#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hlg s HIS -10 N 0.00 3.04 -0.10 1.57 4.02 -1.26 -5.07 115.29 117.49 3hlg s HIS -10 Ca 0.00 0.23 -0.21 0.00 1.02 0.00 0.00 55.06 56.10 3hlg s HIS -10 Cb 0.00 -2.69 -0.04 0.00 -1.02 0.00 0.00 32.58 28.83 3hlg s HIS -10 CO 0.00 -0.80 0.60 -1.12 1.02 0.00 0.00 174.74 174.44 3hlg s SER -9 N -4.36 6.84 -0.07 1.40 0.01 -1.26 -5.00 113.70 111.25 3hlg s SER -9 Ca 0.55 1.01 -0.35 0.00 1.31 0.00 0.00 55.95 58.46 3hlg s SER -9 Cb -0.10 -2.35 -0.13 0.00 0.21 0.00 0.00 66.02 63.65 3hlg s SER -9 CO 0.40 -0.07 1.79 -0.24 0.41 0.00 0.00 173.24 175.53 3hlg n SER -8 N 3.79 3.16 0.00 2.44 2.88 -1.26 -1.82 113.62 122.82 3hlg n SER -8 Ca -0.04 1.01 0.00 0.00 -1.33 0.00 0.00 58.87 58.51 3hlg n SER -8 Cb 0.51 -1.34 0.00 0.00 -0.75 0.00 0.00 64.21 62.64 3hlg n SER -8 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hlg n GLY -7 N 4.15 0.82 3.39 0.46 0.00 -1.26 -5.03 105.19 107.71 3hlg n GLY -7 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 3hlg n GLY -7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hlg s LEU -6 N 0.00 2.40 0.24 0.99 1.43 -0.75 -5.10 118.68 117.89 3hlg s LEU -6 Ca 0.00 -0.34 -0.31 0.00 -1.03 0.00 0.00 54.13 52.45 3hlg s LEU -6 Cb 0.00 -1.45 -0.12 0.00 0.03 0.00 0.00 46.19 44.65 3hlg s LEU -6 CO 0.00 0.32 1.66 0.52 0.23 0.00 0.00 176.35 179.08 3hlg n VAL -5 N 2.45 0.45 -2.35 -1.59 0.31 -1.26 -4.63 118.33 111.71 3hlg n VAL -5 Ca -0.17 -0.11 -0.36 0.00 -0.01 0.00 0.00 64.34 63.69 3hlg n VAL -5 Cb 0.52 -1.95 -0.03 0.00 -0.91 0.00 0.00 33.84 31.47 3hlg n VAL -5 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3hlg s PRO -4 N 0.42 3.28 0.79 5.55 0.04 -1.26 -4.94 135.00 138.88 3hlg s PRO -4 Ca 0.70 -1.40 -0.10 0.00 0.04 0.00 0.00 61.00 60.25 3hlg s PRO -4 Cb -0.51 -5.36 0.18 0.00 0.04 0.00 0.00 34.50 28.84 3hlg s PRO -4 CO 0.40 -2.94 1.08 0.54 0.04 0.00 0.00 177.00 176.11 3hlg n ARG -3 N 8.49 -0.77 -1.72 4.56 5.12 -1.26 -5.01 116.66 126.07 3hlg n ARG -3 Ca 0.44 -2.03 -0.43 0.00 -1.93 0.00 0.00 57.85 53.91 3hlg n ARG -3 Cb 0.47 -1.00 -0.03 0.00 -1.16 0.00 0.00 32.46 30.74 3hlg n ARG -3 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3hlg n GLY -2 N -2.41 1.36 0.01 -0.13 0.00 -1.26 -4.92 105.19 97.83 3hlg n GLY -2 Ca 0.15 0.56 0.07 0.00 0.00 0.00 0.00 46.02 46.79 3hlg n GLY -2 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hlg n SER -1 N 3.11 1.64 -3.29 1.61 3.41 -1.26 -4.84 113.62 113.99 3hlg n SER -1 Ca 0.13 -0.14 -0.18 0.00 -0.26 0.00 0.00 58.87 58.42 3hlg n SER -1 Cb 0.35 1.52 -0.07 0.00 -0.26 0.00 0.00 64.21 65.75 3hlg n SER -1 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 3hlg s HIS 0 N -2.84 1.57 0.45 7.33 -3.43 -1.26 -5.06 115.29 112.05 3hlg s HIS 0 Ca -0.03 -1.57 0.16 0.00 -0.80 0.00 0.00 55.06 52.82 3hlg s HIS 0 Cb 0.09 -0.53 1.07 0.00 -1.43 0.00 0.00 32.58 31.78 3hlg s HIS 0 CO 0.57 -0.96 2.01 0.52 -2.00 0.00 0.00 174.74 174.88 3hlg h MET 1 N 2.12 0.00 -0.10 -0.38 0.00 -1.99 -2.17 114.93 112.41 3hlg h MET 1 Ca -0.26 0.00 -0.01 0.00 0.00 0.00 0.00 59.70 59.43 3hlg h MET 1 Cb 1.23 0.00 -0.00 0.00 0.00 0.00 0.00 31.60 32.83 3hlg h MET 1 CO 0.37 0.17 0.02 0.78 0.00 0.00 0.00 176.91 178.25 3hlg h GLY 2 N 0.55 0.18 -0.49 8.32 0.00 -2.00 -2.69 103.07 106.92 3hlg h GLY 2 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.22 3hlg h GLY 2 CO 0.02 0.10 0.00 -1.14 0.00 0.00 0.00 176.54 175.52 3hlg n SER 3 N -4.87 1.44 -0.10 0.19 3.41 -1.14 -3.17 113.62 109.38 3hlg n SER 3 Ca -0.06 -1.55 -0.16 0.00 -0.26 0.00 0.00 58.87 56.84 3hlg n SER 3 Cb 0.15 -0.04 -0.13 0.00 -0.26 0.00 0.00 64.21 63.92 3hlg n SER 3 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3hlg n ILE 4 N 0.14 1.51 -0.16 -1.33 5.41 -0.83 -3.01 119.36 121.10 3hlg n ILE 4 Ca 0.18 -0.68 -0.10 0.00 1.00 0.00 0.00 62.75 63.15 3hlg n ILE 4 Cb 0.32 -1.18 -0.01 0.00 -0.71 0.00 0.00 39.64 38.06 3hlg n ILE 4 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3hlg h ILE 5 N 0.01 1.26 0.00 1.39 2.04 -1.59 -3.00 117.51 117.63 3hlg h ILE 5 Ca -0.53 -1.06 -0.05 0.00 1.00 0.00 0.00 64.86 64.22 3hlg h ILE 5 Cb 2.02 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 39.15 3hlg h ILE 5 CO -0.02 0.36 -0.22 0.44 0.00 0.00 0.00 178.15 178.71 3hlg h ASP 6 N 0.64 0.00 0.06 1.72 5.19 -1.75 -2.90 116.42 119.38 3hlg h ASP 6 Ca 0.13 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.53 3hlg h ASP 6 Cb 0.51 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.02 3hlg h ASP 6 CO 0.02 0.22 -0.05 0.00 -3.12 0.00 0.00 179.24 176.32 3hlg h ALA 7 N 1.78 1.81 -2.76 3.45 0.00 -1.43 -3.37 119.26 118.73 3hlg h ALA 7 Ca -0.00 -0.04 -0.71 0.00 0.00 0.00 0.00 54.91 54.15 3hlg h ALA 7 Cb 0.88 -0.01 -0.25 0.00 0.00 0.00 0.00 17.79 18.41 3hlg h ALA 7 CO 0.03 0.06 -0.49 0.00 0.00 0.00 0.00 179.25 178.85 3hlg s ALA 8 N -4.85 3.30 0.61 0.00 0.00 -1.10 -5.08 121.76 114.65 3hlg s ALA 8 Ca -0.05 -1.86 -0.17 0.00 0.00 0.00 0.00 51.96 49.88 3hlg s ALA 8 Cb 0.16 -2.65 -0.02 0.00 0.00 0.00 0.00 23.12 20.61 3hlg s ALA 8 CO 0.65 -1.49 1.15 0.00 0.00 0.00 0.00 175.76 176.07 3hlg s ALA 9 N 1.53 2.53 0.56 0.00 0.00 -1.26 -4.92 121.76 120.19 3hlg s ALA 9 Ca 0.02 0.79 -0.21 0.00 0.00 0.00 0.00 51.96 52.56 3hlg s ALA 9 Cb -0.21 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.49 3hlg s ALA 9 CO 0.06 -1.14 1.26 0.00 0.00 0.00 0.00 175.76 175.94 3hlg n ALA 10 N -1.86 1.19 -2.12 0.00 0.00 -1.26 -4.91 120.51 111.55 3hlg n ALA 10 Ca 0.12 0.10 -0.42 0.00 0.00 0.00 0.00 53.44 53.23 3hlg n ALA 10 Cb 0.51 -2.29 -0.03 0.00 0.00 0.00 0.00 19.45 17.64 3hlg n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hlg s ALA 11 N -1.34 3.62 1.03 0.00 0.00 -1.26 -5.02 121.76 118.79 3hlg s ALA 11 Ca 0.73 0.93 -0.16 0.00 0.00 0.00 0.00 51.96 53.46 3hlg s ALA 11 Cb -0.42 -3.66 0.21 0.00 0.00 0.00 0.00 23.12 19.25 3hlg s ALA 11 CO 0.48 -1.11 1.21 0.20 0.00 0.00 0.00 175.76 176.54 3hlg s GLY 12 N 2.42 1.67 0.27 0.00 0.00 -1.26 -4.79 107.32 105.62 3hlg s GLY 12 Ca 0.68 -0.97 -0.00 0.00 0.00 0.00 0.00 44.72 44.43 3hlg s GLY 12 CO 0.27 -0.21 1.75 -2.55 0.00 0.00 0.00 173.10 172.36 3hlg h PRO 13 N -1.92 0.56 -0.15 2.90 0.11 -1.95 -2.28 132.00 129.27 3hlg h PRO 13 Ca -0.46 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 3hlg h PRO 13 Cb 1.28 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 3hlg h PRO 13 CO 0.42 0.37 -0.06 0.28 -0.21 0.00 0.00 178.00 178.80 3hlg h VAL 14 N 0.58 1.31 -0.78 3.15 2.07 -1.93 -1.33 116.25 119.31 3hlg h VAL 14 Ca 0.48 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.93 3hlg h VAL 14 Cb 0.73 1.70 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 3hlg h VAL 14 CO -0.39 0.31 0.49 0.58 0.02 0.00 0.00 177.57 178.59 3hlg h VAL 15 N -0.02 1.21 -0.68 2.57 2.07 -1.88 -0.72 116.25 118.80 3hlg h VAL 15 Ca 0.04 -0.42 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 3hlg h VAL 15 Cb 0.51 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 3hlg h VAL 15 CO 0.02 0.21 0.28 -0.07 0.02 0.00 0.00 177.57 178.03 3hlg h LEU 16 N 1.06 0.91 -0.43 2.57 3.38 -1.33 -2.34 115.31 119.13 3hlg h LEU 16 Ca 0.28 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.05 3hlg h LEU 16 Cb -0.08 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.42 3hlg h LEU 16 CO -0.06 0.81 -0.06 -0.03 0.09 0.00 0.00 178.44 179.19 3hlg h MET 17 N 0.98 0.80 -0.98 1.13 4.05 -0.78 -2.56 114.93 117.57 3hlg h MET 17 Ca 0.23 -0.28 0.05 0.00 -0.28 0.00 0.00 59.70 59.41 3hlg h MET 17 Cb 0.18 -0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 30.86 3hlg h MET 17 CO -0.02 0.90 0.64 0.93 0.23 0.00 0.00 176.91 179.58 3hlg h GLU 18 N 0.63 1.16 -0.64 0.39 5.08 -0.87 -1.91 114.58 118.43 3hlg h GLU 18 Ca 0.12 -0.07 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 3hlg h GLU 18 Cb 0.57 -0.26 -0.04 0.00 0.50 0.00 0.00 28.75 29.52 3hlg h GLU 18 CO 0.03 0.77 0.40 1.15 -1.00 0.00 0.00 179.01 180.36 3hlg h THR 19 N 1.20 1.08 -0.57 1.13 2.02 -1.19 -0.68 112.91 115.90 3hlg h THR 19 Ca 0.40 -0.27 0.07 0.00 0.77 0.00 0.00 66.41 67.38 3hlg h THR 19 Cb 0.07 0.23 -0.06 0.00 -1.74 0.00 0.00 68.15 66.65 3hlg h THR 19 CO -0.14 0.14 0.25 0.00 0.37 0.00 0.00 175.52 176.15 3hlg h ALA 20 N 1.28 0.73 -0.11 6.16 0.00 -0.96 0.11 119.26 126.47 3hlg h ALA 20 Ca 0.26 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 3hlg h ALA 20 Cb 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3hlg h ALA 20 CO -0.11 -0.13 0.06 0.74 0.00 0.00 0.00 179.25 179.82 3hlg h PHE 21 N 0.47 0.15 -0.62 0.00 0.04 -0.98 -0.97 116.94 115.04 3hlg h PHE 21 Ca 0.27 -0.00 0.05 0.00 2.80 0.00 0.00 57.97 61.08 3hlg h PHE 21 Cb 0.25 -0.05 -0.05 0.00 2.20 0.00 0.00 35.95 38.30 3hlg h PHE 21 CO -0.13 0.19 0.35 0.00 -0.60 0.00 0.00 178.31 178.11 3hlg h ARG 22 N 0.07 0.64 -0.42 1.51 3.08 -0.85 -1.72 114.38 116.69 3hlg h ARG 22 Ca 0.04 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 3hlg h ARG 22 Cb 0.09 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 3hlg h ARG 22 CO -0.01 0.42 -0.00 0.87 -1.07 0.00 0.00 179.97 180.18 3hlg h LYS 23 N 0.66 0.69 -0.70 0.04 1.57 -0.86 0.22 116.57 118.18 3hlg h LYS 23 Ca 0.27 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 3hlg h LYS 23 Cb 0.14 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 3hlg h LYS 23 CO -0.16 0.71 0.24 0.00 -0.57 0.00 0.00 179.45 179.67 3hlg h ALA 24 N 1.35 1.10 -0.09 3.86 0.00 -0.58 0.44 119.26 125.35 3hlg h ALA 24 Ca 0.13 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3hlg h ALA 24 Cb 0.41 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3hlg h ALA 24 CO 0.02 0.62 -0.06 0.28 0.00 0.00 0.00 179.25 180.10 3hlg h VAL 25 N 1.03 1.35 -0.77 0.00 2.07 -0.99 0.17 116.25 119.11 3hlg h VAL 25 Ca 0.23 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 3hlg h VAL 25 Cb 0.26 1.92 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 3hlg h VAL 25 CO -0.01 0.32 0.41 -0.33 0.02 0.00 0.00 177.57 177.98 3hlg h GLU 26 N -0.20 1.07 -0.08 1.57 5.08 -0.76 -1.17 114.58 120.09 3hlg h GLU 26 Ca 0.02 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 3hlg h GLU 26 Cb 0.55 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3hlg h GLU 26 CO 0.02 0.79 0.00 -1.13 -1.00 0.00 0.00 179.01 177.69 3hlg n SER 27 N -4.35 0.73 -1.44 1.42 3.41 0.13 -4.92 113.62 108.60 3hlg n SER 27 Ca 0.08 -1.59 -0.15 0.00 -0.26 0.00 0.00 58.87 56.95 3hlg n SER 27 Cb 0.10 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 63.97 3hlg n SER 27 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3hlg n ARG 28 N -0.29 -1.12 0.07 4.33 5.12 -0.44 -4.92 116.66 119.42 3hlg n ARG 28 Ca 0.14 0.86 -0.11 0.00 -1.93 0.00 0.00 57.85 56.81 3hlg n ARG 28 Cb 0.17 -5.10 -0.02 0.00 -1.16 0.00 0.00 32.46 26.35 3hlg n ARG 28 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 3hlg h GLN 29 N 0.00 0.34 -5.38 5.56 4.20 -1.19 -3.45 115.11 115.19 3hlg h GLN 29 Ca -0.33 -0.35 -0.41 0.00 0.06 0.00 0.00 58.65 57.62 3hlg h GLN 29 Cb 1.13 0.10 -0.18 0.00 0.30 0.00 0.00 27.48 28.83 3hlg h GLN 29 CO 0.43 1.03 -0.75 0.96 -0.67 0.00 0.00 178.83 179.83 3hlg s ILE 30 N -3.31 1.33 0.01 2.54 -4.36 -1.11 -4.96 121.20 111.34 3hlg s ILE 30 Ca -0.05 -1.79 -0.22 0.00 -0.26 0.00 0.00 60.65 58.33 3hlg s ILE 30 Cb 0.09 -1.60 -0.17 0.00 1.25 0.00 0.00 42.46 42.03 3hlg s ILE 30 CO 0.85 -0.47 1.27 1.55 0.24 0.00 0.00 174.94 178.39 3hlg h PRO 31 N 3.37 0.25 0.00 0.37 0.14 -1.88 -3.39 132.00 130.86 3hlg h PRO 31 Ca -0.39 -0.15 0.29 0.00 0.14 0.00 0.00 66.00 65.89 3hlg h PRO 31 Cb 1.20 0.01 -0.05 0.00 0.14 0.00 0.00 31.00 32.30 3hlg h PRO 31 CO 0.53 0.72 0.73 0.41 0.14 0.00 0.00 178.00 180.52 3hlg n GLY 32 N 0.35 0.24 3.51 1.56 0.00 -1.19 0.15 105.19 109.80 3hlg n GLY 32 Ca -0.07 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.85 3hlg n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hlg s ALA 33 N -1.76 -1.79 -0.07 4.61 0.00 -0.48 -4.63 121.76 117.64 3hlg s ALA 33 Ca 0.24 1.12 0.03 0.00 0.00 0.00 0.00 51.96 53.35 3hlg s ALA 33 Cb -0.00 0.14 0.01 0.00 0.00 0.00 0.00 23.12 23.26 3hlg s ALA 33 CO -0.01 -0.53 -0.15 0.08 0.00 0.00 0.00 175.76 175.15 3hlg s VAL 34 N -2.28 1.31 -0.02 0.00 1.01 -0.30 -0.36 120.40 119.76 3hlg s VAL 34 Ca -0.01 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.44 3hlg s VAL 34 Cb -0.01 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 3hlg s VAL 34 CO -0.03 0.39 -0.21 0.27 0.00 0.00 0.00 175.10 175.52 3hlg s ILE 35 N 0.50 1.66 -0.05 2.22 -4.36 -0.35 -0.53 121.20 120.30 3hlg s ILE 35 Ca -0.13 -0.90 -0.06 0.00 -0.26 0.00 0.00 60.65 59.30 3hlg s ILE 35 Cb -0.15 -1.38 0.01 0.00 1.25 0.00 0.00 42.46 42.19 3hlg s ILE 35 CO 0.04 0.47 0.16 -0.04 0.24 0.00 0.00 174.94 175.81 3hlg s MET 36 N -0.48 0.24 -0.08 0.37 -1.94 -0.51 -1.15 119.30 115.75 3hlg s MET 36 Ca 0.08 0.12 -0.07 0.00 -1.71 0.00 0.00 55.69 54.11 3hlg s MET 36 Cb -0.08 0.11 0.02 0.00 2.01 0.00 0.00 34.83 36.89 3hlg s MET 36 CO -0.01 -0.04 0.21 0.00 -0.01 0.00 0.00 175.02 175.17 3hlg s ALA 37 N -0.17 -0.51 -0.00 3.03 0.00 -0.26 -1.06 121.76 122.80 3hlg s ALA 37 Ca -0.03 0.64 -0.02 0.00 0.00 0.00 0.00 51.96 52.55 3hlg s ALA 37 Cb -0.02 -0.38 -0.00 0.00 0.00 0.00 0.00 23.12 22.72 3hlg s ALA 37 CO 0.00 -0.11 0.04 1.03 0.00 0.00 0.00 175.76 176.72 3hlg s ARG 38 N 0.29 0.20 0.56 0.00 0.52 -0.59 -1.22 118.95 118.71 3hlg s ARG 38 Ca -0.01 -0.21 0.09 0.00 -0.52 0.00 0.00 55.73 55.07 3hlg s ARG 38 Cb -0.03 0.08 0.07 0.00 0.52 0.00 0.00 34.95 35.59 3hlg s ARG 38 CO -0.01 -0.04 0.68 0.16 0.02 0.00 0.00 175.30 176.11 3hlg s ASP 39 N -0.65 5.02 0.08 0.23 -4.77 -0.97 -1.11 116.67 114.50 3hlg s ASP 39 Ca -0.07 -0.92 -0.13 0.00 -3.30 0.00 0.00 52.55 48.13 3hlg s ASP 39 Cb -0.04 0.26 -0.22 0.00 -1.09 0.00 0.00 42.92 41.82 3hlg s ASP 39 CO -0.00 -1.24 1.19 0.00 0.70 0.00 0.00 175.17 175.82 3hlg h ALA 40 N 0.36 0.14 0.00 2.11 0.00 -1.90 -3.33 119.26 116.63 3hlg h ALA 40 Ca -0.32 -0.71 -0.04 0.00 0.00 0.00 0.00 54.91 53.84 3hlg h ALA 40 Cb 1.29 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 3hlg h ALA 40 CO 0.45 0.70 -0.18 0.66 0.00 0.00 0.00 179.25 180.88 3hlg h SER 41 N 0.36 0.00 0.00 0.00 4.64 -1.94 -3.47 113.55 113.14 3hlg h SER 41 Ca -0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 3hlg h SER 41 Cb 1.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.80 3hlg h SER 41 CO 0.20 0.18 0.00 0.61 -0.87 0.00 0.00 176.83 176.96 3hlg n GLY 42 N -0.61 0.34 0.25 -0.77 0.00 -1.25 -4.96 105.19 98.19 3hlg n GLY 42 Ca -0.02 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.16 3hlg n GLY 42 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3hlg h ASN 43 N 0.00 0.00 -3.54 1.61 2.35 -1.90 -3.38 115.58 110.71 3hlg h ASN 43 Ca 0.00 0.00 -0.67 0.00 -0.55 0.00 0.00 56.30 55.08 3hlg h ASN 43 Cb 0.00 0.00 -0.33 0.00 0.05 0.00 0.00 38.32 38.04 3hlg h ASN 43 CO 0.00 0.00 -0.76 -0.22 -1.65 0.00 0.00 177.43 174.80 3hlg s LEU 44 N -6.01 3.20 -0.39 1.61 2.96 -1.26 -5.02 118.68 113.77 3hlg s LEU 44 Ca 0.02 -0.95 0.03 0.00 -0.22 0.00 0.00 54.13 53.02 3hlg s LEU 44 Cb 0.08 -1.64 0.16 0.00 0.50 0.00 0.00 46.19 45.29 3hlg s LEU 44 CO 0.55 -0.14 0.39 0.21 -1.32 0.00 0.00 176.35 176.04 3hlg s ASN 45 N 1.29 1.09 -0.15 3.68 3.84 -1.26 -2.28 114.94 121.15 3hlg s ASN 45 Ca -0.01 -1.90 0.02 0.00 0.21 0.00 0.00 52.86 51.18 3hlg s ASN 45 Cb -0.17 0.45 0.01 0.00 -0.55 0.00 0.00 41.25 40.99 3hlg s ASN 45 CO -0.05 -0.23 -0.20 -0.47 -2.79 0.00 0.00 177.10 173.37 3hlg s TYR 46 N 1.11 2.72 -0.03 0.43 5.04 -0.36 -5.01 117.35 121.25 3hlg s TYR 46 Ca 0.21 -1.36 0.00 0.00 -2.44 0.00 0.00 57.07 53.49 3hlg s TYR 46 Cb -0.12 -1.86 0.03 0.00 0.35 0.00 0.00 41.96 40.36 3hlg s TYR 46 CO -0.05 -0.64 -0.00 0.99 -1.34 0.00 0.00 175.55 174.51 3hlg s THR 47 N 0.95 0.20 0.02 4.34 2.01 -1.26 -1.10 115.64 120.80 3hlg s THR 47 Ca -0.03 0.07 0.02 0.00 0.31 0.00 0.00 61.69 62.05 3hlg s THR 47 Cb -0.15 -0.29 -0.01 0.00 0.01 0.00 0.00 72.50 72.06 3hlg s THR 47 CO -0.04 0.15 -0.06 -0.13 -0.69 0.00 0.00 174.62 173.84 3hlg s ARG 48 N 0.99 0.46 -0.03 4.92 1.81 -0.30 -5.01 118.95 121.78 3hlg s ARG 48 Ca -0.10 -0.43 0.04 0.00 -1.72 0.00 0.00 55.73 53.51 3hlg s ARG 48 Cb -0.14 -0.34 -0.00 0.00 -0.45 0.00 0.00 34.95 34.02 3hlg s ARG 48 CO -0.02 0.08 -0.15 0.00 -0.68 0.00 0.00 175.30 174.53 3hlg s PHE 50 N -0.04 1.02 0.00 0.00 0.08 0.51 -5.00 117.98 114.54 3hlg s PHE 50 Ca -0.01 -0.20 0.00 0.00 0.12 0.00 0.00 56.93 56.84 3hlg s PHE 50 Cb -0.10 -0.66 0.00 0.00 -0.57 0.00 0.00 43.02 41.69 3hlg s PHE 50 CO 0.01 -0.03 0.00 0.41 -0.10 0.00 0.00 175.22 175.51 3hlg n GLY 51 N 2.85 0.03 3.75 4.36 0.00 -1.26 -1.39 105.19 113.53 3hlg n GLY 51 Ca -0.14 -0.96 -0.26 0.00 0.00 0.00 0.00 46.02 44.66 3hlg n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hlg s ALA 52 N -1.51 3.42 -2.08 4.61 0.00 0.12 -1.26 121.76 125.06 3hlg s ALA 52 Ca 0.00 -1.32 0.14 0.00 0.00 0.00 0.00 51.96 50.78 3hlg s ALA 52 Cb 0.00 -1.20 0.45 0.00 0.00 0.00 0.00 23.12 22.37 3hlg s ALA 52 CO 0.00 0.45 1.35 2.89 0.00 0.00 0.00 175.76 180.45 3hlg n ARG 53 N -0.40 1.80 -3.65 0.00 1.85 -0.62 -3.19 116.66 112.44 3hlg n ARG 53 Ca -0.09 -1.23 -0.03 0.00 -1.00 0.00 0.00 57.85 55.50 3hlg n ARG 53 Cb 0.55 -1.31 -0.01 0.00 -1.05 0.00 0.00 32.46 30.64 3hlg n ARG 53 CO 0.00 0.00 0.00 -0.08 -0.01 0.00 0.00 177.63 177.54 3hlg s THR 54 N -1.60 0.00 -1.95 8.89 -1.32 -1.26 -1.00 115.64 117.39 3hlg s THR 54 Ca 0.27 -0.34 0.17 0.00 -1.21 0.00 0.00 61.69 60.57 3hlg s THR 54 Cb 0.14 -1.67 0.10 0.00 -1.51 0.00 0.00 72.50 69.56 3hlg s THR 54 CO 0.19 0.00 0.99 1.33 -2.21 0.00 0.00 174.62 174.92 3hlg n VAL 55 N -0.39 0.00 -3.14 5.08 0.24 -1.26 -4.86 118.33 114.00 3hlg n VAL 55 Ca -0.07 -0.46 -0.39 0.00 -2.04 0.00 0.00 64.34 61.38 3hlg n VAL 55 Cb 0.61 1.31 -0.05 0.00 -1.47 0.00 0.00 33.84 34.24 3hlg n VAL 55 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 3hlg s ARG 56 N -1.50 4.35 0.35 7.34 0.52 -1.26 -4.95 118.95 123.81 3hlg s ARG 56 Ca 0.18 0.69 -0.27 0.00 -0.52 0.00 0.00 55.73 55.81 3hlg s ARG 56 Cb 0.14 -3.48 -0.09 0.00 0.52 0.00 0.00 34.95 32.04 3hlg s ARG 56 CO 0.25 0.02 1.16 1.03 0.02 0.00 0.00 175.30 177.77 3hlg s ARG 57 N 1.02 4.30 0.04 3.54 0.52 -1.26 -4.74 118.95 122.38 3hlg s ARG 57 Ca 0.32 1.86 -0.01 0.00 -0.52 0.00 0.00 55.73 57.38 3hlg s ARG 57 Cb -0.16 -2.89 0.01 0.00 0.52 0.00 0.00 34.95 32.42 3hlg s ARG 57 CO 0.14 -0.11 0.06 -0.40 0.02 0.00 0.00 175.30 175.01 3hlg n ASP 58 N 0.54 0.03 0.22 0.23 3.85 0.48 -4.85 116.55 117.05 3hlg n ASP 58 Ca 0.02 -1.04 0.15 0.00 -0.71 0.00 0.00 54.79 53.22 3hlg n ASP 58 Cb 0.45 -0.04 0.71 0.00 -1.35 0.00 0.00 41.12 40.89 3hlg n ASP 58 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 3hlg h GLU 59 N 0.00 0.00 -0.70 0.11 9.09 -1.96 -0.98 114.58 120.14 3hlg h GLU 59 Ca -0.02 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.39 3hlg h GLU 59 Cb 0.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.16 3hlg h GLU 59 CO 0.02 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.17 3hlg n ASN 60 N -2.65 3.95 -0.98 3.06 5.03 -1.26 -4.94 115.26 117.47 3hlg n ASN 60 Ca 0.00 -2.03 -0.10 0.00 0.87 0.00 0.00 54.58 53.31 3hlg n ASN 60 Cb 0.18 -0.48 -0.02 0.00 -1.02 0.00 0.00 39.78 38.44 3hlg n ASN 60 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 3hlg n ASN 61 N 1.53 -3.78 -4.77 6.41 4.05 -0.37 -5.03 115.26 113.31 3hlg n ASN 61 Ca 0.24 0.11 -0.24 0.00 0.45 0.00 0.00 54.58 55.14 3hlg n ASN 61 Cb 0.63 -2.64 -0.06 0.00 1.23 0.00 0.00 39.78 38.94 3hlg n ASN 61 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 3hlg s GLN 62 N -3.75 2.31 -0.37 1.20 -1.52 -1.26 -4.77 119.66 111.50 3hlg s GLN 62 Ca 0.00 -1.74 -0.06 0.00 -1.95 0.00 0.00 55.36 51.61 3hlg s GLN 62 Cb 0.00 -2.10 0.06 0.00 -0.22 0.00 0.00 33.01 30.75 3hlg s GLN 62 CO 0.00 -0.11 0.16 -0.51 -0.25 0.00 0.00 175.29 174.58 3hlg s LEU 63 N -3.95 4.68 0.64 2.90 1.43 -1.26 -0.39 118.68 122.73 3hlg s LEU 63 Ca 0.42 -1.39 -0.15 0.00 -1.03 0.00 0.00 54.13 51.99 3hlg s LEU 63 Cb 0.01 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.33 3hlg s LEU 63 CO 0.24 -0.42 1.09 -2.16 0.23 0.00 0.00 176.35 175.33 3hlg s PRO 64 N 1.36 2.99 0.49 1.29 0.04 -1.26 -4.83 135.00 135.08 3hlg s PRO 64 Ca 0.01 1.30 -0.19 0.00 0.04 0.00 0.00 61.00 62.15 3hlg s PRO 64 Cb -0.21 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.26 3hlg s PRO 64 CO 0.01 -1.09 1.01 -1.25 0.04 0.00 0.00 177.00 175.72 3hlg s PRO 65 N -4.14 3.89 -0.21 0.56 0.04 -1.26 -1.60 135.00 132.27 3hlg s PRO 65 Ca 0.65 1.22 -0.24 0.00 0.04 0.00 0.00 61.00 62.67 3hlg s PRO 65 Cb -0.18 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 32.23 3hlg s PRO 65 CO 0.41 -0.34 0.80 -1.17 0.04 0.00 0.00 177.00 176.74 3hlg s LEU 66 N -3.59 4.12 0.30 -3.56 2.96 -0.39 -4.12 118.68 114.40 3hlg s LEU 66 Ca 0.64 1.05 0.11 0.00 -0.22 0.00 0.00 54.13 55.70 3hlg s LEU 66 Cb -0.13 -3.16 -0.05 0.00 0.50 0.00 0.00 46.19 43.34 3hlg s LEU 66 CO 0.21 -0.45 -0.11 -1.10 -1.32 0.00 0.00 176.35 173.59 3hlg s GLN 67 N 2.52 1.88 0.62 1.98 -1.52 -1.26 -4.41 119.66 119.47 3hlg s GLN 67 Ca 0.35 -1.74 0.38 0.00 -1.95 0.00 0.00 55.36 52.40 3hlg s GLN 67 Cb -0.16 -1.85 2.10 0.00 -0.22 0.00 0.00 33.01 32.88 3hlg s GLN 67 CO 0.09 0.26 2.29 -0.24 -0.25 0.00 0.00 175.29 177.44 3hlg h VAL 68 N 2.07 0.21 -0.34 1.09 3.04 -1.96 -1.39 116.25 118.97 3hlg h VAL 68 Ca -0.42 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.19 3hlg h VAL 68 Cb 1.25 1.06 0.00 0.00 -2.01 0.00 0.00 31.29 31.60 3hlg h VAL 68 CO 0.63 0.01 0.00 -0.90 -1.01 0.00 0.00 177.57 176.31 3hlg n ASP 69 N -3.37 3.94 -4.70 3.17 3.85 -1.26 -1.29 116.55 116.90 3hlg n ASP 69 Ca -0.03 -2.76 -0.42 0.00 -0.71 0.00 0.00 54.79 50.87 3hlg n ASP 69 Cb 0.10 -0.50 -0.03 0.00 -1.35 0.00 0.00 41.12 39.35 3hlg n ASP 69 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 3hlg s THR 70 N -2.38 4.05 0.08 2.12 2.01 -0.53 -4.79 115.64 116.20 3hlg s THR 70 Ca 0.40 1.42 -0.31 0.00 0.31 0.00 0.00 61.69 63.52 3hlg s THR 70 Cb 0.30 -3.91 -0.08 0.00 0.01 0.00 0.00 72.50 68.81 3hlg s THR 70 CO 0.12 0.03 1.66 -2.84 -0.69 0.00 0.00 174.62 172.90 3hlg s PRO 71 N 1.91 4.19 0.15 4.92 0.02 -1.26 -3.95 135.00 140.98 3hlg s PRO 71 Ca 0.59 2.35 0.07 0.00 0.02 0.00 0.00 61.00 64.02 3hlg s PRO 71 Cb -0.28 -3.58 -0.04 0.00 0.02 0.00 0.00 34.50 30.63 3hlg s PRO 71 CO 0.25 -0.74 -0.14 0.00 -0.33 0.00 0.00 177.00 176.04 3hlg s ARG 73 N -3.09 4.20 0.08 0.00 3.52 -1.26 -1.42 118.95 120.97 3hlg s ARG 73 Ca 0.14 1.22 0.11 0.00 -0.13 0.00 0.00 55.73 57.08 3hlg s ARG 73 Cb -0.03 -3.66 -0.17 0.00 -1.56 0.00 0.00 34.95 29.52 3hlg s ARG 73 CO 0.04 -0.68 1.04 -0.07 -0.81 0.00 0.00 175.30 174.82 3hlg h LEU 74 N 9.56 0.00 0.00 -0.88 3.38 -1.76 -3.45 115.31 122.16 3hlg h LEU 74 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3hlg h LEU 74 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3hlg h LEU 74 CO 0.98 0.88 0.00 0.00 0.09 0.00 0.00 178.44 180.39 3hlg n ALA 75 N -2.41 0.00 0.36 1.53 0.00 -1.22 -1.66 120.51 117.11 3hlg n ALA 75 Ca -0.07 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.41 3hlg n ALA 75 Cb 0.94 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.58 3hlg n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hlg n ALA 76 N 8.92 1.54 0.33 0.00 0.00 -1.25 -0.84 120.51 129.20 3hlg n ALA 76 Ca 0.00 -0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.54 3hlg n ALA 76 Cb 0.00 -1.12 0.60 0.00 0.00 0.00 0.00 19.45 18.92 3hlg n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hlg h ALA 77 N 2.36 1.00 0.00 0.00 0.00 -0.99 -1.91 119.26 119.72 3hlg h ALA 77 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hlg h ALA 77 Cb 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3hlg h ALA 77 CO 0.00 0.00 -0.02 1.15 0.00 0.00 0.00 179.25 180.38 3hlg h THR 78 N 0.00 0.98 -0.42 0.00 2.02 -1.17 -3.16 112.91 111.16 3hlg h THR 78 Ca 0.00 -0.07 0.05 0.00 0.77 0.00 0.00 66.41 67.16 3hlg h THR 78 Cb 0.30 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 3hlg h THR 78 CO 0.00 0.02 0.28 0.11 0.37 0.00 0.00 175.52 176.30 3hlg h LYS 79 N 0.00 0.35 -0.61 6.66 1.57 -1.45 -0.13 116.57 122.97 3hlg h LYS 79 Ca -0.00 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 3hlg h LYS 79 Cb 0.04 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 3hlg h LYS 79 CO 0.00 0.23 0.12 1.25 -0.57 0.00 0.00 179.45 180.49 3hlg h LEU 80 N 0.36 0.95 -0.12 2.94 5.85 -1.76 -1.17 115.31 122.36 3hlg h LEU 80 Ca 0.18 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 3hlg h LEU 80 Cb 0.26 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 3hlg h LEU 80 CO -0.04 0.95 0.06 -0.07 -0.34 0.00 0.00 178.44 179.00 3hlg h LEU 81 N 0.90 0.14 -0.85 2.25 3.38 -1.20 -1.77 115.31 118.16 3hlg h LEU 81 Ca 0.19 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3hlg h LEU 81 Cb 0.39 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3hlg h LEU 81 CO 0.01 0.18 0.05 0.74 0.09 0.00 0.00 178.44 179.51 3hlg h THR 82 N 0.10 1.25 -0.47 0.22 2.02 -1.31 -1.30 112.91 113.41 3hlg h THR 82 Ca 0.04 -1.00 0.04 0.00 0.77 0.00 0.00 66.41 66.26 3hlg h THR 82 Cb 0.07 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 3hlg h THR 82 CO -0.01 0.36 0.24 0.74 0.37 0.00 0.00 175.52 177.23 3hlg h THR 83 N 0.85 0.97 -0.65 3.16 2.02 -1.06 -0.78 112.91 117.42 3hlg h THR 83 Ca 0.17 -0.16 0.01 0.00 0.77 0.00 0.00 66.41 67.19 3hlg h THR 83 Cb 0.43 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 3hlg h THR 83 CO 0.01 0.09 0.43 0.40 0.37 0.00 0.00 175.52 176.82 3hlg h ILE 84 N 0.48 1.16 -0.88 3.11 2.04 -0.73 -1.31 117.51 121.39 3hlg h ILE 84 Ca 0.20 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 3hlg h ILE 84 Cb 0.10 0.21 -0.04 0.00 -0.74 0.00 0.00 36.82 36.35 3hlg h ILE 84 CO -0.14 0.16 0.45 0.24 0.00 0.00 0.00 178.15 178.86 3hlg h MET 85 N 0.88 1.24 -0.15 2.37 2.86 -0.69 -0.72 114.93 120.72 3hlg h MET 85 Ca 0.24 -0.17 -0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3hlg h MET 85 Cb -0.09 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.33 3hlg h MET 85 CO -0.06 0.93 0.09 0.28 1.06 0.00 0.00 176.91 179.21 3hlg h VAL 86 N 1.24 1.09 -0.24 -2.22 2.07 -0.80 -2.32 116.25 115.07 3hlg h VAL 86 Ca 0.30 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.53 3hlg h VAL 86 Cb 0.08 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 3hlg h VAL 86 CO -0.04 0.09 -0.02 -0.07 0.02 0.00 0.00 177.57 177.54 3hlg h LEU 87 N 0.15 0.33 -0.59 2.57 3.38 -0.81 -0.97 115.31 119.37 3hlg h LEU 87 Ca 0.05 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3hlg h LEU 87 Cb 0.07 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3hlg h LEU 87 CO -0.01 0.41 0.25 1.56 0.09 0.00 0.00 178.44 180.74 3hlg h GLN 88 N 0.35 0.88 -0.93 1.13 4.20 -0.97 -0.81 115.11 118.96 3hlg h GLN 88 Ca 0.08 -0.15 0.02 0.00 0.06 0.00 0.00 58.65 58.66 3hlg h GLN 88 Cb 0.27 -0.15 -0.05 0.00 0.30 0.00 0.00 27.48 27.85 3hlg h GLN 88 CO 0.01 0.74 0.61 0.00 -0.67 0.00 0.00 178.83 179.52 3hlg h MET 90 N 1.22 0.51 -0.37 0.00 1.85 -0.96 -0.51 114.93 116.66 3hlg h MET 90 Ca 0.36 -0.12 -0.02 0.00 -0.61 0.00 0.00 59.70 59.31 3hlg h MET 90 Cb -0.06 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 31.88 3hlg h MET 90 CO -0.09 0.58 0.16 0.93 -0.40 0.00 0.00 176.91 178.09 3hlg h GLU 91 N 0.36 0.52 -0.15 0.39 5.08 -0.49 -1.68 114.58 118.60 3hlg h GLU 91 Ca 0.10 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3hlg h GLU 91 Cb 0.30 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3hlg h GLU 91 CO 0.00 0.42 0.00 0.54 -1.00 0.00 0.00 179.01 178.97 3hlg n ARG 92 N -4.40 1.49 -1.05 2.33 1.74 -0.37 -4.90 116.66 111.49 3hlg n ARG 92 Ca 0.02 -0.74 -0.02 0.00 -0.77 0.00 0.00 57.85 56.34 3hlg n ARG 92 Cb 0.13 -1.30 -0.01 0.00 -1.02 0.00 0.00 32.46 30.26 3hlg n ARG 92 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hlg n GLY 93 N 0.96 0.54 0.08 -0.13 0.00 -0.63 -4.91 105.19 101.09 3hlg n GLY 93 Ca 0.13 -0.53 -0.05 0.00 0.00 0.00 0.00 46.02 45.57 3hlg n GLY 93 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hlg h LEU 94 N 0.00 0.00 -8.13 0.99 3.38 -1.30 -3.47 115.31 106.77 3hlg h LEU 94 Ca -0.04 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 3hlg h LEU 94 Cb 0.18 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.79 3hlg h LEU 94 CO 0.05 0.88 -0.55 0.68 0.09 0.00 0.00 178.44 179.59 3hlg s VAL 95 N -2.75 0.16 -0.04 1.22 -7.23 -1.21 -5.00 120.40 105.56 3hlg s VAL 95 Ca 0.00 -1.61 0.07 0.00 -1.81 0.00 0.00 61.98 58.63 3hlg s VAL 95 Cb 0.09 -1.59 -0.01 0.00 0.56 0.00 0.00 36.38 35.43 3hlg s VAL 95 CO 0.81 -0.74 -0.24 -0.62 -0.31 0.00 0.00 175.10 173.99 3hlg s ASP 96 N -2.93 2.91 0.47 4.85 -1.08 -1.26 -4.36 116.67 115.27 3hlg s ASP 96 Ca 0.10 -0.47 0.19 0.00 -0.52 0.00 0.00 52.55 51.86 3hlg s ASP 96 Cb 0.07 -0.60 1.18 0.00 -1.46 0.00 0.00 42.92 42.10 3hlg s ASP 96 CO -0.07 0.26 2.02 -0.07 0.52 0.00 0.00 175.17 177.83 3hlg h LEU 97 N 5.85 0.00 -2.35 -1.34 3.38 -1.97 -2.57 115.31 116.30 3hlg h LEU 97 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 3hlg h LEU 97 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3hlg h LEU 97 CO 0.47 0.16 0.00 0.47 0.09 0.00 0.00 178.44 179.63 3hlg n ASP 98 N -4.06 3.36 -4.79 -0.43 10.43 -1.26 -0.69 116.55 119.11 3hlg n ASP 98 Ca -0.02 -1.96 -0.34 0.00 2.57 0.00 0.00 54.79 55.04 3hlg n ASP 98 Cb 0.24 -0.25 -0.01 0.00 1.84 0.00 0.00 41.12 42.94 3hlg n ASP 98 CO 0.00 0.00 0.00 -1.83 -1.07 0.00 0.00 177.20 174.30 3hlg s GLU 99 N -1.38 3.54 0.67 -1.24 -1.05 -0.97 -4.86 118.70 113.41 3hlg s GLU 99 Ca 0.36 1.46 -0.14 0.00 -0.15 0.00 0.00 54.97 56.51 3hlg s GLU 99 Cb 0.21 -2.05 0.00 0.00 -0.44 0.00 0.00 34.13 31.86 3hlg s GLU 99 CO 0.29 -0.67 1.09 0.95 0.95 0.00 0.00 175.26 177.87 3hlg s THR 100 N -1.93 3.50 -1.56 1.83 -4.23 -1.26 -2.97 115.64 109.02 3hlg s THR 100 Ca 0.69 0.63 0.28 0.00 -1.18 0.00 0.00 61.69 62.11 3hlg s THR 100 Cb -0.20 -3.17 0.56 0.00 1.34 0.00 0.00 72.50 71.03 3hlg s THR 100 CO 0.25 -0.50 1.97 1.33 -0.54 0.00 0.00 174.62 177.12 3hlg n VAL 101 N -2.63 0.08 -0.36 2.29 0.24 0.04 -4.22 118.33 113.77 3hlg n VAL 101 Ca 0.09 0.02 0.04 0.00 -2.04 0.00 0.00 64.34 62.45 3hlg n VAL 101 Cb 0.53 -0.57 0.19 0.00 -1.47 0.00 0.00 33.84 32.52 3hlg n VAL 101 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 3hlg h ASP 102 N 0.00 1.01 0.25 -1.34 5.19 -1.82 0.85 116.42 120.56 3hlg h ASP 102 Ca 0.00 0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.41 3hlg h ASP 102 Cb 0.20 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.51 3hlg h ASP 102 CO 0.00 0.63 -0.12 -0.09 -3.12 0.00 0.00 179.24 176.54 3hlg h ARG 103 N 1.14 -0.32 0.00 3.56 2.43 -2.00 -2.86 114.38 116.33 3hlg h ARG 103 Ca 0.44 0.02 -0.13 0.00 -0.81 0.00 0.00 59.98 59.50 3hlg h ARG 103 Cb 0.22 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 3hlg h ARG 103 CO -0.19 -0.15 -1.63 1.28 -1.51 0.00 0.00 179.97 177.78 3hlg n LEU 104 N -5.19 0.53 -3.09 3.80 4.77 -1.04 -4.52 117.00 112.25 3hlg n LEU 104 Ca -0.09 0.22 -0.25 0.00 -0.03 0.00 0.00 56.01 55.86 3hlg n LEU 104 Cb 0.18 0.10 -0.05 0.00 -2.33 0.00 0.00 43.42 41.32 3hlg n LEU 104 CO 0.34 0.10 0.04 0.18 -1.33 0.00 0.00 177.39 176.73 3hlg n LEU 105 N -2.68 3.46 0.26 2.23 4.77 0.29 -4.88 117.00 120.45 3hlg n LEU 105 Ca -0.10 -5.46 0.12 0.00 -0.03 0.00 0.00 56.01 50.54 3hlg n LEU 105 Cb 0.77 -0.28 0.71 0.00 -2.33 0.00 0.00 43.42 42.29 3hlg n LEU 105 CO 0.43 2.27 0.97 1.55 -1.33 0.00 0.00 177.39 181.28 3hlg h PRO 106 N 3.28 0.00 -0.26 3.23 0.13 -1.64 -1.13 132.00 135.61 3hlg h PRO 106 Ca 0.13 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.16 3hlg h PRO 106 Cb 0.64 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 3hlg h PRO 106 CO 0.75 0.12 -0.28 0.38 -0.23 0.00 0.00 178.00 178.74 3hlg h ASP 107 N 0.00 0.52 -0.10 1.44 2.03 -1.89 -1.63 116.42 116.80 3hlg h ASP 107 Ca -0.00 -0.19 -0.16 0.00 -0.73 0.00 0.00 57.03 55.95 3hlg h ASP 107 Cb 0.34 -0.14 0.01 0.00 -0.83 0.00 0.00 39.33 38.70 3hlg h ASP 107 CO 0.02 0.79 -0.57 0.25 -1.03 0.00 0.00 179.24 178.70 3hlg h LEU 108 N 0.45 0.66 -1.00 0.15 5.85 -1.71 -3.28 115.31 116.43 3hlg h LEU 108 Ca 0.06 -0.65 0.05 0.00 0.84 0.00 0.00 57.88 58.17 3hlg h LEU 108 Cb 0.72 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.49 3hlg h LEU 108 CO 0.06 1.21 0.65 0.28 -0.34 0.00 0.00 178.44 180.30 3hlg h SER 109 N 0.16 1.07 0.68 1.25 0.02 -1.16 -1.49 113.55 114.09 3hlg h SER 109 Ca -0.04 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 3hlg h SER 109 Cb 1.22 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.52 3hlg h SER 109 CO 0.12 0.72 0.00 0.00 -1.14 0.00 0.00 176.83 176.53 3hlg n ALA 110 N -2.37 1.92 -2.01 3.77 0.00 -0.62 -4.86 120.51 116.35 3hlg n ALA 110 Ca 0.14 -0.07 -0.41 0.00 0.00 0.00 0.00 53.44 53.10 3hlg n ALA 110 Cb 0.12 -1.32 -0.05 0.00 0.00 0.00 0.00 19.45 18.20 3hlg n ALA 110 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3hlg s MET 111 N -2.99 4.69 0.75 0.00 1.00 -0.56 -5.03 119.30 117.15 3hlg s MET 111 Ca 0.10 1.60 -0.09 0.00 0.00 0.00 0.00 55.69 57.30 3hlg s MET 111 Cb 0.13 -3.29 0.07 0.00 0.00 0.00 0.00 34.83 31.74 3hlg s MET 111 CO 0.36 0.23 1.08 -1.25 0.00 0.00 0.00 175.02 175.45 3hlg s PRO 112 N -0.59 2.09 -0.19 2.03 0.04 -1.26 -4.65 135.00 132.46 3hlg s PRO 112 Ca 0.46 -0.12 -0.12 0.00 0.04 0.00 0.00 61.00 61.27 3hlg s PRO 112 Cb -0.27 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.14 3hlg s PRO 112 CO 0.34 -1.39 0.21 0.08 0.04 0.00 0.00 177.00 176.27 3hlg s VAL 113 N -3.38 5.35 -0.18 -0.36 1.01 0.27 -3.03 120.40 120.08 3hlg s VAL 113 Ca 0.61 0.36 -0.29 0.00 0.00 0.00 0.00 61.98 62.65 3hlg s VAL 113 Cb -0.11 -3.55 -0.00 0.00 0.00 0.00 0.00 36.38 32.72 3hlg s VAL 113 CO 0.46 0.40 1.07 -0.22 0.00 0.00 0.00 175.10 176.82 3hlg s LEU 114 N 0.53 4.15 -0.17 3.92 2.96 0.58 -1.20 118.68 129.46 3hlg s LEU 114 Ca 0.12 1.48 0.14 0.00 -0.22 0.00 0.00 54.13 55.65 3hlg s LEU 114 Cb -0.12 -3.54 -0.20 0.00 0.50 0.00 0.00 46.19 42.82 3hlg s LEU 114 CO 0.01 -0.63 0.05 1.21 -1.32 0.00 0.00 176.35 175.67 3hlg n GLU 115 N 6.01 1.24 -3.54 1.98 2.13 0.27 -4.59 120.64 124.14 3hlg n GLU 115 Ca 0.11 -0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.93 3hlg n GLU 115 Cb 0.46 -1.43 0.00 0.00 0.27 0.00 0.00 31.44 30.74 3hlg n GLU 115 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3hlg n GLY 116 N 1.98 -0.56 3.00 8.31 0.00 -1.18 -5.02 105.19 111.74 3hlg n GLY 116 Ca -0.28 -0.88 -0.14 0.00 0.00 0.00 0.00 46.02 44.72 3hlg n GLY 116 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hlg s PHE 117 N -3.00 0.52 0.42 1.61 0.08 -1.26 0.10 117.98 116.44 3hlg s PHE 117 Ca 0.00 -0.31 -0.07 0.00 0.12 0.00 0.00 56.93 56.66 3hlg s PHE 117 Cb 0.00 -0.32 0.10 0.00 -0.57 0.00 0.00 43.02 42.23 3hlg s PHE 117 CO 0.00 -0.06 0.48 -0.40 -0.10 0.00 0.00 175.22 175.14 3hlg n ASP 118 N 2.14 -0.51 0.11 1.36 5.75 -0.50 -4.92 116.55 119.98 3hlg n ASP 118 Ca -0.18 -1.02 -0.03 0.00 -0.01 0.00 0.00 54.79 53.54 3hlg n ASP 118 Cb 0.56 -0.39 0.15 0.00 -1.03 0.00 0.00 41.12 40.41 3hlg n ASP 118 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 3hlg h ASP 119 N -1.06 0.16 0.99 -1.12 5.19 -2.02 -2.83 116.42 115.73 3hlg h ASP 119 Ca -0.16 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.15 3hlg h ASP 119 Cb 0.47 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 39.94 3hlg h ASP 119 CO 0.11 0.72 0.00 0.00 -3.12 0.00 0.00 179.24 176.96 3hlg h ALA 120 N 1.28 1.00 0.00 3.45 0.00 -2.05 -3.46 119.26 119.47 3hlg h ALA 120 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3hlg h ALA 120 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3hlg h ALA 120 CO 0.09 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.75 3hlg n GLY 121 N 0.41 0.76 3.75 0.00 0.00 -1.07 -5.08 105.19 103.97 3hlg n GLY 121 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 3hlg n GLY 121 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hlg s ASN 122 N -2.48 7.23 0.37 1.61 0.01 -1.26 -4.80 114.94 115.62 3hlg s ASN 122 Ca 0.00 2.23 -0.27 0.00 -0.71 0.00 0.00 52.86 54.11 3hlg s ASN 122 Cb 0.00 -2.62 -0.09 0.00 0.41 0.00 0.00 41.25 38.95 3hlg s ASN 122 CO 0.00 -0.20 1.24 0.00 -1.51 0.00 0.00 177.10 176.63 3hlg s ALA 123 N -0.78 3.31 -0.35 0.60 0.00 -1.26 -1.40 121.76 121.88 3hlg s ALA 123 Ca 0.47 1.12 -0.09 0.00 0.00 0.00 0.00 51.96 53.46 3hlg s ALA 123 Cb -0.32 -3.43 0.02 0.00 0.00 0.00 0.00 23.12 19.39 3hlg s ALA 123 CO 0.39 -0.61 0.16 0.50 0.00 0.00 0.00 175.76 176.20 3hlg s ARG 124 N -2.05 2.89 0.13 0.00 3.52 0.11 -4.85 118.95 118.71 3hlg s ARG 124 Ca 0.53 -1.02 0.08 0.00 -0.13 0.00 0.00 55.73 55.20 3hlg s ARG 124 Cb -0.35 -3.59 -0.04 0.00 -1.56 0.00 0.00 34.95 29.40 3hlg s ARG 124 CO 0.46 -0.61 -0.12 -0.51 -0.81 0.00 0.00 175.30 173.70 3hlg s LEU 125 N 1.52 2.91 0.19 -0.88 1.43 -1.26 -0.56 118.68 122.03 3hlg s LEU 125 Ca 0.02 -0.50 -0.06 0.00 -1.03 0.00 0.00 54.13 52.55 3hlg s LEU 125 Cb -0.19 -1.69 -0.02 0.00 0.03 0.00 0.00 46.19 44.32 3hlg s LEU 125 CO 0.05 0.16 0.25 0.00 0.23 0.00 0.00 176.35 177.04 3hlg s ARG 126 N -2.38 1.23 0.31 1.70 1.70 -0.34 -4.94 118.95 116.24 3hlg s ARG 126 Ca 0.21 -1.38 -0.28 0.00 -0.47 0.00 0.00 55.73 53.82 3hlg s ARG 126 Cb -0.10 0.35 -0.09 0.00 -0.57 0.00 0.00 34.95 34.53 3hlg s ARG 126 CO 0.13 -0.44 1.05 -2.00 -1.08 0.00 0.00 175.30 172.95 3hlg s GLU 127 N -4.05 4.54 0.47 3.89 2.12 -1.26 -0.56 118.70 123.85 3hlg s GLU 127 Ca 0.26 1.63 -0.24 0.00 0.36 0.00 0.00 54.97 56.98 3hlg s GLU 127 Cb 0.04 -3.00 -0.07 0.00 0.26 0.00 0.00 34.13 31.36 3hlg s GLU 127 CO 0.06 0.17 1.34 0.50 -0.54 0.00 0.00 175.26 176.80 3hlg s ARG 128 N -1.74 3.61 -0.25 4.30 3.52 -1.26 -4.77 118.95 122.36 3hlg s ARG 128 Ca 0.48 2.21 -0.08 0.00 -0.13 0.00 0.00 55.73 58.21 3hlg s ARG 128 Cb -0.27 -2.53 -0.03 0.00 -1.56 0.00 0.00 34.95 30.55 3hlg s ARG 128 CO 0.34 -0.81 0.08 1.03 -0.81 0.00 0.00 175.30 175.14 3hlg s ARG 129 N -2.56 3.68 0.00 5.12 0.52 -1.26 -4.99 118.95 119.47 3hlg s ARG 129 Ca 0.63 -0.47 0.00 0.00 -0.52 0.00 0.00 55.73 55.38 3hlg s ARG 129 Cb -0.39 -3.36 0.00 0.00 0.52 0.00 0.00 34.95 31.71 3hlg s ARG 129 CO 0.49 -0.19 0.00 0.41 0.02 0.00 0.00 175.30 176.03 3hlg n GLY 130 N 4.94 -0.70 3.67 -3.53 0.00 -1.26 -4.31 105.19 104.00 3hlg n GLY 130 Ca -0.16 -1.69 -0.33 0.00 0.00 0.00 0.00 46.02 43.84 3hlg n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hlg s LYS 131 N -1.98 2.79 0.00 1.61 -0.14 -1.26 -4.83 119.74 115.93 3hlg s LYS 131 Ca 0.00 -0.59 -0.28 0.00 -1.36 0.00 0.00 55.97 53.74 3hlg s LYS 131 Cb 0.00 -2.67 -0.04 0.00 -1.68 0.00 0.00 37.83 33.45 3hlg s LYS 131 CO 0.00 0.64 0.90 0.42 -0.76 0.00 0.00 175.35 176.54 3hlg s ILE 132 N -1.03 4.86 0.34 2.17 1.01 -1.26 -4.84 121.20 122.45 3hlg s ILE 132 Ca 0.18 1.88 0.08 0.00 0.00 0.00 0.00 60.65 62.79 3hlg s ILE 132 Cb -0.11 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.09 3hlg s ILE 132 CO 0.08 0.21 0.29 0.42 0.00 0.00 0.00 174.94 175.95 3hlg s THR 133 N 0.77 3.39 0.39 2.92 -4.23 -1.26 -0.78 115.64 116.84 3hlg s THR 133 Ca 0.47 -1.39 0.08 0.00 -1.18 0.00 0.00 61.69 59.67 3hlg s THR 133 Cb -0.20 -3.15 0.30 0.00 1.34 0.00 0.00 72.50 70.79 3hlg s THR 133 CO 0.25 -0.16 1.98 0.25 -0.54 0.00 0.00 174.62 176.41 3hlg h LEU 134 N 1.25 0.54 -1.19 4.79 5.85 -1.46 -1.36 115.31 123.73 3hlg h LEU 134 Ca -0.44 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.20 3hlg h LEU 134 Cb 1.25 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 3hlg h LEU 134 CO 0.59 0.35 -0.37 -0.09 -0.34 0.00 0.00 178.44 178.58 3hlg h ARG 135 N 0.62 0.06 -0.60 1.25 2.43 -1.22 -1.21 114.38 115.71 3hlg h ARG 135 Ca 0.27 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.34 3hlg h ARG 135 Cb 0.28 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 3hlg h ARG 135 CO -0.08 0.43 0.06 0.45 -1.51 0.00 0.00 179.97 179.31 3hlg h HIS 136 N 0.05 1.07 -0.21 2.20 3.86 -1.54 -2.12 115.15 118.46 3hlg h HIS 136 Ca 0.00 -0.16 -0.02 0.00 -1.16 0.00 0.00 60.37 59.03 3hlg h HIS 136 Cb 0.68 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.85 3hlg h HIS 136 CO 0.00 0.93 0.04 -0.07 0.86 0.00 0.00 177.93 179.69 3hlg h LEU 137 N 0.94 0.33 -1.85 2.43 3.38 -0.94 -1.19 115.31 118.40 3hlg h LEU 137 Ca 0.18 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3hlg h LEU 137 Cb 0.47 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 3hlg h LEU 137 CO 0.02 0.50 -0.10 -0.07 0.09 0.00 0.00 178.44 178.88 3hlg h LEU 138 N 0.15 0.00 -2.26 1.67 3.38 -1.16 -2.92 115.31 114.17 3hlg h LEU 138 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3hlg h LEU 138 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3hlg h LEU 138 CO 0.00 0.10 0.00 0.35 0.09 0.00 0.00 178.44 178.99 3hlg n THR 139 N -3.44 0.54 -3.70 0.22 -2.24 -0.81 -4.26 114.28 100.58 3hlg n THR 139 Ca -0.01 -0.77 -0.25 0.00 -2.27 0.00 0.00 64.05 60.75 3hlg n THR 139 Cb 0.26 0.87 0.05 0.00 -2.10 0.00 0.00 70.33 69.41 3hlg n THR 139 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3hlg n HIS 140 N 0.84 -2.41 -1.25 4.78 8.25 -0.74 -4.87 115.22 119.82 3hlg n HIS 140 Ca 0.12 0.94 0.08 0.00 -0.26 0.00 0.00 57.72 58.60 3hlg n HIS 140 Cb 0.43 -4.56 0.13 0.00 1.12 0.00 0.00 29.99 27.11 3hlg n HIS 140 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3hlg n THR 141 N -4.64 1.67 0.21 1.59 -2.24 -0.53 -1.14 114.28 109.21 3hlg n THR 141 Ca -0.08 -2.09 0.11 0.00 -2.27 0.00 0.00 64.05 59.72 3hlg n THR 141 Cb 0.59 -0.13 0.18 0.00 -2.10 0.00 0.00 70.33 68.87 3hlg n THR 141 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3hlg h SER 142 N 0.12 0.00 0.00 3.42 4.64 -1.80 0.24 113.55 120.17 3hlg h SER 142 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hlg h SER 142 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3hlg h SER 142 CO 0.00 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.63 3hlg n GLY 143 N 1.05 0.29 3.80 -0.77 0.00 -1.26 -3.11 105.19 105.18 3hlg n GLY 143 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 3hlg n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hlg s LEU 144 N 0.00 3.96 0.00 0.99 1.43 -1.26 -0.50 118.68 123.30 3hlg s LEU 144 Ca 0.00 1.88 0.00 0.00 -1.03 0.00 0.00 54.13 54.98 3hlg s LEU 144 Cb 0.00 -4.45 0.00 0.00 0.03 0.00 0.00 46.19 41.77 3hlg s LEU 144 CO 0.00 -0.57 0.00 -0.24 0.23 0.00 0.00 176.35 175.77 3hlg n SER 145 N -0.61 0.35 -4.17 2.29 2.88 -1.26 -4.08 113.62 109.01 3hlg n SER 145 Ca 0.07 -0.30 -0.25 0.00 -1.33 0.00 0.00 58.87 57.07 3hlg n SER 145 Cb 0.52 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.83 3hlg n SER 145 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3hlg s TYR 146 N -1.00 1.58 0.40 0.66 2.02 -1.24 -2.84 117.35 116.94 3hlg s TYR 146 Ca 0.00 -0.31 0.07 0.00 -0.37 0.00 0.00 57.07 56.46 3hlg s TYR 146 Cb 0.00 -1.01 0.83 0.00 -0.40 0.00 0.00 41.96 41.38 3hlg s TYR 146 CO 0.00 -0.02 2.05 0.28 -1.57 0.00 0.00 175.55 176.29 3hlg h VAL 147 N 4.67 1.11 0.00 0.71 2.07 -1.90 -1.59 116.25 121.33 3hlg h VAL 147 Ca -0.37 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 66.92 3hlg h VAL 147 Cb 1.15 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 3hlg h VAL 147 CO 0.48 0.11 0.00 2.22 0.02 0.00 0.00 177.57 180.40 3hlg n PHE 148 N -4.46 0.00 0.00 1.57 1.16 -1.26 -3.61 117.46 110.86 3hlg n PHE 148 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.61 3hlg n PHE 148 Cb 0.06 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.93 3hlg n PHE 148 CO 0.00 0.00 0.00 -0.11 -1.87 0.00 0.00 176.76 174.78 3hlg n LEU 149 N -0.93 1.37 -4.75 5.98 7.94 -0.66 -5.06 117.00 120.89 3hlg n LEU 149 Ca 0.19 0.00 -0.37 0.00 -1.11 0.00 0.00 56.01 54.72 3hlg n LEU 149 Cb 0.09 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.98 3hlg n LEU 149 CO 0.15 0.18 0.07 -2.28 -1.11 0.00 0.00 177.39 174.39 3hlg s HIS 150 N -1.76 3.53 0.34 1.96 2.46 -0.80 -4.99 115.29 116.02 3hlg s HIS 150 Ca 0.00 0.77 0.02 0.00 0.47 0.00 0.00 55.06 56.32 3hlg s HIS 150 Cb 0.00 -2.40 0.59 0.00 -0.13 0.00 0.00 32.58 30.64 3hlg s HIS 150 CO 0.00 0.29 1.97 -1.00 -2.47 0.00 0.00 174.74 173.53 3hlg h PRO 151 N 6.31 0.81 -0.50 2.88 0.13 -1.91 -0.58 132.00 139.15 3hlg h PRO 151 Ca -0.43 -0.08 0.03 0.00 -0.87 0.00 0.00 66.00 64.65 3hlg h PRO 151 Cb 1.18 -0.17 -0.04 0.00 0.13 0.00 0.00 31.00 32.10 3hlg h PRO 151 CO 0.73 0.59 0.28 -0.07 -0.23 0.00 0.00 178.00 179.29 3hlg h LEU 152 N 0.83 0.43 -0.46 1.56 3.38 -1.97 -1.64 115.31 117.45 3hlg h LEU 152 Ca 0.21 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 58.03 3hlg h LEU 152 Cb -0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3hlg h LEU 152 CO -0.04 0.30 -0.76 -0.07 0.09 0.00 0.00 178.44 177.97 3hlg h LEU 153 N 0.55 0.20 -0.49 1.67 3.38 -1.74 -0.77 115.31 118.12 3hlg h LEU 153 Ca 0.21 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 58.07 3hlg h LEU 153 Cb 0.07 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 3hlg h LEU 153 CO -0.12 0.88 0.26 0.03 0.09 0.00 0.00 178.44 179.58 3hlg h ARG 154 N 0.11 0.49 -0.40 1.13 3.08 -0.88 -1.47 114.38 116.44 3hlg h ARG 154 Ca -0.02 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.95 3hlg h ARG 154 Cb 1.33 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 31.26 3hlg h ARG 154 CO 0.11 0.32 0.05 1.49 -1.07 0.00 0.00 179.97 180.88 3hlg h GLU 155 N 0.51 0.66 -0.73 0.04 4.57 -1.18 -1.43 114.58 117.02 3hlg h GLU 155 Ca 0.21 -0.19 0.15 0.00 -1.18 0.00 0.00 59.36 58.35 3hlg h GLU 155 Cb 0.10 -0.07 -0.10 0.00 -0.16 0.00 0.00 28.75 28.52 3hlg h GLU 155 CO -0.14 0.73 0.22 -0.92 -1.18 0.00 0.00 179.01 177.72 3hlg h TYR 156 N 0.51 0.37 -0.27 0.92 5.03 -0.83 0.12 116.97 122.82 3hlg h TYR 156 Ca 0.12 0.04 -0.16 0.00 2.58 0.00 0.00 58.73 61.31 3hlg h TYR 156 Cb 0.39 -0.05 -0.00 0.00 1.55 0.00 0.00 36.73 38.62 3hlg h TYR 156 CO 0.03 -0.02 -0.44 1.98 -1.32 0.00 0.00 178.16 178.39 3hlg h MET 157 N 0.34 0.77 -0.82 1.82 4.05 -1.13 -2.70 114.93 117.26 3hlg h MET 157 Ca 0.40 -0.47 0.07 0.00 -0.28 0.00 0.00 59.70 59.43 3hlg h MET 157 Cb 0.65 0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 31.43 3hlg h MET 157 CO -0.45 1.10 0.48 0.00 0.23 0.00 0.00 176.91 178.27 3hlg h ALA 158 N 0.66 1.13 0.00 0.39 0.00 -0.20 -0.88 119.26 120.37 3hlg h ALA 158 Ca 0.02 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3hlg h ALA 158 Cb 1.04 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3hlg h ALA 158 CO 0.10 0.17 0.00 1.04 0.00 0.00 0.00 179.25 180.56 3hlg n GLN 159 N -4.69 0.18 -0.30 0.00 1.13 0.32 -4.88 117.38 109.13 3hlg n GLN 159 Ca 0.12 0.15 0.00 0.00 -1.94 0.00 0.00 57.00 55.33 3hlg n GLN 159 Cb 0.21 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.06 3hlg n GLN 159 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hlg n GLY 160 N 0.18 0.84 0.17 1.08 0.00 -0.33 -4.97 105.19 102.16 3hlg n GLY 160 Ca 0.07 -0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.09 3hlg n GLY 160 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3hlg h TYR 161 N 0.00 0.00 -0.14 1.61 0.05 -1.65 -3.19 116.97 113.66 3hlg h TYR 161 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3hlg h TYR 161 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 3hlg h TYR 161 CO 0.00 0.00 0.00 1.28 -1.05 0.00 0.00 178.16 178.39 3hlg n LEU 162 N -2.48 2.51 0.27 3.88 4.77 -1.26 -4.72 117.00 119.96 3hlg n LEU 162 Ca 0.02 -2.22 0.15 0.00 -0.03 0.00 0.00 56.01 53.93 3hlg n LEU 162 Cb 0.28 -0.18 0.70 0.00 -2.33 0.00 0.00 43.42 41.89 3hlg n LEU 162 CO 0.23 0.62 0.97 0.06 -1.33 0.00 0.00 177.39 177.94 3hlg h GLN 163 N 0.82 0.00 -0.01 3.23 3.07 -1.88 -1.95 115.11 118.38 3hlg h GLN 163 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3hlg h GLN 163 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.28 3hlg h GLN 163 CO 0.02 0.08 -0.59 -1.13 0.09 0.00 0.00 178.83 177.30 3hlg n SER 164 N -3.26 1.45 -2.05 0.06 3.41 -1.26 -4.48 113.62 107.49 3hlg n SER 164 Ca -0.00 -1.16 -0.23 0.00 -0.26 0.00 0.00 58.87 57.22 3hlg n SER 164 Cb 0.30 0.54 0.05 0.00 -0.26 0.00 0.00 64.21 64.84 3hlg n SER 164 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hlg n ALA 165 N -0.66 5.54 -3.12 7.33 0.00 -0.73 -4.88 120.51 123.99 3hlg n ALA 165 Ca 0.08 -2.27 -0.12 0.00 0.00 0.00 0.00 53.44 51.13 3hlg n ALA 165 Cb 0.40 -1.52 -0.10 0.00 0.00 0.00 0.00 19.45 18.23 3hlg n ALA 165 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 3hlg s GLU 166 N -2.47 0.46 -0.12 0.00 -1.05 -1.26 -0.37 118.70 113.90 3hlg s GLU 166 Ca 0.42 -0.23 -0.09 0.00 -0.15 0.00 0.00 54.97 54.92 3hlg s GLU 166 Cb 0.33 0.20 0.04 0.00 -0.44 0.00 0.00 34.13 34.26 3hlg s GLU 166 CO -0.01 -0.11 0.30 0.21 0.95 0.00 0.00 175.26 176.60 3hlg s LYS 167 N -1.08 0.31 -1.79 -4.83 2.20 -0.85 -4.85 119.74 108.84 3hlg s LYS 167 Ca -0.12 0.50 0.00 0.00 -0.36 0.00 0.00 55.97 55.99 3hlg s LYS 167 Cb -0.06 0.05 0.00 0.00 -1.51 0.00 0.00 37.83 36.31 3hlg s LYS 167 CO 0.02 -0.10 0.00 1.19 -0.36 0.00 0.00 175.35 176.10 3hlg n PHE 168 N 3.52 -0.97 -0.94 4.03 3.72 -1.26 -2.04 117.46 123.52 3hlg n PHE 168 Ca -0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 3hlg n PHE 168 Cb 0.56 -3.96 0.00 0.00 -0.94 0.00 0.00 39.48 35.14 3hlg n PHE 168 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hlg n GLY 169 N -1.01 0.46 3.49 1.37 0.00 -1.26 -4.86 105.19 103.38 3hlg n GLY 169 Ca -0.25 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.41 3hlg n GLY 169 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hlg s ILE 170 N -2.17 4.45 0.22 -0.61 1.01 -0.87 -4.99 121.20 118.24 3hlg s ILE 170 Ca 0.00 -0.13 -0.30 0.00 0.00 0.00 0.00 60.65 60.22 3hlg s ILE 170 Cb 0.00 -3.07 -0.08 0.00 0.01 0.00 0.00 42.46 39.32 3hlg s ILE 170 CO 0.00 0.36 0.95 -1.58 0.00 0.00 0.00 174.94 174.67 3hlg s GLN 171 N 1.39 4.82 0.29 2.79 0.74 -1.26 -2.02 119.66 126.41 3hlg s GLN 171 Ca 0.05 1.50 -0.30 0.00 0.05 0.00 0.00 55.36 56.67 3hlg s GLN 171 Cb -0.15 -3.29 -0.11 0.00 1.10 0.00 0.00 33.01 30.56 3hlg s GLN 171 CO 0.04 0.45 1.58 0.45 -0.55 0.00 0.00 175.29 177.26 3hlg s SER 172 N -0.96 6.40 0.00 6.67 0.15 0.51 -4.89 113.70 121.57 3hlg s SER 172 Ca 0.42 2.92 0.27 0.00 0.70 0.00 0.00 55.95 60.26 3hlg s SER 172 Cb -0.26 -2.63 0.92 0.00 -1.71 0.00 0.00 66.02 62.34 3hlg s SER 172 CO 0.32 -0.89 1.67 0.54 1.20 0.00 0.00 173.24 176.08 3hlg n ARG 173 N 2.25 1.32 -0.04 5.44 5.12 -1.26 -4.20 116.66 125.29 3hlg n ARG 173 Ca 0.08 -0.77 -0.00 0.00 -1.93 0.00 0.00 57.85 55.23 3hlg n ARG 173 Cb 0.38 -1.48 -0.15 0.00 -1.16 0.00 0.00 32.46 30.04 3hlg n ARG 173 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3hlg n LEU 174 N -0.17 0.15 -0.09 0.55 4.32 -1.26 -4.65 117.00 115.85 3hlg n LEU 174 Ca 0.16 0.06 -0.14 0.00 -0.02 0.00 0.00 56.01 56.08 3hlg n LEU 174 Cb 0.35 0.24 -0.04 0.00 -1.62 0.00 0.00 43.42 42.35 3hlg n LEU 174 CO 0.20 0.25 0.51 0.00 -1.22 0.00 0.00 177.39 177.13 3hlg h ALA 175 N 1.44 0.43 -2.86 -1.18 0.00 -1.94 -3.46 119.26 111.68 3hlg h ALA 175 Ca -0.28 -0.45 -0.53 0.00 0.00 0.00 0.00 54.91 53.65 3hlg h ALA 175 Cb 1.67 -0.08 0.10 0.00 0.00 0.00 0.00 17.79 19.48 3hlg h ALA 175 CO 0.02 0.53 0.54 -2.14 0.00 0.00 0.00 179.25 178.20 3hlg s PRO 176 N -4.23 3.41 0.72 0.00 0.02 -1.26 -5.01 135.00 128.65 3hlg s PRO 176 Ca -0.12 2.00 -0.11 0.00 0.02 0.00 0.00 61.00 62.79 3hlg s PRO 176 Cb 0.09 -2.30 0.02 0.00 0.02 0.00 0.00 34.50 32.33 3hlg s PRO 176 CO 0.85 -0.90 1.07 -1.25 -0.33 0.00 0.00 177.00 176.44 3hlg s PRO 177 N -2.84 2.77 0.91 5.54 0.04 -1.26 -5.04 135.00 135.12 3hlg s PRO 177 Ca 0.68 0.80 -0.11 0.00 0.04 0.00 0.00 61.00 62.41 3hlg s PRO 177 Cb -0.34 -1.98 0.14 0.00 0.04 0.00 0.00 34.50 32.35 3hlg s PRO 177 CO 0.41 -1.18 1.09 0.00 0.04 0.00 0.00 177.00 177.36 3hlg s ALA 178 N -3.12 1.46 0.00 8.56 0.00 -1.17 -4.74 121.76 122.75 3hlg s ALA 178 Ca 0.58 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.53 3hlg s ALA 178 Cb -0.13 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.77 3hlg s ALA 178 CO 0.54 -2.44 0.54 1.33 0.00 0.00 0.00 175.76 175.74 3hlg n VAL 179 N -3.95 0.10 -3.86 0.00 0.24 0.35 -0.30 118.33 110.91 3hlg n VAL 179 Ca 0.07 -0.54 -0.10 0.00 -2.04 0.00 0.00 64.34 61.74 3hlg n VAL 179 Cb 0.55 0.97 0.01 0.00 -1.47 0.00 0.00 33.84 33.90 3hlg n VAL 179 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3hlg s ASN 180 N -0.10 0.14 0.40 -1.34 3.84 -1.00 -4.84 114.94 112.03 3hlg s ASN 180 Ca 0.00 -1.16 -0.08 0.00 0.21 0.00 0.00 52.86 51.83 3hlg s ASN 180 Cb 0.00 0.81 -0.05 0.00 -0.55 0.00 0.00 41.25 41.45 3hlg s ASN 180 CO 0.00 -1.59 0.72 -1.81 -2.79 0.00 0.00 177.10 171.64 3hlg s ASP 181 N -3.09 6.44 0.25 -4.21 1.01 -1.26 -4.31 116.67 111.51 3hlg s ASP 181 Ca 0.18 0.98 -0.30 0.00 0.71 0.00 0.00 52.55 54.13 3hlg s ASP 181 Cb -0.04 -2.26 -0.10 0.00 1.01 0.00 0.00 42.92 41.53 3hlg s ASP 181 CO 0.13 -0.39 1.36 -2.16 0.21 0.00 0.00 175.17 174.32 3hlg s PRO 182 N -3.99 4.33 0.00 8.23 0.04 -1.18 -2.08 135.00 140.35 3hlg s PRO 182 Ca 0.49 2.20 0.00 0.00 0.04 0.00 0.00 61.00 63.72 3hlg s PRO 182 Cb -0.10 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.31 3hlg s PRO 182 CO 0.34 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.48 3hlg n GLY 183 N 1.91 1.80 0.13 0.56 0.00 0.84 -4.92 105.19 105.52 3hlg n GLY 183 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.91 3hlg n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hlg h ALA 184 N 0.00 0.10 -2.93 4.61 0.00 -1.62 -3.48 119.26 115.94 3hlg h ALA 184 Ca 0.00 -0.50 0.01 0.00 0.00 0.00 0.00 54.91 54.42 3hlg h ALA 184 Cb 0.00 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.71 3hlg h ALA 184 CO 0.00 0.25 0.12 -1.83 0.00 0.00 0.00 179.25 177.79 3hlg s GLU 185 N -3.42 1.51 -0.24 0.00 -1.05 -1.26 -4.97 118.70 109.27 3hlg s GLU 185 Ca -0.14 -0.86 -0.26 0.00 -0.15 0.00 0.00 54.97 53.56 3hlg s GLU 185 Cb 0.03 0.56 0.00 0.00 -0.44 0.00 0.00 34.13 34.28 3hlg s GLU 185 CO 0.79 -0.66 0.92 -0.46 0.95 0.00 0.00 175.26 176.80 3hlg s TRP 186 N -3.88 3.32 -0.05 4.83 -0.00 -1.26 -4.38 118.94 117.53 3hlg s TRP 186 Ca 0.09 1.28 -0.01 0.00 -0.00 0.00 0.00 56.10 57.45 3hlg s TRP 186 Cb -0.03 -3.15 0.03 0.00 -0.00 0.00 0.00 33.47 30.33 3hlg s TRP 186 CO -0.01 -0.44 0.03 0.42 -0.00 0.00 0.00 176.95 176.96 3hlg s ILE 187 N 3.00 0.10 0.06 5.86 1.01 -0.29 -4.90 121.20 126.03 3hlg s ILE 187 Ca 0.39 0.28 -0.30 0.00 0.00 0.00 0.00 60.65 61.01 3hlg s ILE 187 Cb -0.15 -0.30 -0.08 0.00 0.01 0.00 0.00 42.46 41.94 3hlg s ILE 187 CO 0.07 0.20 1.74 -0.47 0.00 0.00 0.00 174.94 176.48 3hlg s TYR 188 N 1.94 2.13 0.14 3.97 5.04 -1.26 -4.62 117.35 124.68 3hlg s TYR 188 Ca 0.03 0.11 -0.04 0.00 -2.44 0.00 0.00 57.07 54.73 3hlg s TYR 188 Cb -0.12 -4.04 0.02 0.00 0.35 0.00 0.00 41.96 38.16 3hlg s TYR 188 CO -0.04 -4.33 0.26 0.41 -1.34 0.00 0.00 175.55 170.52 3hlg n GLY 189 N 4.14 1.83 0.63 8.97 0.00 -1.26 -3.62 105.19 115.88 3hlg n GLY 189 Ca 0.17 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 45.03 3hlg n GLY 189 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hlg n THR 190 N -0.19 0.15 -0.36 2.61 -2.24 -1.13 -4.33 114.28 108.79 3hlg n THR 190 Ca -0.03 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.83 3hlg n THR 190 Cb 0.21 -0.43 0.25 0.00 -2.10 0.00 0.00 70.33 68.25 3hlg n THR 190 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 3hlg h ASN 191 N 0.48 0.92 1.42 3.42 2.35 -1.90 -1.91 115.58 120.36 3hlg h ASN 191 Ca 0.00 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 3hlg h ASN 191 Cb 0.39 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.62 3hlg h ASN 191 CO 0.00 0.48 -0.29 -0.07 -1.65 0.00 0.00 177.43 175.90 3hlg h LEU 192 N 0.99 0.00 -0.20 1.61 -0.00 -1.81 -0.41 115.31 115.50 3hlg h LEU 192 Ca 0.50 -0.05 -0.10 0.00 -0.00 0.00 0.00 57.88 58.23 3hlg h LEU 192 Cb 0.51 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.16 3hlg h LEU 192 CO -0.27 0.02 -0.28 0.44 -0.00 0.00 0.00 178.44 178.36 3hlg h ASP 193 N 0.00 0.59 -0.35 -0.43 5.19 -1.62 -1.07 116.42 118.73 3hlg h ASP 193 Ca 0.00 -0.52 -0.05 0.00 -0.62 0.00 0.00 57.03 55.84 3hlg h ASP 193 Cb 0.85 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 40.18 3hlg h ASP 193 CO 0.00 0.99 0.00 -0.50 -3.12 0.00 0.00 179.24 176.61 3hlg h TRP 194 N 0.20 0.67 -0.89 4.55 4.06 -1.40 -2.48 115.95 120.66 3hlg h TRP 194 Ca 0.02 -0.11 0.06 0.00 2.06 0.00 0.00 58.89 60.91 3hlg h TRP 194 Cb 0.86 -0.17 -0.06 0.00 -1.00 0.00 0.00 29.16 28.78 3hlg h TRP 194 CO 0.09 0.72 0.58 0.00 -3.56 0.00 0.00 178.44 176.26 3hlg h ALA 195 N 0.86 1.51 -0.73 1.49 0.00 -1.08 -0.91 119.26 120.40 3hlg h ALA 195 Ca 0.10 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3hlg h ALA 195 Cb 0.45 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3hlg h ALA 195 CO 0.02 0.37 0.38 0.78 0.00 0.00 0.00 179.25 180.79 3hlg h GLY 196 N 1.03 1.11 0.91 0.00 0.00 -1.03 -1.34 103.07 103.76 3hlg h GLY 196 Ca 0.38 -0.53 0.03 0.00 0.00 0.00 0.00 47.33 47.21 3hlg h GLY 196 CO -0.14 0.50 0.59 0.50 0.00 0.00 0.00 176.54 178.00 3hlg h LYS 197 N 1.02 1.13 -0.53 4.80 1.79 -0.81 -1.63 116.57 122.34 3hlg h LYS 197 Ca 0.26 -0.07 0.02 0.00 -2.18 0.00 0.00 60.65 58.68 3hlg h LYS 197 Cb 0.08 -0.25 -0.03 0.00 -1.58 0.00 0.00 32.23 30.44 3hlg h LYS 197 CO -0.04 0.75 0.33 1.25 -1.08 0.00 0.00 179.45 180.66 3hlg h LEU 198 N 1.16 0.55 -0.54 2.94 6.46 -0.63 -0.78 115.31 124.47 3hlg h LEU 198 Ca 0.35 -0.00 0.02 0.00 -0.12 0.00 0.00 57.88 58.13 3hlg h LEU 198 Cb -0.03 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 39.74 3hlg h LEU 198 CO -0.11 0.39 0.33 0.58 -0.62 0.00 0.00 178.44 179.02 3hlg h VAL 199 N 0.66 1.08 -0.60 1.05 2.07 -0.92 0.60 116.25 120.20 3hlg h VAL 199 Ca 0.21 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.53 3hlg h VAL 199 Cb -0.01 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.07 3hlg h VAL 199 CO -0.08 0.12 0.36 -0.33 0.02 0.00 0.00 177.57 177.67 3hlg h GLU 200 N 0.67 0.69 0.06 1.57 5.08 -0.79 -1.85 114.58 120.01 3hlg h GLU 200 Ca 0.21 -0.04 -0.24 0.00 -1.00 0.00 0.00 59.36 58.29 3hlg h GLU 200 Cb -0.01 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.08 3hlg h GLU 200 CO -0.08 0.46 -1.07 0.00 -1.00 0.00 0.00 179.01 177.32 3hlg h ARG 201 N 0.71 0.24 -0.04 2.33 3.08 -0.88 0.86 114.38 120.68 3hlg h ARG 201 Ca 0.24 -0.34 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 3hlg h ARG 201 Cb 0.03 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 3hlg h ARG 201 CO -0.11 1.11 -0.35 0.00 -1.07 0.00 0.00 179.97 179.55 3hlg h ALA 202 N 0.76 1.35 0.00 0.04 0.00 -0.77 -3.31 119.26 117.34 3hlg h ALA 202 Ca -0.09 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3hlg h ALA 202 Cb 1.77 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.49 3hlg h ALA 202 CO 0.17 0.48 -1.61 0.25 0.00 0.00 0.00 179.25 178.54 3hlg n THR 203 N -4.10 0.00 -1.02 0.00 -2.24 -0.71 -4.99 114.28 101.22 3hlg n THR 203 Ca -0.02 -0.33 -0.01 0.00 -2.27 0.00 0.00 64.05 61.43 3hlg n THR 203 Cb 0.41 0.23 -0.00 0.00 -2.10 0.00 0.00 70.33 68.86 3hlg n THR 203 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hlg n GLY 204 N 1.62 0.46 3.57 3.38 0.00 0.28 -5.03 105.19 109.47 3hlg n GLY 204 Ca -0.02 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.55 3hlg n GLY 204 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hlg s LEU 205 N -0.17 3.00 0.65 0.99 1.43 -1.13 -5.03 118.68 118.42 3hlg s LEU 205 Ca 0.00 -0.47 -0.14 0.00 -1.03 0.00 0.00 54.13 52.48 3hlg s LEU 205 Cb 0.00 -1.75 -0.00 0.00 0.03 0.00 0.00 46.19 44.47 3hlg s LEU 205 CO 0.00 0.15 1.08 1.51 0.23 0.00 0.00 176.35 179.32 3hlg s ASP 206 N -2.47 5.30 0.40 2.29 3.84 -1.26 -4.23 116.67 120.54 3hlg s ASP 206 Ca 0.23 1.87 0.11 0.00 -0.00 0.00 0.00 52.55 54.76 3hlg s ASP 206 Cb -0.10 -2.53 0.84 0.00 -1.38 0.00 0.00 42.92 39.74 3hlg s ASP 206 CO 0.14 -1.50 1.93 0.25 -0.00 0.00 0.00 175.17 176.00 3hlg h LEU 207 N -0.05 0.15 0.24 2.11 5.85 -1.94 -1.59 115.31 120.08 3hlg h LEU 207 Ca -0.46 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.22 3hlg h LEU 207 Cb 1.23 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 3hlg h LEU 207 CO 0.55 0.33 -0.13 -0.08 -0.34 0.00 0.00 178.44 178.77 3hlg h GLU 208 N 0.15 -0.33 -0.69 1.25 4.57 -1.98 0.12 114.58 117.68 3hlg h GLU 208 Ca 0.03 0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.21 3hlg h GLU 208 Cb 0.37 0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.00 3hlg h GLU 208 CO 0.02 -0.22 0.35 0.37 -1.18 0.00 0.00 179.01 178.35 3hlg h GLN 209 N -0.35 0.98 -0.20 1.92 4.15 -1.82 -1.96 115.11 117.83 3hlg h GLN 209 Ca -0.03 -0.13 0.01 0.00 0.77 0.00 0.00 58.65 59.27 3hlg h GLN 209 Cb 0.28 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 3hlg h GLN 209 CO 0.04 0.76 0.12 -0.92 -1.93 0.00 0.00 178.83 176.90 3hlg h TYR 210 N 0.96 0.23 -0.44 3.99 3.20 -1.07 -1.17 116.97 122.67 3hlg h TYR 210 Ca 0.24 0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.21 3hlg h TYR 210 Cb 0.08 -0.08 -0.09 0.00 1.54 0.00 0.00 36.73 38.18 3hlg h TYR 210 CO 0.00 0.14 -0.19 1.25 -1.64 0.00 0.00 178.16 177.72 3hlg h LEU 211 N 0.26 -0.65 -0.42 2.82 5.85 -0.61 -1.14 115.31 121.42 3hlg h LEU 211 Ca 0.08 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 3hlg h LEU 211 Cb -0.01 0.36 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 3hlg h LEU 211 CO -0.03 -0.22 0.21 1.56 -0.34 0.00 0.00 178.44 179.62 3hlg h GLN 212 N -0.10 0.59 0.00 1.25 1.08 -0.86 -0.88 115.11 116.19 3hlg h GLN 212 Ca 0.21 -0.08 -0.09 0.00 -1.45 0.00 0.00 58.65 57.24 3hlg h GLN 212 Cb 0.42 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 3hlg h GLN 212 CO -0.50 0.50 -0.44 0.93 -0.95 0.00 0.00 178.83 178.37 3hlg h GLU 213 N 0.53 0.00 0.00 1.46 5.08 -0.97 -0.66 114.58 120.02 3hlg h GLU 213 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3hlg h GLU 213 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3hlg h GLU 213 CO -0.02 0.44 -0.62 0.09 -1.00 0.00 0.00 179.01 177.90 3hlg n ASN 214 N -3.39 3.12 -0.03 1.42 3.02 -0.45 -4.54 115.26 114.41 3hlg n ASN 214 Ca 0.01 -0.17 -0.06 0.00 -0.03 0.00 0.00 54.58 54.33 3hlg n ASN 214 Cb 0.61 0.96 -0.02 0.00 -0.61 0.00 0.00 39.78 40.72 3hlg n ASN 214 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3hlg n ILE 215 N -1.27 0.33 0.08 2.41 5.41 -0.41 -4.77 119.36 121.13 3hlg n ILE 215 Ca 0.00 -0.06 -0.12 0.00 1.00 0.00 0.00 62.75 63.57 3hlg n ILE 215 Cb 0.00 -1.58 -0.08 0.00 -0.71 0.00 0.00 39.64 37.27 3hlg n ILE 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3hlg h ALA 217 N -0.11 0.24 0.00 0.00 0.00 -1.34 -0.59 119.26 117.46 3hlg h ALA 217 Ca -0.03 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3hlg h ALA 217 Cb 0.51 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 3hlg h ALA 217 CO 0.04 -0.41 -0.01 -1.35 0.00 0.00 0.00 179.25 177.52 3hlg h PRO 218 N 0.08 0.00 -0.16 0.00 0.11 -1.80 -2.19 132.00 128.05 3hlg h PRO 218 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 3hlg h PRO 218 Cb 0.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.27 3hlg h PRO 218 CO -0.21 0.01 0.00 1.28 -0.21 0.00 0.00 178.00 178.87 3hlg n LEU 219 N -3.64 2.82 -1.36 2.35 4.77 -0.70 -4.98 117.00 116.26 3hlg n LEU 219 Ca -0.03 -1.24 -0.13 0.00 -0.03 0.00 0.00 56.01 54.59 3hlg n LEU 219 Cb 0.10 -0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.08 3hlg n LEU 219 CO 0.26 0.55 -0.16 0.61 -1.33 0.00 0.00 177.39 177.33 3hlg n GLY 220 N 1.10 0.18 3.70 -0.72 0.00 -0.37 -4.99 105.19 104.09 3hlg n GLY 220 Ca 0.13 -0.36 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 3hlg n GLY 220 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hlg s ILE 221 N -2.61 5.02 -0.68 -0.61 1.01 -0.40 -4.95 121.20 117.97 3hlg s ILE 221 Ca 0.00 1.45 0.06 0.00 0.00 0.00 0.00 60.65 62.16 3hlg s ILE 221 Cb 0.00 -4.05 0.07 0.00 0.01 0.00 0.00 42.46 38.49 3hlg s ILE 221 CO 0.00 0.20 0.78 0.35 0.00 0.00 0.00 174.94 176.26 3hlg n THR 222 N 4.04 0.20 -2.34 2.92 -2.24 -1.26 -4.48 114.28 111.12 3hlg n THR 222 Ca -0.00 -0.60 -0.06 0.00 -2.27 0.00 0.00 64.05 61.12 3hlg n THR 222 Cb 0.51 1.00 0.06 0.00 -2.10 0.00 0.00 70.33 69.79 3hlg n THR 222 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3hlg n ASP 223 N 0.27 2.53 -3.95 3.42 3.85 -1.26 -5.02 116.55 116.38 3hlg n ASP 223 Ca 0.04 -2.83 -0.29 0.00 -0.71 0.00 0.00 54.79 50.99 3hlg n ASP 223 Cb 0.19 -0.41 -0.16 0.00 -1.35 0.00 0.00 41.12 39.38 3hlg n ASP 223 CO 0.00 0.00 0.00 -0.32 -1.01 0.00 0.00 177.20 175.87 3hlg s MET 224 N -2.99 1.81 -0.03 0.11 1.75 -1.26 -4.12 119.30 114.58 3hlg s MET 224 Ca 0.37 -0.64 -0.23 0.00 -1.25 0.00 0.00 55.69 53.94 3hlg s MET 224 Cb 0.37 -2.16 0.05 0.00 2.84 0.00 0.00 34.83 35.92 3hlg s MET 224 CO -0.04 -0.39 0.51 -0.08 -0.65 0.00 0.00 175.02 174.37 3hlg s THR 225 N 1.52 0.03 -0.49 10.11 -1.32 -0.45 -4.87 115.64 120.16 3hlg s THR 225 Ca 0.01 -0.22 0.24 0.00 -1.21 0.00 0.00 61.69 60.50 3hlg s THR 225 Cb -0.15 -0.83 0.27 0.00 -1.51 0.00 0.00 72.50 70.28 3hlg s THR 225 CO -0.08 -0.12 1.57 -0.26 -2.21 0.00 0.00 174.62 173.51 3hlg h PHE 226 N 3.36 0.00 -2.31 9.09 -1.00 -1.86 0.26 116.94 124.47 3hlg h PHE 226 Ca -0.28 0.00 -0.68 0.00 2.81 0.00 0.00 57.97 59.82 3hlg h PHE 226 Cb 1.16 0.00 -0.36 0.00 3.61 0.00 0.00 35.95 40.36 3hlg h PHE 226 CO 0.44 0.00 -0.01 1.63 -1.61 0.00 0.00 178.31 178.77 3hlg n LYS 227 N -2.81 3.93 -0.31 1.51 4.76 -1.26 -4.85 118.16 119.13 3hlg n LYS 227 Ca 0.04 -4.76 0.09 0.00 -2.87 0.00 0.00 58.31 50.80 3hlg n LYS 227 Cb 0.50 -2.33 0.30 0.00 -1.84 0.00 0.00 35.03 31.66 3hlg n LYS 227 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3hlg h LEU 228 N 3.70 0.81 -0.58 -0.35 5.85 -1.93 -1.48 115.31 121.32 3hlg h LEU 228 Ca 0.27 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.03 3hlg h LEU 228 Cb 0.47 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.38 3hlg h LEU 228 CO 0.97 0.44 0.00 0.00 -0.34 0.00 0.00 178.44 179.51 3hlg n GLN 229 N -4.58 0.14 -0.13 1.25 1.13 -1.26 -1.14 117.38 112.79 3hlg n GLN 229 Ca 0.17 0.40 0.10 0.00 -1.94 0.00 0.00 57.00 55.74 3hlg n GLN 229 Cb 0.38 -1.79 0.30 0.00 0.11 0.00 0.00 30.24 29.24 3hlg n GLN 229 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3hlg n GLN 230 N -2.06 1.96 -3.87 -1.09 6.02 -0.56 -4.65 117.38 113.13 3hlg n GLN 230 Ca 0.02 -1.45 -0.29 0.00 -0.01 0.00 0.00 57.00 55.27 3hlg n GLN 230 Cb 0.20 -1.41 -0.13 0.00 1.02 0.00 0.00 30.24 29.92 3hlg n GLN 230 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3hlg s ARG 231 N -1.65 2.12 0.34 -1.09 1.81 -0.29 -4.96 118.95 115.23 3hlg s ARG 231 Ca 0.33 -2.93 0.10 0.00 -1.72 0.00 0.00 55.73 51.50 3hlg s ARG 231 Cb 0.18 -3.17 0.85 0.00 -0.45 0.00 0.00 34.95 32.35 3hlg s ARG 231 CO 0.26 -1.23 1.80 -1.35 -0.68 0.00 0.00 175.30 174.10 3hlg h PRO 232 N 5.87 0.64 -0.57 3.54 0.11 -1.82 -0.80 132.00 138.96 3hlg h PRO 232 Ca 0.07 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.10 3hlg h PRO 232 Cb 0.82 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.76 3hlg h PRO 232 CO 0.67 0.42 0.17 0.38 -0.21 0.00 0.00 178.00 179.43 3hlg h ASP 233 N 0.66 0.79 0.01 -2.05 -0.00 -1.94 -1.73 116.42 112.16 3hlg h ASP 233 Ca 0.55 -0.13 -0.24 0.00 -0.00 0.00 0.00 57.03 57.21 3hlg h ASP 233 Cb 1.00 -0.21 0.02 0.00 -0.00 0.00 0.00 39.33 40.15 3hlg h ASP 233 CO -0.32 0.75 -0.95 0.24 -0.00 0.00 0.00 179.24 178.96 3hlg h MET 234 N 0.83 0.62 -1.00 4.15 2.86 -1.64 -3.28 114.93 117.47 3hlg h MET 234 Ca 0.19 -0.68 0.11 0.00 -2.06 0.00 0.00 59.70 57.26 3hlg h MET 234 Cb 0.26 0.20 -0.08 0.00 0.06 0.00 0.00 31.60 32.03 3hlg h MET 234 CO -0.01 1.28 0.63 -0.07 1.06 0.00 0.00 176.91 179.80 3hlg h LEU 235 N 0.25 0.93 -1.98 1.22 3.38 -1.03 -0.21 115.31 117.87 3hlg h LEU 235 Ca -0.12 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3hlg h LEU 235 Cb 1.62 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 42.22 3hlg h LEU 235 CO 0.19 0.51 -0.09 0.00 0.09 0.00 0.00 178.44 179.14 3hlg h ALA 236 N 1.53 1.19 -0.00 1.53 0.00 -1.38 -3.13 119.26 118.99 3hlg h ALA 236 Ca 0.49 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3hlg h ALA 236 Cb 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3hlg h ALA 236 CO -0.25 0.11 -0.01 0.54 0.00 0.00 0.00 179.25 179.64 3hlg n ARG 237 N -3.47 -0.16 -1.66 0.00 1.74 -0.68 -5.08 116.66 107.35 3hlg n ARG 237 Ca -0.02 -0.62 -0.33 0.00 -0.77 0.00 0.00 57.85 56.11 3hlg n ARG 237 Cb 0.23 -1.02 0.06 0.00 -1.02 0.00 0.00 32.46 30.71 3hlg n ARG 237 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 3hlg s ARG 238 N -0.29 2.60 0.69 5.56 1.70 -0.18 -4.36 118.95 124.67 3hlg s ARG 238 Ca 0.03 1.49 -0.16 0.00 -0.47 0.00 0.00 55.73 56.62 3hlg s ARG 238 Cb 0.02 -1.92 0.02 0.00 -0.57 0.00 0.00 34.95 32.50 3hlg s ARG 238 CO 0.04 -1.42 1.18 0.00 -1.08 0.00 0.00 175.30 174.01 3hlg s ALA 239 N -2.25 2.27 0.16 7.88 0.00 0.00 -4.93 121.76 124.89 3hlg s ALA 239 Ca 0.69 0.81 -0.03 0.00 0.00 0.00 0.00 51.96 53.43 3hlg s ALA 239 Cb -0.23 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.41 3hlg s ALA 239 CO 0.43 -1.62 0.38 -0.51 0.00 0.00 0.00 175.76 174.44 3hlg s ASP 240 N -2.11 6.45 0.30 0.00 1.01 -0.17 -4.95 116.67 117.20 3hlg s ASP 240 Ca 0.73 0.53 -0.28 0.00 0.71 0.00 0.00 52.55 54.23 3hlg s ASP 240 Cb -0.27 -2.06 -0.09 0.00 1.01 0.00 0.00 42.92 41.50 3hlg s ASP 240 CO 0.42 0.02 1.01 -1.58 0.21 0.00 0.00 175.17 175.25 3hlg s GLN 241 N -2.89 4.61 0.09 8.23 0.74 -1.26 -4.58 119.66 124.60 3hlg s GLN 241 Ca 0.40 1.56 0.08 0.00 0.05 0.00 0.00 55.36 57.45 3hlg s GLN 241 Cb -0.12 -3.03 -0.04 0.00 1.10 0.00 0.00 33.01 30.93 3hlg s GLN 241 CO 0.26 0.26 -0.15 0.99 -0.55 0.00 0.00 175.29 176.11 3hlg s THR 242 N -1.34 3.06 -0.03 -0.34 2.01 -0.74 -1.72 115.64 116.53 3hlg s THR 242 Ca 0.47 -1.31 0.05 0.00 0.31 0.00 0.00 61.69 61.21 3hlg s THR 242 Cb -0.26 -2.38 -0.01 0.00 0.01 0.00 0.00 72.50 69.86 3hlg s THR 242 CO 0.33 0.18 -0.19 -2.28 -0.69 0.00 0.00 174.62 171.96 3hlg s HIS 243 N -1.11 1.85 -0.32 4.92 2.46 -0.06 -0.93 115.29 122.10 3hlg s HIS 243 Ca 0.18 -0.46 -0.17 0.00 0.47 0.00 0.00 55.06 55.08 3hlg s HIS 243 Cb -0.11 -1.22 -0.02 0.00 -0.13 0.00 0.00 32.58 31.11 3hlg s HIS 243 CO 0.10 -0.12 0.46 0.50 -2.47 0.00 0.00 174.74 173.22 3hlg s ARG 244 N -0.21 3.78 0.15 2.88 3.52 -0.12 -1.06 118.95 127.89 3hlg s ARG 244 Ca 0.01 -0.06 -0.31 0.00 -0.13 0.00 0.00 55.73 55.23 3hlg s ARG 244 Cb -0.10 -3.75 -0.09 0.00 -1.56 0.00 0.00 34.95 29.45 3hlg s ARG 244 CO 0.01 -0.49 1.53 1.21 -0.81 0.00 0.00 175.30 176.74 3hlg s ASN 245 N 1.69 6.64 0.42 -2.12 2.47 -0.84 -4.62 114.94 118.59 3hlg s ASN 245 Ca 0.17 2.54 0.10 0.00 0.42 0.00 0.00 52.86 56.09 3hlg s ASN 245 Cb -0.16 -2.59 0.93 0.00 -1.45 0.00 0.00 41.25 37.98 3hlg s ASN 245 CO 0.12 -0.79 2.03 -1.28 -3.72 0.00 0.00 177.10 173.46 3hlg h SER 246 N 6.85 0.42 0.01 -4.21 0.87 -1.97 -0.95 113.55 114.58 3hlg h SER 246 Ca -0.42 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.13 3hlg h SER 246 Cb 1.21 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 3hlg h SER 246 CO 0.90 0.29 -0.01 0.00 -0.53 0.00 0.00 176.83 177.48 3hlg h ALA 247 N 1.73 -0.02 -0.00 6.23 0.00 -1.98 -3.39 119.26 121.82 3hlg h ALA 247 Ca 0.20 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3hlg h ALA 247 Cb 0.17 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3hlg h ALA 247 CO -0.05 -0.22 -0.03 -0.40 0.00 0.00 0.00 179.25 178.55 3hlg n ASP 248 N -4.83 1.03 -0.34 0.00 5.75 -1.22 -5.01 116.55 111.94 3hlg n ASP 248 Ca -0.09 -1.02 -0.04 0.00 -0.01 0.00 0.00 54.79 53.63 3hlg n ASP 248 Cb 0.29 0.20 -0.02 0.00 -1.03 0.00 0.00 41.12 40.55 3hlg n ASP 248 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hlg n GLY 249 N 0.35 0.63 3.86 6.12 0.00 -0.37 -5.00 105.19 110.78 3hlg n GLY 249 Ca 0.02 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 3hlg n GLY 249 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hlg s ARG 250 N -1.84 3.91 -0.03 1.61 1.81 -1.26 -4.79 118.95 118.37 3hlg s ARG 250 Ca 0.00 0.61 -0.20 0.00 -1.72 0.00 0.00 55.73 54.42 3hlg s ARG 250 Cb 0.00 -2.40 -0.05 0.00 -0.45 0.00 0.00 34.95 32.05 3hlg s ARG 250 CO 0.00 0.06 0.57 -0.51 -0.68 0.00 0.00 175.30 174.74 3hlg s LEU 251 N -3.38 4.39 0.05 2.53 1.43 -1.26 -1.98 118.68 120.46 3hlg s LEU 251 Ca 0.53 1.09 0.02 0.00 -1.03 0.00 0.00 54.13 54.74 3hlg s LEU 251 Cb -0.10 -2.88 -0.03 0.00 0.03 0.00 0.00 46.19 43.21 3hlg s LEU 251 CO 0.23 0.08 -0.06 -0.13 0.23 0.00 0.00 176.35 176.70 3hlg s ARG 252 N -0.02 0.54 0.28 1.70 0.52 -0.23 -4.98 118.95 116.77 3hlg s ARG 252 Ca 0.30 -0.85 -0.30 0.00 -0.52 0.00 0.00 55.73 54.36 3hlg s ARG 252 Cb -0.18 -0.18 -0.12 0.00 0.52 0.00 0.00 34.95 35.00 3hlg s ARG 252 CO 0.16 0.01 1.58 0.98 0.02 0.00 0.00 175.30 178.05 3hlg n TYR 253 N 1.18 2.75 -3.90 -0.53 9.36 -1.26 -0.89 117.16 123.88 3hlg n TYR 253 Ca -0.21 0.27 -0.34 0.00 3.32 0.00 0.00 57.90 60.94 3hlg n TYR 253 Cb 0.56 -2.58 -0.13 0.00 -0.63 0.00 0.00 39.34 36.56 3hlg n TYR 253 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 3hlg s ASP 254 N 0.50 4.96 -1.33 2.98 -1.08 -0.70 -4.75 116.67 117.25 3hlg s ASP 254 Ca 0.65 -1.74 -0.16 0.00 -0.52 0.00 0.00 52.55 50.77 3hlg s ASP 254 Cb -0.52 -1.72 0.02 0.00 -1.46 0.00 0.00 42.92 39.24 3hlg s ASP 254 CO 0.48 -0.38 2.04 -0.67 0.52 0.00 0.00 175.17 177.15 3hlg n ASP 255 N 4.52 4.04 -4.74 -0.34 4.64 -1.26 -4.28 116.55 119.13 3hlg n ASP 255 Ca -0.06 -2.84 -0.41 0.00 -1.38 0.00 0.00 54.79 50.10 3hlg n ASP 255 Cb 0.42 -1.64 -0.03 0.00 -1.04 0.00 0.00 41.12 38.83 3hlg n ASP 255 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 3hlg s SER 256 N 3.84 6.93 0.50 1.67 0.15 -1.26 -4.90 113.70 120.63 3hlg s SER 256 Ca 0.51 2.36 0.24 0.00 0.70 0.00 0.00 55.95 59.76 3hlg s SER 256 Cb 0.10 -2.61 1.30 0.00 -1.71 0.00 0.00 66.02 63.11 3hlg s SER 256 CO -0.01 -0.50 1.94 1.62 1.20 0.00 0.00 173.24 177.49 3hlg h VAL 257 N 3.78 0.70 0.00 4.45 3.04 -1.94 -1.64 116.25 124.64 3hlg h VAL 257 Ca -0.44 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 3hlg h VAL 257 Cb 1.21 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 31.04 3hlg h VAL 257 CO 0.77 0.03 0.00 1.88 -1.01 0.00 0.00 177.57 179.24 3hlg h TYR 258 N 0.14 0.00 -0.02 3.17 0.05 -1.91 -2.00 116.97 116.40 3hlg h TYR 258 Ca 0.34 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.12 3hlg h TYR 258 Cb 1.16 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.90 3hlg h TYR 258 CO -0.00 0.00 -0.25 1.19 -1.05 0.00 0.00 178.16 178.05 3hlg n PHE 259 N -2.72 0.00 0.21 4.88 3.72 -0.62 -4.35 117.46 118.59 3hlg n PHE 259 Ca 0.01 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.47 3hlg n PHE 259 Cb 0.26 -0.03 -0.08 0.00 -0.94 0.00 0.00 39.48 38.69 3hlg n PHE 259 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 3hlg n ARG 260 N 0.15 1.48 -3.75 -1.08 1.85 -0.78 -5.01 116.66 109.51 3hlg n ARG 260 Ca 0.12 -0.07 -0.13 0.00 -1.00 0.00 0.00 57.85 56.78 3hlg n ARG 260 Cb 0.45 -1.19 -0.11 0.00 -1.05 0.00 0.00 32.46 30.57 3hlg n ARG 260 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3hlg s ALA 261 N -2.54 -0.87 -0.17 2.89 0.00 -1.02 -5.03 121.76 115.02 3hlg s ALA 261 Ca -0.01 1.02 0.18 0.00 0.00 0.00 0.00 51.96 53.16 3hlg s ALA 261 Cb 0.08 -0.60 0.28 0.00 0.00 0.00 0.00 23.12 22.89 3hlg s ALA 261 CO 0.49 -0.17 1.55 -0.44 0.00 0.00 0.00 175.76 177.19 3hlg h ASP 262 N 5.74 0.00 -4.32 0.00 3.45 -1.88 -3.41 116.42 116.00 3hlg h ASP 262 Ca -0.28 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.18 3hlg h ASP 262 Cb 1.18 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.95 3hlg h ASP 262 CO 0.29 0.34 0.00 0.61 -1.57 0.00 0.00 179.24 178.91 3hlg n GLY 263 N 1.00 -1.02 0.20 2.75 0.00 -1.26 -4.71 105.19 102.15 3hlg n GLY 263 Ca 0.02 -1.61 0.09 0.00 0.00 0.00 0.00 46.02 44.51 3hlg n GLY 263 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3hlg h GLU 264 N 0.00 0.00 -4.75 1.61 4.11 -1.97 -3.46 114.58 110.12 3hlg h GLU 264 Ca 0.00 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.17 3hlg h GLU 264 Cb 0.00 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.10 3hlg h GLU 264 CO 0.00 0.25 -0.68 -1.83 0.07 0.00 0.00 179.01 176.81 3hlg s GLU 265 N -3.31 0.97 -0.29 1.06 -1.05 -1.26 -5.11 118.70 109.70 3hlg s GLU 265 Ca 0.03 -1.43 -0.27 0.00 -0.15 0.00 0.00 54.97 53.16 3hlg s GLU 265 Cb 0.08 -0.27 0.01 0.00 -0.44 0.00 0.00 34.13 33.51 3hlg s GLU 265 CO 0.67 -0.06 0.95 0.00 0.95 0.00 0.00 175.26 177.77 3hlg s PHE 267 N 3.27 3.34 -1.85 0.00 0.08 -1.26 -4.81 117.98 116.75 3hlg s PHE 267 Ca 0.40 -1.51 0.14 0.00 0.12 0.00 0.00 56.93 56.07 3hlg s PHE 267 Cb -0.14 -3.41 0.80 0.00 -0.57 0.00 0.00 43.02 39.71 3hlg s PHE 267 CO 0.12 -0.94 1.29 0.41 -0.10 0.00 0.00 175.22 176.00 3hlg n GLY 268 N 5.04 -0.52 0.01 4.36 0.00 -1.25 -0.91 105.19 111.91 3hlg n GLY 268 Ca -0.11 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 45.96 3hlg n GLY 268 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hlg n GLY 269 N -0.12 -1.32 0.00 -0.02 0.00 -1.25 -3.87 105.19 98.62 3hlg n GLY 269 Ca 0.10 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.83 3hlg n GLY 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hlg n GLN 270 N -1.58 0.04 -0.08 1.61 10.64 -0.63 -3.92 117.38 123.45 3hlg n GLN 270 Ca 0.06 0.00 0.12 0.00 -1.83 0.00 0.00 57.00 55.34 3hlg n GLN 270 Cb 0.35 -0.00 0.26 0.00 -0.86 0.00 0.00 30.24 29.99 3hlg n GLN 270 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3hlg n GLY 271 N 0.00 0.95 3.80 2.61 0.00 -0.09 -3.41 105.19 109.05 3hlg n GLY 271 Ca 0.00 -0.62 -0.39 0.00 0.00 0.00 0.00 46.02 45.02 3hlg n GLY 271 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hlg s VAL 272 N -1.78 4.73 -0.13 1.61 1.01 -1.26 -4.37 120.40 120.20 3hlg s VAL 272 Ca 0.34 1.27 -0.03 0.00 0.00 0.00 0.00 61.98 63.56 3hlg s VAL 272 Cb 0.21 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 3hlg s VAL 272 CO 0.30 0.53 -0.05 -0.36 0.00 0.00 0.00 175.10 175.53 3hlg s PHE 273 N -0.99 3.01 0.31 5.22 0.08 0.92 -2.30 117.98 124.22 3hlg s PHE 273 Ca 0.30 -0.23 -0.19 0.00 0.12 0.00 0.00 56.93 56.93 3hlg s PHE 273 Cb -0.20 -1.89 0.04 0.00 -0.57 0.00 0.00 43.02 40.40 3hlg s PHE 273 CO 0.19 0.06 0.77 0.45 -0.10 0.00 0.00 175.22 176.59 3hlg s SER 274 N 0.06 -0.14 0.43 1.36 0.15 -0.51 -1.34 113.70 113.71 3hlg s SER 274 Ca -0.01 -0.80 -0.08 0.00 0.70 0.00 0.00 55.95 55.76 3hlg s SER 274 Cb -0.14 0.75 -0.05 0.00 -1.71 0.00 0.00 66.02 64.88 3hlg s SER 274 CO 0.03 -1.44 0.76 -0.94 1.20 0.00 0.00 173.24 172.85 3hlg s SER 275 N -3.00 6.40 0.29 5.45 1.04 -1.25 -0.80 113.70 121.83 3hlg s SER 275 Ca 0.13 1.01 0.02 0.00 0.48 0.00 0.00 55.95 57.59 3hlg s SER 275 Cb -0.05 -2.28 0.58 0.00 0.10 0.00 0.00 66.02 64.37 3hlg s SER 275 CO 0.08 -0.46 1.84 -0.65 0.98 0.00 0.00 173.24 175.03 3hlg h PRO 276 N 0.83 0.94 -0.25 4.02 0.11 -1.74 -2.05 132.00 133.86 3hlg h PRO 276 Ca -0.47 -0.06 0.03 0.00 0.11 0.00 0.00 66.00 65.61 3hlg h PRO 276 Cb 1.20 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 3hlg h PRO 276 CO 0.63 0.62 0.08 0.78 -0.21 0.00 0.00 178.00 179.91 3hlg h GLY 277 N 0.97 0.30 1.18 -0.55 0.00 -1.54 -0.75 103.07 102.68 3hlg h GLY 277 Ca 0.49 -0.05 -0.11 0.00 0.00 0.00 0.00 47.33 47.66 3hlg h GLY 277 CO -0.26 0.03 -0.13 1.76 0.00 0.00 0.00 176.54 177.94 3hlg h SER 278 N 0.20 0.96 -0.64 0.19 0.02 -1.75 -2.48 113.55 110.05 3hlg h SER 278 Ca 0.11 -0.32 0.01 0.00 -0.84 0.00 0.00 61.79 60.75 3hlg h SER 278 Cb 0.08 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 3hlg h SER 278 CO -0.11 1.09 0.42 0.22 -1.14 0.00 0.00 176.83 177.30 3hlg h TYR 279 N 0.85 0.79 -0.20 3.45 3.20 -1.05 -2.09 116.97 121.91 3hlg h TYR 279 Ca 0.13 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 3hlg h TYR 279 Cb 0.68 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 3hlg h TYR 279 CO 0.04 0.48 0.04 1.98 -1.64 0.00 0.00 178.16 179.07 3hlg h MET 280 N 0.84 0.28 -0.69 1.82 4.05 -0.98 -1.35 114.93 118.91 3hlg h MET 280 Ca 0.24 -0.03 0.01 0.00 -0.28 0.00 0.00 59.70 59.64 3hlg h MET 280 Cb -0.07 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 30.64 3hlg h MET 280 CO -0.06 0.27 0.46 0.87 0.23 0.00 0.00 176.91 178.67 3hlg h LYS 281 N 0.28 0.90 0.19 0.39 1.57 -0.91 0.14 116.57 119.12 3hlg h LYS 281 Ca 0.07 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3hlg h LYS 281 Cb 0.12 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.23 3hlg h LYS 281 CO -0.00 0.59 -0.09 0.28 -0.57 0.00 0.00 179.45 179.66 3hlg h VAL 282 N 0.92 0.91 -0.44 0.50 2.07 -1.14 -1.90 116.25 117.17 3hlg h VAL 282 Ca 0.26 -0.64 0.07 0.00 0.82 0.00 0.00 66.70 67.21 3hlg h VAL 282 Cb -0.09 1.29 -0.06 0.00 -1.52 0.00 0.00 31.29 30.91 3hlg h VAL 282 CO -0.06 0.14 0.10 -0.07 0.02 0.00 0.00 177.57 177.71 3hlg h LEU 283 N -0.58 0.04 -0.73 2.57 3.38 -1.24 -2.26 115.31 116.49 3hlg h LEU 283 Ca -0.03 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3hlg h LEU 283 Cb 0.43 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 3hlg h LEU 283 CO 0.04 0.06 0.38 -0.74 0.09 0.00 0.00 178.44 178.27 3hlg h HIS 284 N 0.24 1.03 -0.80 1.13 2.76 -0.73 -0.58 115.15 118.21 3hlg h HIS 284 Ca 0.21 -0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.33 3hlg h HIS 284 Cb 0.25 -0.32 -0.04 0.00 1.55 0.00 0.00 27.41 28.85 3hlg h HIS 284 CO -0.20 0.74 0.45 1.03 -1.30 0.00 0.00 177.93 178.65 3hlg h SER 285 N 1.02 0.98 -0.58 3.26 0.87 -1.06 0.34 113.55 118.38 3hlg h SER 285 Ca 0.26 -0.09 -0.08 0.00 -1.23 0.00 0.00 61.79 60.65 3hlg h SER 285 Cb 0.07 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.76 3hlg h SER 285 CO -0.04 0.79 0.06 -0.07 -0.53 0.00 0.00 176.83 177.04 3hlg h LEU 286 N 1.10 0.95 -0.29 2.23 3.38 -1.09 -2.26 115.31 119.32 3hlg h LEU 286 Ca 0.28 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3hlg h LEU 286 Cb 0.01 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3hlg h LEU 286 CO -0.05 0.99 0.09 0.25 0.09 0.00 0.00 178.44 179.81 3hlg h LEU 287 N 0.88 0.43 -1.41 1.67 5.85 -0.65 -2.86 115.31 119.21 3hlg h LEU 287 Ca 0.17 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3hlg h LEU 287 Cb 0.46 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.38 3hlg h LEU 287 CO 0.02 0.52 0.00 0.11 -0.34 0.00 0.00 178.44 178.75 3hlg h LYS 288 N 0.32 0.00 -6.17 1.25 1.57 -0.89 -3.47 116.57 109.18 3hlg h LYS 288 Ca 0.09 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.42 3hlg h LYS 288 Cb 0.25 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.57 3hlg h LYS 288 CO -0.00 0.00 -0.75 0.54 -0.57 0.00 0.00 179.45 178.67 3hlg n ARG 289 N -2.80 -6.09 0.00 3.15 1.74 -0.86 -4.87 116.66 106.93 3hlg n ARG 289 Ca 0.01 0.66 0.15 0.00 -0.77 0.00 0.00 57.85 57.90 3hlg n ARG 289 Cb 0.24 -5.57 0.86 0.00 -1.02 0.00 0.00 32.46 26.97 3hlg n ARG 289 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3hlg n ASP 290 N -2.90 0.12 0.00 0.55 3.85 -1.18 -4.70 116.55 112.29 3hlg n ASP 290 Ca 0.00 -0.80 0.00 0.00 -0.71 0.00 0.00 54.79 53.28 3hlg n ASP 290 Cb 0.55 -0.07 0.00 0.00 -1.35 0.00 0.00 41.12 40.25 3hlg n ASP 290 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3hlg n GLY 291 N 1.10 0.68 0.20 6.12 0.00 -1.24 -4.89 105.19 107.15 3hlg n GLY 291 Ca 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.16 3hlg n GLY 291 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hlg h LEU 292 N 0.00 0.46 0.00 0.99 4.07 -1.91 -3.35 115.31 115.56 3hlg h LEU 292 Ca 0.00 -0.24 -0.36 0.00 0.08 0.00 0.00 57.88 57.36 3hlg h LEU 292 Cb 0.06 -0.13 -0.06 0.00 1.08 0.00 0.00 40.66 41.60 3hlg h LEU 292 CO 0.00 0.91 -2.33 0.18 -1.08 0.00 0.00 178.44 176.13 3hlg n LEU 293 N -3.94 2.74 -3.81 1.67 4.77 -1.26 -4.92 117.00 112.26 3hlg n LEU 293 Ca -0.03 -0.04 -0.11 0.00 -0.03 0.00 0.00 56.01 55.80 3hlg n LEU 293 Cb 0.59 -0.79 -0.08 0.00 -2.33 0.00 0.00 43.42 40.81 3hlg n LEU 293 CO 0.45 0.82 -0.05 -0.76 -1.33 0.00 0.00 177.39 176.52 3hlg s LEU 294 N -6.54 1.16 0.51 2.23 1.43 -1.26 -4.86 118.68 111.36 3hlg s LEU 294 Ca -0.32 -0.29 -0.22 0.00 -1.03 0.00 0.00 54.13 52.27 3hlg s LEU 294 Cb 0.09 1.12 -0.06 0.00 0.03 0.00 0.00 46.19 47.37 3hlg s LEU 294 CO 0.51 -0.58 1.27 -1.10 0.23 0.00 0.00 176.35 176.69 3hlg s GLN 295 N -2.53 3.41 0.33 1.70 -0.21 -1.26 -3.73 119.66 117.37 3hlg s GLN 295 Ca -0.05 2.03 0.08 0.00 0.02 0.00 0.00 55.36 57.43 3hlg s GLN 295 Cb -0.01 -2.32 0.79 0.00 1.00 0.00 0.00 33.01 32.46 3hlg s GLN 295 CO -0.03 -0.91 1.81 -1.35 -2.12 0.00 0.00 175.29 172.68 3hlg h PRO 296 N 1.71 0.71 0.00 2.91 0.11 -1.95 -0.92 132.00 134.57 3hlg h PRO 296 Ca -0.50 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.49 3hlg h PRO 296 Cb 1.28 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3hlg h PRO 296 CO 0.58 0.47 -0.34 -0.56 -0.21 0.00 0.00 178.00 177.94 3hlg h GLN 297 N 0.73 0.00 -0.10 1.05 -0.00 -1.98 -0.89 115.11 113.91 3hlg h GLN 297 Ca 0.54 0.00 -0.16 0.00 -0.00 0.00 0.00 58.65 59.03 3hlg h GLN 297 Cb 0.88 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 28.37 3hlg h GLN 297 CO -0.31 0.34 -0.54 1.15 -0.00 0.00 0.00 178.83 179.46 3hlg h THR 298 N 0.00 1.36 -0.82 1.86 2.02 -1.56 -2.81 112.91 112.96 3hlg h THR 298 Ca -0.00 -1.86 0.05 0.00 0.77 0.00 0.00 66.41 65.37 3hlg h THR 298 Cb 0.71 2.18 -0.06 0.00 -1.74 0.00 0.00 68.15 69.24 3hlg h THR 298 CO 0.04 0.56 0.51 0.58 0.37 0.00 0.00 175.52 177.59 3hlg h VAL 299 N 0.17 1.07 -0.81 3.16 2.07 -1.15 -2.13 116.25 118.63 3hlg h VAL 299 Ca -0.04 -0.33 0.06 0.00 0.82 0.00 0.00 66.70 67.21 3hlg h VAL 299 Cb 1.19 0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 3hlg h VAL 299 CO 0.11 0.18 0.53 0.44 0.02 0.00 0.00 177.57 178.85 3hlg h ASP 300 N 0.96 0.79 -0.65 0.57 3.32 -1.10 -1.21 116.42 119.11 3hlg h ASP 300 Ca 0.35 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.43 3hlg h ASP 300 Cb 0.10 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.45 3hlg h ASP 300 CO -0.15 0.51 0.43 0.25 -1.72 0.00 0.00 179.24 178.56 3hlg h LEU 301 N 0.90 0.67 -1.98 1.55 5.85 -1.12 -2.14 115.31 119.03 3hlg h LEU 301 Ca 0.34 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 59.05 3hlg h LEU 301 Cb 0.21 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.08 3hlg h LEU 301 CO -0.12 0.47 -0.04 0.24 -0.34 0.00 0.00 178.44 178.65 3hlg h MET 302 N 0.78 0.00 -0.08 1.25 2.86 -1.11 -2.32 114.93 116.32 3hlg h MET 302 Ca 0.25 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 3hlg h MET 302 Cb 0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 3hlg h MET 302 CO -0.07 0.04 0.00 1.19 1.06 0.00 0.00 176.91 179.13 3hlg n PHE 303 N -4.40 0.08 -3.16 -0.22 3.72 -0.81 -1.71 117.46 110.95 3hlg n PHE 303 Ca -0.03 -0.04 -0.39 0.00 -0.05 0.00 0.00 57.45 56.94 3hlg n PHE 303 Cb 0.12 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.61 3hlg n PHE 303 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3hlg s GLN 304 N -1.92 4.36 -0.21 -1.08 -1.52 -0.87 -4.96 119.66 113.47 3hlg s GLN 304 Ca 0.35 0.75 -0.36 0.00 -1.95 0.00 0.00 55.36 54.15 3hlg s GLN 304 Cb 0.20 -3.39 -0.13 0.00 -0.22 0.00 0.00 33.01 29.48 3hlg s GLN 304 CO 0.31 0.25 1.89 -2.30 -0.25 0.00 0.00 175.29 175.19 3hlg n PRO 305 N 3.16 1.62 0.05 2.91 -0.02 -1.26 -4.34 135.00 137.11 3hlg n PRO 305 Ca -0.05 0.57 0.11 0.00 -2.02 0.00 0.00 63.50 62.12 3hlg n PRO 305 Cb 0.51 -2.43 0.03 0.00 -0.02 0.00 0.00 33.50 31.59 3hlg n PRO 305 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hlg n ALA 306 N 6.84 3.09 -2.64 3.55 0.00 0.34 -4.93 120.51 126.75 3hlg n ALA 306 Ca 0.27 -0.35 -0.38 0.00 0.00 0.00 0.00 53.44 52.99 3hlg n ALA 306 Cb 0.23 -1.02 -0.06 0.00 0.00 0.00 0.00 19.45 18.59 3hlg n ALA 306 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hlg s LEU 307 N -4.31 4.33 0.87 0.00 1.43 -1.26 -5.05 118.68 114.69 3hlg s LEU 307 Ca 0.02 0.85 -0.11 0.00 -1.03 0.00 0.00 54.13 53.87 3hlg s LEU 307 Cb 0.13 -2.66 0.11 0.00 0.03 0.00 0.00 46.19 43.81 3hlg s LEU 307 CO 0.79 0.10 1.10 -1.61 0.23 0.00 0.00 176.35 176.96 3hlg s GLU 308 N 0.12 1.46 0.34 1.70 2.02 -1.26 -4.59 118.70 118.49 3hlg s GLU 308 Ca 0.25 1.19 0.09 0.00 0.02 0.00 0.00 54.97 56.51 3hlg s GLU 308 Cb -0.16 -1.80 0.82 0.00 0.10 0.00 0.00 34.13 33.09 3hlg s GLU 308 CO 0.11 -2.20 1.81 -1.35 0.02 0.00 0.00 175.26 173.64 3hlg h PRO 309 N -1.54 0.66 -0.33 0.39 0.11 -1.98 -0.64 132.00 128.67 3hlg h PRO 309 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3hlg h PRO 309 Cb 1.26 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 3hlg h PRO 309 CO 0.49 0.44 0.22 -0.09 -0.21 0.00 0.00 178.00 178.84 3hlg h ARG 310 N 0.68 0.43 -0.12 1.05 2.43 -1.99 -0.39 114.38 116.47 3hlg h ARG 310 Ca 0.54 -0.03 -0.21 0.00 -0.81 0.00 0.00 59.98 59.47 3hlg h ARG 310 Cb 0.94 -0.10 0.01 0.00 -0.42 0.00 0.00 29.97 30.40 3hlg h ARG 310 CO -0.31 0.28 -0.78 -0.07 -1.51 0.00 0.00 179.97 177.59 3hlg h LEU 311 N 0.44 0.78 -0.35 3.80 3.38 -1.67 -2.09 115.31 119.60 3hlg h LEU 311 Ca 0.12 -0.52 0.05 0.00 0.09 0.00 0.00 57.88 57.63 3hlg h LEU 311 Cb -0.05 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.43 3hlg h LEU 311 CO -0.03 1.30 0.08 -0.08 0.09 0.00 0.00 178.44 179.79 3hlg h GLU 312 N 0.44 0.19 -0.13 1.13 4.81 -1.00 0.58 114.58 120.59 3hlg h GLU 312 Ca -0.05 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.20 3hlg h GLU 312 Cb 1.39 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.70 3hlg h GLU 312 CO 0.15 0.13 -0.04 0.93 -0.73 0.00 0.00 179.01 179.44 3hlg h GLU 313 N 0.20 -0.02 -0.49 1.92 4.39 -1.03 -1.90 114.58 117.66 3hlg h GLU 313 Ca 0.16 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.77 3hlg h GLU 313 Cb 0.18 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 3hlg h GLU 313 CO -0.21 -0.01 -0.07 0.37 -1.16 0.00 0.00 179.01 177.93 3hlg h GLN 314 N -0.02 0.86 -0.15 2.33 -0.00 -0.98 -1.57 115.11 115.59 3hlg h GLN 314 Ca 0.07 -0.28 -0.00 0.00 -0.00 0.00 0.00 58.65 58.44 3hlg h GLN 314 Cb 0.12 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 27.52 3hlg h GLN 314 CO -0.15 0.91 0.07 1.98 0.00 0.00 0.00 178.83 181.64 3hlg h MET 315 N 0.78 0.21 -0.89 1.69 4.05 -0.73 -0.99 114.93 119.05 3hlg h MET 315 Ca 0.14 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.53 3hlg h MET 315 Cb 0.57 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.29 3hlg h MET 315 CO 0.03 0.25 0.55 -0.91 0.23 0.00 0.00 176.91 177.07 3hlg h ASN 316 N 0.12 1.05 -0.21 1.39 2.35 -1.24 0.13 115.58 119.17 3hlg h ASN 316 Ca 0.05 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3hlg h ASN 316 Cb 0.11 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 3hlg h ASN 316 CO -0.01 0.80 0.12 -0.61 -1.65 0.00 0.00 177.43 176.07 3hlg h GLN 317 N 1.21 0.29 -0.40 0.81 -0.00 -1.15 0.14 115.11 116.02 3hlg h GLN 317 Ca 0.32 -0.03 -0.00 0.00 -0.00 0.00 0.00 58.65 58.93 3hlg h GLN 317 Cb -0.08 -0.06 -0.02 0.00 0.00 0.00 0.00 27.48 27.33 3hlg h GLN 317 CO -0.06 0.28 0.24 1.25 0.00 0.00 0.00 178.83 180.53 3hlg h HIS 318 N 0.23 0.52 -0.17 3.99 2.76 -0.88 -1.38 115.15 120.22 3hlg h HIS 318 Ca 0.07 -0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.17 3hlg h HIS 318 Cb 0.07 -0.17 -0.00 0.00 1.55 0.00 0.00 27.41 28.85 3hlg h HIS 318 CO -0.04 0.37 -0.17 0.52 -1.30 0.00 0.00 177.93 177.31 3hlg h MET 319 N 0.52 0.41 -0.87 5.26 2.86 -0.83 -2.26 114.93 120.02 3hlg h MET 319 Ca 0.14 -0.22 0.11 0.00 -2.06 0.00 0.00 59.70 57.67 3hlg h MET 319 Cb 0.00 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 31.61 3hlg h MET 319 CO -0.03 0.79 0.56 -0.44 1.06 0.00 0.00 176.91 178.85 3hlg h ASP 320 N 0.06 0.73 0.21 1.22 3.32 -0.70 -1.75 116.42 119.51 3hlg h ASP 320 Ca 0.03 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3hlg h ASP 320 Cb 0.71 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.14 3hlg h ASP 320 CO 0.04 0.42 -0.03 0.00 -1.72 0.00 0.00 179.24 177.95 3hlg n ALA 321 N -2.42 2.66 -2.92 3.45 0.00 -0.53 -4.40 120.51 116.35 3hlg n ALA 321 Ca 0.15 -0.24 -0.23 0.00 0.00 0.00 0.00 53.44 53.12 3hlg n ALA 321 Cb 0.35 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.36 3hlg n ALA 321 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hlg n SER 322 N -0.88 3.24 0.16 0.00 7.64 -0.66 -4.84 113.62 118.29 3hlg n SER 322 Ca 0.19 -3.42 0.13 0.00 1.01 0.00 0.00 58.87 56.77 3hlg n SER 322 Cb 0.22 -0.56 0.55 0.00 -1.01 0.00 0.00 64.21 63.41 3hlg n SER 322 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3hlg h PRO 323 N 2.93 0.00 0.00 1.43 0.13 -1.77 -0.66 132.00 134.06 3hlg h PRO 323 Ca 0.13 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.22 3hlg h PRO 323 Cb 0.75 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.87 3hlg h PRO 323 CO 0.71 0.00 -0.20 1.12 -0.23 0.00 0.00 178.00 179.40 3hlg h HIS 324 N 0.00 0.00 0.00 1.56 2.07 -1.94 -3.29 115.15 113.55 3hlg h HIS 324 Ca 0.00 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.34 3hlg h HIS 324 Cb 0.31 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.27 3hlg h HIS 324 CO 0.00 0.20 -1.28 -0.89 -3.07 0.00 0.00 177.93 172.89 3hlg n ILE 325 N -3.40 1.49 -3.31 6.12 5.41 -0.70 -5.01 119.36 119.95 3hlg n ILE 325 Ca -0.00 -0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.63 3hlg n ILE 325 Cb 0.40 -2.16 0.00 0.00 -0.71 0.00 0.00 39.64 37.17 3hlg n ILE 325 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 3hlg n ASN 326 N -4.45 -6.68 0.21 4.38 5.15 -0.34 -4.79 115.26 108.74 3hlg n ASN 326 Ca -0.27 -0.32 0.05 0.00 -0.60 0.00 0.00 54.58 53.45 3hlg n ASN 326 Cb 0.58 -3.86 0.50 0.00 -0.53 0.00 0.00 39.78 36.47 3hlg n ASN 326 CO 0.00 0.00 0.00 1.88 1.40 0.00 0.00 177.26 180.54 3hlg h TYR 327 N 0.48 0.05 0.00 1.20 0.05 -1.94 -2.77 116.97 114.04 3hlg h TYR 327 Ca -0.25 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.52 3hlg h TYR 327 Cb 1.16 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.89 3hlg h TYR 327 CO 0.19 0.19 0.00 0.41 -1.05 0.00 0.00 178.16 177.89 3hlg n GLY 328 N -1.09 -1.12 7.00 3.88 0.00 -1.26 -4.67 105.19 107.94 3hlg n GLY 328 Ca -0.02 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3hlg n GLY 328 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hlg n GLY 329 N 1.11 3.27 0.13 -0.02 0.00 -1.05 -2.38 105.19 106.25 3hlg n GLY 329 Ca 0.20 0.26 0.12 0.00 0.00 0.00 0.00 46.02 46.59 3hlg n GLY 329 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hlg n PRO 330 N 9.13 0.20 -1.37 1.61 -0.04 -1.26 -4.85 135.00 138.42 3hlg n PRO 330 Ca 0.00 0.40 -0.35 0.00 -0.04 0.00 0.00 63.50 63.51 3hlg n PRO 330 Cb 0.00 -1.86 0.10 0.00 -0.04 0.00 0.00 33.50 31.70 3hlg n PRO 330 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3hlg n MET 331 N -2.23 0.57 -1.64 0.54 2.81 -1.00 -4.90 117.12 111.26 3hlg n MET 331 Ca 0.02 0.26 -0.41 0.00 -1.81 0.00 0.00 57.70 55.77 3hlg n MET 331 Cb 0.25 -2.46 0.01 0.00 -0.71 0.00 0.00 33.22 30.31 3hlg n MET 331 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 3hlg n PRO 332 N -2.64 1.50 0.23 0.03 -0.02 -1.26 -4.87 135.00 127.97 3hlg n PRO 332 Ca 0.14 0.54 0.10 0.00 -2.02 0.00 0.00 63.50 62.26 3hlg n PRO 332 Cb 0.49 -2.15 0.51 0.00 -0.02 0.00 0.00 33.50 32.33 3hlg n PRO 332 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 3hlg h MET 333 N 1.66 0.00 -5.04 -0.52 2.86 -1.93 -3.36 114.93 108.60 3hlg h MET 333 Ca -0.46 0.00 -0.67 0.00 -2.06 0.00 0.00 59.70 56.52 3hlg h MET 333 Cb 1.33 0.00 -0.32 0.00 0.06 0.00 0.00 31.60 32.66 3hlg h MET 333 CO 0.58 0.23 -0.81 0.08 1.06 0.00 0.00 176.91 178.05 3hlg s VAL 334 N -3.82 2.54 -0.21 -2.22 1.01 -1.26 -4.42 120.40 112.02 3hlg s VAL 334 Ca -0.01 -0.78 -0.25 0.00 0.00 0.00 0.00 61.98 60.94 3hlg s VAL 334 Cb 0.11 -2.11 0.07 0.00 0.00 0.00 0.00 36.38 34.45 3hlg s VAL 334 CO 0.63 0.49 0.68 -0.22 0.00 0.00 0.00 175.10 176.69 3hlg s LEU 335 N 1.36 -0.60 -0.30 3.92 2.96 -1.26 -5.12 118.68 119.64 3hlg s LEU 335 Ca 0.05 1.21 -0.29 0.00 -0.22 0.00 0.00 54.13 54.88 3hlg s LEU 335 Cb -0.13 2.38 0.01 0.00 0.50 0.00 0.00 46.19 48.94 3hlg s LEU 335 CO -0.09 -0.33 1.11 -0.60 -1.32 0.00 0.00 176.35 175.12 3hlg s ARG 336 N -0.03 4.08 0.27 1.98 6.06 -1.26 -4.98 118.95 125.08 3hlg s ARG 336 Ca -0.03 1.16 0.08 0.00 -2.50 0.00 0.00 55.73 54.44 3hlg s ARG 336 Cb -0.04 -3.75 -0.06 0.00 0.06 0.00 0.00 34.95 31.17 3hlg s ARG 336 CO 0.03 -0.89 -0.09 1.03 -2.50 0.00 0.00 175.30 172.88 3hlg s ARG 337 N 3.66 1.56 0.11 5.12 0.52 -1.26 -1.21 118.95 127.45 3hlg s ARG 337 Ca 0.47 -1.77 0.01 0.00 -0.52 0.00 0.00 55.73 53.93 3hlg s ARG 337 Cb -0.14 -1.29 -0.01 0.00 0.52 0.00 0.00 34.95 34.04 3hlg s ARG 337 CO 0.15 0.11 0.05 0.45 0.02 0.00 0.00 175.30 176.09 3hlg n SER 338 N -0.58 0.63 -4.24 0.23 2.88 -0.23 -4.80 113.62 107.51 3hlg n SER 338 Ca -0.06 -1.62 -0.29 0.00 -1.33 0.00 0.00 58.87 55.57 3hlg n SER 338 Cb 0.62 0.35 -0.16 0.00 -0.75 0.00 0.00 64.21 64.28 3hlg n SER 338 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 3hlg s PHE 339 N -2.11 2.15 0.00 0.66 2.19 -1.26 -1.06 117.98 118.55 3hlg s PHE 339 Ca 0.08 -0.54 0.00 0.00 0.33 0.00 0.00 56.93 56.79 3hlg s PHE 339 Cb 0.00 -1.41 0.00 0.00 -1.31 0.00 0.00 43.02 40.31 3hlg s PHE 339 CO 0.05 -0.13 0.00 0.41 1.83 0.00 0.00 175.22 177.38 3hlg n GLY 340 N 2.81 2.20 3.21 13.12 0.00 -0.08 -0.51 105.19 125.94 3hlg n GLY 340 Ca -0.17 -1.80 -0.38 0.00 0.00 0.00 0.00 46.02 43.66 3hlg n GLY 340 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hlg s LEU 341 N 0.00 4.98 0.00 0.99 1.43 -0.69 -4.58 118.68 120.81 3hlg s LEU 341 Ca 0.00 -1.61 0.00 0.00 -1.03 0.00 0.00 54.13 51.49 3hlg s LEU 341 Cb 0.00 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.32 3hlg s LEU 341 CO 0.00 -0.50 0.00 0.61 0.23 0.00 0.00 176.35 176.69 3hlg n GLY 342 N 4.79 1.95 0.00 -3.19 0.00 -1.26 -4.61 105.19 102.86 3hlg n GLY 342 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3hlg n GLY 342 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hlg n GLY 343 N -0.16 -1.33 3.75 -0.02 0.00 -1.26 -4.57 105.19 101.60 3hlg n GLY 343 Ca 0.00 -0.98 -0.40 0.00 0.00 0.00 0.00 46.02 44.64 3hlg n GLY 343 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hlg s ILE 344 N -2.93 4.45 -0.14 -0.61 1.01 0.28 -0.91 121.20 122.34 3hlg s ILE 344 Ca 0.00 1.81 -0.04 0.00 0.00 0.00 0.00 60.65 62.42 3hlg s ILE 344 Cb 0.00 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.24 3hlg s ILE 344 CO 0.00 0.44 -0.01 -0.63 0.00 0.00 0.00 174.94 174.74 3hlg s ILE 345 N -0.63 4.19 -0.08 2.92 1.01 -0.23 -1.18 121.20 127.20 3hlg s ILE 345 Ca 0.39 -0.26 -0.30 0.00 0.00 0.00 0.00 60.65 60.48 3hlg s ILE 345 Cb -0.23 -2.83 -0.02 0.00 0.01 0.00 0.00 42.46 39.39 3hlg s ILE 345 CO 0.27 0.51 1.12 0.00 0.00 0.00 0.00 174.94 176.84 3hlg s ALA 346 N 0.05 3.47 -2.51 9.38 0.00 -0.68 -1.07 121.76 130.40 3hlg s ALA 346 Ca 0.02 0.51 0.23 0.00 0.00 0.00 0.00 51.96 52.72 3hlg s ALA 346 Cb -0.13 -3.49 0.58 0.00 0.00 0.00 0.00 23.12 20.08 3hlg s ALA 346 CO 0.02 -0.72 1.47 1.28 0.00 0.00 0.00 175.76 177.81 3hlg n LEU 347 N 5.19 2.50 -3.74 0.00 4.77 -0.35 -0.30 117.00 125.07 3hlg n LEU 347 Ca 0.10 -1.00 -0.10 0.00 -0.03 0.00 0.00 56.01 54.98 3hlg n LEU 347 Cb 0.47 -0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.38 3hlg n LEU 347 CO 0.54 0.50 0.04 -1.83 -1.33 0.00 0.00 177.39 175.30 3hlg s GLU 348 N -1.76 0.91 0.31 3.23 -1.05 -1.25 -4.89 118.70 114.20 3hlg s GLU 348 Ca 0.34 -0.72 -0.30 0.00 -0.15 0.00 0.00 54.97 54.15 3hlg s GLU 348 Cb 0.20 0.39 -0.11 0.00 -0.44 0.00 0.00 34.13 34.17 3hlg s GLU 348 CO 0.30 -0.32 1.58 -0.51 0.95 0.00 0.00 175.26 177.26 3hlg s ASP 349 N -2.57 6.36 0.26 0.83 1.01 -1.26 -3.78 116.67 117.52 3hlg s ASP 349 Ca 0.01 2.98 0.01 0.00 0.71 0.00 0.00 52.55 56.26 3hlg s ASP 349 Cb 0.02 -2.64 0.34 0.00 1.01 0.00 0.00 42.92 41.64 3hlg s ASP 349 CO -0.09 -0.91 1.67 -0.07 0.21 0.00 0.00 175.17 175.98 3hlg h LEU 350 N 4.46 0.51 -5.18 1.23 4.07 -1.58 -3.39 115.31 115.43 3hlg h LEU 350 Ca -0.48 -0.20 -0.28 0.00 0.08 0.00 0.00 57.88 57.00 3hlg h LEU 350 Cb 1.22 -0.14 -0.19 0.00 1.08 0.00 0.00 40.66 42.64 3hlg h LEU 350 CO 0.76 0.80 -0.60 -0.67 -1.08 0.00 0.00 178.44 177.65 3hlg n ASP 351 N -4.08 -2.30 0.00 -0.43 2.03 -1.26 -4.94 116.55 105.57 3hlg n ASP 351 Ca -0.01 -3.23 0.00 0.00 0.52 0.00 0.00 54.79 52.08 3hlg n ASP 351 Cb 0.45 1.39 0.00 0.00 -0.72 0.00 0.00 41.12 42.24 3hlg n ASP 351 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hlg n GLY 352 N 1.51 3.24 1.36 0.27 0.00 -1.26 -1.19 105.19 109.13 3hlg n GLY 352 Ca 0.11 0.24 0.12 0.00 0.00 0.00 0.00 46.02 46.49 3hlg n GLY 352 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hlg n GLU 353 N 14.00 2.71 0.07 1.61 1.02 -1.26 -4.41 120.64 134.38 3hlg n GLU 353 Ca 0.00 -2.66 0.12 0.00 -0.02 0.00 0.00 57.16 54.60 3hlg n GLU 353 Cb 0.00 -1.57 0.09 0.00 -0.02 0.00 0.00 31.44 29.93 3hlg n GLU 353 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 3hlg h ASN 354 N 4.36 0.00 0.00 1.62 -0.26 -1.57 -3.49 115.58 116.23 3hlg h ASN 354 Ca 0.00 -0.15 0.00 0.00 -0.56 0.00 0.00 56.30 55.59 3hlg h ASN 354 Cb 1.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.26 3hlg h ASN 354 CO 0.00 0.08 0.00 1.87 -1.06 0.00 0.00 177.43 178.32 3hlg n TRP 355 N -2.32 0.00 -1.77 1.19 -0.00 -1.25 -4.47 117.44 108.82 3hlg n TRP 355 Ca 0.02 0.00 -0.38 0.00 -0.00 0.00 0.00 57.50 57.14 3hlg n TRP 355 Cb 0.48 0.00 0.04 0.00 -0.00 0.00 0.00 31.31 31.84 3hlg n TRP 355 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 177.69 178.72 3hlg s ARG 356 N 1.48 3.06 0.24 5.87 0.52 -1.26 -4.80 118.95 124.07 3hlg s ARG 356 Ca 0.00 2.22 0.05 0.00 -0.52 0.00 0.00 55.73 57.48 3hlg s ARG 356 Cb 0.00 -2.20 -0.03 0.00 0.52 0.00 0.00 34.95 33.23 3hlg s ARG 356 CO 0.00 -1.25 0.33 1.03 0.02 0.00 0.00 175.30 175.43 3hlg s ARG 357 N -2.97 3.35 0.19 3.54 1.81 -1.26 -1.50 118.95 122.11 3hlg s ARG 357 Ca 0.73 -0.81 -0.30 0.00 -1.72 0.00 0.00 55.73 53.64 3hlg s ARG 357 Cb -0.40 -2.84 -0.17 0.00 -0.45 0.00 0.00 34.95 31.09 3hlg s ARG 357 CO 0.47 0.43 0.71 1.17 -0.68 0.00 0.00 175.30 177.40 3hlg n LYS 358 N -1.34 0.30 -0.45 3.54 4.81 -1.25 -2.11 118.16 121.67 3hlg n LYS 358 Ca -0.09 0.11 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 3hlg n LYS 358 Cb 0.57 -1.26 0.00 0.00 0.02 0.00 0.00 35.03 34.36 3hlg n LYS 358 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hlg n GLY 359 N 1.82 0.85 3.80 3.14 0.00 0.59 -4.78 105.19 110.61 3hlg n GLY 359 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 3hlg n GLY 359 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hlg s SER 360 N -3.00 6.97 -0.03 1.61 1.04 -0.90 -4.66 113.70 114.72 3hlg s SER 360 Ca 0.00 1.79 0.06 0.00 0.48 0.00 0.00 55.95 58.28 3hlg s SER 360 Cb 0.00 -2.56 -0.02 0.00 0.10 0.00 0.00 66.02 63.54 3hlg s SER 360 CO 0.00 -0.34 -0.21 -0.22 0.98 0.00 0.00 173.24 173.45 3hlg s LEU 361 N -2.87 2.35 0.02 2.42 2.96 -0.24 -1.69 118.68 121.63 3hlg s LEU 361 Ca 0.59 -0.35 -0.21 0.00 -0.22 0.00 0.00 54.13 53.94 3hlg s LEU 361 Cb -0.13 -1.43 0.04 0.00 0.50 0.00 0.00 46.19 45.17 3hlg s LEU 361 CO 0.18 0.33 0.47 0.28 -1.32 0.00 0.00 176.35 176.28 3hlg s THR 362 N -0.64 0.04 0.00 3.68 -1.32 -0.32 -0.83 115.64 116.25 3hlg s THR 362 Ca 0.10 -0.33 0.00 0.00 -1.21 0.00 0.00 61.69 60.25 3hlg s THR 362 Cb -0.10 -0.90 0.00 0.00 -1.51 0.00 0.00 72.50 69.98 3hlg s THR 362 CO -0.00 -0.18 0.00 0.33 -2.21 0.00 0.00 174.62 172.56 3hlg n PHE 363 N 0.68 -0.07 -3.76 9.09 7.35 -1.09 -0.56 117.46 129.10 3hlg n PHE 363 Ca -0.19 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.45 3hlg n PHE 363 Cb 0.59 0.00 0.02 0.00 0.35 0.00 0.00 39.48 40.44 3hlg n PHE 363 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3hlg n GLY 364 N 0.00 0.91 3.14 7.13 0.00 -1.26 -1.95 105.19 113.16 3hlg n GLY 364 Ca 0.00 -1.18 -0.18 0.00 0.00 0.00 0.00 46.02 44.66 3hlg n GLY 364 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hlg s GLY 365 N -3.01 0.76 0.16 -0.02 0.00 -0.36 -2.48 107.32 102.38 3hlg s GLY 365 Ca 0.17 -0.86 -0.08 0.00 0.00 0.00 0.00 44.72 43.95 3hlg s GLY 365 CO 0.08 -0.87 0.99 0.61 0.00 0.00 0.00 173.10 173.90 3hlg n GLY 366 N 1.64 -1.16 1.44 0.20 0.00 -1.26 -1.77 105.19 104.27 3hlg n GLY 366 Ca -0.20 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.51 3hlg n GLY 366 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hlg n PRO 367 N -4.99 0.63 -3.32 1.61 -0.02 -1.26 -2.82 135.00 124.83 3hlg n PRO 367 Ca 0.09 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.36 3hlg n PRO 367 Cb 0.29 -1.19 0.06 0.00 -0.02 0.00 0.00 33.50 32.65 3hlg n PRO 367 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3hlg n ASN 368 N 1.33 -5.75 -4.74 2.55 3.02 -0.88 -2.27 115.26 108.52 3hlg n ASN 368 Ca 0.00 -0.42 -0.38 0.00 -0.03 0.00 0.00 54.58 53.75 3hlg n ASN 368 Cb 0.31 -4.42 -0.06 0.00 -0.61 0.00 0.00 39.78 35.01 3hlg n ASN 368 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hlg s ILE 369 N -3.23 5.11 -0.04 2.41 1.01 -0.73 -3.76 121.20 121.97 3hlg s ILE 369 Ca 0.45 1.03 0.02 0.00 0.00 0.00 0.00 60.65 62.15 3hlg s ILE 369 Cb -0.20 -3.84 0.01 0.00 0.01 0.00 0.00 42.46 38.44 3hlg s ILE 369 CO 0.56 0.36 -0.08 -0.69 0.00 0.00 0.00 174.94 175.08 3hlg s VAL 370 N 0.33 0.80 0.15 2.92 1.01 -0.10 -1.22 120.40 124.29 3hlg s VAL 370 Ca 0.27 -0.32 0.08 0.00 0.00 0.00 0.00 61.98 62.02 3hlg s VAL 370 Cb -0.16 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 3hlg s VAL 370 CO 0.12 0.27 -0.18 -1.66 0.00 0.00 0.00 175.10 173.65 3hlg s TRP 371 N 0.53 1.77 -0.06 5.22 1.48 -0.82 -0.90 118.94 126.16 3hlg s TRP 371 Ca -0.09 -0.47 -0.25 0.00 -1.06 0.00 0.00 56.10 54.24 3hlg s TRP 371 Cb -0.12 -0.91 0.05 0.00 -1.16 0.00 0.00 33.47 31.34 3hlg s TRP 371 CO 0.01 0.29 0.55 1.14 -4.06 0.00 0.00 176.95 174.88 3hlg s GLN 372 N -2.59 0.89 -0.10 3.25 1.03 -0.62 -2.68 119.66 118.84 3hlg s GLN 372 Ca 0.13 0.17 0.02 0.00 0.04 0.00 0.00 55.36 55.73 3hlg s GLN 372 Cb -0.07 0.42 0.01 0.00 0.03 0.00 0.00 33.01 33.40 3hlg s GLN 372 CO 0.06 -0.26 -0.16 0.42 -2.54 0.00 0.00 175.29 172.81 3hlg s ILE 373 N -1.07 1.54 -0.52 3.63 1.01 -0.01 -1.57 121.20 124.21 3hlg s ILE 373 Ca -0.11 -0.68 0.04 0.00 0.00 0.00 0.00 60.65 59.90 3hlg s ILE 373 Cb -0.02 -1.39 0.14 0.00 0.01 0.00 0.00 42.46 41.20 3hlg s ILE 373 CO 0.07 0.45 0.28 -0.62 0.00 0.00 0.00 174.94 175.12 3hlg s ASP 374 N 0.85 4.16 0.25 3.58 -1.08 0.04 -1.08 116.67 123.39 3hlg s ASP 374 Ca -0.09 -3.03 -0.05 0.00 -0.52 0.00 0.00 52.55 48.86 3hlg s ASP 374 Cb -0.15 -1.47 0.34 0.00 -1.46 0.00 0.00 42.92 40.17 3hlg s ASP 374 CO 0.01 -0.22 1.89 -0.65 0.52 0.00 0.00 175.17 176.71 3hlg h PRO 375 N 6.40 1.13 -0.62 4.34 0.11 -1.83 -0.86 132.00 140.68 3hlg h PRO 375 Ca -0.03 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 65.98 3hlg h PRO 375 Cb 0.88 -0.26 -0.03 0.00 0.11 0.00 0.00 31.00 31.71 3hlg h PRO 375 CO 0.64 0.75 0.27 0.87 -0.21 0.00 0.00 178.00 180.32 3hlg h LYS 376 N 1.17 0.91 0.00 1.05 1.57 -1.91 -2.69 116.57 116.66 3hlg h LYS 376 Ca 0.39 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3hlg h LYS 376 Cb 0.07 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.22 3hlg h LYS 376 CO -0.14 0.75 0.00 0.00 -0.57 0.00 0.00 179.45 179.49 3hlg h ALA 377 N 1.11 1.00 -1.02 3.86 0.00 -1.76 -3.47 119.26 118.98 3hlg h ALA 377 Ca 0.21 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.98 3hlg h ALA 377 Cb 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3hlg h ALA 377 CO -0.02 0.00 -0.18 0.41 0.00 0.00 0.00 179.25 179.46 3hlg n GLY 378 N 1.18 0.08 3.17 0.00 0.00 -0.36 -3.39 105.19 105.89 3hlg n GLY 378 Ca 0.05 -0.59 -0.18 0.00 0.00 0.00 0.00 46.02 45.30 3hlg n GLY 378 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hlg s LEU 379 N -2.03 2.29 0.03 0.99 1.43 -1.02 -3.73 118.68 116.63 3hlg s LEU 379 Ca 0.00 -0.64 0.03 0.00 -1.03 0.00 0.00 54.13 52.50 3hlg s LEU 379 Cb -0.00 -0.51 -0.02 0.00 0.03 0.00 0.00 46.19 45.69 3hlg s LEU 379 CO 0.00 -0.09 -0.09 0.00 0.23 0.00 0.00 176.35 176.40 3hlg s THR 381 N -0.92 0.45 -0.02 0.00 -4.23 -0.61 -1.54 115.64 108.78 3hlg s THR 381 Ca -0.04 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 3hlg s THR 381 Cb -0.07 -0.99 0.02 0.00 1.34 0.00 0.00 72.50 72.79 3hlg s THR 381 CO 0.01 -0.64 -0.00 -0.22 -0.54 0.00 0.00 174.62 173.22 3hlg s LEU 382 N -2.19 1.42 -0.18 4.79 2.96 -0.22 -1.60 118.68 123.68 3hlg s LEU 382 Ca -0.02 -0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 3hlg s LEU 382 Cb -0.03 -0.15 0.02 0.00 0.50 0.00 0.00 46.19 46.53 3hlg s LEU 382 CO -0.03 -0.06 -0.18 0.00 -1.32 0.00 0.00 176.35 174.76 3hlg s ALA 383 N 0.68 2.21 -0.22 5.97 0.00 -0.08 -1.42 121.76 128.90 3hlg s ALA 383 Ca -0.06 -1.16 -0.01 0.00 0.00 0.00 0.00 51.96 50.73 3hlg s ALA 383 Cb -0.09 -1.16 0.02 0.00 0.00 0.00 0.00 23.12 21.88 3hlg s ALA 383 CO -0.01 -0.40 -0.12 0.12 0.00 0.00 0.00 175.76 175.35 3hlg s PHE 384 N 1.34 2.96 0.42 0.00 5.36 0.31 -0.92 117.98 127.44 3hlg s PHE 384 Ca 0.04 -1.56 0.06 0.00 -0.96 0.00 0.00 56.93 54.51 3hlg s PHE 384 Cb -0.13 -2.00 -0.07 0.00 -0.34 0.00 0.00 43.02 40.48 3hlg s PHE 384 CO -0.12 -0.74 0.02 -0.06 -1.46 0.00 0.00 175.22 172.85 3hlg s PHE 385 N 1.32 2.34 -0.46 10.12 0.08 -1.25 -1.15 117.98 128.98 3hlg s PHE 385 Ca 0.02 -0.76 0.09 0.00 0.12 0.00 0.00 56.93 56.40 3hlg s PHE 385 Cb -0.15 -1.69 0.33 0.00 -0.57 0.00 0.00 43.02 40.94 3hlg s PHE 385 CO -0.08 0.36 0.79 1.04 -0.10 0.00 0.00 175.22 177.23 3hlg n GLN 386 N -0.99 1.85 -3.83 0.44 1.13 -1.22 -4.57 117.38 110.18 3hlg n GLN 386 Ca -0.07 -3.98 -0.19 0.00 -1.94 0.00 0.00 57.00 50.83 3hlg n GLN 386 Cb 0.67 -1.89 -0.17 0.00 0.11 0.00 0.00 30.24 28.96 3hlg n GLN 386 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 3hlg s LEU 387 N -2.69 0.83 0.29 1.08 2.96 -0.96 -1.80 118.68 118.40 3hlg s LEU 387 Ca 0.43 -0.01 0.09 0.00 -0.22 0.00 0.00 54.13 54.42 3hlg s LEU 387 Cb 0.30 -0.23 -0.04 0.00 0.50 0.00 0.00 46.19 46.71 3hlg s LEU 387 CO -0.10 -0.15 0.02 -1.61 -1.32 0.00 0.00 176.35 173.18 3hlg s GLU 388 N 1.44 2.25 0.66 1.98 2.02 -0.10 -3.12 118.70 123.83 3hlg s GLU 388 Ca -0.04 -1.51 -0.14 0.00 0.02 0.00 0.00 54.97 53.30 3hlg s GLU 388 Cb -0.13 -2.11 -0.00 0.00 0.10 0.00 0.00 34.13 31.99 3hlg s GLU 388 CO -0.03 0.28 1.09 -1.25 0.02 0.00 0.00 175.26 175.37 3hlg s PRO 389 N -3.70 2.90 0.55 0.39 0.04 -1.26 -0.94 135.00 132.97 3hlg s PRO 389 Ca 0.33 1.27 -0.18 0.00 0.04 0.00 0.00 61.00 62.46 3hlg s PRO 389 Cb -0.05 -1.97 -0.12 0.00 0.04 0.00 0.00 34.50 32.40 3hlg s PRO 389 CO 0.20 -1.15 0.19 1.87 0.04 0.00 0.00 177.00 178.15 3hlg n TRP 390 N -2.50 -1.83 -2.96 0.56 -0.00 -1.13 -3.39 117.44 106.19 3hlg n TRP 390 Ca 0.09 0.44 -0.17 0.00 -0.00 0.00 0.00 57.50 57.87 3hlg n TRP 390 Cb 0.52 -1.82 0.04 0.00 -0.00 0.00 0.00 31.31 30.06 3hlg n TRP 390 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 3hlg n ASN 391 N 1.49 -5.01 -4.69 5.87 5.15 -1.26 -4.96 115.26 111.85 3hlg n ASN 391 Ca 0.10 -0.26 -0.42 0.00 -0.60 0.00 0.00 54.58 53.39 3hlg n ASN 391 Cb 0.47 -3.79 -0.03 0.00 -0.53 0.00 0.00 39.78 35.91 3hlg n ASN 391 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3hlg s ASP 392 N -2.92 6.84 0.25 1.20 -1.08 -1.22 -4.93 116.67 114.82 3hlg s ASP 392 Ca 0.28 2.17 -0.05 0.00 -0.52 0.00 0.00 52.55 54.43 3hlg s ASP 392 Cb -0.13 -2.57 0.29 0.00 -1.46 0.00 0.00 42.92 39.06 3hlg s ASP 392 CO 0.35 -0.70 1.92 -0.65 0.52 0.00 0.00 175.17 176.60 3hlg h PRO 393 N 7.61 1.27 -0.32 4.34 0.11 -1.93 0.02 132.00 143.10 3hlg h PRO 393 Ca -0.39 -0.08 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 3hlg h PRO 393 Cb 1.19 -0.29 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 3hlg h PRO 393 CO 0.89 0.84 0.13 0.28 -0.21 0.00 0.00 178.00 179.93 3hlg h VAL 394 N 1.31 1.18 -0.67 3.15 2.07 -1.97 -0.37 116.25 120.95 3hlg h VAL 394 Ca 0.38 -0.55 -0.08 0.00 0.82 0.00 0.00 66.70 67.27 3hlg h VAL 394 Cb -0.08 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 3hlg h VAL 394 CO -0.10 0.19 0.13 0.00 0.02 0.00 0.00 177.57 177.81 3hlg h ARG 396 N 1.03 0.54 -0.50 0.00 2.43 -0.82 -0.04 114.38 117.02 3hlg h ARG 396 Ca 0.21 -0.10 -0.04 0.00 -0.81 0.00 0.00 59.98 59.24 3hlg h ARG 396 Cb 0.42 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 3hlg h ARG 396 CO 0.01 0.53 0.17 -0.44 -1.51 0.00 0.00 179.97 178.73 3hlg h ASP 397 N 0.44 0.71 -0.71 -3.80 3.32 -0.95 -0.81 116.42 114.62 3hlg h ASP 397 Ca 0.12 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 3hlg h ASP 397 Cb 0.19 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 3hlg h ASP 397 CO -0.01 0.71 0.36 -0.07 -1.72 0.00 0.00 179.24 178.51 3hlg h LEU 398 N 0.67 0.91 -0.30 1.55 3.38 -1.18 -0.67 115.31 119.68 3hlg h LEU 398 Ca 0.16 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3hlg h LEU 398 Cb 0.24 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3hlg h LEU 398 CO -0.01 0.78 0.16 0.74 0.09 0.00 0.00 178.44 180.19 3hlg h THR 399 N 0.98 1.14 -0.27 0.22 2.02 -0.74 0.05 112.91 116.32 3hlg h THR 399 Ca 0.25 -0.38 0.03 0.00 0.77 0.00 0.00 66.41 67.07 3hlg h THR 399 Cb 0.09 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.32 3hlg h THR 399 CO -0.03 0.14 0.09 0.03 0.37 0.00 0.00 175.52 176.12 3hlg h ARG 400 N 0.36 0.20 -0.57 6.66 3.08 -0.93 -0.96 114.38 122.21 3hlg h ARG 400 Ca 0.10 -0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.22 3hlg h ARG 400 Cb 0.09 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.03 3hlg h ARG 400 CO -0.02 0.13 0.23 1.15 -1.07 0.00 0.00 179.97 180.40 3hlg h THR 401 N 0.21 0.83 0.44 2.04 2.02 -0.80 0.28 112.91 117.91 3hlg h THR 401 Ca 0.12 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 3hlg h THR 401 Cb 0.09 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 3hlg h THR 401 CO -0.12 0.08 -0.37 0.15 0.37 0.00 0.00 175.52 175.62 3hlg h PHE 402 N 0.43 -1.00 -0.57 3.16 3.57 -0.67 -1.87 116.94 119.99 3hlg h PHE 402 Ca 0.28 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.75 3hlg h PHE 402 Cb 0.30 0.38 -0.03 0.00 2.79 0.00 0.00 35.95 39.39 3hlg h PHE 402 CO -0.15 -0.53 0.26 0.93 -2.23 0.00 0.00 178.31 176.59 3hlg h GLU 403 N -0.81 0.84 -0.50 1.11 5.08 -0.87 -1.95 114.58 117.47 3hlg h GLU 403 Ca -0.04 -0.14 0.07 0.00 -1.00 0.00 0.00 59.36 58.26 3hlg h GLU 403 Cb 0.71 -0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.75 3hlg h GLU 403 CO -0.03 0.70 0.15 0.45 -1.00 0.00 0.00 179.01 179.28 3hlg h HIS 404 N 0.78 0.26 -0.37 4.33 3.86 -0.88 -1.05 115.15 122.08 3hlg h HIS 404 Ca 0.19 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.42 3hlg h HIS 404 Cb 0.15 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 28.57 3hlg h HIS 404 CO 0.00 0.06 0.17 0.00 0.86 0.00 0.00 177.93 179.02 3hlg h ALA 405 N 1.35 0.48 -0.01 2.45 0.00 -1.02 -0.58 119.26 121.93 3hlg h ALA 405 Ca 0.24 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3hlg h ALA 405 Cb 0.29 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3hlg h ALA 405 CO -0.28 0.06 0.01 0.82 0.00 0.00 0.00 179.25 179.86 3hlg h ILE 406 N 0.46 1.09 -0.59 0.00 1.08 -1.06 -2.11 117.51 116.38 3hlg h ILE 406 Ca 0.13 -0.27 0.04 0.00 -0.39 0.00 0.00 64.86 64.37 3hlg h ILE 406 Cb 0.14 1.25 -0.04 0.00 -3.07 0.00 0.00 36.82 35.10 3hlg h ILE 406 CO -0.01 0.07 0.34 1.88 -0.69 0.00 0.00 178.15 179.74 3hlg h TYR 407 N -0.09 0.64 -0.92 1.37 0.05 -1.18 0.19 116.97 117.02 3hlg h TYR 407 Ca 0.00 0.02 0.03 0.00 0.05 0.00 0.00 58.73 58.83 3hlg h TYR 407 Cb 0.11 -0.20 -0.05 0.00 1.01 0.00 0.00 36.73 37.60 3hlg h TYR 407 CO -0.04 0.34 0.60 0.00 -1.05 0.00 0.00 178.16 178.01 3hlg h ALA 408 N 1.28 1.20 0.00 3.88 0.00 -0.84 -2.30 119.26 122.49 3hlg h ALA 408 Ca 0.25 -0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.88 3hlg h ALA 408 Cb 0.08 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 3hlg h ALA 408 CO -0.13 0.49 -1.65 1.04 0.00 0.00 0.00 179.25 179.00 3hlg n GLN 409 N -4.49 0.63 0.00 0.00 6.02 -0.81 -4.69 117.38 114.04 3hlg n GLN 409 Ca 0.11 0.22 0.00 0.00 -0.01 0.00 0.00 57.00 57.32 3hlg n GLN 409 Cb 0.07 -1.76 0.00 0.00 1.02 0.00 0.00 30.24 29.56 3hlg n GLN 409 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3hlg n TYR 410 N -2.92 0.00 -2.23 1.08 0.53 0.65 -5.03 117.16 109.24 3hlg n TYR 410 Ca -0.15 0.00 -0.40 0.00 -1.02 0.00 0.00 57.90 56.33 3hlg n TYR 410 Cb 0.95 0.00 -0.03 0.00 -1.03 0.00 0.00 39.34 39.24 3hlg n TYR 410 CO 0.00 0.00 0.00 1.14 -1.02 0.00 0.00 176.86 176.98 3hlg s GLN 411 N -0.16 4.37 -0.15 -0.72 -2.07 -0.87 -4.97 119.66 115.08 3hlg s GLN 411 Ca 0.00 2.06 -0.01 0.00 -1.82 0.00 0.00 55.36 55.58 3hlg s GLN 411 Cb 0.00 -3.03 -0.02 0.00 -1.09 0.00 0.00 33.01 28.87 3hlg s GLN 411 CO 0.00 -0.12 -0.10 -1.14 -1.32 0.00 0.00 175.29 172.61 3hlg s GLN 412 N -1.79 3.44 0.00 9.60 0.74 -1.22 -5.02 119.66 125.40 3hlg s GLN 412 Ca 0.49 -0.64 0.00 0.00 0.05 0.00 0.00 55.36 55.26 3hlg s GLN 412 Cb -0.36 -2.75 0.00 0.00 1.10 0.00 0.00 33.01 31.00 3hlg s GLN 412 CO 0.48 0.15 0.00 0.41 -0.55 0.00 0.00 175.29 175.78