 -7.21 -4.83 0.55 2.03 -1.25 -4.95 116.55 100.23 2ksy n ASP 28 Ca 0.09 0.73 -0.31 0.00 0.52 0.00 0.00 54.79 55.82 2ksy n ASP 28 Cb 0.47 -3.66 0.03 0.00 -0.72 0.00 0.00 41.12 37.24 2ksy n ASP 28 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ksy s ALA 29 N -1.59 2.79 0.00 -1.67 0.00 -1.26 -5.04 121.76 114.99 2ksy s ALA 29 Ca 0.10 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.18 2ksy s ALA 29 Cb -0.02 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.94 2ksy s ALA 29 CO 0.56 -0.98 0.20 0.41 0.00 0.00 0.00 175.76 175.95 2ksy n GLY 30 N -1.89 -0.09 2.11 0.00 0.00 -1.26 -4.86 105.19 99.20 2ksy n GLY 30 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2ksy n GLY 30 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ksy n SER 31 N -0.63 -1.97 0.11 1.61 2.88 -1.26 -4.80 113.62 109.56 2ksy n SER 31 Ca 0.00 0.46 0.17 0.00 -1.33 0.00 0.00 58.87 58.17 2ksy n SER 31 Cb 0.00 2.03 0.73 0.00 -0.75 0.00 0.00 64.21 66.22 2ksy n SER 31 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 2ksy h GLY 32 N 0.00 0.00 0.79 0.46 0.00 -2.04 -0.49 103.07 101.79 2ksy h GLY 32 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 2ksy h GLY 32 CO 0.00 0.00 -1.44 1.18 0.00 0.00 0.00 176.54 176.28 2ksy n GLU 33 N -4.19 0.63 0.13 4.80 -0.58 -1.26 -4.11 120.64 116.06 2ksy n GLU 33 Ca 0.05 0.12 0.17 0.00 -0.42 0.00 0.00 57.16 57.08 2ksy n GLU 33 Cb 0.43 -1.76 0.73 0.00 -0.57 0.00 0.00 31.44 30.28 2ksy n GLU 33 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ksy h ARG 34 N 0.00 0.00 0.47 3.49 3.08 -1.39 -2.29 114.38 117.73 2ksy h ARG 34 Ca -0.12 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2ksy h ARG 34 Cb 1.38 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.41 2ksy h ARG 34 CO 0.02 0.00 -0.47 -0.09 -1.07 0.00 0.00 179.97 178.36 2ksy h ARG 35 N 0.00 -0.91 -0.12 0.04 9.65 -1.70 0.32 114.38 121.66 2ksy h ARG 35 Ca 0.14 0.06 -0.16 0.00 -1.10 0.00 0.00 59.98 58.92 2ksy h ARG 35 Cb 0.63 0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 29.41 2ksy h ARG 35 CO -0.00 -0.61 -0.61 1.88 2.80 0.00 0.00 179.97 183.43 2ksy h TYR 36 N -0.95 0.53 0.31 2.20 -1.99 -1.77 -2.59 116.97 112.71 2ksy h TYR 36 Ca -0.05 -0.20 -0.02 0.00 2.00 0.00 0.00 58.73 60.46 2ksy h TYR 36 Cb 0.83 -0.09 0.00 0.00 2.00 0.00 0.00 36.73 39.47 2ksy h TYR 36 CO -0.24 0.92 -0.15 1.88 -0.00 0.00 0.00 178.16 180.57 2ksy h TYR 37 N 0.31 -0.38 -0.82 4.88 0.05 -1.32 -2.22 116.97 117.47 2ksy h TYR 37 Ca -0.01 -0.01 0.08 0.00 0.05 0.00 0.00 58.73 58.84 2ksy h TYR 37 Cb 1.15 0.13 -0.05 0.00 1.01 0.00 0.00 36.73 38.96 2ksy h TYR 37 CO 0.04 -0.04 0.53 0.28 -1.05 0.00 0.00 178.16 177.92 2ksy h VAL 38 N -0.93 1.00 0.11 -2.88 2.07 -0.46 -0.29 116.25 114.87 2ksy h VAL 38 Ca -0.04 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 2ksy h VAL 38 Cb 0.51 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 2ksy h VAL 38 CO 0.07 0.15 -0.05 0.74 0.02 0.00 0.00 177.57 178.50 2ksy h THR 39 N 0.84 0.96 0.09 2.57 2.02 -1.49 0.14 112.91 118.04 2ksy h THR 39 Ca 0.36 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 67.29 2ksy h THR 39 Cb 0.32 1.12 -0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2ksy h THR 39 CO -0.14 0.06 -0.05 0.25 0.37 0.00 0.00 175.52 176.02 2ksy h LEU 40 N -0.26 -0.11 -1.60 2.58 5.85 -0.80 -1.92 115.31 119.06 2ksy h LEU 40 Ca -0.01 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.74 2ksy h LEU 40 Cb 0.21 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 2ksy h LEU 40 CO 0.02 -0.08 0.32 0.58 -0.34 0.00 0.00 178.44 178.95 2ksy h VAL 41 N -0.13 1.04 -0.84 1.05 2.07 -1.04 -1.58 116.25 116.83 2ksy h VAL 41 Ca -0.01 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.36 2ksy h VAL 41 Cb 0.10 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 30.29 2ksy h VAL 41 CO 0.01 0.10 0.54 1.23 0.02 0.00 0.00 177.57 179.47 2ksy h GLY 42 N 0.53 1.21 0.91 2.17 0.00 0.06 0.01 103.07 107.97 2ksy h GLY 42 Ca 0.20 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 2ksy h GLY 42 CO -0.05 0.35 -0.05 -2.22 0.00 0.00 0.00 176.54 174.57 2ksy h ILE 43 N 1.05 0.95 0.00 2.60 2.04 -0.87 -0.95 117.51 122.33 2ksy h ILE 43 Ca 0.33 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.99 2ksy h ILE 43 Cb -0.00 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 2ksy h ILE 43 CO -0.11 0.05 -0.04 0.77 0.00 0.00 0.00 178.15 178.82 2ksy h SER 44 N -0.23 0.00 0.09 1.72 4.64 -1.25 -1.54 113.55 116.96 2ksy h SER 44 Ca -0.01 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2ksy h SER 44 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2ksy h SER 44 CO 0.02 0.04 -0.04 1.23 -0.87 0.00 0.00 176.83 177.21 2ksy h GLY 45 N 0.40 -0.12 1.10 -0.77 0.00 -0.39 -2.12 103.07 101.17 2ksy h GLY 45 Ca -0.00 0.04 0.04 0.00 0.00 0.00 0.00 47.33 47.42 2ksy h GLY 45 CO 0.00 -0.04 0.50 0.16 0.00 0.00 0.00 176.54 177.16 2ksy h ILE 46 N -0.99 1.10 -0.42 2.60 3.07 -1.10 -1.73 117.51 120.03 2ksy h ILE 46 Ca -0.01 -0.31 -0.12 0.00 1.55 0.00 0.00 64.86 65.96 2ksy h ILE 46 Cb 0.36 0.11 -0.01 0.00 -0.27 0.00 0.00 36.82 37.01 2ksy h ILE 46 CO 0.02 0.16 -0.22 0.00 -1.05 0.00 0.00 178.15 177.07 2ksy h ALA 47 N 1.56 0.60 -0.84 0.16 0.00 -1.40 -2.45 119.26 116.89 2ksy h ALA 47 Ca 0.31 -0.38 0.09 0.00 0.00 0.00 0.00 54.91 54.92 2ksy h ALA 47 Cb 0.10 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 2ksy h ALA 47 CO -0.09 0.58 0.50 0.00 0.00 0.00 0.00 179.25 180.23 2ksy h ALA 48 N 0.83 1.19 -0.02 0.00 0.00 -0.60 -1.24 119.26 119.42 2ksy h ALA 48 Ca 0.09 0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.79 2ksy h ALA 48 Cb 0.79 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.42 2ksy h ALA 48 CO 0.06 0.15 -0.95 -0.39 0.00 0.00 0.00 179.25 178.13 2ksy h VAL 49 N 0.85 1.35 -0.62 0.00 -1.51 -1.44 -2.24 116.25 112.64 2ksy h VAL 49 Ca 0.40 -2.32 -0.00 0.00 -1.23 0.00 0.00 66.70 63.54 2ksy h VAL 49 Cb 0.32 2.35 -0.03 0.00 -2.13 0.00 0.00 31.29 31.80 2ksy h VAL 49 CO -0.23 0.71 0.39 0.00 -1.23 0.00 0.00 177.57 177.21 2ksy h ALA 50 N 0.63 0.79 -0.04 5.19 0.00 -0.92 0.12 119.26 125.03 2ksy h ALA 50 Ca -0.09 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 2ksy h ALA 50 Cb 1.59 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2ksy h ALA 50 CO 0.17 0.26 -0.68 1.88 0.00 0.00 0.00 179.25 180.88 2ksy h TYR 51 N 0.84 0.26 -0.37 0.00 0.05 -1.30 -1.53 116.97 114.92 2ksy h TYR 51 Ca 0.22 -0.11 -0.15 0.00 0.05 0.00 0.00 58.73 58.75 2ksy h TYR 51 Cb -0.05 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 37.64 2ksy h TYR 51 CO -0.02 0.81 -0.35 0.00 -1.05 0.00 0.00 178.16 177.55 2ksy h ALA 52 N 1.16 0.67 -0.02 3.88 0.00 -0.88 -0.52 119.26 123.55 2ksy h ALA 52 Ca -0.02 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.39 2ksy h ALA 52 Cb 1.21 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2ksy h ALA 52 CO 0.10 0.67 -0.24 -0.39 0.00 0.00 0.00 179.25 179.39 2ksy h VAL 53 N 0.72 1.50 -0.16 0.00 -1.51 -0.73 -2.83 116.25 113.23 2ksy h VAL 53 Ca 0.07 -1.82 -0.01 0.00 -1.23 0.00 0.00 66.70 63.71 2ksy h VAL 53 Cb 0.92 2.60 -0.01 0.00 -2.13 0.00 0.00 31.29 32.67 2ksy h VAL 53 CO 0.09 0.50 0.04 0.24 -1.23 0.00 0.00 177.57 177.20 2ksy h MET 54 N -0.42 0.23 0.00 5.19 2.07 -1.32 0.13 114.93 120.81 2ksy h MET 54 Ca -0.02 -0.02 -0.03 0.00 -2.07 0.00 0.00 59.70 57.55 2ksy h MET 54 Cb 0.94 -0.05 -0.00 0.00 -1.87 0.00 0.00 31.60 30.63 2ksy h MET 54 CO 0.05 0.22 -0.13 0.00 1.07 0.00 0.00 176.91 178.12 2ksy h ALA 55 N 1.82 1.07 -0.01 6.32 0.00 -1.06 -2.27 119.26 125.12 2ksy h ALA 55 Ca 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2ksy h ALA 55 Cb 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2ksy h ALA 55 CO -0.00 0.16 0.00 1.28 0.00 0.00 0.00 179.25 180.69 2ksy n LEU 56 N -3.34 1.13 0.00 0.00 4.77 0.02 -4.72 117.00 114.86 2ksy n LEU 56 Ca -0.00 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 2ksy n LEU 56 Cb 0.34 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2ksy n LEU 56 CO 0.30 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 2ksy n GLY 57 N 1.13 3.19 3.77 -0.72 0.00 -0.85 -5.03 105.19 106.67 2ksy n GLY 57 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 2ksy n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ksy s VAL 58 N -1.98 2.98 0.00 1.61 0.11 -1.19 -3.16 120.40 118.77 2ksy s VAL 58 Ca 0.00 0.66 0.00 0.00 -2.93 0.00 0.00 61.98 59.71 2ksy s VAL 58 Cb 0.00 -3.29 0.00 0.00 -1.53 0.00 0.00 36.38 31.56 2ksy s VAL 58 CO 0.00 -0.09 0.00 0.61 -3.33 0.00 0.00 175.10 172.29 2ksy n GLY 59 N 0.35 0.91 3.54 6.54 0.00 -1.26 -4.07 105.19 111.20 2ksy n GLY 59 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2ksy n GLY 59 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ksy s TRP 60 N -2.56 2.87 -0.15 1.61 0.52 -1.19 -2.26 118.94 117.78 2ksy s TRP 60 Ca 0.00 0.17 -0.02 0.00 0.02 0.00 0.00 56.10 56.26 2ksy s TRP 60 Cb 0.00 -3.97 -0.02 0.00 -1.15 0.00 0.00 33.47 28.33 2ksy s TRP 60 CO 0.00 -1.20 -0.08 0.54 0.02 0.00 0.00 176.95 176.23 2ksy s VAL 61 N 3.77 3.43 0.59 4.03 0.11 -0.90 -5.04 120.40 126.39 2ksy s VAL 61 Ca 0.33 -0.52 -0.15 0.00 -2.93 0.00 0.00 61.98 58.71 2ksy s VAL 61 Cb -0.11 -2.49 -0.04 0.00 -1.53 0.00 0.00 36.38 32.21 2ksy s VAL 61 CO 0.23 0.50 1.05 -2.16 -3.33 0.00 0.00 175.10 171.38 2ksy s PRO 62 N 0.55 3.37 -0.36 1.54 0.04 -1.26 -2.35 135.00 136.53 2ksy s PRO 62 Ca -0.06 1.14 0.01 0.00 0.04 0.00 0.00 61.00 62.13 2ksy s PRO 62 Cb -0.15 -2.04 0.15 0.00 0.04 0.00 0.00 34.50 32.49 2ksy s PRO 62 CO 0.03 -0.76 0.28 0.08 0.04 0.00 0.00 177.00 176.67 2ksy s VAL 63 N -2.55 -0.05 0.00 -0.36 1.01 0.96 -4.88 120.40 114.54 2ksy s VAL 63 Ca 0.62 -1.45 0.00 0.00 0.00 0.00 0.00 61.98 61.15 2ksy s VAL 63 Cb -0.15 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.30 2ksy s VAL 63 CO 0.38 -0.84 0.00 0.00 0.00 0.00 0.00 175.10 174.65 2ksy n ALA 64 N 4.08 0.00 0.00 5.51 0.00 -1.26 -0.32 120.51 128.51 2ksy n ALA 64 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2ksy n ALA 64 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 2ksy n ALA 64 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ksy n GLU 65 N 0.00 0.67 -3.87 0.00 4.71 -1.26 -5.05 120.64 115.84 2ksy n GLU 65 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 57.16 56.94 2ksy n GLU 65 Cb 0.00 -0.94 -0.02 0.00 -1.01 0.00 0.00 31.44 29.47 2ksy n GLU 65 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2ksy s ARG 66 N -1.81 3.25 -0.03 3.49 0.52 0.56 -5.12 118.95 119.80 2ksy s ARG 66 Ca 0.00 -0.89 0.06 0.00 -0.52 0.00 0.00 55.73 54.38 2ksy s ARG 66 Cb 0.00 -2.80 -0.01 0.00 0.52 0.00 0.00 34.95 32.66 2ksy s ARG 66 CO 0.00 0.32 -0.22 0.99 0.02 0.00 0.00 175.30 176.41 2ksy s THR 67 N -2.07 1.80 0.06 0.02 2.01 -1.26 -0.03 115.64 116.17 2ksy s THR 67 Ca 0.37 -0.95 0.06 0.00 0.31 0.00 0.00 61.69 61.48 2ksy s THR 67 Cb -0.09 -1.51 -0.03 0.00 0.01 0.00 0.00 72.50 70.88 2ksy s THR 67 CO 0.29 0.51 -0.18 0.68 -0.69 0.00 0.00 174.62 175.23 2ksy s VAL 68 N -0.31 1.41 -0.32 3.82 -7.23 -0.99 -4.97 120.40 111.82 2ksy s VAL 68 Ca 0.02 -1.20 -0.06 0.00 -1.81 0.00 0.00 61.98 58.94 2ksy s VAL 68 Cb -0.11 -1.26 0.03 0.00 0.56 0.00 0.00 36.38 35.59 2ksy s VAL 68 CO 0.01 0.04 0.08 -0.36 -0.31 0.00 0.00 175.10 174.56 2ksy s PHE 69 N -0.93 3.20 0.06 2.82 0.08 -1.26 -2.12 117.98 119.83 2ksy s PHE 69 Ca 0.04 -1.26 -0.23 0.00 0.12 0.00 0.00 56.93 55.60 2ksy s PHE 69 Cb -0.09 -2.25 -0.15 0.00 -0.57 0.00 0.00 43.02 39.96 2ksy s PHE 69 CO 0.02 -0.67 1.60 0.28 -0.10 0.00 0.00 175.22 176.35 2ksy h VAL 70 N 6.05 1.12 0.00 -0.44 2.07 -1.82 -2.67 116.25 120.56 2ksy h VAL 70 Ca -0.27 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2ksy h VAL 70 Cb 1.10 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 2ksy h VAL 70 CO 0.60 0.10 0.00 -0.65 0.02 0.00 0.00 177.57 177.64 2ksy h PRO 71 N -0.10 0.00 0.11 1.57 0.11 -1.92 -1.97 132.00 129.81 2ksy h PRO 71 Ca 0.01 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 2ksy h PRO 71 Cb 0.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.26 2ksy h PRO 71 CO -0.00 0.00 -0.05 -0.09 -0.21 0.00 0.00 178.00 177.65 2ksy h ARG 72 N 0.00 -0.15 -0.33 1.05 2.43 -1.84 -1.48 114.38 114.07 2ksy h ARG 72 Ca 0.00 0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.07 2ksy h ARG 72 Cb 0.03 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2ksy h ARG 72 CO 0.00 0.26 -0.23 1.88 -1.51 0.00 0.00 179.97 180.36 2ksy h TYR 73 N -0.95 0.72 -0.39 2.20 0.05 -1.47 -2.77 116.97 114.36 2ksy h TYR 73 Ca -0.02 -0.16 -0.08 0.00 0.05 0.00 0.00 58.73 58.53 2ksy h TYR 73 Cb 0.47 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 38.02 2ksy h TYR 73 CO 0.09 0.82 -0.07 0.97 -1.05 0.00 0.00 178.16 178.92 2ksy h ILE 74 N 0.56 1.27 -0.96 -2.88 -0.00 -1.48 -2.41 117.51 111.61 2ksy h ILE 74 Ca 0.08 -1.14 0.17 0.00 -0.00 0.00 0.00 64.86 63.97 2ksy h ILE 74 Cb 0.70 1.22 -0.10 0.00 -0.00 0.00 0.00 36.82 38.64 2ksy h ILE 74 CO 0.05 0.38 0.57 -0.78 -0.00 0.00 0.00 178.15 178.37 2ksy h ASP 75 N 0.54 0.74 -0.19 2.19 3.58 -1.02 0.31 116.42 122.57 2ksy h ASP 75 Ca 0.10 0.09 -0.09 0.00 0.42 0.00 0.00 57.03 57.55 2ksy h ASP 75 Cb 0.58 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.57 2ksy h ASP 75 CO 0.03 0.29 -0.15 -0.50 -2.88 0.00 0.00 179.24 176.04 2ksy h TRP 76 N 0.76 0.65 -0.94 0.28 6.55 -1.21 -0.19 115.95 121.86 2ksy h TRP 76 Ca 0.54 -0.12 0.01 0.00 0.95 0.00 0.00 58.89 60.27 2ksy h TRP 76 Cb 0.77 -0.17 -0.05 0.00 -0.86 0.00 0.00 29.16 28.86 2ksy h TRP 76 CO -0.03 0.72 0.62 0.82 -1.05 0.00 0.00 178.44 179.52 2ksy h ILE 77 N 0.54 1.23 0.00 1.49 2.04 0.10 -0.99 117.51 121.91 2ksy h ILE 77 Ca 0.09 -0.43 -0.25 0.00 1.00 0.00 0.00 64.86 65.27 2ksy h ILE 77 Cb 0.57 -0.14 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 2ksy h ILE 77 CO 0.04 0.23 -1.72 0.00 0.00 0.00 0.00 178.15 176.69 2ksy n LEU 78 N -4.44 0.71 -0.06 1.44 -0.00 -0.98 -4.32 117.00 109.36 2ksy n LEU 78 Ca 0.11 0.33 -0.10 0.00 -0.00 0.00 0.00 56.01 56.35 2ksy n LEU 78 Cb 0.03 0.18 -0.09 0.00 -0.00 0.00 0.00 43.42 43.54 2ksy n LEU 78 CO 0.36 0.31 0.28 0.71 -0.00 0.00 0.00 177.39 179.05 2ksy h THR 79 N 0.00 1.23 -0.23 1.47 1.35 -0.96 -3.28 112.91 112.50 2ksy h THR 79 Ca -0.28 -1.90 0.06 0.00 -0.55 0.00 0.00 66.41 63.74 2ksy h THR 79 Cb 1.88 2.32 -0.07 0.00 -1.73 0.00 0.00 68.15 70.55 2ksy h THR 79 CO 0.06 0.41 -0.28 0.74 -0.25 0.00 0.00 175.52 176.20 2ksy h THR 80 N -0.99 0.33 0.00 6.82 2.02 -1.39 0.69 112.91 120.39 2ksy h THR 80 Ca -0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 2ksy h THR 80 Cb 0.68 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2ksy h THR 80 CO 0.00 0.00 -0.00 -0.65 0.37 0.00 0.00 175.52 175.24 2ksy h PRO 81 N -0.30 0.00 -0.03 6.66 0.11 -1.75 -0.28 132.00 136.40 2ksy h PRO 81 Ca 0.13 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.06 2ksy h PRO 81 Cb 0.50 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.60 2ksy h PRO 81 CO -0.40 0.00 -0.76 1.25 -0.21 0.00 0.00 178.00 177.88 2ksy h LEU 82 N 0.00 0.29 0.17 2.35 5.85 -0.94 -1.23 115.31 121.80 2ksy h LEU 82 Ca -0.00 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 2ksy h LEU 82 Cb 0.00 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2ksy h LEU 82 CO 0.00 0.94 -0.08 0.40 -0.34 0.00 0.00 178.44 179.36 2ksy h ILE 83 N 0.15 0.94 -0.02 4.05 1.08 -0.32 -1.60 117.51 121.80 2ksy h ILE 83 Ca -0.03 -0.85 -0.02 0.00 -0.39 0.00 0.00 64.86 63.57 2ksy h ILE 83 Cb 1.34 1.43 -0.00 0.00 -3.07 0.00 0.00 36.82 36.52 2ksy h ILE 83 CO 0.12 0.19 -0.07 -0.37 -0.69 0.00 0.00 178.15 177.32 2ksy h VAL 84 N -0.67 1.06 -0.27 1.67 -1.51 -1.54 -0.25 116.25 114.75 2ksy h VAL 84 Ca -0.02 -0.29 -0.09 0.00 -1.23 0.00 0.00 66.70 65.06 2ksy h VAL 84 Cb 0.48 1.13 -0.01 0.00 -2.13 0.00 0.00 31.29 30.76 2ksy h VAL 84 CO 0.04 0.09 -0.21 0.22 -1.23 0.00 0.00 177.57 176.47 2ksy h TYR 85 N 0.02 0.55 0.10 5.19 5.03 -1.09 -1.65 116.97 125.13 2ksy h TYR 85 Ca 0.00 -0.11 0.00 0.00 2.58 0.00 0.00 58.73 61.21 2ksy h TYR 85 Cb 0.15 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 38.28 2ksy h TYR 85 CO 0.00 0.68 -0.08 0.35 -1.32 0.00 0.00 178.16 177.79 2ksy h PHE 86 N 0.45 -0.21 -0.22 -3.82 3.04 -0.02 -0.65 116.94 115.51 2ksy h PHE 86 Ca 0.07 -0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.02 2ksy h PHE 86 Cb 0.62 0.08 -0.01 0.00 2.56 0.00 0.00 35.95 39.20 2ksy h PHE 86 CO 0.02 -0.13 0.12 -0.07 -2.02 0.00 0.00 178.31 176.24 2ksy h LEU 87 N -0.19 0.26 -1.24 0.59 4.07 -1.30 -0.61 115.31 116.90 2ksy h LEU 87 Ca -0.00 -0.01 -0.07 0.00 0.08 0.00 0.00 57.88 57.87 2ksy h LEU 87 Cb 0.17 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 2ksy h LEU 87 CO -0.01 0.22 -0.35 1.23 -1.08 0.00 0.00 178.44 178.45 2ksy h GLY 88 N 0.37 0.00 1.23 0.83 0.00 -0.36 -2.78 103.07 102.36 2ksy h GLY 88 Ca 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.21 2ksy h GLY 88 CO -0.01 0.00 -0.67 1.41 0.00 0.00 0.00 176.54 177.26 2ksy h LEU 89 N 0.00 0.90 0.31 3.11 3.38 0.37 0.24 115.31 123.62 2ksy h LEU 89 Ca -0.00 -0.54 -0.01 0.00 0.09 0.00 0.00 57.88 57.41 2ksy h LEU 89 Cb 0.70 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2ksy h LEU 89 CO 0.05 1.33 -0.15 -0.07 0.09 0.00 0.00 178.44 179.69 2ksy h LEU 90 N 0.56 -0.36 0.08 1.67 3.38 -1.23 -3.26 115.31 116.15 2ksy h LEU 90 Ca -0.02 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2ksy h LEU 90 Cb 1.29 0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2ksy h LEU 90 CO 0.14 -0.26 -0.04 0.00 0.09 0.00 0.00 178.44 178.37 2ksy h ALA 91 N 0.27 -0.11 -0.38 1.53 0.00 -1.56 -3.46 119.26 115.56 2ksy h ALA 91 Ca -0.04 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2ksy h ALA 91 Cb 0.33 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2ksy h ALA 91 CO 0.07 -0.25 0.00 0.41 0.00 0.00 0.00 179.25 179.47 2ksy n GLY 92 N 0.55 0.80 3.40 0.00 0.00 0.84 -4.53 105.19 106.25 2ksy n GLY 92 Ca -0.08 -0.56 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 2ksy n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ksy s LEU 93 N -0.38 0.02 0.81 0.99 1.02 -1.15 -5.02 118.68 114.97 2ksy s LEU 93 Ca 0.00 1.31 -0.10 0.00 0.02 0.00 0.00 54.13 55.35 2ksy s LEU 93 Cb 0.00 -3.02 0.11 0.00 0.02 0.00 0.00 46.19 43.30 2ksy s LEU 93 CO 0.00 -4.74 1.15 -1.81 0.02 0.00 0.00 176.35 170.97 2ksy s ASP 94 N -2.63 4.25 0.15 2.29 1.11 -1.26 -4.83 116.67 115.74 2ksy s ASP 94 Ca 0.69 0.46 -0.18 0.00 0.18 0.00 0.00 52.55 53.70 2ksy s ASP 94 Cb -0.22 -0.89 0.03 0.00 1.07 0.00 0.00 42.92 42.92 2ksy s ASP 94 CO 0.63 -2.01 1.73 -1.28 1.18 0.00 0.00 175.17 175.42 2ksy h SER 95 N -1.02 -0.02 -0.23 0.27 0.87 -2.00 -1.43 113.55 109.99 2ksy h SER 95 Ca -0.44 0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.05 2ksy h SER 95 Cb 1.30 0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 63.33 2ksy h SER 95 CO 0.55 0.03 -0.30 0.03 -0.53 0.00 0.00 176.83 176.61 2ksy h ARG 96 N 0.15 0.61 -0.51 2.24 3.08 -1.99 -3.07 114.38 114.88 2ksy h ARG 96 Ca 0.14 -0.35 0.10 0.00 0.07 0.00 0.00 59.98 59.94 2ksy h ARG 96 Cb 0.16 0.03 -0.08 0.00 0.08 0.00 0.00 29.97 30.15 2ksy h ARG 96 CO -0.20 0.95 0.05 0.93 -1.07 0.00 0.00 179.97 180.64 2ksy h GLU 97 N 0.31 0.16 -0.55 0.04 4.39 -1.86 -0.31 114.58 116.75 2ksy h GLU 97 Ca 0.03 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.76 2ksy h GLU 97 Cb 0.88 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.44 2ksy h GLU 97 CO 0.07 0.11 0.30 0.74 -1.16 0.00 0.00 179.01 179.07 2ksy h PHE 98 N 0.17 0.55 0.00 4.33 0.04 -1.29 -0.90 116.94 119.83 2ksy h PHE 98 Ca 0.26 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 61.03 2ksy h PHE 98 Cb 0.38 -0.17 -0.00 0.00 2.20 0.00 0.00 35.95 38.37 2ksy h PHE 98 CO -0.28 0.28 -0.08 0.78 -0.60 0.00 0.00 178.31 178.41 2ksy h GLY 99 N 0.58 0.00 0.55 -1.45 0.00 -1.04 -1.98 103.07 99.72 2ksy h GLY 99 Ca 0.24 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.51 2ksy h GLY 99 CO -0.15 0.00 -0.20 -2.22 0.00 0.00 0.00 176.54 173.97 2ksy h ILE 100 N 0.00 1.46 -0.22 2.60 2.04 0.28 -2.22 117.51 121.45 2ksy h ILE 100 Ca -0.00 -1.66 -0.12 0.00 1.00 0.00 0.00 64.86 64.07 2ksy h ILE 100 Cb 0.19 2.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.69 2ksy h ILE 100 CO 0.01 0.46 -0.39 -0.37 0.00 0.00 0.00 178.15 177.86 2ksy h VAL 101 N -0.35 1.30 -0.05 1.67 -1.51 -1.22 -2.51 116.25 113.59 2ksy h VAL 101 Ca -0.01 -1.53 -0.04 0.00 -1.23 0.00 0.00 66.70 63.88 2ksy h VAL 101 Cb 0.85 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 31.57 2ksy h VAL 101 CO 0.04 0.48 -0.14 0.40 -1.23 0.00 0.00 177.57 177.13 2ksy h ILE 102 N 0.41 1.44 -0.76 7.19 1.08 -1.44 -2.81 117.51 122.62 2ksy h ILE 102 Ca 0.04 -1.52 0.00 0.00 -0.39 0.00 0.00 64.86 62.99 2ksy h ILE 102 Cb 0.87 2.32 -0.04 0.00 -3.07 0.00 0.00 36.82 36.90 2ksy h ILE 102 CO 0.07 0.42 0.49 0.00 -0.69 0.00 0.00 178.15 178.44 2ksy h THR 103 N -0.36 1.20 0.02 -0.27 1.03 -1.43 -2.18 112.91 110.91 2ksy h THR 103 Ca -0.00 -0.39 -0.00 0.00 -0.01 0.00 0.00 66.41 66.01 2ksy h THR 103 Cb 0.75 0.09 0.00 0.00 -1.07 0.00 0.00 68.15 67.92 2ksy h THR 103 CO 0.03 0.20 -0.01 0.25 -0.01 0.00 0.00 175.52 175.98 2ksy h LEU 104 N 1.04 -0.02 -1.83 0.00 5.85 -1.46 -2.19 115.31 116.70 2ksy h LEU 104 Ca 0.28 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.99 2ksy h LEU 104 Cb -0.10 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 2ksy h LEU 104 CO -0.06 0.01 0.16 0.78 -0.34 0.00 0.00 178.44 178.99 2ksy h ASN 105 N -0.05 0.19 0.76 1.25 -0.26 -1.20 -2.61 115.58 113.66 2ksy h ASN 105 Ca -0.00 -0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 55.70 2ksy h ASN 105 Cb 0.04 -0.05 0.01 0.00 -1.06 0.00 0.00 38.32 37.26 2ksy h ASN 105 CO 0.00 0.13 -0.36 0.74 -1.06 0.00 0.00 177.43 176.88 2ksy h THR 106 N 0.22 0.23 -0.71 2.81 2.02 -0.78 -1.32 112.91 115.38 2ksy h THR 106 Ca 0.09 -0.07 0.09 0.00 0.77 0.00 0.00 66.41 67.30 2ksy h THR 106 Cb 0.10 0.24 -0.05 0.00 -1.74 0.00 0.00 68.15 66.71 2ksy h THR 106 CO -0.02 0.01 0.47 1.62 0.37 0.00 0.00 175.52 177.97 2ksy h VAL 107 N -1.07 0.94 0.73 3.16 3.04 -1.32 -1.32 116.25 120.41 2ksy h VAL 107 Ca -0.10 -0.21 -0.04 0.00 -1.01 0.00 0.00 66.70 65.34 2ksy h VAL 107 Cb 0.79 0.27 0.01 0.00 -2.01 0.00 0.00 31.29 30.35 2ksy h VAL 107 CO 0.17 0.11 -0.35 0.58 -1.01 0.00 0.00 177.57 177.07 2ksy h VAL 108 N 0.61 0.23 -0.60 1.51 2.07 -1.18 -0.60 116.25 118.29 2ksy h VAL 108 Ca 0.33 -0.11 0.04 0.00 0.82 0.00 0.00 66.70 67.78 2ksy h VAL 108 Cb 0.46 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 2ksy h VAL 108 CO -0.11 0.01 0.40 0.24 0.02 0.00 0.00 177.57 178.13 2ksy h MET 109 N -1.06 0.64 -0.15 1.57 2.86 -0.89 -0.69 114.93 117.20 2ksy h MET 109 Ca -0.10 -0.04 -0.10 0.00 -2.06 0.00 0.00 59.70 57.40 2ksy h MET 109 Cb 0.77 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.27 2ksy h MET 109 CO 0.16 0.42 -0.36 -0.07 1.06 0.00 0.00 176.91 178.12 2ksy h LEU 110 N 0.65 0.33 -0.45 1.22 3.38 -1.10 0.90 115.31 120.24 2ksy h LEU 110 Ca 0.25 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2ksy h LEU 110 Cb 0.17 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2ksy h LEU 110 CO -0.07 0.67 0.24 0.00 0.09 0.00 0.00 178.44 179.37 2ksy h ALA 111 N 1.35 0.58 -0.04 1.53 0.00 0.46 -2.20 119.26 120.93 2ksy h ALA 111 Ca 0.03 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.68 2ksy h ALA 111 Cb 0.77 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2ksy h ALA 111 CO 0.06 0.11 -0.73 0.78 0.00 0.00 0.00 179.25 179.46 2ksy h GLY 112 N 0.59 0.29 0.00 0.00 0.00 -1.28 -1.34 103.07 101.33 2ksy h GLY 112 Ca 0.16 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.06 2ksy h GLY 112 CO -0.02 0.38 0.00 0.33 0.00 0.00 0.00 176.54 177.23 2ksy n PHE 113 N -3.79 0.00 0.31 5.60 -0.00 0.29 -2.18 117.46 117.69 2ksy n PHE 113 Ca -0.03 0.00 0.19 0.00 -0.00 0.00 0.00 57.45 57.61 2ksy n PHE 113 Cb 0.71 -0.32 0.99 0.00 -0.00 0.00 0.00 39.48 40.85 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 -1.78 1.11 -0.42 3.13 0.00 -1.54 -2.86 119.26 116.90 2ksy h ALA 114 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2ksy h ALA 114 Cb 0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 2ksy h ALA 114 CO 0.00 0.03 -0.04 0.78 0.00 0.00 0.00 179.25 180.02 2ksy h GLY 115 N 0.60 0.38 2.00 0.00 0.00 -0.74 0.71 103.07 106.03 2ksy h GLY 115 Ca -0.00 0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.41 2ksy h GLY 115 CO 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 176.54 176.41 2ksy h ALA 116 N 1.39 1.00 -0.58 3.60 0.00 -1.24 -3.15 119.26 120.28 2ksy h ALA 116 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2ksy h ALA 116 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2ksy h ALA 116 CO -0.38 0.00 0.00 -1.33 0.00 0.00 0.00 179.25 177.54 2ksy n MET 117 N -2.42 3.75 -2.01 0.00 2.00 -0.15 -4.90 117.12 113.39 2ksy n MET 117 Ca 0.05 -2.86 -0.36 0.00 0.00 0.00 0.00 57.70 54.53 2ksy n MET 117 Cb 0.42 -1.89 0.03 0.00 0.00 0.00 0.00 33.22 31.78 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 -2.00 2.67 -2.03 2.03 -7.23 0.06 -4.91 120.40 108.99 2ksy s VAL 118 Ca 0.49 0.41 0.18 0.00 -1.81 0.00 0.00 61.98 61.25 2ksy s VAL 118 Cb 0.33 -3.15 0.50 0.00 0.56 0.00 0.00 36.38 34.61 2ksy s VAL 118 CO 0.21 -0.10 1.67 -0.81 -0.31 0.00 0.00 175.10 175.76 2ksy n PRO 119 N -1.62 1.07 0.00 4.82 -0.04 -1.26 -4.90 135.00 133.07 2ksy n PRO 119 Ca 0.13 -0.11 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 2ksy n PRO 119 Cb 0.50 -1.29 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 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 0.81 1.19 1.00 0.55 0.00 -1.26 -5.00 105.19 102.48 2ksy n GLY 120 Ca 0.14 0.34 0.09 0.00 0.00 0.00 0.00 46.02 46.59 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 0.31 -0.61 -5.35 -1.26 -4.47 119.36 108.96 2ksy n ILE 121 Ca 0.00 -0.99 0.19 0.00 -0.27 0.00 0.00 62.75 61.68 2ksy n ILE 121 Cb 0.00 0.52 1.02 0.00 -1.74 0.00 0.00 39.64 39.44 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 3.19 0.00 -0.93 6.28 4.39 -1.94 -2.24 114.58 123.32 2ksy h GLU 122 Ca 0.00 0.00 0.21 0.00 0.34 0.00 0.00 59.36 59.91 2ksy h GLU 122 Cb 0.86 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.44 2ksy h GLU 122 CO 0.00 0.00 0.61 0.07 -1.16 0.00 0.00 179.01 178.53 2ksy h ARG 123 N 0.00 0.41 -0.66 2.33 0.11 -1.78 1.00 114.38 115.78 2ksy h ARG 123 Ca 0.00 -0.02 0.07 0.00 0.10 0.00 0.00 59.98 60.13 2ksy h ARG 123 Cb 0.19 -0.09 -0.04 0.00 1.11 0.00 0.00 29.97 31.14 2ksy h ARG 123 CO 0.00 0.27 0.44 1.88 0.10 0.00 0.00 179.97 182.66 2ksy h TYR 124 N 0.42 0.64 -0.01 4.08 0.05 -1.76 -1.13 116.97 119.27 2ksy h TYR 124 Ca 0.50 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 59.27 2ksy h TYR 124 Cb 1.22 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 38.75 2ksy h TYR 124 CO -0.00 0.33 -0.09 0.00 -1.05 0.00 0.00 178.16 177.35 2ksy h ALA 125 N 1.65 0.02 -0.16 3.88 0.00 -1.02 -1.98 119.26 121.64 2ksy h ALA 125 Ca 0.29 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.86 2ksy h ALA 125 Cb 0.33 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 2ksy h ALA 125 CO -0.09 -0.06 -0.19 -0.07 0.00 0.00 0.00 179.25 178.84 2ksy h LEU 126 N -0.59 -0.61 -0.94 0.00 4.07 -1.19 -1.58 115.31 114.48 2ksy h LEU 126 Ca -0.01 0.11 -0.06 0.00 0.08 0.00 0.00 57.88 58.00 2ksy h LEU 126 Cb 0.80 0.28 -0.02 0.00 1.08 0.00 0.00 40.66 42.80 2ksy h LEU 126 CO 0.02 -0.24 0.09 0.15 -1.08 0.00 0.00 178.44 177.38 2ksy h PHE 127 N -0.23 0.91 -0.84 1.13 3.57 -1.33 -2.53 116.94 117.63 2ksy h PHE 127 Ca 0.11 -0.10 0.21 0.00 3.53 0.00 0.00 57.97 61.72 2ksy h PHE 127 Cb 0.39 -0.26 -0.13 0.00 2.79 0.00 0.00 35.95 38.74 2ksy h PHE 127 CO -0.32 0.78 0.20 0.78 -2.23 0.00 0.00 178.31 177.53 2ksy h GLY 128 N 0.99 1.24 1.31 2.40 0.00 -0.49 0.63 103.07 109.16 2ksy h GLY 128 Ca 0.17 -0.02 -0.16 0.00 0.00 0.00 0.00 47.33 47.32 2ksy h GLY 128 CO 0.01 -0.32 -0.47 1.98 0.00 0.00 0.00 176.54 177.73 2ksy h MET 129 N 0.22 0.74 -0.06 4.80 1.85 -1.18 -2.86 114.93 118.44 2ksy h MET 129 Ca 0.51 -0.43 -0.04 0.00 -0.61 0.00 0.00 59.70 59.14 2ksy h MET 129 Cb 0.98 0.03 -0.01 0.00 0.43 0.00 0.00 31.60 33.04 2ksy h MET 129 CO -0.62 1.05 -0.14 0.78 -0.40 0.00 0.00 176.91 177.57 2ksy h GLY 130 N 0.90 0.10 0.28 1.39 0.00 0.45 0.72 103.07 106.90 2ksy h GLY 130 Ca 0.03 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 2ksy h GLY 130 CO 0.10 0.06 -0.05 0.00 0.00 0.00 0.00 176.54 176.65 2ksy h ALA 131 N 1.77 -0.13 -0.98 3.60 0.00 -0.28 0.84 119.26 124.07 2ksy h ALA 131 Ca 0.02 -0.26 0.06 0.00 0.00 0.00 0.00 54.91 54.73 2ksy h ALA 131 Cb 0.31 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 2ksy h ALA 131 CO 0.02 -0.21 0.63 0.28 0.00 0.00 0.00 179.25 179.97 2ksy h VAL 132 N -0.86 1.09 -0.44 0.00 2.07 -1.43 -0.20 116.25 116.48 2ksy h VAL 132 Ca -0.01 -0.40 -0.09 0.00 0.82 0.00 0.00 66.70 67.02 2ksy h VAL 132 Cb 0.57 -0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 2ksy h VAL 132 CO 0.02 0.21 -0.08 0.00 0.02 0.00 0.00 177.57 177.74 2ksy h ALA 133 N 1.44 1.03 -0.08 1.67 0.00 -0.89 -2.47 119.26 119.95 2ksy h ALA 133 Ca 0.42 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2ksy h ALA 133 Cb 0.15 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2ksy h ALA 133 CO -0.17 0.59 -0.07 0.35 0.00 0.00 0.00 179.25 179.95 2ksy h PHE 134 N 0.71 -0.18 -0.25 0.00 3.57 0.95 -0.19 116.94 121.55 2ksy h PHE 134 Ca 0.13 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.69 2ksy h PHE 134 Cb 0.55 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.37 2ksy h PHE 134 CO 0.03 -0.11 0.18 0.82 -2.23 0.00 0.00 178.31 176.99 2ksy h ILE 135 N -0.09 0.93 -0.53 1.41 2.04 -1.13 0.54 117.51 120.68 2ksy h ILE 135 Ca 0.06 -0.03 -0.08 0.00 1.00 0.00 0.00 64.86 65.80 2ksy h ILE 135 Cb 0.17 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2ksy h ILE 135 CO -0.14 0.02 0.01 1.23 0.00 0.00 0.00 178.15 179.27 2ksy h GLY 136 N 0.10 0.97 0.72 5.37 0.00 -0.61 0.58 103.07 110.21 2ksy h GLY 136 Ca 0.12 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.73 2ksy h GLY 136 CO -0.01 0.62 -0.11 -2.00 0.00 0.00 0.00 176.54 175.04 2ksy h LEU 137 N 0.84 0.33 -1.61 3.11 5.85 0.10 -2.32 115.31 121.60 2ksy h LEU 137 Ca 0.16 -0.46 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 2ksy h LEU 137 Cb 0.48 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 2ksy h LEU 137 CO 0.02 0.72 -0.00 -0.37 -0.34 0.00 0.00 178.44 178.47 2ksy h VAL 138 N -0.06 1.11 -0.68 1.05 -1.51 -1.15 0.27 116.25 115.28 2ksy h VAL 138 Ca 0.02 -0.43 -0.01 0.00 -1.23 0.00 0.00 66.70 65.06 2ksy h VAL 138 Cb 0.62 0.99 -0.03 0.00 -2.13 0.00 0.00 31.29 30.74 2ksy h VAL 138 CO 0.03 0.14 0.39 0.22 -1.23 0.00 0.00 177.57 177.12 2ksy h TYR 139 N 0.23 0.90 -0.19 5.19 3.20 -0.64 -1.30 116.97 124.38 2ksy h TYR 139 Ca 0.06 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.78 2ksy h TYR 139 Cb 0.17 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 2ksy h TYR 139 CO 0.00 0.62 -0.47 1.88 -1.64 0.00 0.00 178.16 178.55 2ksy h TYR 140 N 0.94 0.59 -1.00 -3.82 0.05 -0.43 0.53 116.97 113.83 2ksy h TYR 140 Ca 0.24 -0.19 0.10 0.00 0.05 0.00 0.00 58.73 58.94 2ksy h TYR 140 Cb -0.01 -0.12 -0.08 0.00 1.01 0.00 0.00 36.73 37.53 2ksy h TYR 140 CO 0.00 0.87 0.64 -0.07 -1.05 0.00 0.00 178.16 178.55 2ksy h LEU 141 N 0.39 0.96 -1.76 3.88 3.38 -0.18 -1.33 115.31 120.65 2ksy h LEU 141 Ca 0.02 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2ksy h LEU 141 Cb 0.98 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2ksy h LEU 141 CO 0.09 0.55 0.00 0.52 0.09 0.00 0.00 178.44 179.68 2ksy n VAL 142 N -4.57 0.01 0.00 1.22 0.31 -1.00 -4.07 118.33 110.23 2ksy n VAL 142 Ca 0.18 -0.51 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 2ksy n VAL 142 Cb 0.30 1.39 0.00 0.00 -0.91 0.00 0.00 33.84 34.61 2ksy n VAL 142 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ksy n GLY 143 N 1.08 -0.53 0.28 2.92 0.00 0.18 -4.77 105.19 104.36 2ksy n GLY 143 Ca 0.11 -1.30 0.15 0.00 0.00 0.00 0.00 46.02 44.99 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 0.26 1.61 0.13 -1.86 -3.16 132.00 128.98 2ksy h PRO 144 Ca 0.00 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.14 2ksy h PRO 144 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 2ksy h PRO 144 CO 0.00 0.07 -0.45 0.52 -0.23 0.00 0.00 178.00 177.91 2ksy h MET 145 N 0.00 -0.75 -0.21 0.86 2.86 -1.89 -0.28 114.93 115.51 2ksy h MET 145 Ca -0.00 0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 2ksy h MET 145 Cb 0.24 0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 2ksy h MET 145 CO 0.01 -0.50 0.11 0.00 1.06 0.00 0.00 176.91 177.58 2ksy h THR 146 N -0.78 1.08 -0.27 2.22 1.03 -1.69 -1.73 112.91 112.76 2ksy h THR 146 Ca -0.01 -0.21 -0.09 0.00 -0.01 0.00 0.00 66.41 66.09 2ksy h THR 146 Cb 0.75 0.80 -0.01 0.00 -1.07 0.00 0.00 68.15 68.61 2ksy h THR 146 CO -0.18 0.08 -0.21 -0.33 -0.01 0.00 0.00 175.52 174.88 2ksy h GLU 147 N 0.29 0.50 -0.19 0.00 5.08 -1.41 -2.08 114.58 116.77 2ksy h GLU 147 Ca 0.08 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 2ksy h GLU 147 Cb 0.03 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2ksy h GLU 147 CO -0.01 0.68 -0.17 1.03 -1.00 0.00 0.00 179.01 179.54 2ksy h SER 148 N 0.45 0.48 -0.65 1.42 0.87 -0.16 -3.18 113.55 112.76 2ksy h SER 148 Ca 0.07 -0.47 -0.06 0.00 -1.23 0.00 0.00 61.79 60.11 2ksy h SER 148 Cb 0.61 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.41 2ksy h SER 148 CO 0.04 0.85 0.20 0.00 -0.53 0.00 0.00 176.83 177.39 2ksy h ALA 149 N 0.65 1.08 0.00 6.23 0.00 -1.39 -1.49 119.26 124.32 2ksy h ALA 149 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2ksy h ALA 149 Cb 0.70 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2ksy h ALA 149 CO 0.04 0.62 0.00 -1.13 0.00 0.00 0.00 179.25 178.79 2ksy n SER 150 N -4.26 0.00 -0.01 0.00 3.41 -0.79 -1.47 113.62 110.50 2ksy n SER 150 Ca 0.05 -0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 2ksy n SER 150 Cb 0.23 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 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 -1.13 0.33 -0.07 4.33 6.02 -0.61 -4.73 117.38 121.53 2ksy n GLN 151 Ca 0.07 -0.43 -0.13 0.00 -0.01 0.00 0.00 57.00 56.50 2ksy n GLN 151 Cb 0.06 -0.93 -0.11 0.00 1.02 0.00 0.00 30.24 30.29 2ksy n GLN 151 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ksy h ARG 152 N 0.06 0.00 -3.15 -1.09 2.47 -0.77 -3.50 114.38 108.39 2ksy h ARG 152 Ca 0.00 0.00 0.02 0.00 -1.26 0.00 0.00 59.98 58.74 2ksy h ARG 152 Cb 0.01 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.29 2ksy h ARG 152 CO 0.00 0.84 0.17 0.45 0.56 0.00 0.00 179.97 181.99 2ksy s SER 153 N -6.21 -0.13 0.14 7.04 0.15 -1.24 -5.01 113.70 108.45 2ksy s SER 153 Ca -0.18 -0.82 -0.11 0.00 0.70 0.00 0.00 55.95 55.55 2ksy s SER 153 Cb -0.01 0.73 -0.04 0.00 -1.71 0.00 0.00 66.02 64.99 2ksy s SER 153 CO 0.57 -1.39 1.47 -1.28 1.20 0.00 0.00 173.24 173.81 2ksy h SER 154 N 2.05 1.00 0.05 5.45 0.87 -1.92 -3.17 113.55 117.88 2ksy h SER 154 Ca -0.23 -0.47 -0.22 0.00 -1.23 0.00 0.00 61.79 59.64 2ksy h SER 154 Cb 1.25 -0.28 0.02 0.00 -0.44 0.00 0.00 62.40 62.95 2ksy h SER 154 CO 0.30 1.27 -0.89 1.23 -0.53 0.00 0.00 176.83 178.20 2ksy h GLY 155 N 0.77 0.57 -0.14 5.77 0.00 -1.96 -3.30 103.07 104.79 2ksy h GLY 155 Ca 0.06 -1.10 0.26 0.00 0.00 0.00 0.00 47.33 46.55 2ksy h GLY 155 CO 0.10 0.97 0.65 -2.22 0.00 0.00 0.00 176.54 176.04 2ksy h ILE 156 N 0.05 0.53 -0.33 2.60 1.08 -1.85 0.28 117.51 119.87 2ksy h ILE 156 Ca -0.13 -0.16 -0.11 0.00 -0.39 0.00 0.00 64.86 64.08 2ksy h ILE 156 Cb 1.59 0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 35.37 2ksy h ILE 156 CO 0.17 0.08 -0.24 0.50 -0.69 0.00 0.00 178.15 177.97 2ksy h LYS 157 N 0.45 0.65 -0.20 2.37 3.64 -1.62 -2.23 116.57 119.64 2ksy h LYS 157 Ca 0.61 -0.26 -0.15 0.00 -1.27 0.00 0.00 60.65 59.57 2ksy h LYS 157 Cb 1.42 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.21 2ksy h LYS 157 CO -0.35 0.84 -0.47 1.03 -2.27 0.00 0.00 179.45 178.23 2ksy h SER 158 N 0.57 0.76 -0.11 4.20 0.87 -0.58 -2.55 113.55 116.71 2ksy h SER 158 Ca 0.08 -0.56 -0.10 0.00 -1.23 0.00 0.00 61.79 59.98 2ksy h SER 158 Cb 0.72 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 2ksy h SER 158 CO 0.06 1.19 -0.25 -0.07 -0.53 0.00 0.00 176.83 177.23 2ksy h LEU 159 N 0.37 0.55 -0.06 2.23 4.07 -1.21 -2.62 115.31 118.64 2ksy h LEU 159 Ca -0.00 -0.19 -0.07 0.00 0.08 0.00 0.00 57.88 57.70 2ksy h LEU 159 Cb 1.08 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.67 2ksy h LEU 159 CO 0.10 0.79 -0.22 0.22 -1.08 0.00 0.00 178.44 178.25 2ksy h TYR 160 N 0.48 0.35 -0.33 1.13 5.03 -1.42 -2.47 116.97 119.74 2ksy h TYR 160 Ca 0.07 -0.14 -0.02 0.00 2.58 0.00 0.00 58.73 61.22 2ksy h TYR 160 Cb 0.68 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.89 2ksy h TYR 160 CO 0.03 0.85 0.14 -0.39 -1.32 0.00 0.00 178.16 177.46 2ksy h VAL 161 N -0.25 1.18 -0.44 1.81 -1.51 -1.47 0.99 116.25 116.55 2ksy h VAL 161 Ca -0.01 -0.53 -0.07 0.00 -1.23 0.00 0.00 66.70 64.85 2ksy h VAL 161 Cb 0.86 0.91 -0.02 0.00 -2.13 0.00 0.00 31.29 30.92 2ksy h VAL 161 CO 0.05 0.19 -0.01 0.03 -1.23 0.00 0.00 177.57 176.60 2ksy h ARG 162 N 0.39 0.79 -0.17 5.19 2.47 -1.57 -0.55 114.38 120.92 2ksy h ARG 162 Ca 0.11 -0.26 -0.12 0.00 -1.26 0.00 0.00 59.98 58.46 2ksy h ARG 162 Cb 0.17 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.42 2ksy h ARG 162 CO -0.01 0.86 -0.35 -0.07 0.56 0.00 0.00 179.97 180.96 2ksy h LEU 163 N 0.63 0.61 -0.44 3.04 4.07 -1.38 -2.71 115.31 119.13 2ksy h LEU 163 Ca 0.12 -0.55 -0.13 0.00 0.08 0.00 0.00 57.88 57.41 2ksy h LEU 163 Cb 0.51 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.06 2ksy h LEU 163 CO 0.02 1.05 -0.22 0.08 -1.08 0.00 0.00 178.44 178.29 2ksy h ARG 164 N 0.19 0.93 -0.25 1.13 -0.00 -0.81 -1.41 114.38 114.16 2ksy h ARG 164 Ca 0.01 -0.41 0.02 0.00 -0.00 0.00 0.00 59.98 59.59 2ksy h ARG 164 Cb 0.95 -0.03 -0.02 0.00 -0.00 0.00 0.00 29.97 30.87 2ksy h ARG 164 CO 0.08 1.07 0.12 -0.91 -0.00 0.00 0.00 179.97 180.33 2ksy h ASN 165 N 0.77 0.18 -0.12 0.08 -0.26 -1.14 -0.53 115.58 114.55 2ksy h ASN 165 Ca 0.10 0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.84 2ksy h ASN 165 Cb 0.79 -0.02 -0.01 0.00 -1.06 0.00 0.00 38.32 38.02 2ksy h ASN 165 CO 0.07 0.14 0.04 0.25 -1.06 0.00 0.00 177.43 176.87 2ksy h LEU 166 N 0.26 0.18 0.22 1.61 6.46 -1.43 -2.71 115.31 119.90 2ksy h LEU 166 Ca 0.10 -0.19 0.00 0.00 -0.12 0.00 0.00 57.88 57.68 2ksy h LEU 166 Cb 0.03 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 39.89 2ksy h LEU 166 CO -0.07 0.32 -0.22 0.74 -0.62 0.00 0.00 178.44 178.59 2ksy h THR 167 N 0.03 0.53 -0.95 1.05 2.02 -1.07 -2.77 112.91 111.75 2ksy h THR 167 Ca 0.04 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.31 2ksy h THR 167 Cb 0.20 0.53 -0.07 0.00 -1.74 0.00 0.00 68.15 67.06 2ksy h THR 167 CO -0.00 0.00 0.59 1.62 0.37 0.00 0.00 175.52 178.10 2ksy h VAL 168 N -0.47 0.99 0.33 3.16 3.04 -1.13 0.93 116.25 123.11 2ksy h VAL 168 Ca -0.00 -0.35 -0.01 0.00 -1.01 0.00 0.00 66.70 65.33 2ksy h VAL 168 Cb 0.44 -0.11 -0.00 0.00 -2.01 0.00 0.00 31.29 29.60 2ksy h VAL 168 CO -0.05 0.18 -0.21 0.58 -1.01 0.00 0.00 177.57 177.06 2ksy h VAL 169 N 1.01 0.00 0.00 1.51 2.07 -1.22 0.13 116.25 119.75 2ksy h VAL 169 Ca 0.44 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.92 2ksy h VAL 169 Cb 0.31 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 2ksy h VAL 169 CO -0.22 0.00 -0.20 0.17 0.02 0.00 0.00 177.57 177.34 2ksy h LEU 170 N -0.51 0.00 -0.81 2.57 8.10 -1.43 -2.11 115.31 121.12 2ksy h LEU 170 Ca -0.04 0.00 -0.13 0.00 0.11 0.00 0.00 57.88 57.82 2ksy h LEU 170 Cb 0.41 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.61 2ksy h LEU 170 CO 0.04 0.20 -0.59 -0.50 -4.11 0.00 0.00 178.44 173.48 2ksy h TRP 171 N 0.00 0.03 0.00 0.17 4.06 -0.71 -2.54 115.95 116.96 2ksy h TRP 171 Ca -0.00 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.94 2ksy h TRP 171 Cb 0.41 -0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.57 2ksy h TRP 171 CO 0.00 0.60 0.00 0.00 -3.56 0.00 0.00 178.44 175.48 2ksy n ALA 172 N -2.43 2.04 0.11 1.49 0.00 0.02 -2.30 120.51 119.44 2ksy n ALA 172 Ca -0.01 -0.09 0.08 0.00 0.00 0.00 0.00 53.44 53.42 2ksy n ALA 172 Cb 0.59 -1.33 0.01 0.00 0.00 0.00 0.00 19.45 18.72 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 0.18 -0.29 0.00 1.08 -1.45 -3.37 117.51 113.65 2ksy h ILE 173 Ca 0.00 -1.31 0.05 0.00 -0.39 0.00 0.00 64.86 63.22 2ksy h ILE 173 Cb 0.23 1.78 -0.05 0.00 -3.07 0.00 0.00 36.82 35.71 2ksy h ILE 173 CO 0.00 0.10 -0.03 1.88 -0.69 0.00 0.00 178.15 179.41 2ksy h TYR 174 N 0.00 -0.08 -1.20 1.37 0.05 -1.55 -1.44 116.97 114.12 2ksy h TYR 174 Ca -0.03 0.02 0.35 0.00 0.05 0.00 0.00 58.73 59.12 2ksy h TYR 174 Cb 1.15 0.08 -0.05 0.00 1.01 0.00 0.00 36.73 38.93 2ksy h TYR 174 CO 0.00 -0.08 0.91 -1.35 -1.05 0.00 0.00 178.16 176.59 2ksy h PRO 175 N 0.05 0.00 0.08 4.88 0.11 -1.77 0.63 132.00 135.98 2ksy h PRO 175 Ca 0.14 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.13 2ksy h PRO 175 Cb 0.20 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.32 2ksy h PRO 175 CO -0.26 0.00 -0.53 0.74 -0.21 0.00 0.00 178.00 177.74 2ksy h PHE 176 N 0.00 0.32 -0.61 0.65 0.04 -1.52 -2.82 116.94 113.00 2ksy h PHE 176 Ca 0.57 -0.23 -0.07 0.00 2.80 0.00 0.00 57.97 61.05 2ksy h PHE 176 Cb 2.39 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 40.50 2ksy h PHE 176 CO 0.00 1.20 0.12 0.82 -0.60 0.00 0.00 178.31 179.85 2ksy h ILE 177 N -0.63 1.25 -0.11 -0.55 1.08 -0.61 0.12 117.51 118.06 2ksy h ILE 177 Ca -0.10 -0.94 -0.19 0.00 -0.39 0.00 0.00 64.86 63.25 2ksy h ILE 177 Cb 1.39 0.65 0.01 0.00 -3.07 0.00 0.00 36.82 35.80 2ksy h ILE 177 CO 0.08 0.35 -0.66 -0.25 -0.69 0.00 0.00 178.15 176.98 2ksy h TRP 178 N 0.92 0.87 -0.00 1.37 7.01 -1.27 0.30 115.95 125.15 2ksy h TRP 178 Ca 0.19 -0.40 -0.00 0.00 2.11 0.00 0.00 58.89 60.79 2ksy h TRP 178 Cb 0.37 -0.13 -0.00 0.00 -2.10 0.00 0.00 29.16 27.30 2ksy h TRP 178 CO 0.02 1.21 -0.00 1.25 -2.79 0.00 0.00 178.44 178.13 2ksy h LEU 179 N 0.29 0.01 0.03 0.65 7.12 -1.37 -0.42 115.31 121.62 2ksy h LEU 179 Ca -0.05 -0.31 -0.06 0.00 0.13 0.00 0.00 57.88 57.58 2ksy h LEU 179 Cb 1.31 -0.00 0.01 0.00 -0.53 0.00 0.00 40.66 41.44 2ksy h LEU 179 CO 0.14 0.32 -0.27 -0.07 -0.13 0.00 0.00 178.44 178.43 2ksy h LEU 180 N -0.31 0.18 -9.48 2.25 3.38 -0.86 0.60 115.31 111.08 2ksy h LEU 180 Ca 0.00 -0.90 -0.30 0.00 0.09 0.00 0.00 57.88 56.77 2ksy h LEU 180 Cb 0.31 -0.06 0.17 0.00 0.09 0.00 0.00 40.66 41.18 2ksy h LEU 180 CO 0.00 1.06 -0.27 0.61 0.09 0.00 0.00 178.44 179.93 2ksy n GLY 181 N 1.38 -2.99 0.29 0.83 0.00 0.10 -0.27 105.19 104.53 2ksy n GLY 181 Ca -0.11 -1.17 0.09 0.00 0.00 0.00 0.00 46.02 44.83 2ksy n GLY 181 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ksy h PRO 182 N -3.02 0.27 0.00 1.61 0.11 -1.84 0.49 132.00 129.63 2ksy h PRO 182 Ca -0.34 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2ksy h PRO 182 Cb 1.05 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2ksy h PRO 182 CO 0.22 0.18 0.18 -2.30 -0.21 0.00 0.00 178.00 176.07 2ksy n PRO 183 N -5.15 0.08 0.00 1.05 -0.02 -1.26 -4.12 135.00 125.58 2ksy n PRO 183 Ca 0.17 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2ksy n PRO 183 Cb 0.54 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 2ksy n PRO 183 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ksy n GLY 184 N -1.30 0.81 0.31 -1.23 0.00 0.01 -4.47 105.19 99.32 2ksy n GLY 184 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.09 2ksy n GLY 184 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2ksy n VAL 185 N 0.00 0.00 -2.92 1.61 0.24 0.20 -5.00 118.33 112.46 2ksy n VAL 185 Ca 0.00 -0.31 -0.07 0.00 -2.04 0.00 0.00 64.34 61.92 2ksy n VAL 185 Cb 0.00 1.16 0.01 0.00 -1.47 0.00 0.00 33.84 33.54 2ksy n VAL 185 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ksy n ALA 186 N -0.28 -3.00 -0.11 2.33 0.00 0.27 -4.94 120.51 114.77 2ksy n ALA 186 Ca 0.06 0.66 -0.24 0.00 0.00 0.00 0.00 53.44 53.92 2ksy n ALA 186 Cb 0.32 -2.06 -0.11 0.00 0.00 0.00 0.00 19.45 17.60 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 0.33 1.92 0.00 0.00 4.77 0.63 -4.90 117.00 119.76 2ksy n LEU 187 Ca 0.03 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 2ksy n LEU 187 Cb 0.30 -0.94 0.00 0.00 -2.33 0.00 0.00 43.42 40.45 2ksy n LEU 187 CO 0.41 0.37 0.00 0.18 -1.33 0.00 0.00 177.39 177.03 2ksy n LEU 188 N -4.34 0.00 -4.90 2.23 4.77 -1.26 -5.10 117.00 108.39 2ksy n LEU 188 Ca -0.37 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.28 2ksy n LEU 188 Cb 0.75 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.79 2ksy n LEU 188 CO 0.16 -0.05 -0.15 0.28 -1.33 0.00 0.00 177.39 176.31 2ksy s THR 189 N 1.56 5.42 0.28 -5.08 -1.32 -1.26 -4.83 115.64 110.42 2ksy s THR 189 Ca 0.00 -0.16 0.02 0.00 -1.21 0.00 0.00 61.69 60.34 2ksy s THR 189 Cb 0.00 -3.55 0.29 0.00 -1.51 0.00 0.00 72.50 67.73 2ksy s THR 189 CO 0.00 0.30 1.67 -0.65 -2.21 0.00 0.00 174.62 173.73 2ksy h PRO 190 N 3.73 0.27 -0.69 7.08 0.11 -1.99 -0.29 132.00 140.23 2ksy h PRO 190 Ca -0.48 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.64 2ksy h PRO 190 Cb 1.18 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 2ksy h PRO 190 CO 0.70 0.18 0.43 0.00 -0.21 0.00 0.00 178.00 179.09 2ksy h THR 191 N 0.27 1.10 0.03 -1.15 1.03 -1.99 -0.12 112.91 112.09 2ksy h THR 191 Ca 0.54 -0.29 -0.00 0.00 -0.01 0.00 0.00 66.41 66.64 2ksy h THR 191 Cb 1.05 0.18 0.00 0.00 -1.07 0.00 0.00 68.15 68.30 2ksy h THR 191 CO -0.60 0.16 -0.01 0.58 -0.01 0.00 0.00 175.52 175.64 2ksy h VAL 192 N 0.85 1.37 -0.60 0.00 2.07 -1.52 -2.34 116.25 116.08 2ksy h VAL 192 Ca 0.27 -1.33 0.08 0.00 0.82 0.00 0.00 66.70 66.54 2ksy h VAL 192 Cb -0.00 2.24 -0.06 0.00 -1.52 0.00 0.00 31.29 31.95 2ksy h VAL 192 CO -0.10 0.33 0.27 -0.78 0.02 0.00 0.00 177.57 177.31 2ksy h ASP 193 N -0.63 0.33 -0.31 0.57 3.58 -1.07 -1.15 116.42 117.74 2ksy h ASP 193 Ca -0.00 0.06 -0.06 0.00 0.42 0.00 0.00 57.03 57.45 2ksy h ASP 193 Cb 0.58 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.61 2ksy h ASP 193 CO 0.01 0.21 0.01 0.58 -2.88 0.00 0.00 179.24 177.17 2ksy h VAL 194 N 0.49 1.22 -0.27 2.25 2.07 -1.08 -2.11 116.25 118.82 2ksy h VAL 194 Ca 0.29 -0.86 0.04 0.00 0.82 0.00 0.00 66.70 66.98 2ksy h VAL 194 Cb 0.29 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 2ksy h VAL 194 CO -0.25 0.30 0.06 0.00 0.02 0.00 0.00 177.57 177.70 2ksy h ALA 195 N 1.41 0.28 -0.47 1.67 0.00 -0.64 0.15 119.26 121.65 2ksy h ALA 195 Ca 0.13 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 2ksy h ALA 195 Cb 0.36 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2ksy h ALA 195 CO 0.01 -0.35 -0.15 -0.07 0.00 0.00 0.00 179.25 178.68 2ksy h LEU 196 N 0.16 0.96 0.78 0.00 3.38 -1.31 -1.66 115.31 117.63 2ksy h LEU 196 Ca 0.12 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 2ksy h LEU 196 Cb 0.12 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 2ksy h LEU 196 CO -0.16 1.12 -0.49 0.40 0.09 0.00 0.00 178.44 179.40 2ksy h ILE 197 N 0.79 0.00 -0.88 1.22 1.08 -0.97 0.31 117.51 119.06 2ksy h ILE 197 Ca 0.12 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 64.79 2ksy h ILE 197 Cb 0.72 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.41 2ksy h ILE 197 CO 0.05 0.00 0.59 0.58 -0.69 0.00 0.00 178.15 178.69 2ksy h VAL 198 N -1.19 0.66 -0.34 1.67 2.07 -0.76 0.28 116.25 118.65 2ksy h VAL 198 Ca -0.10 -0.11 -0.14 0.00 0.82 0.00 0.00 66.70 67.16 2ksy h VAL 198 Cb 0.96 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2ksy h VAL 198 CO 0.10 0.06 -0.36 0.22 0.02 0.00 0.00 177.57 177.61 2ksy h TYR 199 N 0.33 0.91 -0.37 1.57 3.20 -0.47 -1.15 116.97 120.99 2ksy h TYR 199 Ca 0.45 -0.26 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 2ksy h TYR 199 Cb 1.24 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.29 2ksy h TYR 199 CO -0.00 1.02 0.18 -0.07 -1.64 0.00 0.00 178.16 177.64 2ksy h LEU 200 N 0.64 0.48 -0.20 2.82 3.38 0.32 -1.49 115.31 121.27 2ksy h LEU 200 Ca 0.06 -0.12 -0.12 0.00 0.09 0.00 0.00 57.88 57.79 2ksy h LEU 200 Cb 0.90 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 2ksy h LEU 200 CO 0.08 0.47 -0.33 0.44 0.09 0.00 0.00 178.44 179.19 2ksy h ASP 201 N 0.46 0.63 -0.03 -0.43 3.32 -1.35 -2.55 116.42 116.47 2ksy h ASP 201 Ca 0.13 -0.53 0.00 0.00 0.02 0.00 0.00 57.03 56.65 2ksy h ASP 201 Cb 0.12 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 2ksy h ASP 201 CO -0.02 1.05 0.02 0.25 -1.72 0.00 0.00 179.24 178.82 2ksy h LEU 202 N 0.24 0.03 0.17 1.55 6.46 -1.12 -2.52 115.31 120.11 2ksy h LEU 202 Ca 0.01 -0.00 -0.30 0.00 -0.12 0.00 0.00 57.88 57.47 2ksy h LEU 202 Cb 0.92 -0.01 0.01 0.00 -0.73 0.00 0.00 40.66 40.86 2ksy h LEU 202 CO 0.08 0.02 -1.41 0.58 -0.62 0.00 0.00 178.44 177.08 2ksy h VAL 203 N 0.03 1.32 0.00 1.05 2.07 -1.20 -2.47 116.25 117.05 2ksy h VAL 203 Ca 0.01 -2.86 0.00 0.00 0.82 0.00 0.00 66.70 64.67 2ksy h VAL 203 Cb 0.01 2.92 0.00 0.00 -1.52 0.00 0.00 31.29 32.69 2ksy h VAL 203 CO -0.00 0.85 0.00 0.41 0.02 0.00 0.00 177.57 178.85 2ksy n THR 204 N -3.57 0.00 0.00 2.57 -1.04 -0.95 0.39 114.28 111.68 2ksy n THR 204 Ca -0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.87 2ksy n THR 204 Cb 1.06 -0.76 0.00 0.00 -1.82 0.00 0.00 70.33 68.81 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 -0.82 0.00 0.39 12.58 0.31 -0.93 -2.29 118.33 127.58 2ksy n VAL 206 Ca 0.02 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.19 2ksy n VAL 206 Cb 0.01 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 32.86 2ksy n VAL 206 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2ksy h GLY 207 N 0.00 -1.07 2.00 2.92 0.00 -0.15 -1.16 103.07 105.61 2ksy h GLY 207 Ca 0.00 0.40 -0.04 0.00 0.00 0.00 0.00 47.33 47.69 2ksy h GLY 207 CO 0.00 -0.39 -0.18 0.27 0.00 0.00 0.00 176.54 176.24 2ksy h PHE 208 N -1.21 0.00 -0.11 5.60 -0.00 -1.44 -1.68 116.94 118.10 2ksy h PHE 208 Ca -0.10 0.00 -0.11 0.00 -0.00 0.00 0.00 57.97 57.75 2ksy h PHE 208 Cb 0.79 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.72 2ksy h PHE 208 CO 0.01 0.18 -0.44 0.78 -0.00 0.00 0.00 178.31 178.85 2ksy h GLY 209 N 0.87 0.28 0.43 6.09 0.00 -1.72 1.04 103.07 110.06 2ksy h GLY 209 Ca -0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 2ksy h GLY 209 CO 0.02 0.25 -0.16 0.74 0.00 0.00 0.00 176.54 177.40 2ksy h PHE 210 N 0.22 0.19 0.00 5.60 0.04 -0.38 -1.76 116.94 120.84 2ksy h PHE 210 Ca 0.02 -0.09 -0.02 0.00 2.80 0.00 0.00 57.97 60.68 2ksy h PHE 210 Cb 0.86 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.98 2ksy h PHE 210 CO 0.02 0.84 -0.09 0.82 -0.60 0.00 0.00 178.31 179.30 2ksy h ILE 211 N -0.52 0.93 -0.75 -0.55 2.04 -1.27 -0.83 117.51 116.55 2ksy h ILE 211 Ca -0.02 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 2ksy h ILE 211 Cb 0.87 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 38.09 2ksy h ILE 211 CO 0.03 0.09 0.35 0.00 0.00 0.00 0.00 178.15 178.62 2ksy h ALA 212 N 1.91 0.97 -0.12 1.87 0.00 0.14 -2.62 119.26 121.42 2ksy h ALA 212 Ca -0.00 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 2ksy h ALA 212 Cb 0.17 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2ksy h ALA 212 CO 0.01 0.55 -0.15 -0.07 0.00 0.00 0.00 179.25 179.59 2ksy h LEU 213 N 1.06 0.33 -0.17 0.00 3.38 -0.28 -2.72 115.31 116.92 2ksy h LEU 213 Ca 0.26 -0.51 0.05 0.00 0.09 0.00 0.00 57.88 57.77 2ksy h LEU 213 Cb 0.14 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 40.73 2ksy h LEU 213 CO -0.03 0.77 -0.32 -0.78 0.09 0.00 0.00 178.44 178.17 2ksy h ASP 214 N -0.10 -0.99 0.20 -0.43 1.82 -1.21 0.37 116.42 116.07 2ksy h ASP 214 Ca 0.01 0.15 -0.00 0.00 -0.39 0.00 0.00 57.03 56.80 2ksy h ASP 214 Cb 0.69 0.43 -0.01 0.00 0.68 0.00 0.00 39.33 41.12 2ksy h ASP 214 CO 0.03 -0.35 -0.15 0.00 -1.61 0.00 0.00 179.24 177.16 2ksy h ALA 215 N 0.48 -0.34 -0.40 -0.78 0.00 -1.55 -2.39 119.26 114.28 2ksy h ALA 215 Ca 0.11 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2ksy h ALA 215 Cb 0.54 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2ksy h ALA 215 CO -0.37 -0.70 0.27 0.00 0.00 0.00 0.00 179.25 178.44 2ksy h ALA 216 N 0.42 1.85 -0.46 0.00 0.00 -1.14 -1.01 119.26 118.92 2ksy h ALA 216 Ca -0.01 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2ksy h ALA 216 Cb 0.32 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2ksy h ALA 216 CO -0.01 0.10 0.06 0.00 0.00 0.00 0.00 179.25 179.41 2ksy h ALA 217 N 1.77 1.25 -0.21 0.00 0.00 0.21 -2.01 119.26 120.26 2ksy h ALA 217 Ca 0.16 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.67 2ksy h ALA 217 Cb 0.13 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2ksy h ALA 217 CO -0.04 0.51 -0.63 1.15 0.00 0.00 0.00 179.25 180.24 2ksy h THR 218 N 0.69 1.29 -0.28 0.00 2.02 -0.76 -0.96 112.91 114.91 2ksy h THR 218 Ca 0.15 -1.85 -0.05 0.00 0.77 0.00 0.00 66.41 65.43 2ksy h THR 218 Cb 0.33 1.80 -0.02 0.00 -1.74 0.00 0.00 68.15 68.52 2ksy h THR 218 CO 0.01 0.59 -0.03 -0.07 0.37 0.00 0.00 175.52 176.39 2ksy h LEU 219 N 0.56 0.41 0.00 2.58 3.38 -1.03 -1.48 115.31 119.73 2ksy h LEU 219 Ca -0.01 -0.07 -0.24 0.00 0.09 0.00 0.00 57.88 57.64 2ksy h LEU 219 Cb 1.23 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 2ksy h LEU 219 CO 0.13 0.49 -1.26 0.03 0.09 0.00 0.00 178.44 177.92 2ksy h ARG 220 N 0.42 0.01 0.00 1.13 3.08 -1.32 -2.75 114.38 114.95 2ksy h ARG 220 Ca 0.09 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 2ksy h ARG 220 Cb 0.32 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 2ksy h ARG 220 CO 0.01 0.83 -0.25 0.00 -1.07 0.00 0.00 179.97 179.50 2ksy h ALA 221 N 0.98 1.00 0.00 0.04 0.00 -0.78 -3.02 119.26 117.48 2ksy h ALA 221 Ca -0.11 -0.22 -0.21 0.00 0.00 0.00 0.00 54.91 54.37 2ksy h ALA 221 Cb 1.86 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.58 2ksy h ALA 221 CO 0.11 0.31 -1.64 -0.85 0.00 0.00 0.00 179.25 177.18 2ksy n GLU 222 N -3.38 0.63 -0.82 0.00 0.28 -0.59 -5.07 120.64 111.69 2ksy n GLU 222 Ca 0.00 0.17 0.11 0.00 -0.16 0.00 0.00 57.16 57.29 2ksy n GLU 222 Cb 0.46 -1.74 -0.03 0.00 1.43 0.00 0.00 31.44 31.55 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 -2.85 -2.89 -3.64 -1.84 8.25 -1.04 -4.96 115.22 106.24 2ksy n HIS 223 Ca -0.14 1.02 -0.06 0.00 -0.26 0.00 0.00 57.72 58.28 2ksy n HIS 223 Cb 0.90 -1.79 -0.07 0.00 1.12 0.00 0.00 29.99 30.16 2ksy n HIS 223 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2ksy s GLY 224 N -6.22 -0.65 -0.16 -1.41 0.00 -1.26 -4.96 107.32 92.67 2ksy s GLY 224 Ca 0.00 2.42 -0.11 0.00 0.00 0.00 0.00 44.72 47.03 2ksy s GLY 224 CO 0.00 2.47 0.22 1.18 0.00 0.00 0.00 173.10 176.97 2ksy n GLU 225 N 4.42 -4.76 -3.75 2.90 1.02 -1.26 -5.01 120.64 114.20 2ksy n GLU 225 Ca -0.19 3.56 -0.32 0.00 -0.02 0.00 0.00 57.16 60.19 2ksy n GLU 225 Cb 0.58 -5.07 -0.05 0.00 -0.02 0.00 0.00 31.44 26.89 2ksy n GLU 225 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2ksy s SER 226 N -0.66 6.45 0.02 1.62 0.01 -1.26 -5.06 113.70 114.82 2ksy s SER 226 Ca -0.26 0.50 -0.30 0.00 1.31 0.00 0.00 55.95 57.20 2ksy s SER 226 Cb 0.02 -2.05 -0.05 0.00 0.21 0.00 0.00 66.02 64.14 2ksy s SER 226 CO 0.69 0.10 1.25 -0.76 0.41 0.00 0.00 173.24 174.93 2ksy s LEU 227 N -2.56 4.33 -0.19 2.44 1.43 -1.26 -4.92 118.68 117.96 2ksy s LEU 227 Ca 0.38 1.99 -0.02 0.00 -1.03 0.00 0.00 54.13 55.45 2ksy s LEU 227 Cb -0.12 -3.57 -0.11 0.00 0.03 0.00 0.00 46.19 42.42 2ksy s LEU 227 CO 0.25 -0.57 -0.19 0.00 0.23 0.00 0.00 176.35 176.07 2ksy n ALA 228 N 4.63 1.64 0.00 4.21 0.00 -1.26 -5.12 120.51 124.61 2ksy n ALA 228 Ca 0.11 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.76 2ksy n ALA 228 Cb 0.45 0.13 0.00 0.00 0.00 0.00 0.00 19.45 20.03 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 2.34 -0.36 3.76 0.00 0.00 -1.26 -5.13 105.19 104.54 2ksy n GLY 229 Ca -0.35 0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 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 3.28 -0.59 1.61 1.01 -1.26 -4.98 120.40 119.48 2ksy s VAL 230 Ca 0.00 1.26 -0.26 0.00 0.00 0.00 0.00 61.98 62.98 2ksy s VAL 230 Cb 0.00 -3.78 0.04 0.00 0.00 0.00 0.00 36.38 32.63 2ksy s VAL 230 CO 0.00 0.27 1.06 1.51 0.00 0.00 0.00 175.10 177.94 2ksy s ASP 231 N -0.85 6.34 -0.03 3.32 -4.77 -1.26 -4.78 116.67 114.65 2ksy s ASP 231 Ca 0.47 -0.26 0.04 0.00 -3.30 0.00 0.00 52.55 49.50 2ksy s ASP 231 Cb -0.33 -2.49 0.06 0.00 -1.09 0.00 0.00 42.92 39.07 2ksy s ASP 231 CO 0.43 -1.40 0.89 0.35 0.70 0.00 0.00 175.17 176.14 2ksy n THR 232 N 6.35 0.57 1.99 2.11 -2.24 -1.26 -4.75 114.28 117.05 2ksy n THR 232 Ca 0.04 -0.65 0.12 0.00 -2.27 0.00 0.00 64.05 61.28 2ksy n THR 232 Cb 0.48 0.49 0.69 0.00 -2.10 0.00 0.00 70.33 69.89 2ksy n THR 232 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2ksy n ASP 233 N -0.39 0.00 -4.54 3.42 5.68 -1.26 -4.79 116.55 114.67 2ksy n ASP 233 Ca 0.03 -1.27 -0.29 0.00 -0.50 0.00 0.00 54.79 52.76 2ksy n ASP 233 Cb 0.55 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.42 2ksy n ASP 233 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2ksy s THR 234 N -2.00 3.14 -0.04 2.12 -4.23 -1.26 -5.07 115.64 108.30 2ksy s THR 234 Ca 0.35 -1.42 -0.20 0.00 -1.18 0.00 0.00 61.69 59.24 2ksy s THR 234 Cb 0.16 -2.47 -0.15 0.00 1.34 0.00 0.00 72.50 71.38 2ksy s THR 234 CO 0.27 0.07 0.86 1.55 -0.54 0.00 0.00 174.62 176.84 2ksy h PRO 235 N 3.55 -0.27 -7.58 3.99 0.13 -2.00 -3.46 132.00 126.35 2ksy h PRO 235 Ca -0.49 0.02 -0.46 0.00 -0.87 0.00 0.00 66.00 64.20 2ksy h PRO 235 Cb 1.17 0.06 0.12 0.00 0.13 0.00 0.00 31.00 32.48 2ksy h PRO 235 CO 0.50 0.10 0.35 0.00 -0.23 0.00 0.00 178.00 178.73 2ksy s ALA 236 N -3.84 2.70 -0.05 -0.56 0.00 -1.26 -5.11 121.76 113.64 2ksy s ALA 236 Ca -0.12 -0.99 -0.05 0.00 0.00 0.00 0.00 51.96 50.80 2ksy s ALA 236 Cb 0.01 -2.74 0.01 0.00 0.00 0.00 0.00 23.12 20.40 2ksy s ALA 236 CO 0.44 -1.85 0.14 0.54 0.00 0.00 0.00 175.76 175.03 2ksy s VAL 237 N -3.58 0.01 0.28 0.00 0.11 -1.26 -5.08 120.40 110.88 2ksy s VAL 237 Ca 0.66 -0.08 0.10 0.00 -2.93 0.00 0.00 61.98 59.73 2ksy s VAL 237 Cb -0.08 -0.24 -0.05 0.00 -1.53 0.00 0.00 36.38 34.49 2ksy s VAL 237 CO 0.49 -0.05 -0.08 0.00 -3.33 0.00 0.00 175.10 172.13 2ksy s ALA 238 N -0.09 3.00 0.43 1.54 0.00 -1.26 -5.14 121.76 120.23 2ksy s ALA 238 Ca -0.02 -1.80 0.01 0.00 0.00 0.00 0.00 51.96 50.16 2ksy s ALA 238 Cb -0.02 -0.50 -0.01 0.00 0.00 0.00 0.00 23.12 22.60 2ksy s ALA 238 CO 0.00 0.24 0.64 -0.51 0.00 0.00 0.00 175.76 176.13 2ksy s ASP 239 N -3.61 5.90 0.00 0.00 1.11 -1.26 -5.00 116.67 113.80 2ksy s ASP 239 Ca 0.31 0.26 0.00 0.00 0.18 0.00 0.00 52.55 53.30 2ksy s ASP 239 Cb -0.05 -1.56 0.00 0.00 1.07 0.00 0.00 42.92 42.39 2ksy s ASP 239 CO 0.18 -0.63 0.05 0.00 1.18 0.00 0.00 175.17 175.95 2ksy n LEU 240 N -2.01 0.00 -4.08 1.23 -0.00 -1.26 -5.10 117.00 105.79 2ksy n LEU 240 Ca 0.01 -0.16 -0.27 0.00 -0.00 0.00 0.00 56.01 55.59 2ksy n LEU 240 Cb 0.58 0.00 -0.17 0.00 -0.00 0.00 0.00 43.42 43.83 2ksy n LEU 240 CO 0.47 0.27 -0.49 -1.61 -0.00 0.00 0.00 177.39 176.03 2ksy s GLU 241 N 0.00 2.09 0.74 1.47 2.02 -1.26 -5.14 118.70 118.62 2ksy s GLU 241 Ca 0.00 -0.55 -0.07 0.00 0.02 0.00 0.00 54.97 54.37 2ksy s GLU 241 Cb 0.00 -1.68 0.08 0.00 0.10 0.00 0.00 34.13 32.64 2ksy s GLU 241 CO 0.00 0.06 1.05 -1.01 0.02 0.00 0.00 175.26 175.38 2ksy s HIS 242 N 0.61 2.62 -0.00 1.61 3.76 -1.26 -4.87 115.29 117.76 2ksy s HIS 242 Ca -0.15 0.35 -0.01 0.00 -0.15 0.00 0.00 55.06 55.10 2ksy s HIS 242 Cb -0.16 -3.28 0.00 0.00 1.11 0.00 0.00 32.58 30.25 2ksy s HIS 242 CO 0.05 -1.59 0.02 0.72 -0.85 0.00 0.00 174.74 173.09 2ksy n HIS 243 N -3.01 -4.39 0.05 1.40 8.25 -1.26 -4.97 115.22 111.30 2ksy n HIS 243 Ca 0.10 2.61 0.02 0.00 -0.26 0.00 0.00 57.72 60.18 2ksy n HIS 243 Cb 0.60 -3.69 0.04 0.00 1.12 0.00 0.00 29.99 28.06 2ksy n HIS 243 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2ksy n HIS 244 N 1.66 0.10 -2.47 4.41 -0.00 -1.26 -5.07 115.22 112.59 2ksy n HIS 244 Ca -0.04 -0.26 -0.04 0.00 -0.00 0.00 0.00 57.72 57.37 2ksy n HIS 244 Cb 0.06 -0.02 -0.04 0.00 -0.00 0.00 0.00 29.99 29.99 2ksy n HIS 244 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2ksy n HIS 245 N 0.09 -4.32 -4.05 4.41 8.25 -1.26 -5.09 115.22 113.25 2ksy n HIS 245 Ca 0.04 2.53 -0.14 0.00 -0.26 0.00 0.00 57.72 59.89 2ksy n HIS 245 Cb 0.23 -3.79 -0.04 0.00 1.12 0.00 0.00 29.99 27.51 2ksy n HIS 245 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2ksy n HIS 246 N 1.63 -1.22 1.66 4.41 1.44 -1.26 -5.34 115.22 116.54 2ksy n HIS 246 Ca -0.33 -2.17 0.15 0.00 -2.01 0.00 0.00 57.72 53.36 2ksy n HIS 246 Cb 0.50 0.45 0.66 0.00 0.12 0.00 0.00 29.99 31.72 2ksy n HIS 246 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11