#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 0.00-12.43 0.00 1.12 0.31 -1.26 -4.98 118.33 101.09 2ksy n VAL 2 Ca 0.00 2.73 0.00 0.00 -0.01 0.00 0.00 64.34 67.06 2ksy n VAL 2 Cb 0.00 -6.27 0.00 0.00 -0.91 0.00 0.00 33.84 26.66 2ksy n VAL 2 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ksy n GLY 3 N 1.80 0.02 0.17 2.92 0.00 -1.26 -4.97 105.19 103.86 2ksy n GLY 3 Ca -0.34 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.57 2ksy n GLY 3 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ksy h LEU 4 N 0.00 0.50 -1.12 0.99 3.38 -1.98 -3.23 115.31 113.84 2ksy h LEU 4 Ca 0.00 -0.34 0.13 0.00 0.09 0.00 0.00 57.88 57.75 2ksy h LEU 4 Cb 0.00 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.52 2ksy h LEU 4 CO 0.00 1.10 0.61 0.71 0.09 0.00 0.00 178.44 180.95 2ksy h THR 5 N 0.27 0.89 -0.79 0.22 1.35 -1.88 -1.15 112.91 111.83 2ksy h THR 5 Ca -0.04 -0.30 0.13 0.00 -0.55 0.00 0.00 66.41 65.65 2ksy h THR 5 Cb 1.37 -0.06 -0.06 0.00 -1.73 0.00 0.00 68.15 67.67 2ksy h THR 5 CO 0.13 0.16 0.52 0.71 -0.25 0.00 0.00 175.52 176.79 2ksy h THR 6 N 0.87 0.85 0.33 6.82 1.35 -1.88 -1.37 112.91 119.88 2ksy h THR 6 Ca 0.48 -0.19 -0.02 0.00 -0.55 0.00 0.00 66.41 66.13 2ksy h THR 6 Cb 0.57 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 67.24 2ksy h THR 6 CO -0.24 0.10 -0.16 -0.07 -0.25 0.00 0.00 175.52 174.90 2ksy h LEU 7 N 0.56 -0.38 -1.20 3.87 -0.00 -1.37 -1.03 115.31 115.75 2ksy h LEU 7 Ca 0.38 0.01 -0.05 0.00 -0.00 0.00 0.00 57.88 58.22 2ksy h LEU 7 Cb 0.70 0.10 -0.02 0.00 -0.00 0.00 0.00 40.66 41.44 2ksy h LEU 7 CO -0.14 -0.27 -0.01 -0.26 -0.00 0.00 0.00 178.44 177.76 2ksy h PHE 8 N -0.46 0.55 -0.33 1.13 0.04 -1.47 -1.74 116.94 114.66 2ksy h PHE 8 Ca -0.05 -0.06 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 2ksy h PHE 8 Cb 0.35 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.32 2ksy h PHE 8 CO -0.05 0.55 0.16 -1.49 -0.60 0.00 0.00 178.31 176.88 2ksy h TRP 9 N 0.51 0.47 -0.48 -0.55 -0.00 -1.00 -0.02 115.95 114.88 2ksy h TRP 9 Ca 0.11 -0.02 -0.04 0.00 -0.00 0.00 0.00 58.89 58.93 2ksy h TRP 9 Cb 0.35 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.16 29.34 2ksy h TRP 9 CO 0.01 0.41 0.13 -0.07 -0.00 0.00 0.00 178.44 178.93 2ksy h LEU 10 N 0.40 0.65 -1.09 -4.49 3.38 -0.85 -1.80 115.31 111.50 2ksy h LEU 10 Ca 0.11 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 2ksy h LEU 10 Cb 0.12 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2ksy h LEU 10 CO -0.01 0.64 -0.43 1.23 0.09 0.00 0.00 178.44 179.96 2ksy h GLY 11 N 0.89 0.00 1.93 0.83 0.00 -0.76 -2.69 103.07 103.28 2ksy h GLY 11 Ca 0.16 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.34 2ksy h GLY 11 CO -0.01 0.00 -0.70 0.00 0.00 0.00 0.00 176.54 175.84 2ksy h ALA 12 N 1.57 0.82 0.26 3.60 0.00 -0.18 -1.79 119.26 123.53 2ksy h ALA 12 Ca -0.00 -0.62 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 2ksy h ALA 12 Cb 0.81 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2ksy h ALA 12 CO 0.06 0.84 -0.12 0.82 0.00 0.00 0.00 179.25 180.85 2ksy h ILE 13 N 0.04 0.76 -0.68 0.00 1.08 -1.11 -1.09 117.51 116.50 2ksy h ILE 13 Ca -0.01 -0.74 -0.01 0.00 -0.39 0.00 0.00 64.86 63.70 2ksy h ILE 13 Cb 1.23 1.14 -0.03 0.00 -3.07 0.00 0.00 36.82 36.09 2ksy h ILE 13 CO 0.10 0.15 0.36 1.23 -0.69 0.00 0.00 178.15 179.29 2ksy h GLY 14 N -0.76 1.01 0.95 5.37 0.00 -1.54 -2.43 103.07 105.66 2ksy h GLY 14 Ca -0.04 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 46.82 2ksy h GLY 14 CO 0.06 0.43 0.16 1.98 0.00 0.00 0.00 176.54 179.16 2ksy h MET 15 N 0.95 0.67 -0.85 4.80 1.85 -1.32 -2.60 114.93 118.43 2ksy h MET 15 Ca 0.24 -0.13 0.10 0.00 -0.61 0.00 0.00 59.70 59.30 2ksy h MET 15 Cb 0.04 -0.10 -0.08 0.00 0.43 0.00 0.00 31.60 31.89 2ksy h MET 15 CO -0.04 0.63 0.49 1.25 -0.40 0.00 0.00 176.91 178.84 2ksy h LEU 16 N 0.57 0.69 -0.57 3.39 7.12 -0.73 0.23 115.31 126.00 2ksy h LEU 16 Ca 0.14 0.05 0.02 0.00 0.13 0.00 0.00 57.88 58.23 2ksy h LEU 16 Cb 0.23 -0.08 -0.04 0.00 -0.53 0.00 0.00 40.66 40.24 2ksy h LEU 16 CO -0.01 0.38 0.36 0.58 -0.13 0.00 0.00 178.44 179.62 2ksy h VAL 17 N 0.80 1.08 -0.70 1.05 2.07 -1.10 -2.21 116.25 117.24 2ksy h VAL 17 Ca 0.42 -0.24 -0.06 0.00 0.82 0.00 0.00 66.70 67.63 2ksy h VAL 17 Cb 0.41 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 2ksy h VAL 17 CO -0.26 0.13 0.18 1.23 0.02 0.00 0.00 177.57 178.87 2ksy h GLY 18 N 0.71 1.19 0.35 2.17 0.00 -0.85 -1.46 103.07 105.17 2ksy h GLY 18 Ca 0.23 -0.74 0.08 0.00 0.00 0.00 0.00 47.33 46.90 2ksy h GLY 18 CO -0.09 0.69 0.05 -0.84 0.00 0.00 0.00 176.54 176.35 2ksy h THR 19 N 1.04 0.70 -0.16 4.70 2.02 -0.42 -1.65 112.91 119.14 2ksy h THR 19 Ca 0.22 -0.06 -0.17 0.00 0.77 0.00 0.00 66.41 67.17 2ksy h THR 19 Cb 0.35 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2ksy h THR 19 CO 0.00 0.03 -0.59 -0.07 0.37 0.00 0.00 175.52 175.26 2ksy h LEU 20 N 0.17 0.60 -1.21 2.58 3.38 -1.30 -0.64 115.31 118.89 2ksy h LEU 20 Ca 0.22 -0.34 0.05 0.00 0.09 0.00 0.00 57.88 57.91 2ksy h LEU 20 Cb 0.31 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 2ksy h LEU 20 CO -0.33 1.06 0.55 0.00 0.09 0.00 0.00 178.44 179.81 2ksy h ALA 21 N 0.95 1.52 0.00 1.53 0.00 -0.47 0.04 119.26 122.83 2ksy h ALA 21 Ca -0.00 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.63 2ksy h ALA 21 Cb 1.15 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 2ksy h ALA 21 CO 0.11 0.37 -1.64 1.19 0.00 0.00 0.00 179.25 179.28 2ksy n PHE 22 N -4.47 0.92 0.01 0.00 3.72 -0.70 -3.38 117.46 113.56 2ksy n PHE 22 Ca 0.12 0.32 -0.13 0.00 -0.05 0.00 0.00 57.45 57.71 2ksy n PHE 22 Cb 0.16 -1.13 -0.10 0.00 -0.94 0.00 0.00 39.48 37.47 2ksy n PHE 22 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2ksy h ALA 23 N 1.18 -0.06 -0.42 4.37 0.00 -0.75 0.24 119.26 123.83 2ksy h ALA 23 Ca -0.25 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 2ksy h ALA 23 Cb 1.85 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.64 2ksy h ALA 23 CO 0.06 -0.29 0.00 2.35 0.00 0.00 0.00 179.25 181.38 2ksy h TRP 24 N -0.55 0.80 0.00 0.00 2.91 -1.19 -2.03 115.95 115.90 2ksy h TRP 24 Ca -0.01 -0.14 -0.10 0.00 1.13 0.00 0.00 58.89 59.78 2ksy h TRP 24 Cb 0.49 -0.21 -0.01 0.00 -0.51 0.00 0.00 29.16 28.92 2ksy h TRP 24 CO 0.09 0.80 -0.48 0.00 -1.03 0.00 0.00 178.44 177.82 2ksy h ALA 25 N 0.89 0.90 -0.23 2.65 0.00 -1.63 -3.21 119.26 118.64 2ksy h ALA 25 Ca 0.12 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 2ksy h ALA 25 Cb 0.48 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2ksy h ALA 25 CO 0.02 0.60 -0.21 0.78 0.00 0.00 0.00 179.25 180.44 2ksy h GLY 26 N 2.28 0.59 1.77 0.00 0.00 -0.28 -2.94 103.07 104.49 2ksy h GLY 26 Ca -0.00 -0.60 0.03 0.00 0.00 0.00 0.00 47.33 46.76 2ksy h GLY 26 CO 0.06 0.54 0.09 3.21 0.00 0.00 0.00 176.54 180.44 2ksy h ARG 27 N 0.24 0.00 -3.84 4.80 2.47 -1.38 -3.31 114.38 113.36 2ksy h ARG 27 Ca 0.04 0.00 -0.75 0.00 -1.26 0.00 0.00 59.98 58.01 2ksy h ARG 27 Cb 0.75 0.00 -0.30 0.00 -1.65 0.00 0.00 29.97 28.78 2ksy h ARG 27 CO 0.05 0.00 -0.16 0.34 0.56 0.00 0.00 179.97 180.76 2ksy s ASP 28 N -6.37 6.03 0.00 7.04 2.15 -1.11 -5.00 116.67 119.41 2ksy s ASP 28 Ca -0.05 -2.57 0.00 0.00 0.43 0.00 0.00 52.55 50.36 2ksy s ASP 28 Cb 0.16 -2.06 0.00 0.00 -0.30 0.00 0.00 42.92 40.73 2ksy s ASP 28 CO 0.61 -0.54 0.00 0.00 -0.17 0.00 0.00 175.17 175.07 2ksy n ALA 29 N 4.02 0.00 -1.95 3.66 0.00 -1.25 -4.88 120.51 120.12 2ksy n ALA 29 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2ksy n ALA 29 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2ksy n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ksy n GLY 30 N 0.00 0.50 2.88 0.00 0.00 -1.26 -5.08 105.19 102.22 2ksy n GLY 30 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2ksy n GLY 30 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ksy s SER 31 N -1.00 1.71 0.00 1.61 1.04 -1.26 -4.75 113.70 111.05 2ksy s SER 31 Ca 0.00 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.23 2ksy s SER 31 Cb 0.00 -0.64 0.00 0.00 0.10 0.00 0.00 66.02 65.48 2ksy s SER 31 CO 0.00 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 174.72 2ksy n GLY 32 N 4.70 2.12 0.16 7.32 0.00 -1.26 -4.86 105.19 113.37 2ksy n GLY 32 Ca -0.14 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.80 1.61 4.39 -2.00 -3.31 114.58 114.46 2ksy h GLU 33 Ca 0.00 0.00 0.23 0.00 0.34 0.00 0.00 59.36 59.93 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 0.14 0.57 -0.09 -1.16 0.00 0.00 179.01 178.47 2ksy h ARG 34 N 0.00 0.04 -0.69 2.33 2.43 -1.89 0.58 114.38 117.18 2ksy h ARG 34 Ca -0.02 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 2ksy h ARG 34 Cb 1.14 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.65 2ksy h ARG 34 CO 0.02 0.03 0.40 -0.09 -1.51 0.00 0.00 179.97 178.81 2ksy h ARG 35 N 0.04 0.95 -0.02 0.20 2.43 -2.00 -0.33 114.38 115.66 2ksy h ARG 35 Ca 0.38 -0.10 -0.12 0.00 -0.81 0.00 0.00 59.98 59.34 2ksy h ARG 35 Cb 1.47 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.81 2ksy h ARG 35 CO -0.02 0.70 -0.54 1.88 -1.51 0.00 0.00 179.97 180.48 2ksy h TYR 36 N 0.95 0.05 0.24 2.20 -1.99 -1.14 -2.53 116.97 114.75 2ksy h TYR 36 Ca 0.25 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.95 2ksy h TYR 36 Cb 0.01 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 38.73 2ksy h TYR 36 CO -0.01 0.57 -0.11 1.88 -0.00 0.00 0.00 178.16 180.49 2ksy h TYR 37 N 0.03 -0.30 -0.82 4.88 0.05 -1.01 -2.60 116.97 117.21 2ksy h TYR 37 Ca -0.00 -0.01 0.07 0.00 0.05 0.00 0.00 58.73 58.84 2ksy h TYR 37 Cb 0.96 0.10 -0.05 0.00 1.01 0.00 0.00 36.73 38.74 2ksy h TYR 37 CO 0.00 0.05 0.54 0.28 -1.05 0.00 0.00 178.16 177.98 2ksy h VAL 38 N -0.94 1.02 0.10 -2.88 2.07 -1.15 -0.30 116.25 114.17 2ksy h VAL 38 Ca -0.03 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 2ksy h VAL 38 Cb 0.48 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2ksy h VAL 38 CO 0.05 0.16 -0.05 0.74 0.02 0.00 0.00 177.57 178.49 2ksy h THR 39 N 0.86 0.93 -0.30 2.57 2.02 -1.51 -0.44 112.91 117.05 2ksy h THR 39 Ca 0.36 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.46 2ksy h THR 39 Cb 0.29 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 2ksy h THR 39 CO -0.13 0.02 0.18 0.25 0.37 0.00 0.00 175.52 176.20 2ksy h LEU 40 N -0.17 0.36 -1.48 2.58 5.85 -0.98 -1.93 115.31 119.54 2ksy h LEU 40 Ca -0.01 -0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.74 2ksy h LEU 40 Cb 0.13 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 2ksy h LEU 40 CO 0.02 0.30 0.45 0.58 -0.34 0.00 0.00 178.44 179.46 2ksy h VAL 41 N 0.38 0.95 -0.81 1.05 2.07 -0.93 -0.70 116.25 118.25 2ksy h VAL 41 Ca 0.11 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 2ksy h VAL 41 Cb 0.01 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 30.04 2ksy h VAL 41 CO -0.02 0.11 0.44 1.23 0.02 0.00 0.00 177.57 179.35 2ksy h GLY 42 N 0.60 1.22 0.76 2.17 0.00 -0.29 -1.89 103.07 105.64 2ksy h GLY 42 Ca 0.31 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 2ksy h GLY 42 CO -0.10 0.54 -0.34 -2.22 0.00 0.00 0.00 176.54 174.42 2ksy h ILE 43 N 1.13 0.30 -0.08 2.60 2.04 -0.79 -1.22 117.51 121.49 2ksy h ILE 43 Ca 0.29 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.17 2ksy h ILE 43 Cb 0.05 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.42 2ksy h ILE 43 CO -0.04 0.00 0.08 0.28 0.00 0.00 0.00 178.15 178.47 2ksy h SER 44 N -0.79 0.00 0.13 1.72 0.02 -1.39 -1.98 113.55 111.26 2ksy h SER 44 Ca -0.05 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 2ksy h SER 44 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 2ksy h SER 44 CO 0.01 0.00 -0.06 1.23 -1.14 0.00 0.00 176.83 176.87 2ksy h GLY 45 N 0.00 -0.18 1.18 -3.77 0.00 -0.65 -2.05 103.07 97.61 2ksy h GLY 45 Ca 0.04 0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 2ksy h GLY 45 CO -0.00 -0.07 0.45 0.16 0.00 0.00 0.00 176.54 177.08 2ksy h ILE 46 N -0.85 1.23 -0.35 2.60 3.07 -1.02 -2.59 117.51 119.58 2ksy h ILE 46 Ca -0.02 -0.54 -0.08 0.00 1.55 0.00 0.00 64.86 65.77 2ksy h ILE 46 Cb 0.54 0.15 -0.01 0.00 -0.27 0.00 0.00 36.82 37.23 2ksy h ILE 46 CO 0.03 0.25 -0.11 0.00 -1.05 0.00 0.00 178.15 177.27 2ksy h ALA 47 N 1.40 0.49 -0.51 0.16 0.00 -1.46 -2.57 119.26 116.78 2ksy h ALA 47 Ca 0.28 -0.32 0.07 0.00 0.00 0.00 0.00 54.91 54.95 2ksy h ALA 47 Cb -0.00 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 2ksy h ALA 47 CO -0.05 0.36 0.16 0.00 0.00 0.00 0.00 179.25 179.73 2ksy h ALA 48 N 0.81 0.61 -0.19 0.00 0.00 -1.00 -0.71 119.26 118.78 2ksy h ALA 48 Ca 0.09 0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 2ksy h ALA 48 Cb 0.63 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2ksy h ALA 48 CO 0.04 -0.23 -0.36 -0.39 0.00 0.00 0.00 179.25 178.31 2ksy h VAL 49 N 0.33 1.29 -0.44 0.00 -1.51 -1.47 -2.49 116.25 111.97 2ksy h VAL 49 Ca 0.25 -1.45 -0.09 0.00 -1.23 0.00 0.00 66.70 64.18 2ksy h VAL 49 Cb 0.28 1.54 -0.02 0.00 -2.13 0.00 0.00 31.29 30.96 2ksy h VAL 49 CO -0.27 0.45 -0.07 0.00 -1.23 0.00 0.00 177.57 176.45 2ksy h ALA 50 N 1.27 1.04 -0.40 5.19 0.00 -0.90 -1.35 119.26 124.11 2ksy h ALA 50 Ca 0.04 -0.30 -0.14 0.00 0.00 0.00 0.00 54.91 54.51 2ksy h ALA 50 Cb 0.80 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2ksy h ALA 50 CO 0.06 0.59 -0.30 1.88 0.00 0.00 0.00 179.25 181.49 2ksy h TYR 51 N 0.71 1.01 -0.33 0.00 0.05 -0.98 -0.90 116.97 116.53 2ksy h TYR 51 Ca 0.13 -0.26 -0.04 0.00 0.05 0.00 0.00 58.73 58.60 2ksy h TYR 51 Cb 0.54 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 38.04 2ksy h TYR 51 CO 0.03 1.05 0.05 0.00 -1.05 0.00 0.00 178.16 178.24 2ksy h ALA 52 N 0.93 0.44 -0.18 3.88 0.00 -1.17 0.77 119.26 123.93 2ksy h ALA 52 Ca 0.08 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2ksy h ALA 52 Cb 0.85 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2ksy h ALA 52 CO 0.07 0.14 -0.06 -0.39 0.00 0.00 0.00 179.25 179.02 2ksy h VAL 53 N 0.38 1.30 -0.04 0.00 -1.51 -1.21 -1.22 116.25 113.95 2ksy h VAL 53 Ca 0.10 -1.06 -0.02 0.00 -1.23 0.00 0.00 66.70 64.49 2ksy h VAL 53 Cb 0.36 1.62 -0.00 0.00 -2.13 0.00 0.00 31.29 31.14 2ksy h VAL 53 CO 0.01 0.32 -0.09 0.24 -1.23 0.00 0.00 177.57 176.81 2ksy h MET 54 N 0.06 0.05 -0.01 5.19 2.07 -1.14 -1.61 114.93 119.55 2ksy h MET 54 Ca 0.04 -0.01 -0.15 0.00 -2.07 0.00 0.00 59.70 57.51 2ksy h MET 54 Cb 0.51 -0.01 -0.02 0.00 -1.87 0.00 0.00 31.60 30.21 2ksy h MET 54 CO 0.02 0.15 -0.72 0.00 1.07 0.00 0.00 176.91 177.43 2ksy h ALA 55 N 1.86 0.79 0.00 6.32 0.00 -0.55 -2.97 119.26 124.71 2ksy h ALA 55 Ca 0.01 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2ksy h ALA 55 Cb 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2ksy h ALA 55 CO 0.01 0.88 0.00 1.28 0.00 0.00 0.00 179.25 181.42 2ksy n LEU 56 N -3.70 0.00 0.00 0.00 4.77 -0.49 -4.65 117.00 112.93 2ksy n LEU 56 Ca -0.01 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 2ksy n LEU 56 Cb 0.70 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2ksy n LEU 56 CO 0.44 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 2ksy n GLY 57 N 1.10 1.22 3.76 -0.72 0.00 -1.07 -5.05 105.19 104.43 2ksy n GLY 57 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.29 3.49 0.00 1.61 0.11 -1.11 -3.33 120.40 118.89 2ksy s VAL 58 Ca 0.00 1.47 0.00 0.00 -2.93 0.00 0.00 61.98 60.52 2ksy s VAL 58 Cb 0.00 -3.92 0.00 0.00 -1.53 0.00 0.00 36.38 30.93 2ksy s VAL 58 CO 0.00 0.32 0.00 0.61 -3.33 0.00 0.00 175.10 172.70 2ksy n GLY 59 N 1.11 0.11 3.65 6.54 0.00 -1.26 -4.15 105.19 111.18 2ksy n GLY 59 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2ksy n GLY 59 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ksy s TRP 60 N -2.00 2.87 -0.15 1.61 0.52 -1.21 -2.47 118.94 118.10 2ksy s TRP 60 Ca 0.00 1.03 -0.01 0.00 0.02 0.00 0.00 56.10 57.13 2ksy s TRP 60 Cb 0.00 -3.62 -0.01 0.00 -1.15 0.00 0.00 33.47 28.68 2ksy s TRP 60 CO 0.00 -1.50 -0.10 0.54 0.02 0.00 0.00 176.95 175.90 2ksy s VAL 61 N 3.77 3.18 0.42 4.03 0.11 -0.38 -5.01 120.40 126.53 2ksy s VAL 61 Ca 0.53 -0.60 -0.23 0.00 -2.93 0.00 0.00 61.98 58.75 2ksy s VAL 61 Cb -0.19 -2.37 -0.09 0.00 -1.53 0.00 0.00 36.38 32.21 2ksy s VAL 61 CO 0.16 0.50 1.07 -2.84 -3.33 0.00 0.00 175.10 170.67 2ksy s PRO 62 N 0.61 4.03 -0.35 1.54 0.02 -1.26 -1.76 135.00 137.83 2ksy s PRO 62 Ca -0.06 1.55 -0.00 0.00 0.02 0.00 0.00 61.00 62.50 2ksy s PRO 62 Cb -0.15 -2.45 0.14 0.00 0.02 0.00 0.00 34.50 32.05 2ksy s PRO 62 CO 0.03 -0.27 0.21 0.08 -0.33 0.00 0.00 177.00 176.72 2ksy s VAL 63 N -1.68 0.16 0.00 3.83 1.01 0.69 -4.89 120.40 119.52 2ksy s VAL 63 Ca 0.60 -1.68 0.00 0.00 0.00 0.00 0.00 61.98 60.90 2ksy s VAL 63 Cb -0.23 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.03 2ksy s VAL 63 CO 0.28 -0.98 0.00 0.00 0.00 0.00 0.00 175.10 174.40 2ksy n ALA 64 N 4.09 0.00 0.00 5.51 0.00 -1.26 -0.27 120.51 128.58 2ksy n ALA 64 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2ksy n ALA 64 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.82 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 0.74 -3.45 0.00 4.07 -1.26 -5.06 120.64 115.67 2ksy n GLU 65 Ca 0.00 0.00 -0.19 0.00 -0.06 0.00 0.00 57.16 56.91 2ksy n GLU 65 Cb 0.00 -0.94 -0.01 0.00 -0.06 0.00 0.00 31.44 30.43 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 -1.76 3.04 -0.02 5.31 1.70 0.63 -5.13 118.95 122.73 2ksy s ARG 66 Ca 0.00 -1.07 0.06 0.00 -0.47 0.00 0.00 55.73 54.24 2ksy s ARG 66 Cb 0.00 -2.77 -0.01 0.00 -0.57 0.00 0.00 34.95 31.59 2ksy s ARG 66 CO 0.00 0.03 -0.19 0.99 -1.08 0.00 0.00 175.30 175.05 2ksy s THR 67 N -2.21 1.49 0.06 4.99 2.01 -1.26 -0.22 115.64 120.50 2ksy s THR 67 Ca 0.46 -0.80 0.08 0.00 0.31 0.00 0.00 61.69 61.73 2ksy s THR 67 Cb -0.09 -1.24 -0.03 0.00 0.01 0.00 0.00 72.50 71.15 2ksy s THR 67 CO 0.31 0.42 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.76 2ksy s VAL 68 N -0.41 1.75 -0.33 3.82 1.01 -0.72 -4.96 120.40 120.55 2ksy s VAL 68 Ca 0.06 -1.34 -0.06 0.00 0.00 0.00 0.00 61.98 60.64 2ksy s VAL 68 Cb -0.08 -1.54 0.03 0.00 0.00 0.00 0.00 36.38 34.80 2ksy s VAL 68 CO -0.01 0.14 0.10 -0.36 0.00 0.00 0.00 175.10 174.97 2ksy s PHE 69 N -0.92 3.23 -0.02 5.22 0.08 -1.26 -1.25 117.98 123.06 2ksy s PHE 69 Ca 0.08 -1.33 -0.26 0.00 0.12 0.00 0.00 56.93 55.54 2ksy s PHE 69 Cb -0.09 -2.27 -0.20 0.00 -0.57 0.00 0.00 43.02 39.89 2ksy s PHE 69 CO 0.03 -0.70 1.26 0.28 -0.10 0.00 0.00 175.22 175.99 2ksy h VAL 70 N 6.11 1.40 0.00 -0.44 2.07 -1.87 -3.11 116.25 120.42 2ksy h VAL 70 Ca -0.25 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 66.09 2ksy h VAL 70 Cb 1.09 2.19 0.00 0.00 -1.52 0.00 0.00 31.29 33.05 2ksy h VAL 70 CO 0.60 0.31 0.29 1.55 0.02 0.00 0.00 177.57 180.34 2ksy h PRO 71 N -0.48 0.00 0.05 1.57 0.13 -1.89 -0.06 132.00 131.33 2ksy h PRO 71 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2ksy h PRO 71 Cb 0.51 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.64 2ksy h PRO 71 CO 0.00 0.00 -0.03 -0.09 -0.23 0.00 0.00 178.00 177.66 2ksy h ARG 72 N 0.00 -0.07 -0.57 0.86 2.43 -1.91 -2.07 114.38 113.05 2ksy h ARG 72 Ca 0.00 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.08 2ksy h ARG 72 Cb 0.57 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 2ksy h ARG 72 CO 0.00 0.51 -0.04 1.88 -1.51 0.00 0.00 179.97 180.81 2ksy h TYR 73 N -0.92 1.11 -0.34 2.20 0.05 -1.28 -2.52 116.97 115.27 2ksy h TYR 73 Ca -0.01 -0.20 -0.10 0.00 0.05 0.00 0.00 58.73 58.47 2ksy h TYR 73 Cb 0.61 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 38.05 2ksy h TYR 73 CO 0.15 1.00 -0.22 0.97 -1.05 0.00 0.00 178.16 179.01 2ksy h ILE 74 N 0.92 1.27 -0.70 -2.88 -0.00 -1.18 -2.53 117.51 112.41 2ksy h ILE 74 Ca 0.16 -1.29 -0.01 0.00 -0.00 0.00 0.00 64.86 63.72 2ksy h ILE 74 Cb 0.58 1.24 -0.03 0.00 -0.00 0.00 0.00 36.82 38.61 2ksy h ILE 74 CO 0.04 0.42 0.40 -0.78 -0.00 0.00 0.00 178.15 178.23 2ksy h ASP 75 N 0.58 0.84 -0.26 2.19 3.58 -1.07 -1.35 116.42 120.94 2ksy h ASP 75 Ca 0.09 -0.06 -0.09 0.00 0.42 0.00 0.00 57.03 57.39 2ksy h ASP 75 Cb 0.69 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.51 2ksy h ASP 75 CO 0.05 0.67 -0.13 -0.50 -2.88 0.00 0.00 179.24 176.45 2ksy h TRP 76 N 0.96 0.74 -0.00 0.28 6.55 -1.06 0.16 115.95 123.58 2ksy h TRP 76 Ca 0.25 -0.13 -0.07 0.00 0.95 0.00 0.00 58.89 59.89 2ksy h TRP 76 Cb -0.01 -0.19 -0.01 0.00 -0.86 0.00 0.00 29.16 28.09 2ksy h TRP 76 CO 0.00 0.77 -0.33 0.82 -1.05 0.00 0.00 178.44 178.66 2ksy h ILE 77 N 0.61 1.24 0.00 1.49 2.04 -0.89 0.13 117.51 122.12 2ksy h ILE 77 Ca 0.11 -1.12 -0.06 0.00 1.00 0.00 0.00 64.86 64.78 2ksy h ILE 77 Cb 0.57 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 2ksy h ILE 77 CO 0.04 0.32 -1.31 0.18 0.00 0.00 0.00 178.15 177.37 2ksy n LEU 78 N -4.15 0.70 -0.13 1.44 4.77 -0.77 -4.35 117.00 114.50 2ksy n LEU 78 Ca -0.02 0.28 -0.25 0.00 -0.03 0.00 0.00 56.01 55.99 2ksy n LEU 78 Cb 0.37 0.01 -0.08 0.00 -2.33 0.00 0.00 43.42 41.38 2ksy n LEU 78 CO 0.38 -0.04 -1.29 0.35 -1.33 0.00 0.00 177.39 175.46 2ksy n THR 79 N -2.68 1.51 0.00 -5.08 -2.24 0.52 -4.35 114.28 101.97 2ksy n THR 79 Ca -0.04 -0.28 -0.11 0.00 -2.27 0.00 0.00 64.05 61.35 2ksy n THR 79 Cb 0.65 -1.97 -0.04 0.00 -2.10 0.00 0.00 70.33 66.87 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 -0.99 0.26 -0.00 4.28 2.02 -0.95 0.12 112.91 117.65 2ksy h THR 80 Ca -0.56 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.62 2ksy h THR 80 Cb 1.49 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 68.16 2ksy h THR 80 CO -0.34 0.00 0.18 -0.65 0.37 0.00 0.00 175.52 175.08 2ksy h PRO 81 N -0.42 0.00 0.04 6.66 0.11 -1.76 0.81 132.00 137.44 2ksy h PRO 81 Ca 0.09 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.94 2ksy h PRO 81 Cb 0.56 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.69 2ksy h PRO 81 CO -0.35 0.00 -1.07 1.25 -0.21 0.00 0.00 178.00 177.61 2ksy h LEU 82 N 0.00 0.75 0.09 2.35 7.12 -0.97 -1.98 115.31 122.66 2ksy h LEU 82 Ca 0.00 -0.63 -0.00 0.00 0.13 0.00 0.00 57.88 57.38 2ksy h LEU 82 Cb 0.36 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 40.26 2ksy h LEU 82 CO -0.00 1.44 -0.04 0.40 -0.13 0.00 0.00 178.44 180.11 2ksy h ILE 83 N 0.29 1.09 -0.16 4.05 1.08 -0.14 -1.33 117.51 122.39 2ksy h ILE 83 Ca -0.13 -0.67 -0.02 0.00 -0.39 0.00 0.00 64.86 63.65 2ksy h ILE 83 Cb 1.73 1.52 -0.01 0.00 -3.07 0.00 0.00 36.82 36.99 2ksy h ILE 83 CO 0.20 0.16 0.03 -0.37 -0.69 0.00 0.00 178.15 177.48 2ksy h VAL 84 N -0.43 1.09 -0.12 1.67 -1.51 -1.55 -0.07 116.25 115.34 2ksy h VAL 84 Ca -0.01 -0.32 -0.07 0.00 -1.23 0.00 0.00 66.70 65.06 2ksy h VAL 84 Cb 0.36 0.94 -0.01 0.00 -2.13 0.00 0.00 31.29 30.45 2ksy h VAL 84 CO 0.02 0.11 -0.27 0.22 -1.23 0.00 0.00 177.57 176.42 2ksy h TYR 85 N 0.23 0.23 0.07 5.19 3.20 -1.09 -1.29 116.97 123.51 2ksy h TYR 85 Ca 0.06 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 2ksy h TYR 85 Cb 0.11 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.32 2ksy h TYR 85 CO 0.00 0.46 -0.03 0.35 -1.64 0.00 0.00 178.16 177.30 2ksy h PHE 86 N 0.19 -0.09 -0.52 -3.82 3.04 0.16 -0.92 116.94 114.99 2ksy h PHE 86 Ca 0.03 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.97 2ksy h PHE 86 Cb 0.58 0.03 -0.03 0.00 2.56 0.00 0.00 35.95 39.09 2ksy h PHE 86 CO 0.01 0.11 0.28 -0.07 -2.02 0.00 0.00 178.31 176.63 2ksy h LEU 87 N -0.28 0.63 -1.41 0.59 3.38 -1.29 -0.91 115.31 116.02 2ksy h LEU 87 Ca -0.01 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 2ksy h LEU 87 Cb 0.24 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2ksy h LEU 87 CO 0.02 0.51 -0.29 1.23 0.09 0.00 0.00 178.44 180.00 2ksy h GLY 88 N 0.79 0.00 1.39 0.83 0.00 -0.91 -2.66 103.07 102.51 2ksy h GLY 88 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.33 2ksy h GLY 88 CO -0.03 0.00 -0.67 1.41 0.00 0.00 0.00 176.54 177.24 2ksy h LEU 89 N 0.00 0.71 0.06 3.11 3.38 0.24 0.03 115.31 122.84 2ksy h LEU 89 Ca -0.00 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 57.53 2ksy h LEU 89 Cb 0.58 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2ksy h LEU 89 CO 0.04 1.19 -0.03 -0.07 0.09 0.00 0.00 178.44 179.66 2ksy h LEU 90 N 0.44 -0.07 -0.04 1.67 3.38 -1.11 -3.21 115.31 116.38 2ksy h LEU 90 Ca -0.02 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2ksy h LEU 90 Cb 1.26 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2ksy h LEU 90 CO 0.13 -0.03 -0.08 0.00 0.09 0.00 0.00 178.44 178.55 2ksy h ALA 91 N 0.84 0.06 -0.47 1.53 0.00 -1.55 -3.44 119.26 116.23 2ksy h ALA 91 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2ksy h ALA 91 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2ksy h ALA 91 CO 0.01 -0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.59 2ksy n GLY 92 N 0.46 0.84 3.83 0.00 0.00 -0.01 -4.39 105.19 105.92 2ksy n GLY 92 Ca -0.08 -0.72 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.43 2.16 0.64 0.99 1.02 -1.15 -5.07 118.68 116.84 2ksy s LEU 93 Ca 0.00 0.56 -0.01 0.00 0.02 0.00 0.00 54.13 54.70 2ksy s LEU 93 Cb 0.00 -2.67 0.07 0.00 0.02 0.00 0.00 46.19 43.62 2ksy s LEU 93 CO 0.00 -2.83 0.90 -1.81 0.02 0.00 0.00 176.35 172.63 2ksy s ASP 94 N -4.48 4.83 0.34 2.29 1.01 -1.26 -4.90 116.67 114.50 2ksy s ASP 94 Ca 0.69 -0.05 0.02 0.00 0.71 0.00 0.00 52.55 53.92 2ksy s ASP 94 Cb -0.08 -0.60 0.61 0.00 1.01 0.00 0.00 42.92 43.85 2ksy s ASP 94 CO 0.53 -1.50 2.00 0.77 0.21 0.00 0.00 175.17 177.18 2ksy h SER 95 N -0.28 0.76 -0.08 0.27 4.64 -2.00 -1.62 113.55 115.24 2ksy h SER 95 Ca -0.40 -0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 60.74 2ksy h SER 95 Cb 1.29 -0.19 0.01 0.00 -0.31 0.00 0.00 62.40 63.20 2ksy h SER 95 CO 0.49 0.55 -0.54 0.08 -0.87 0.00 0.00 176.83 176.55 2ksy h ARG 96 N 0.90 0.51 -0.43 4.77 0.11 -1.99 -2.84 114.38 115.40 2ksy h ARG 96 Ca 0.24 -0.44 0.04 0.00 0.10 0.00 0.00 59.98 59.92 2ksy h ARG 96 Cb -0.10 0.10 -0.04 0.00 1.11 0.00 0.00 29.97 31.04 2ksy h ARG 96 CO -0.05 1.07 0.21 0.93 0.10 0.00 0.00 179.97 182.23 2ksy h GLU 97 N 0.09 0.41 -0.87 0.08 5.08 -1.85 -1.85 114.58 115.67 2ksy h GLU 97 Ca -0.04 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2ksy h GLU 97 Cb 1.19 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.31 2ksy h GLU 97 CO 0.11 0.27 0.56 0.74 -1.00 0.00 0.00 179.01 179.69 2ksy h PHE 98 N 0.42 1.10 -0.35 4.33 0.04 -1.37 -1.75 116.94 119.36 2ksy h PHE 98 Ca 0.19 0.02 0.04 0.00 2.80 0.00 0.00 57.97 61.01 2ksy h PHE 98 Cb 0.10 -0.37 -0.02 0.00 2.20 0.00 0.00 35.95 37.86 2ksy h PHE 98 CO -0.11 0.71 0.24 0.78 -0.60 0.00 0.00 178.31 179.33 2ksy h GLY 99 N 1.18 0.38 0.79 -1.45 0.00 -1.10 -0.15 103.07 102.72 2ksy h GLY 99 Ca 0.32 -0.13 -0.12 0.00 0.00 0.00 0.00 47.33 47.39 2ksy h GLY 99 CO -0.07 0.11 -0.43 -2.22 0.00 0.00 0.00 176.54 173.93 2ksy h ILE 100 N 0.33 1.39 -0.06 2.60 2.04 -0.74 -2.19 117.51 120.89 2ksy h ILE 100 Ca 0.15 -1.80 -0.02 0.00 1.00 0.00 0.00 64.86 64.19 2ksy h ILE 100 Cb 0.18 2.27 -0.00 0.00 -0.74 0.00 0.00 36.82 38.53 2ksy h ILE 100 CO -0.03 0.53 -0.03 0.58 0.00 0.00 0.00 178.15 179.20 2ksy h VAL 101 N -0.01 1.33 -0.32 1.67 2.07 -1.01 -2.33 116.25 117.65 2ksy h VAL 101 Ca -0.03 -1.04 -0.02 0.00 0.82 0.00 0.00 66.70 66.42 2ksy h VAL 101 Cb 1.08 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.75 2ksy h VAL 101 CO 0.09 0.29 0.12 0.40 0.02 0.00 0.00 177.57 178.48 2ksy h ILE 102 N -0.27 1.19 -0.32 4.57 1.08 -1.15 -2.68 117.51 119.92 2ksy h ILE 102 Ca 0.01 -0.60 -0.02 0.00 -0.39 0.00 0.00 64.86 63.86 2ksy h ILE 102 Cb 0.47 0.98 -0.02 0.00 -3.07 0.00 0.00 36.82 35.19 2ksy h ILE 102 CO 0.01 0.21 0.10 0.00 -0.69 0.00 0.00 178.15 177.78 2ksy h THR 103 N 0.37 1.14 0.33 -0.27 1.03 -1.45 -2.35 112.91 111.71 2ksy h THR 103 Ca 0.11 -0.47 -0.02 0.00 -0.01 0.00 0.00 66.41 66.02 2ksy h THR 103 Cb 0.21 0.79 0.00 0.00 -1.07 0.00 0.00 68.15 68.08 2ksy h THR 103 CO -0.01 0.18 -0.16 0.25 -0.01 0.00 0.00 175.52 175.77 2ksy h LEU 104 N 0.46 -0.38 -1.87 0.00 5.85 -1.10 -1.83 115.31 116.44 2ksy h LEU 104 Ca 0.11 0.01 0.11 0.00 0.84 0.00 0.00 57.88 58.94 2ksy h LEU 104 Cb 0.14 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 2ksy h LEU 104 CO -0.01 -0.26 0.32 0.78 -0.34 0.00 0.00 178.44 178.93 2ksy h ASN 105 N -0.45 0.13 -0.77 1.25 -0.26 -1.19 0.11 115.58 114.40 2ksy h ASN 105 Ca -0.05 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.68 2ksy h ASN 105 Cb 0.35 -0.02 -0.04 0.00 -1.06 0.00 0.00 38.32 37.55 2ksy h ASN 105 CO 0.07 0.08 0.40 0.74 -1.06 0.00 0.00 177.43 177.66 2ksy h THR 106 N 0.15 1.24 -0.31 2.81 2.02 -0.83 -0.96 112.91 117.03 2ksy h THR 106 Ca 0.21 -0.64 -0.15 0.00 0.77 0.00 0.00 66.41 66.61 2ksy h THR 106 Cb 0.66 0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2ksy h THR 106 CO -0.03 0.28 -0.39 0.58 0.37 0.00 0.00 175.52 176.32 2ksy h VAL 107 N 1.10 1.29 -0.38 3.16 2.07 -0.35 -2.20 116.25 120.94 2ksy h VAL 107 Ca 0.27 -1.57 0.04 0.00 0.82 0.00 0.00 66.70 66.26 2ksy h VAL 107 Cb 0.07 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 2ksy h VAL 107 CO -0.04 0.51 0.16 0.58 0.02 0.00 0.00 177.57 178.80 2ksy h VAL 108 N 0.59 0.92 -0.10 2.57 2.07 -0.83 -1.56 116.25 119.91 2ksy h VAL 108 Ca 0.04 -0.11 -0.11 0.00 0.82 0.00 0.00 66.70 67.34 2ksy h VAL 108 Cb 0.99 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2ksy h VAL 108 CO 0.09 0.06 -0.43 0.24 0.02 0.00 0.00 177.57 177.55 2ksy h MET 109 N 0.33 0.22 -0.22 1.57 2.86 -1.19 -2.70 114.93 115.80 2ksy h MET 109 Ca 0.17 -0.11 -0.06 0.00 -2.06 0.00 0.00 59.70 57.64 2ksy h MET 109 Cb 0.12 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 2ksy h MET 109 CO -0.15 0.62 -0.15 1.25 1.06 0.00 0.00 176.91 179.54 2ksy h LEU 110 N 0.19 0.35 0.22 1.22 5.85 -0.74 0.50 115.31 122.90 2ksy h LEU 110 Ca 0.01 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2ksy h LEU 110 Cb 0.84 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.78 2ksy h LEU 110 CO 0.07 0.53 -0.11 0.00 -0.34 0.00 0.00 178.44 178.59 2ksy h ALA 111 N 1.51 -0.29 -0.46 1.25 0.00 -1.00 -2.77 119.26 117.50 2ksy h ALA 111 Ca 0.06 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2ksy h ALA 111 Cb 0.47 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2ksy h ALA 111 CO 0.03 -0.45 0.12 0.78 0.00 0.00 0.00 179.25 179.73 2ksy h GLY 112 N -0.74 0.73 0.27 0.00 0.00 -1.41 0.13 103.07 102.06 2ksy h GLY 112 Ca -0.03 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 46.90 2ksy h GLY 112 CO 0.05 0.37 -0.24 -2.75 0.00 0.00 0.00 176.54 173.97 2ksy h PHE 113 N 0.66 -0.66 0.00 5.60 3.04 -0.90 -2.37 116.94 122.31 2ksy h PHE 113 Ca 0.15 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.09 2ksy h PHE 113 Cb 0.23 0.25 -0.00 0.00 2.56 0.00 0.00 35.95 38.99 2ksy h PHE 113 CO 0.01 -0.33 -0.08 0.00 -2.02 0.00 0.00 178.31 175.90 2ksy h ALA 114 N -1.40 1.13 -0.29 2.41 0.00 -1.47 -2.94 119.26 116.70 2ksy h ALA 114 Ca -0.03 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.85 2ksy h ALA 114 Cb 0.43 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2ksy h ALA 114 CO -0.01 0.10 0.02 0.78 0.00 0.00 0.00 179.25 180.13 2ksy h GLY 115 N 1.14 0.30 2.00 0.00 0.00 -0.22 -0.96 103.07 105.33 2ksy h GLY 115 Ca -0.00 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2ksy h GLY 115 CO 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 176.54 176.50 2ksy h ALA 116 N 1.24 1.00 -0.35 3.60 0.00 -1.30 -3.16 119.26 120.30 2ksy h ALA 116 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2ksy h ALA 116 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2ksy h ALA 116 CO -0.22 0.00 0.00 -0.12 0.00 0.00 0.00 179.25 178.91 2ksy n MET 117 N -2.30 3.12 -3.23 0.00 0.00 -0.39 -4.86 117.12 109.46 2ksy n MET 117 Ca 0.05 -1.80 -0.39 0.00 0.00 0.00 0.00 57.70 55.56 2ksy n MET 117 Cb 0.40 -1.87 -0.06 0.00 0.00 0.00 0.00 33.22 31.69 2ksy n MET 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 175.97 176.11 2ksy s VAL 118 N -1.95 4.72 -0.99 1.12 -7.23 -1.05 -4.97 120.40 110.05 2ksy s VAL 118 Ca 0.31 1.28 0.25 0.00 -1.81 0.00 0.00 61.98 62.02 2ksy s VAL 118 Cb 0.23 -3.93 0.01 0.00 0.56 0.00 0.00 36.38 33.25 2ksy s VAL 118 CO 0.11 0.53 1.43 -0.81 -0.31 0.00 0.00 175.10 176.04 2ksy n PRO 119 N 1.88 0.00 0.00 4.82 -0.04 -1.26 -4.88 135.00 135.53 2ksy n PRO 119 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2ksy n PRO 119 Cb 0.51 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 2ksy n PRO 119 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ksy n GLY 120 N 1.50 1.93 0.41 0.55 0.00 -1.26 -5.05 105.19 103.27 2ksy n GLY 120 Ca 0.06 -0.17 0.01 0.00 0.00 0.00 0.00 46.02 45.92 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 0.28 0.30 -0.61 -6.64 -1.26 -4.81 119.36 106.62 2ksy n ILE 121 Ca 0.00 -0.34 0.16 0.00 -1.77 0.00 0.00 62.75 60.81 2ksy n ILE 121 Cb 0.00 0.41 0.78 0.00 -1.44 0.00 0.00 39.64 39.39 2ksy n ILE 121 CO 0.00 0.00 0.00 -0.33 -1.77 0.00 0.00 176.55 174.45 2ksy h GLU 122 N 0.00 0.00 -0.90 6.28 5.08 -1.93 -3.03 114.58 120.08 2ksy h GLU 122 Ca 0.00 0.00 0.19 0.00 -1.00 0.00 0.00 59.36 58.55 2ksy h GLU 122 Cb 1.32 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.46 2ksy h GLU 122 CO 0.00 0.00 0.46 0.07 -1.00 0.00 0.00 179.01 178.54 2ksy h ARG 123 N 0.00 0.54 -0.41 2.33 0.11 -1.88 0.61 114.38 115.68 2ksy h ARG 123 Ca 0.00 -0.03 0.07 0.00 0.10 0.00 0.00 59.98 60.12 2ksy h ARG 123 Cb 0.22 -0.12 -0.02 0.00 1.11 0.00 0.00 29.97 31.16 2ksy h ARG 123 CO 0.00 0.36 0.28 1.88 0.10 0.00 0.00 179.97 182.58 2ksy h TYR 124 N 0.55 0.26 0.19 4.08 0.05 -1.88 -0.57 116.97 119.66 2ksy h TYR 124 Ca 0.53 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 59.31 2ksy h TYR 124 Cb 0.89 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.54 2ksy h TYR 124 CO -0.09 0.14 -0.09 0.00 -1.05 0.00 0.00 178.16 177.07 2ksy h ALA 125 N 1.78 -0.25 -0.42 3.88 0.00 -1.10 -1.62 119.26 121.54 2ksy h ALA 125 Ca 0.18 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.98 2ksy h ALA 125 Cb 0.39 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 2ksy h ALA 125 CO -0.04 -0.29 -0.00 -0.07 0.00 0.00 0.00 179.25 178.86 2ksy h LEU 126 N -0.96 -0.17 -1.15 0.00 3.38 -1.27 -0.18 115.31 114.96 2ksy h LEU 126 Ca -0.03 0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2ksy h LEU 126 Cb 0.46 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 2ksy h LEU 126 CO 0.04 -0.05 0.08 0.15 0.09 0.00 0.00 178.44 178.75 2ksy h PHE 127 N 0.11 0.69 -0.61 1.13 3.57 -1.22 -2.39 116.94 118.22 2ksy h PHE 127 Ca 0.21 -0.06 0.12 0.00 3.53 0.00 0.00 57.97 61.77 2ksy h PHE 127 Cb 0.29 -0.20 -0.12 0.00 2.79 0.00 0.00 35.95 38.71 2ksy h PHE 127 CO -0.28 0.61 -0.19 0.78 -2.23 0.00 0.00 178.31 177.01 2ksy h GLY 128 N 0.89 0.35 1.60 2.40 0.00 0.00 0.69 103.07 109.01 2ksy h GLY 128 Ca 0.14 0.25 -0.07 0.00 0.00 0.00 0.00 47.33 47.65 2ksy h GLY 128 CO 0.00 -0.24 -0.11 1.98 0.00 0.00 0.00 176.54 178.18 2ksy h MET 129 N -0.04 0.48 0.04 4.80 1.85 -1.24 -2.89 114.93 117.94 2ksy h MET 129 Ca 0.29 -0.13 0.01 0.00 -0.61 0.00 0.00 59.70 59.26 2ksy h MET 129 Cb 0.48 -0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.44 2ksy h MET 129 CO -0.65 0.60 -0.10 0.78 -0.40 0.00 0.00 176.91 177.13 2ksy h GLY 130 N 0.90 -0.15 0.89 1.39 0.00 0.76 -0.11 103.07 106.75 2ksy h GLY 130 Ca 0.09 0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.55 2ksy h GLY 130 CO 0.03 -0.11 0.02 0.00 0.00 0.00 0.00 176.54 176.48 2ksy h ALA 131 N 0.74 0.10 -1.01 3.60 0.00 -0.70 0.26 119.26 122.26 2ksy h ALA 131 Ca 0.03 0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.08 2ksy h ALA 131 Cb 0.22 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.95 2ksy h ALA 131 CO -0.08 -0.44 0.63 0.28 0.00 0.00 0.00 179.25 179.65 2ksy h VAL 132 N 0.07 0.92 -0.16 0.00 2.07 -1.33 0.36 116.25 118.18 2ksy h VAL 132 Ca 0.05 -0.34 -0.13 0.00 0.82 0.00 0.00 66.70 67.09 2ksy h VAL 132 Cb 0.04 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 29.63 2ksy h VAL 132 CO -0.06 0.18 -0.46 0.00 0.02 0.00 0.00 177.57 177.25 2ksy h ALA 133 N 1.54 0.92 0.58 1.67 0.00 -0.20 -2.62 119.26 121.15 2ksy h ALA 133 Ca 0.50 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2ksy h ALA 133 Cb 0.50 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2ksy h ALA 133 CO -0.27 0.65 -0.44 0.35 0.00 0.00 0.00 179.25 179.54 2ksy h PHE 134 N 0.32 -1.19 -0.72 0.00 3.57 0.17 -1.35 116.94 117.75 2ksy h PHE 134 Ca 0.02 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.63 2ksy h PHE 134 Cb 0.94 0.44 -0.05 0.00 2.79 0.00 0.00 35.95 40.07 2ksy h PHE 134 CO 0.03 -0.63 0.47 -0.84 -2.23 0.00 0.00 178.31 175.11 2ksy h ILE 135 N -0.99 0.88 -0.72 1.41 3.07 -1.46 0.11 117.51 119.81 2ksy h ILE 135 Ca -0.07 -0.18 0.05 0.00 1.55 0.00 0.00 64.86 66.21 2ksy h ILE 135 Cb 0.83 0.32 -0.04 0.00 -0.27 0.00 0.00 36.82 37.65 2ksy h ILE 135 CO 0.02 0.09 0.47 1.23 -1.05 0.00 0.00 178.15 178.91 2ksy h GLY 136 N 0.52 0.97 0.41 0.16 0.00 -0.90 0.17 103.07 104.39 2ksy h GLY 136 Ca 0.34 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 2ksy h GLY 136 CO -0.11 0.26 -0.08 -2.00 0.00 0.00 0.00 176.54 174.60 2ksy h LEU 137 N 0.81 -0.20 -1.97 3.11 5.85 0.23 -2.62 115.31 120.53 2ksy h LEU 137 Ca 0.30 -0.34 0.12 0.00 0.84 0.00 0.00 57.88 58.80 2ksy h LEU 137 Cb 0.16 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 2ksy h LEU 137 CO -0.09 0.33 0.30 -0.37 -0.34 0.00 0.00 178.44 178.27 2ksy h VAL 138 N -0.83 0.80 -0.23 1.05 -1.51 -1.19 -0.09 116.25 114.25 2ksy h VAL 138 Ca -0.02 -0.01 -0.02 0.00 -1.23 0.00 0.00 66.70 65.42 2ksy h VAL 138 Cb 0.52 0.76 -0.01 0.00 -2.13 0.00 0.00 31.29 30.44 2ksy h VAL 138 CO 0.04 0.01 0.08 0.22 -1.23 0.00 0.00 177.57 176.69 2ksy h TYR 139 N 0.04 0.36 -0.71 5.19 3.20 -0.60 -2.57 116.97 121.88 2ksy h TYR 139 Ca 0.20 -0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.11 2ksy h TYR 139 Cb 0.76 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.88 2ksy h TYR 139 CO -0.00 0.40 0.47 1.88 -1.64 0.00 0.00 178.16 179.27 2ksy h TYR 140 N 0.22 0.73 0.44 -3.82 0.05 -0.63 0.12 116.97 114.07 2ksy h TYR 140 Ca 0.08 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.86 2ksy h TYR 140 Cb 0.20 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 37.71 2ksy h TYR 140 CO -0.00 0.38 -0.23 -0.07 -1.05 0.00 0.00 178.16 177.18 2ksy h LEU 141 N 0.71 -0.57 -0.87 3.88 3.38 -1.07 -2.00 115.31 118.78 2ksy h LEU 141 Ca 0.31 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.31 2ksy h LEU 141 Cb 0.29 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2ksy h LEU 141 CO -0.10 -0.39 0.00 0.58 0.09 0.00 0.00 178.44 178.62 2ksy h VAL 142 N -0.63 0.00 0.00 1.22 2.07 -1.15 -2.91 116.25 114.85 2ksy h VAL 142 Ca -0.06 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2ksy h VAL 142 Cb 0.49 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2ksy h VAL 142 CO 0.08 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.28 2ksy n GLY 143 N 0.01 -1.65 0.32 2.17 0.00 0.37 -4.43 105.19 101.98 2ksy n GLY 143 Ca 0.02 -0.95 0.18 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.08 1.61 0.13 -1.84 -1.83 132.00 130.00 2ksy h PRO 144 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.15 2ksy h PRO 144 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2ksy h PRO 144 CO 0.00 0.00 0.06 0.52 -0.23 0.00 0.00 178.00 178.35 2ksy h MET 145 N 0.00 0.00 0.18 0.86 2.86 -1.70 0.15 114.93 117.28 2ksy h MET 145 Ca 0.01 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.41 2ksy h MET 145 Cb 0.12 0.00 0.03 0.00 0.06 0.00 0.00 31.60 31.80 2ksy h MET 145 CO -0.00 0.00 -1.09 1.15 1.06 0.00 0.00 176.91 178.03 2ksy h THR 146 N 0.00 1.40 -0.16 2.22 2.02 -1.11 -2.74 112.91 114.54 2ksy h THR 146 Ca 0.04 -2.59 -0.14 0.00 0.77 0.00 0.00 66.41 64.49 2ksy h THR 146 Cb 0.16 3.12 -0.01 0.00 -1.74 0.00 0.00 68.15 69.68 2ksy h THR 146 CO -0.00 0.75 -0.49 -0.08 0.37 0.00 0.00 175.52 176.07 2ksy h GLU 147 N -0.19 0.42 0.04 6.66 4.57 -1.52 -1.42 114.58 123.14 2ksy h GLU 147 Ca -0.19 -0.24 -0.00 0.00 -1.18 0.00 0.00 59.36 57.74 2ksy h GLU 147 Cb 1.84 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 30.45 2ksy h GLU 147 CO 0.19 0.82 -0.02 0.77 -1.18 0.00 0.00 179.01 179.59 2ksy h SER 148 N 0.33 -0.05 -0.55 1.04 0.02 -0.82 -2.77 113.55 110.76 2ksy h SER 148 Ca 0.02 -0.48 -0.07 0.00 -0.84 0.00 0.00 61.79 60.42 2ksy h SER 148 Cb 0.98 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.51 2ksy h SER 148 CO 0.09 0.47 0.09 0.00 -1.14 0.00 0.00 176.83 176.33 2ksy h ALA 149 N 0.34 1.04 0.00 3.77 0.00 -1.53 0.20 119.26 123.08 2ksy h ALA 149 Ca -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2ksy h ALA 149 Cb 0.52 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2ksy h ALA 149 CO 0.01 0.61 0.00 -1.13 0.00 0.00 0.00 179.25 178.74 2ksy n SER 150 N -4.23 0.00 0.00 0.00 3.41 -0.54 -2.35 113.62 109.92 2ksy n SER 150 Ca 0.04 -0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 2ksy n SER 150 Cb 0.28 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 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 -1.21 -0.28 -0.07 4.33 6.02 -0.62 -4.78 117.38 120.77 2ksy n GLN 151 Ca 0.10 -0.50 -0.11 0.00 -0.01 0.00 0.00 57.00 56.49 2ksy n GLN 151 Cb 0.13 -0.86 -0.10 0.00 1.02 0.00 0.00 30.24 30.43 2ksy n GLN 151 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2ksy h ARG 152 N 0.00 0.00 -3.14 -1.09 1.12 -0.25 -3.50 114.38 107.52 2ksy h ARG 152 Ca 0.00 0.00 0.03 0.00 -1.11 0.00 0.00 59.98 58.90 2ksy h ARG 152 Cb 0.21 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 30.12 2ksy h ARG 152 CO 0.00 0.75 0.16 -1.12 -3.11 0.00 0.00 179.97 176.65 2ksy s SER 153 N -6.07 -0.18 0.18 -3.80 0.01 -1.25 -4.99 113.70 97.61 2ksy s SER 153 Ca -0.15 -0.74 -0.04 0.00 1.31 0.00 0.00 55.95 56.33 2ksy s SER 153 Cb -0.02 0.71 0.08 0.00 0.21 0.00 0.00 66.02 67.00 2ksy s SER 153 CO 0.51 -1.34 1.49 0.28 0.41 0.00 0.00 173.24 174.59 2ksy h SER 154 N 2.05 0.68 0.06 2.44 0.02 -1.90 -3.12 113.55 113.77 2ksy h SER 154 Ca -0.22 -0.36 -0.25 0.00 -0.84 0.00 0.00 61.79 60.12 2ksy h SER 154 Cb 1.25 -0.19 0.02 0.00 0.14 0.00 0.00 62.40 63.62 2ksy h SER 154 CO 0.27 1.09 -1.02 1.23 -1.14 0.00 0.00 176.83 177.26 2ksy h GLY 155 N 1.00 0.66 0.21 -3.77 0.00 -1.96 -3.28 103.07 95.94 2ksy h GLY 155 Ca 0.01 -1.27 0.19 0.00 0.00 0.00 0.00 47.33 46.26 2ksy h GLY 155 CO 0.11 1.12 0.61 -2.22 0.00 0.00 0.00 176.54 176.16 2ksy h ILE 156 N 0.19 0.71 -0.73 2.60 1.08 -1.84 0.19 117.51 119.72 2ksy h ILE 156 Ca -0.14 -0.23 0.03 0.00 -0.39 0.00 0.00 64.86 64.13 2ksy h ILE 156 Cb 1.70 -0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 35.41 2ksy h ILE 156 CO 0.20 0.12 0.47 0.50 -0.69 0.00 0.00 178.15 178.74 2ksy h LYS 157 N 0.66 0.89 -0.27 2.37 3.64 -1.58 -0.81 116.57 121.47 2ksy h LYS 157 Ca 0.54 -0.05 -0.17 0.00 -1.27 0.00 0.00 60.65 59.69 2ksy h LYS 157 Cb 0.97 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 2ksy h LYS 157 CO -0.30 0.59 -0.49 0.77 -2.27 0.00 0.00 179.45 177.75 2ksy h SER 158 N 0.92 0.90 -0.65 4.20 0.02 -1.12 -2.42 113.55 115.40 2ksy h SER 158 Ca 0.29 -0.53 -0.05 0.00 -0.84 0.00 0.00 61.79 60.65 2ksy h SER 158 Cb -0.01 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.24 2ksy h SER 158 CO -0.10 1.26 0.20 -0.07 -1.14 0.00 0.00 176.83 176.98 2ksy h LEU 159 N 0.57 0.96 -0.03 5.07 -0.00 -0.93 -2.80 115.31 118.14 2ksy h LEU 159 Ca 0.02 -0.17 -0.08 0.00 -0.00 0.00 0.00 57.88 57.65 2ksy h LEU 159 Cb 1.09 -0.25 0.00 0.00 -0.00 0.00 0.00 40.66 41.51 2ksy h LEU 159 CO 0.11 0.90 -0.28 0.22 -0.00 0.00 0.00 178.44 179.40 2ksy h TYR 160 N 0.99 0.35 -0.24 1.13 3.20 -1.16 -2.49 116.97 118.75 2ksy h TYR 160 Ca 0.22 -0.16 0.03 0.00 3.14 0.00 0.00 58.73 61.96 2ksy h TYR 160 Cb 0.29 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 2ksy h TYR 160 CO 0.02 0.91 0.05 -0.39 -1.64 0.00 0.00 178.16 177.11 2ksy h VAL 161 N -0.32 0.89 -0.18 1.81 -1.51 -1.43 0.16 116.25 115.67 2ksy h VAL 161 Ca -0.02 -0.05 -0.06 0.00 -1.23 0.00 0.00 66.70 65.34 2ksy h VAL 161 Cb 0.96 0.74 -0.00 0.00 -2.13 0.00 0.00 31.29 30.86 2ksy h VAL 161 CO 0.06 0.03 -0.12 -0.09 -1.23 0.00 0.00 177.57 176.21 2ksy h ARG 162 N 0.14 0.40 -0.02 5.19 2.43 -1.61 -1.97 114.38 118.93 2ksy h ARG 162 Ca 0.11 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2ksy h ARG 162 Cb 0.11 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2ksy h ARG 162 CO -0.15 0.73 0.01 -0.07 -1.51 0.00 0.00 179.97 178.99 2ksy h LEU 163 N 0.07 0.03 -0.38 3.80 4.07 -1.32 -1.96 115.31 119.62 2ksy h LEU 163 Ca 0.03 -0.09 -0.02 0.00 0.08 0.00 0.00 57.88 57.89 2ksy h LEU 163 Cb 0.63 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 42.35 2ksy h LEU 163 CO 0.03 0.11 0.17 -0.09 -1.08 0.00 0.00 178.44 177.59 2ksy h ARG 164 N -0.05 0.55 0.19 1.13 1.12 -0.75 0.04 114.38 116.61 2ksy h ARG 164 Ca 0.01 -0.09 -0.01 0.00 -1.11 0.00 0.00 59.98 58.78 2ksy h ARG 164 Cb 0.09 -0.10 -0.00 0.00 -0.01 0.00 0.00 29.97 29.95 2ksy h ARG 164 CO -0.00 0.50 -0.11 -0.91 -3.11 0.00 0.00 179.97 176.34 2ksy h ASN 165 N 0.47 -0.28 0.28 -3.80 -0.26 -1.30 -0.33 115.58 110.36 2ksy h ASN 165 Ca 0.13 0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.87 2ksy h ASN 165 Cb 0.14 0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.48 2ksy h ASN 165 CO -0.01 -0.19 -0.13 0.25 -1.06 0.00 0.00 177.43 176.29 2ksy h LEU 166 N -0.29 -0.32 -0.04 1.61 6.46 -1.32 -2.76 115.31 118.66 2ksy h LEU 166 Ca -0.02 -0.12 0.03 0.00 -0.12 0.00 0.00 57.88 57.66 2ksy h LEU 166 Cb 0.24 0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.21 2ksy h LEU 166 CO 0.02 -0.07 -0.21 0.74 -0.62 0.00 0.00 178.44 178.31 2ksy h THR 167 N -0.57 0.51 -0.96 1.05 2.02 -0.97 -2.54 112.91 111.44 2ksy h THR 167 Ca -0.04 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.22 2ksy h THR 167 Cb 0.42 0.51 -0.07 0.00 -1.74 0.00 0.00 68.15 67.26 2ksy h THR 167 CO 0.06 0.00 0.61 1.62 0.37 0.00 0.00 175.52 178.18 2ksy h VAL 168 N -0.31 1.04 0.39 3.16 3.04 -1.10 0.11 116.25 122.58 2ksy h VAL 168 Ca 0.07 -0.37 -0.02 0.00 -1.01 0.00 0.00 66.70 65.37 2ksy h VAL 168 Cb 0.41 -0.13 -0.00 0.00 -2.01 0.00 0.00 31.29 29.55 2ksy h VAL 168 CO -0.22 0.20 -0.23 0.58 -1.01 0.00 0.00 177.57 176.89 2ksy h VAL 169 N 1.08 0.00 0.00 1.51 2.07 -1.15 0.16 116.25 119.92 2ksy h VAL 169 Ca 0.43 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.91 2ksy h VAL 169 Cb 0.23 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 2ksy h VAL 169 CO -0.19 0.00 -0.18 0.17 0.02 0.00 0.00 177.57 177.38 2ksy h LEU 170 N -0.58 0.00 -0.79 2.57 8.10 -1.44 -2.05 115.31 121.12 2ksy h LEU 170 Ca -0.05 0.00 -0.13 0.00 0.11 0.00 0.00 57.88 57.81 2ksy h LEU 170 Cb 0.46 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.67 2ksy h LEU 170 CO 0.06 0.18 -0.57 -0.50 -4.11 0.00 0.00 178.44 173.51 2ksy h TRP 171 N 0.00 0.13 0.00 0.17 4.06 -0.68 -2.58 115.95 117.06 2ksy h TRP 171 Ca -0.00 -0.05 0.00 0.00 2.06 0.00 0.00 58.89 60.90 2ksy h TRP 171 Cb 0.37 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 28.50 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 -2.45 2.06 0.13 1.49 0.00 0.03 -2.30 120.51 119.47 2ksy n ALA 172 Ca -0.02 -0.09 0.09 0.00 0.00 0.00 0.00 53.44 53.42 2ksy n ALA 172 Cb 0.58 -1.34 0.04 0.00 0.00 0.00 0.00 19.45 18.73 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 0.17 -0.20 0.00 1.08 -1.45 -3.37 117.51 113.75 2ksy h ILE 173 Ca 0.00 -1.29 0.05 0.00 -0.39 0.00 0.00 64.86 63.23 2ksy h ILE 173 Cb 0.22 1.82 -0.05 0.00 -3.07 0.00 0.00 36.82 35.74 2ksy h ILE 173 CO 0.00 0.10 -0.13 1.88 -0.69 0.00 0.00 178.15 179.31 2ksy h TYR 174 N 0.00 -0.31 -1.15 1.37 0.05 -1.56 -1.30 116.97 114.07 2ksy h TYR 174 Ca -0.03 0.02 0.33 0.00 0.05 0.00 0.00 58.73 59.11 2ksy h TYR 174 Cb 1.13 0.17 -0.05 0.00 1.01 0.00 0.00 36.73 39.00 2ksy h TYR 174 CO 0.00 -0.19 0.88 -1.35 -1.05 0.00 0.00 178.16 176.45 2ksy h PRO 175 N -0.12 0.00 0.00 4.88 0.11 -1.78 -0.38 132.00 134.72 2ksy h PRO 175 Ca 0.11 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.21 2ksy h PRO 175 Cb 0.29 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.40 2ksy h PRO 175 CO -0.27 0.00 -0.07 0.74 -0.21 0.00 0.00 178.00 178.19 2ksy h PHE 176 N 0.00 0.00 -0.41 0.65 0.04 -1.50 -3.13 116.94 112.59 2ksy h PHE 176 Ca 0.55 0.00 0.03 0.00 2.80 0.00 0.00 57.97 61.34 2ksy h PHE 176 Cb 2.31 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 40.43 2ksy h PHE 176 CO 0.00 1.01 0.22 0.82 -0.60 0.00 0.00 178.31 179.76 2ksy h ILE 177 N -1.00 1.00 -0.64 -0.55 1.08 -0.61 0.22 117.51 117.01 2ksy h ILE 177 Ca -0.02 -0.15 -0.03 0.00 -0.39 0.00 0.00 64.86 64.27 2ksy h ILE 177 Cb 1.00 0.52 -0.03 0.00 -3.07 0.00 0.00 36.82 35.25 2ksy h ILE 177 CO -0.01 0.08 0.30 -0.25 -0.69 0.00 0.00 178.15 177.58 2ksy h TRP 178 N 0.45 0.93 -0.03 1.37 7.01 -1.39 0.67 115.95 124.96 2ksy h TRP 178 Ca 0.17 -0.05 -0.01 0.00 2.11 0.00 0.00 58.89 61.11 2ksy h TRP 178 Cb 0.05 -0.29 -0.00 0.00 -2.10 0.00 0.00 29.16 26.82 2ksy h TRP 178 CO -0.09 0.71 -0.01 1.25 -2.79 0.00 0.00 178.44 177.51 2ksy h LEU 179 N 0.89 0.05 0.04 0.65 7.12 -1.40 -3.06 115.31 119.60 2ksy h LEU 179 Ca 0.22 -0.36 -0.00 0.00 0.13 0.00 0.00 57.88 57.87 2ksy h LEU 179 Cb 0.13 -0.01 0.00 0.00 -0.53 0.00 0.00 40.66 40.25 2ksy h LEU 179 CO -0.03 0.40 -0.02 -0.07 -0.13 0.00 0.00 178.44 178.60 2ksy h LEU 180 N -0.30 -0.04 0.00 2.25 3.38 -0.51 0.27 115.31 120.36 2ksy h LEU 180 Ca 0.01 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.32 2ksy h LEU 180 Cb 0.38 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2ksy h LEU 180 CO 0.00 0.72 0.00 0.61 0.09 0.00 0.00 178.44 179.86 2ksy n GLY 181 N 1.21 -1.64 2.81 0.83 0.00 0.23 -1.76 105.19 106.87 2ksy n GLY 181 Ca -0.08 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 2ksy n GLY 181 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ksy n PRO 182 N -0.29 0.32 0.00 1.61 -0.02 -1.15 -3.89 135.00 131.57 2ksy n PRO 182 Ca 0.00 -0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.13 2ksy n PRO 182 Cb 0.00 -1.20 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 2ksy n PRO 182 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2ksy n PRO 183 N 0.81 0.00 0.00 0.52 -0.02 -1.26 -3.26 135.00 131.79 2ksy n PRO 183 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 2ksy n PRO 183 Cb 0.15 -1.25 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 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 -0.50 -2.62 0.00 -1.23 0.00 -1.22 -4.60 105.19 95.02 2ksy n GLY 184 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.19 0.00 -3.42 1.61 0.24 0.95 -4.99 118.33 110.54 2ksy n VAL 185 Ca 0.00 -0.11 -0.32 0.00 -2.04 0.00 0.00 64.34 61.87 2ksy n VAL 185 Cb 0.00 1.33 0.03 0.00 -1.47 0.00 0.00 33.84 33.73 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 -0.13 -2.33 -0.11 2.33 0.00 -0.73 -4.95 120.51 114.60 2ksy n ALA 186 Ca 0.00 0.37 -0.24 0.00 0.00 0.00 0.00 53.44 53.57 2ksy n ALA 186 Cb 0.08 -2.17 -0.11 0.00 0.00 0.00 0.00 19.45 17.25 2ksy n ALA 186 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2ksy n LEU 187 N -0.02 1.93 0.00 0.00 4.77 -0.72 -5.02 117.00 117.94 2ksy n LEU 187 Ca -0.06 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 2ksy n LEU 187 Cb 0.64 -0.93 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 2ksy n LEU 187 CO 0.49 0.39 0.00 0.18 -1.33 0.00 0.00 177.39 177.13 2ksy n LEU 188 N -4.33 0.00 -4.75 2.23 4.77 -1.26 -5.10 117.00 108.57 2ksy n LEU 188 Ca -0.39 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.19 2ksy n LEU 188 Cb 0.76 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.80 2ksy n LEU 188 CO 0.15 -0.23 0.55 -0.89 -1.33 0.00 0.00 177.39 175.64 2ksy s THR 189 N 0.86 4.53 0.24 -5.08 2.01 -1.26 -4.95 115.64 112.00 2ksy s THR 189 Ca 0.00 1.82 -0.09 0.00 0.31 0.00 0.00 61.69 63.73 2ksy s THR 189 Cb 0.00 -4.20 0.29 0.00 0.01 0.00 0.00 72.50 68.60 2ksy s THR 189 CO 0.00 0.39 1.62 -0.65 -0.69 0.00 0.00 174.62 175.29 2ksy h PRO 190 N 5.24 0.05 -0.99 4.92 0.11 -1.99 0.32 132.00 139.67 2ksy h PRO 190 Ca -0.44 -0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.74 2ksy h PRO 190 Cb 1.21 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.24 2ksy h PRO 190 CO 0.70 0.03 0.64 0.00 -0.21 0.00 0.00 178.00 179.16 2ksy h THR 191 N 0.05 1.05 0.23 -1.15 1.03 -1.98 0.08 112.91 112.23 2ksy h THR 191 Ca 0.39 -0.38 -0.01 0.00 -0.01 0.00 0.00 66.41 66.40 2ksy h THR 191 Cb 0.66 -0.16 0.00 0.00 -1.07 0.00 0.00 68.15 67.58 2ksy h THR 191 CO -0.71 0.20 -0.11 0.58 -0.01 0.00 0.00 175.52 175.47 2ksy h VAL 192 N 1.11 0.83 -0.72 0.00 2.07 -1.36 -2.11 116.25 116.09 2ksy h VAL 192 Ca 0.44 -0.68 0.02 0.00 0.82 0.00 0.00 66.70 67.30 2ksy h VAL 192 Cb 0.24 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 2ksy h VAL 192 CO -0.18 0.14 0.46 0.44 0.02 0.00 0.00 177.57 178.45 2ksy h ASP 193 N -0.68 0.76 -0.56 0.57 3.32 -1.15 -1.65 116.42 117.03 2ksy h ASP 193 Ca -0.03 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 2ksy h ASP 193 Cb 0.47 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 2ksy h ASP 193 CO 0.05 0.53 0.33 0.58 -1.72 0.00 0.00 179.24 179.01 2ksy h VAL 194 N 0.90 1.17 -0.41 -1.35 2.07 -1.00 -2.02 116.25 115.62 2ksy h VAL 194 Ca 0.28 -0.42 0.02 0.00 0.82 0.00 0.00 66.70 67.40 2ksy h VAL 194 Cb -0.02 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.10 2ksy h VAL 194 CO -0.10 0.19 0.22 0.00 0.02 0.00 0.00 177.57 177.91 2ksy h ALA 195 N 1.56 0.51 -0.68 1.67 0.00 -0.58 0.04 119.26 121.78 2ksy h ALA 195 Ca 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 2ksy h ALA 195 Cb 0.01 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2ksy h ALA 195 CO -0.04 -0.12 0.28 -0.07 0.00 0.00 0.00 179.25 179.31 2ksy h LEU 196 N 0.45 0.90 0.68 0.00 3.38 -1.12 -0.85 115.31 118.76 2ksy h LEU 196 Ca 0.17 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2ksy h LEU 196 Cb 0.04 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.57 2ksy h LEU 196 CO -0.10 0.80 -0.33 0.40 0.09 0.00 0.00 178.44 179.30 2ksy h ILE 197 N 0.97 0.30 -0.86 1.22 1.08 -0.67 0.20 117.51 119.76 2ksy h ILE 197 Ca 0.23 -0.09 0.18 0.00 -0.39 0.00 0.00 64.86 64.79 2ksy h ILE 197 Cb 0.17 0.33 -0.06 0.00 -3.07 0.00 0.00 36.82 34.19 2ksy h ILE 197 CO -0.02 0.01 0.57 0.58 -0.69 0.00 0.00 178.15 178.60 2ksy h VAL 198 N -0.98 0.72 -0.14 1.67 2.07 -0.89 0.37 116.25 119.08 2ksy h VAL 198 Ca -0.09 -0.15 -0.13 0.00 0.82 0.00 0.00 66.70 67.15 2ksy h VAL 198 Cb 0.72 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 2ksy h VAL 198 CO 0.15 0.08 -0.47 0.22 0.02 0.00 0.00 177.57 177.57 2ksy h TYR 199 N 0.43 0.41 -0.26 1.57 3.20 -0.57 -2.07 116.97 119.68 2ksy h TYR 199 Ca 0.44 -0.13 -0.08 0.00 3.14 0.00 0.00 58.73 62.10 2ksy h TYR 199 Cb 1.06 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.24 2ksy h TYR 199 CO -0.00 0.75 -0.17 -0.07 -1.64 0.00 0.00 178.16 177.03 2ksy h LEU 200 N 0.28 0.60 -0.83 2.82 3.38 0.29 0.45 115.31 122.30 2ksy h LEU 200 Ca 0.02 -0.43 -0.10 0.00 0.09 0.00 0.00 57.88 57.45 2ksy h LEU 200 Cb 0.93 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 2ksy h LEU 200 CO 0.08 0.90 -0.22 0.44 0.09 0.00 0.00 178.44 179.73 2ksy h ASP 201 N 0.30 0.63 0.84 -0.43 3.32 -1.25 -2.69 116.42 117.15 2ksy h ASP 201 Ca 0.05 -0.22 -0.12 0.00 0.02 0.00 0.00 57.03 56.76 2ksy h ASP 201 Cb 0.70 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.06 2ksy h ASP 201 CO 0.05 0.85 -0.59 -0.07 -1.72 0.00 0.00 179.24 177.75 2ksy h LEU 202 N 0.56 0.00 -0.05 1.55 3.38 -1.27 -3.24 115.31 116.23 2ksy h LEU 202 Ca 0.08 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.80 2ksy h LEU 202 Cb 0.68 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.44 2ksy h LEU 202 CO 0.05 0.59 -1.07 1.62 0.09 0.00 0.00 178.44 179.73 2ksy h VAL 203 N 0.00 1.41 0.00 1.22 3.04 -0.71 -2.36 116.25 118.85 2ksy h VAL 203 Ca -0.01 -2.61 0.00 0.00 -1.01 0.00 0.00 66.70 63.07 2ksy h VAL 203 Cb 1.17 2.60 0.00 0.00 -2.01 0.00 0.00 31.29 33.05 2ksy h VAL 203 CO 0.08 0.78 0.00 0.41 -1.01 0.00 0.00 177.57 177.82 2ksy n THR 204 N -3.70 0.00 0.00 3.17 -1.04 -1.03 0.01 114.28 111.69 2ksy n THR 204 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 2ksy n THR 204 Cb 0.91 -0.30 0.00 0.00 -1.82 0.00 0.00 70.33 69.11 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 -0.57 0.00 0.41 12.58 0.31 -0.89 -1.92 118.33 128.25 2ksy n VAL 206 Ca 0.02 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.17 2ksy n VAL 206 Cb 0.01 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.85 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 -1.21 2.00 2.92 0.00 -0.51 -0.92 103.07 105.35 2ksy h GLY 207 Ca 0.00 0.47 -0.10 0.00 0.00 0.00 0.00 47.33 47.71 2ksy h GLY 207 CO 0.00 -0.42 -0.46 0.27 0.00 0.00 0.00 176.54 175.93 2ksy h PHE 208 N -1.10 0.00 -0.32 5.60 -5.15 -1.52 -2.78 116.94 111.67 2ksy h PHE 208 Ca -0.10 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.61 2ksy h PHE 208 Cb 0.86 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.02 2ksy h PHE 208 CO -0.02 0.46 -0.02 0.78 -2.00 0.00 0.00 178.31 177.50 2ksy h GLY 209 N 1.99 0.53 0.43 6.09 0.00 -1.71 1.57 103.07 111.96 2ksy h GLY 209 Ca -0.00 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 2ksy h GLY 209 CO 0.06 0.29 -0.10 0.74 0.00 0.00 0.00 176.54 177.53 2ksy h PHE 210 N 0.47 0.14 0.00 5.60 0.04 -0.96 -1.69 116.94 120.54 2ksy h PHE 210 Ca 0.10 -0.06 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 2ksy h PHE 210 Cb 0.34 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.47 2ksy h PHE 210 CO 0.01 0.77 -0.07 0.82 -0.60 0.00 0.00 178.31 179.24 2ksy h ILE 211 N -0.53 0.85 -0.64 -0.55 2.04 -1.29 -0.97 117.51 116.42 2ksy h ILE 211 Ca -0.01 -0.25 -0.05 0.00 1.00 0.00 0.00 64.86 65.56 2ksy h ILE 211 Cb 0.78 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 2ksy h ILE 211 CO 0.02 0.07 0.22 0.00 0.00 0.00 0.00 178.15 178.46 2ksy h ALA 212 N 1.93 0.84 0.22 1.87 0.00 0.25 -1.67 119.26 122.70 2ksy h ALA 212 Ca -0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2ksy h ALA 212 Cb 0.13 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2ksy h ALA 212 CO 0.01 0.49 -0.10 -0.07 0.00 0.00 0.00 179.25 179.57 2ksy h LEU 213 N 0.92 -0.25 -0.06 0.00 3.38 -0.26 -2.37 115.31 116.67 2ksy h LEU 213 Ca 0.21 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.94 2ksy h LEU 213 Cb 0.26 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 2ksy h LEU 213 CO -0.01 0.22 -0.29 -0.78 0.09 0.00 0.00 178.44 177.67 2ksy h ASP 214 N -0.79 -0.88 0.52 -0.43 3.58 -1.33 0.14 116.42 117.22 2ksy h ASP 214 Ca -0.03 0.12 -0.02 0.00 0.42 0.00 0.00 57.03 57.53 2ksy h ASP 214 Cb 0.51 0.37 -0.01 0.00 1.72 0.00 0.00 39.33 41.92 2ksy h ASP 214 CO 0.05 -0.35 -0.37 0.00 -2.88 0.00 0.00 179.24 175.69 2ksy h ALA 215 N 0.41 -0.89 -0.87 -0.78 0.00 -1.41 -2.18 119.26 113.53 2ksy h ALA 215 Ca 0.08 -0.17 0.12 0.00 0.00 0.00 0.00 54.91 54.94 2ksy h ALA 215 Cb 0.52 0.48 -0.07 0.00 0.00 0.00 0.00 17.79 18.73 2ksy h ALA 215 CO -0.29 -1.02 0.56 0.00 0.00 0.00 0.00 179.25 178.50 2ksy h ALA 216 N -0.51 1.75 -0.25 0.00 0.00 -1.29 0.10 119.26 119.07 2ksy h ALA 216 Ca -0.06 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2ksy h ALA 216 Cb 0.72 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2ksy h ALA 216 CO 0.03 0.04 0.03 0.00 0.00 0.00 0.00 179.25 179.35 2ksy h ALA 217 N 1.58 1.60 0.02 0.00 0.00 -0.36 -1.49 119.26 120.61 2ksy h ALA 217 Ca 0.42 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.98 2ksy h ALA 217 Cb 0.56 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 18.26 2ksy h ALA 217 CO -0.18 0.30 -0.90 1.15 0.00 0.00 0.00 179.25 179.61 2ksy h THR 218 N 0.35 1.34 -0.07 0.00 2.02 -0.23 -1.59 112.91 114.74 2ksy h THR 218 Ca 0.08 -2.22 -0.02 0.00 0.77 0.00 0.00 66.41 65.03 2ksy h THR 218 Cb 0.19 2.52 -0.01 0.00 -1.74 0.00 0.00 68.15 69.11 2ksy h THR 218 CO 0.00 0.67 -0.04 -0.07 0.37 0.00 0.00 175.52 176.45 2ksy h LEU 219 N 0.18 0.09 0.04 2.58 3.38 -0.81 -1.02 115.31 119.74 2ksy h LEU 219 Ca -0.12 -0.01 -0.26 0.00 0.09 0.00 0.00 57.88 57.58 2ksy h LEU 219 Cb 1.59 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 42.29 2ksy h LEU 219 CO 0.18 0.15 -1.33 -0.09 0.09 0.00 0.00 178.44 177.44 2ksy h ARG 220 N 0.10 0.08 0.00 1.13 2.43 -1.29 -2.80 114.38 114.03 2ksy h ARG 220 Ca 0.02 -0.13 -0.04 0.00 -0.81 0.00 0.00 59.98 59.03 2ksy h ARG 220 Cb 0.15 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 2ksy h ARG 220 CO 0.01 0.90 -0.19 0.00 -1.51 0.00 0.00 179.97 179.18 2ksy h ALA 221 N 0.85 0.99 0.00 2.80 0.00 -0.55 -3.07 119.26 120.28 2ksy h ALA 221 Ca -0.15 -0.17 -0.26 0.00 0.00 0.00 0.00 54.91 54.33 2ksy h ALA 221 Cb 1.91 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 19.62 2ksy h ALA 221 CO 0.13 0.23 -1.76 -0.85 0.00 0.00 0.00 179.25 177.00 2ksy n GLU 222 N -3.30 0.64 -2.03 0.00 0.28 -0.46 -5.07 120.64 110.70 2ksy n GLU 222 Ca 0.01 0.21 0.00 0.00 -0.16 0.00 0.00 57.16 57.22 2ksy n GLU 222 Cb 0.44 -1.74 0.00 0.00 1.43 0.00 0.00 31.44 31.57 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 -2.93 -3.90 -2.92 -1.84 8.25 -1.06 -5.06 115.22 105.76 2ksy n HIS 223 Ca -0.17 2.32 -0.02 0.00 -0.26 0.00 0.00 57.72 59.59 2ksy n HIS 223 Cb 1.00 -3.47 0.00 0.00 1.12 0.00 0.00 29.99 28.65 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 -0.47 -1.34 0.27 -1.41 0.00 -1.26 -4.93 107.32 98.18 2ksy s GLY 224 Ca 0.00 0.01 -0.30 0.00 0.00 0.00 0.00 44.72 44.43 2ksy s GLY 224 CO 0.00 3.76 1.50 1.85 0.00 0.00 0.00 173.10 180.20 2ksy s GLU 225 N 1.31 4.21 1.24 2.90 2.56 -1.26 -4.36 118.70 125.31 2ksy s GLU 225 Ca 0.23 2.41 0.00 0.00 0.00 0.00 0.00 54.97 57.61 2ksy s GLU 225 Cb -0.00 -3.08 0.00 0.00 2.00 0.00 0.00 34.13 33.05 2ksy s GLU 225 CO -0.07 -0.50 0.00 0.43 -0.56 0.00 0.00 175.26 174.56 2ksy n SER 226 N 2.24 0.00 -4.40 -1.70 7.64 -1.26 -4.47 113.62 111.66 2ksy n SER 226 Ca 0.07 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.62 2ksy n SER 226 Cb 0.39 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.45 2ksy n SER 226 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2ksy s LEU 227 N 0.00 2.86 0.00 -3.43 2.96 -1.26 -4.81 118.68 115.00 2ksy s LEU 227 Ca 0.00 -0.28 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 2ksy s LEU 227 Cb 0.00 -1.66 0.12 0.00 0.50 0.00 0.00 46.19 45.15 2ksy s LEU 227 CO 0.00 0.16 0.87 0.00 -1.32 0.00 0.00 176.35 176.06 2ksy n ALA 228 N 3.55 0.66 -3.10 5.97 0.00 -1.26 -4.92 120.51 121.41 2ksy n ALA 228 Ca -0.18 -1.94 -0.39 0.00 0.00 0.00 0.00 53.44 50.93 2ksy n ALA 228 Cb 0.53 0.42 -0.12 0.00 0.00 0.00 0.00 19.45 20.28 2ksy n ALA 228 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2ksy s GLY 229 N -4.77 1.90 0.22 0.00 0.00 -1.26 -5.01 107.32 98.40 2ksy s GLY 229 Ca 0.61 -1.81 -0.30 0.00 0.00 0.00 0.00 44.72 43.22 2ksy s GLY 229 CO 0.40 0.83 1.23 0.14 0.00 0.00 0.00 173.10 175.70 2ksy s VAL 230 N 1.46 3.33 -0.39 1.40 1.01 -1.26 -4.96 120.40 120.98 2ksy s VAL 230 Ca 0.00 1.17 -0.29 0.00 0.00 0.00 0.00 61.98 62.87 2ksy s VAL 230 Cb -0.20 -3.75 0.01 0.00 0.00 0.00 0.00 36.38 32.44 2ksy s VAL 230 CO 0.04 0.21 1.31 -1.81 0.00 0.00 0.00 175.10 174.85 2ksy s ASP 231 N -0.05 6.51 0.00 3.32 1.01 -1.26 -4.79 116.67 121.41 2ksy s ASP 231 Ca 0.52 0.86 0.00 0.00 0.71 0.00 0.00 52.55 54.64 2ksy s ASP 231 Cb -0.35 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.04 2ksy s ASP 231 CO 0.40 -1.28 0.00 0.35 0.21 0.00 0.00 175.17 174.85 2ksy n THR 232 N 6.75 0.00 -3.13 -1.27 -2.24 -1.26 -5.02 114.28 108.11 2ksy n THR 232 Ca 0.15 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.53 2ksy n THR 232 Cb 0.48 -1.29 -0.06 0.00 -2.10 0.00 0.00 70.33 67.37 2ksy n THR 232 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ksy s ASP 233 N -4.85 6.74 0.50 3.42 2.15 -1.26 -5.05 116.67 118.31 2ksy s ASP 233 Ca 0.00 0.90 -0.21 0.00 0.43 0.00 0.00 52.55 53.67 2ksy s ASP 233 Cb 0.00 -2.35 -0.07 0.00 -0.30 0.00 0.00 42.92 40.20 2ksy s ASP 233 CO 0.00 -0.20 1.10 0.42 -0.17 0.00 0.00 175.17 176.32 2ksy s THR 234 N 1.51 3.40 0.15 1.71 -4.23 -1.26 -4.97 115.64 111.96 2ksy s THR 234 Ca 0.30 0.92 -0.09 0.00 -1.18 0.00 0.00 61.69 61.64 2ksy s THR 234 Cb -0.16 -3.40 -0.05 0.00 1.34 0.00 0.00 72.50 70.23 2ksy s THR 234 CO 0.12 -0.14 1.48 1.55 -0.54 0.00 0.00 174.62 177.09 2ksy h PRO 235 N 1.59 0.85 -6.04 3.99 0.13 -2.04 -3.44 132.00 127.04 2ksy h PRO 235 Ca -0.50 -0.47 -0.66 0.00 -0.87 0.00 0.00 66.00 63.51 2ksy h PRO 235 Cb 1.24 0.03 -0.11 0.00 0.13 0.00 0.00 31.00 32.29 2ksy h PRO 235 CO 0.59 1.11 -0.59 0.00 -0.23 0.00 0.00 178.00 178.87 2ksy s ALA 236 N -4.30 3.51 -0.21 -0.56 0.00 -1.26 -5.10 121.76 113.84 2ksy s ALA 236 Ca -0.10 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 50.97 2ksy s ALA 236 Cb 0.11 -1.52 0.02 0.00 0.00 0.00 0.00 23.12 21.74 2ksy s ALA 236 CO 0.87 0.68 -0.14 0.08 0.00 0.00 0.00 175.76 177.25 2ksy s VAL 237 N -1.17 2.39 0.01 0.00 1.01 -1.26 -4.95 120.40 116.42 2ksy s VAL 237 Ca 0.22 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.20 2ksy s VAL 237 Cb -0.12 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.15 2ksy s VAL 237 CO 0.13 0.38 0.00 0.00 0.00 0.00 0.00 175.10 175.61 2ksy n ALA 238 N 4.62 3.00 -2.64 5.51 0.00 -1.26 -5.13 120.51 124.62 2ksy n ALA 238 Ca -0.19 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.20 2ksy n ALA 238 Cb 0.48 0.35 -0.04 0.00 0.00 0.00 0.00 19.45 20.24 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 -2.87 -1.29 0.00 0.00 8.00 -1.26 -4.99 116.55 114.14 2ksy n ASP 239 Ca 0.00 1.34 0.00 0.00 0.71 0.00 0.00 54.79 56.84 2ksy n ASP 239 Cb 0.34 -4.92 0.00 0.00 -0.02 0.00 0.00 41.12 36.52 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 1.82 0.12 -4.69 0.64 4.77 -1.26 -5.04 117.00 113.36 2ksy n LEU 240 Ca -0.38 -0.39 -0.42 0.00 -0.03 0.00 0.00 56.01 54.79 2ksy n LEU 240 Cb 0.58 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.64 2ksy n LEU 240 CO 0.35 0.03 1.23 -0.70 -1.33 0.00 0.00 177.39 176.97 2ksy s GLU 241 N -0.53 4.24 -0.36 3.23 2.56 -1.26 -4.97 118.70 121.62 2ksy s GLU 241 Ca 0.00 2.18 -0.24 0.00 0.00 0.00 0.00 54.97 56.90 2ksy s GLU 241 Cb 0.00 -3.56 0.01 0.00 2.00 0.00 0.00 34.13 32.58 2ksy s GLU 241 CO 0.00 -0.66 0.84 -1.58 -0.56 0.00 0.00 175.26 173.30 2ksy s HIS 242 N 2.44 3.12 0.03 5.30 5.65 -1.26 -5.03 115.29 125.53 2ksy s HIS 242 Ca 0.69 0.68 0.02 0.00 0.25 0.00 0.00 55.06 56.70 2ksy s HIS 242 Cb -0.36 -3.47 -0.02 0.00 -1.18 0.00 0.00 32.58 27.55 2ksy s HIS 242 CO 0.30 -0.74 -0.06 -3.38 -0.65 0.00 0.00 174.74 170.21 2ksy s HIS 243 N 3.22 0.50 0.35 3.88 -3.43 -1.26 -5.16 115.29 113.40 2ksy s HIS 243 Ca 0.34 -0.39 -0.04 0.00 -0.80 0.00 0.00 55.06 54.17 2ksy s HIS 243 Cb -0.13 -0.31 -0.05 0.00 -1.43 0.00 0.00 32.58 30.66 2ksy s HIS 243 CO 0.17 -0.08 0.62 -3.38 -2.00 0.00 0.00 174.74 170.07 2ksy s HIS 244 N -1.04 3.50 0.90 0.38 -3.43 -1.26 -5.07 115.29 109.26 2ksy s HIS 244 Ca -0.08 0.65 -0.11 0.00 -0.80 0.00 0.00 55.06 54.73 2ksy s HIS 244 Cb -0.08 -2.13 0.13 0.00 -1.43 0.00 0.00 32.58 29.08 2ksy s HIS 244 CO -0.00 0.04 1.11 -3.38 -2.00 0.00 0.00 174.74 170.51 2ksy s HIS 245 N -2.29 1.95 0.20 0.38 -3.43 -1.26 -5.05 115.29 105.78 2ksy s HIS 245 Ca 0.44 1.59 0.11 0.00 -0.80 0.00 0.00 55.06 56.41 2ksy s HIS 245 Cb -0.10 -3.21 -0.04 0.00 -1.43 0.00 0.00 32.58 27.79 2ksy s HIS 245 CO 0.34 -2.60 -0.24 -1.01 -2.00 0.00 0.00 174.74 169.24 2ksy s HIS 246 N -2.74 2.28 -2.00 0.38 3.76 -1.26 -5.36 115.29 110.36 2ksy s HIS 246 Ca 0.65 -0.36 0.09 0.00 -0.15 0.00 0.00 55.06 55.28 2ksy s HIS 246 Cb -0.21 -1.12 0.51 0.00 1.11 0.00 0.00 32.58 32.87 2ksy s HIS 246 CO 0.58 0.50 0.96 0.72 -0.85 0.00 0.00 174.74 176.65