#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rjd h ARG 3 N 0.00 0.67 -0.62 5.31 2.43 -2.03 -1.78 114.38 118.36 1rjd h ARG 3 Ca 0.00 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.04 1rjd h ARG 3 Cb 0.00 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 1rjd h ARG 3 CO 0.00 0.44 0.04 0.82 -1.51 0.00 0.00 179.97 179.76 1rjd h ILE 4 N 0.69 1.26 -0.38 1.20 2.04 -1.95 -0.81 117.51 119.55 1rjd h ILE 4 Ca 0.33 -1.11 -0.06 0.00 1.00 0.00 0.00 64.86 65.02 1rjd h ILE 4 Cb 0.27 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1rjd h ILE 4 CO -0.22 0.41 -0.01 0.40 0.00 0.00 0.00 178.15 178.73 1rjd h ILE 5 N 0.97 1.26 -0.94 -0.67 2.04 -1.90 -2.82 117.51 115.45 1rjd h ILE 5 Ca 0.18 -1.02 0.11 0.00 1.00 0.00 0.00 64.86 65.14 1rjd h ILE 5 Cb 0.51 1.16 -0.08 0.00 -0.74 0.00 0.00 36.82 37.67 1rjd h ILE 5 CO 0.02 0.34 0.57 1.56 0.00 0.00 0.00 178.15 180.65 1rjd h GLN 6 N 0.50 0.89 0.00 2.37 4.20 -1.11 -2.75 115.11 119.20 1rjd h GLN 6 Ca 0.11 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1rjd h GLN 6 Cb 0.49 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1rjd h GLN 6 CO 0.02 0.59 0.00 1.04 -0.67 0.00 0.00 178.83 179.81 1rjd n GLN 7 N -4.67 0.22 0.30 1.46 6.02 -0.33 -2.36 117.38 118.01 1rjd n GLN 7 Ca 0.17 0.09 0.17 0.00 -0.01 0.00 0.00 57.00 57.42 1rjd n GLN 7 Cb 0.34 -1.50 0.93 0.00 1.02 0.00 0.00 30.24 31.03 1rjd n GLN 7 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 1rjd h THR 8 N 0.00 0.35 -0.08 5.09 1.35 -1.45 -2.10 112.91 116.06 1rjd h THR 8 Ca 0.00 -0.21 -0.02 0.00 -0.55 0.00 0.00 66.41 65.63 1rjd h THR 8 Cb 0.26 1.15 -0.01 0.00 -1.73 0.00 0.00 68.15 67.82 1rjd h THR 8 CO 0.00 0.04 -0.05 -0.78 -0.25 0.00 0.00 175.52 174.47 1rjd h ASP 9 N 0.00 0.10 -0.51 5.36 3.58 -1.67 -2.67 116.42 120.61 1rjd h ASP 9 Ca -0.00 -0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.39 1rjd h ASP 9 Cb 0.14 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.14 1rjd h ASP 9 CO 0.00 0.18 0.15 1.88 -2.88 0.00 0.00 179.24 178.58 1rjd h TYR 10 N 0.12 0.88 -0.30 0.28 0.99 -1.60 0.22 116.97 117.55 1rjd h TYR 10 Ca 0.03 -0.08 -0.03 0.00 2.00 0.00 0.00 58.73 60.65 1rjd h TYR 10 Cb 0.17 -0.26 -0.01 0.00 1.00 0.00 0.00 36.73 37.63 1rjd h TYR 10 CO 0.00 0.72 0.06 -0.44 -0.00 0.00 0.00 178.16 178.51 1rjd h ASP 11 N 0.83 0.47 -0.61 3.88 3.32 -1.64 -1.20 116.42 121.47 1rjd h ASP 11 Ca 0.18 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 1rjd h ASP 11 Cb 0.28 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 1rjd h ASP 11 CO -0.00 0.59 0.37 0.00 -1.72 0.00 0.00 179.24 178.47 1rjd h ALA 12 N 0.89 0.78 -0.32 3.45 0.00 -1.03 -1.77 119.26 121.26 1rjd h ALA 12 Ca 0.09 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1rjd h ALA 12 Cb 0.31 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1rjd h ALA 12 CO 0.00 0.26 0.03 1.25 0.00 0.00 0.00 179.25 180.79 1rjd h LEU 13 N 0.83 0.53 -0.56 0.00 5.85 -0.58 -1.41 115.31 119.96 1rjd h LEU 13 Ca 0.22 -0.28 0.09 0.00 0.84 0.00 0.00 57.88 58.75 1rjd h LEU 13 Cb -0.02 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 40.80 1rjd h LEU 13 CO -0.04 0.67 0.15 0.28 -0.34 0.00 0.00 178.44 179.17 1rjd h SER 14 N 0.36 0.09 -0.29 1.25 0.02 -1.09 0.58 113.55 114.47 1rjd h SER 14 Ca 0.09 0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.13 1rjd h SER 14 Cb 0.39 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 1rjd h SER 14 CO 0.01 0.07 0.17 0.00 -1.14 0.00 0.00 176.83 175.94 1rjd h LYS 16 N 0.37 0.28 -0.38 0.00 1.63 -0.76 -1.72 116.57 115.99 1rjd h LYS 16 Ca 0.10 -0.02 -0.12 0.00 -0.85 0.00 0.00 60.65 59.77 1rjd h LYS 16 Cb 0.03 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.58 1rjd h LYS 16 CO -0.02 0.19 -0.24 -0.07 -3.45 0.00 0.00 179.45 175.86 1rjd h LEU 17 N 0.29 0.78 -0.52 5.20 3.38 -0.70 -1.94 115.31 121.79 1rjd h LEU 17 Ca 0.14 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 1rjd h LEU 17 Cb 0.09 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 1rjd h LEU 17 CO -0.13 0.99 0.32 0.00 0.09 0.00 0.00 178.44 179.71 1rjd h ALA 18 N 1.07 0.66 -0.56 1.53 0.00 -0.83 0.26 119.26 121.39 1rjd h ALA 18 Ca 0.09 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1rjd h ALA 18 Cb 0.75 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1rjd h ALA 18 CO 0.06 0.14 0.04 0.00 0.00 0.00 0.00 179.25 179.49 1rjd h ALA 19 N 1.16 1.02 -0.21 0.00 0.00 -1.05 -1.57 119.26 118.61 1rjd h ALA 19 Ca 0.19 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1rjd h ALA 19 Cb -0.02 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1rjd h ALA 19 CO -0.04 0.61 -0.26 0.82 0.00 0.00 0.00 179.25 180.39 1rjd h ILE 20 N 0.87 1.33 -0.58 0.00 2.04 -1.15 0.33 117.51 120.34 1rjd h ILE 20 Ca 0.17 -1.45 0.04 0.00 1.00 0.00 0.00 64.86 64.62 1rjd h ILE 20 Cb 0.45 1.79 -0.05 0.00 -0.74 0.00 0.00 36.82 38.28 1rjd h ILE 20 CO 0.02 0.45 0.33 -1.28 0.00 0.00 0.00 178.15 177.66 1rjd h SER 21 N 0.21 0.50 0.35 1.72 0.87 -0.70 -2.42 113.55 114.07 1rjd h SER 21 Ca 0.03 0.02 -0.20 0.00 -1.23 0.00 0.00 61.79 60.41 1rjd h SER 21 Cb 0.83 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.70 1rjd h SER 21 CO 0.06 0.34 -0.81 0.58 -0.53 0.00 0.00 176.83 176.47 1rjd h VAL 22 N 0.63 1.41 0.00 2.23 2.07 -1.31 -3.48 116.25 117.80 1rjd h VAL 22 Ca 0.25 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.46 1rjd h VAL 22 Cb 0.11 2.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1rjd h VAL 22 CO -0.14 0.69 0.00 0.61 0.02 0.00 0.00 177.57 178.74 1rjd n GLY 23 N 0.71 1.33 0.28 2.17 0.00 -0.53 -4.99 105.19 104.16 1rjd n GLY 23 Ca -0.05 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.98 1rjd n GLY 23 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1rjd h TYR 24 N 0.00 0.77 -3.85 1.61 0.05 -1.24 -3.42 116.97 110.90 1rjd h TYR 24 Ca 0.00 0.03 -0.69 0.00 0.05 0.00 0.00 58.73 58.12 1rjd h TYR 24 Cb 0.00 -0.23 -0.21 0.00 1.01 0.00 0.00 36.73 37.29 1rjd h TYR 24 CO 0.00 0.34 -0.86 -0.51 -1.05 0.00 0.00 178.16 176.08 1rjd s LEU 25 N -10.27 2.37 0.59 3.88 1.43 -1.14 -4.11 118.68 111.43 1rjd s LEU 25 Ca -0.13 -0.73 -0.17 0.00 -1.03 0.00 0.00 54.13 52.07 1rjd s LEU 25 Cb 0.18 -1.25 -0.03 0.00 0.03 0.00 0.00 46.19 45.11 1rjd s LEU 25 CO 0.77 0.18 1.09 -2.16 0.23 0.00 0.00 176.35 176.46 1rjd s PRO 26 N -2.10 3.19 -0.45 1.29 0.04 -1.26 -4.11 135.00 131.60 1rjd s PRO 26 Ca 0.15 1.40 -0.07 0.00 0.04 0.00 0.00 61.00 62.52 1rjd s PRO 26 Cb -0.10 -2.00 0.11 0.00 0.04 0.00 0.00 34.50 32.55 1rjd s PRO 26 CO 0.07 -0.94 0.29 0.45 0.04 0.00 0.00 177.00 176.91 1rjd s SER 27 N -2.34 5.55 0.43 6.66 0.15 -1.26 -4.99 113.70 117.90 1rjd s SER 27 Ca 0.68 -1.93 0.13 0.00 0.70 0.00 0.00 55.95 55.52 1rjd s SER 27 Cb -0.20 -1.95 0.93 0.00 -1.71 0.00 0.00 66.02 63.09 1rjd s SER 27 CO 0.34 -0.64 1.97 0.77 1.20 0.00 0.00 173.24 176.88 1rjd h SER 28 N 8.31 0.08 0.37 5.45 4.64 -1.95 -0.51 113.55 129.95 1rjd h SER 28 Ca -0.18 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.10 1rjd h SER 28 Cb 1.06 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1rjd h SER 28 CO 0.80 0.25 -0.18 1.23 -0.87 0.00 0.00 176.83 178.06 1rjd h GLY 29 N 0.60 -0.51 1.84 -0.77 0.00 -1.94 -0.65 103.07 101.63 1rjd h GLY 29 Ca 0.02 0.19 -0.13 0.00 0.00 0.00 0.00 47.33 47.41 1rjd h GLY 29 CO 0.02 -0.19 -0.53 1.41 0.00 0.00 0.00 176.54 177.25 1rjd h LEU 30 N -1.00 0.19 -1.08 3.11 3.38 -1.98 -2.53 115.31 115.40 1rjd h LEU 30 Ca -0.05 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1rjd h LEU 30 Cb 0.51 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1rjd h LEU 30 CO 0.08 0.69 -0.06 0.00 0.09 0.00 0.00 178.44 179.24 1rjd n GLN 31 N -3.92 1.65 -3.80 1.13 6.02 -0.20 -4.38 117.38 113.87 1rjd n GLN 31 Ca -0.02 -1.08 -0.26 0.00 -0.01 0.00 0.00 57.00 55.63 1rjd n GLN 31 Cb 0.56 -1.48 0.03 0.00 1.02 0.00 0.00 30.24 30.37 1rjd n GLN 31 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1rjd n ARG 32 N 0.27 -5.40 -3.63 -1.09 1.74 -0.64 -4.97 116.66 102.94 1rjd n ARG 32 Ca 0.17 0.62 -0.37 0.00 -0.77 0.00 0.00 57.85 57.50 1rjd n ARG 32 Cb 0.41 -5.37 -0.06 0.00 -1.02 0.00 0.00 32.46 26.41 1rjd n ARG 32 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1rjd s LEU 33 N -7.01 4.42 0.97 0.55 1.43 -0.35 -5.03 118.68 113.66 1rjd s LEU 33 Ca 0.36 0.77 -0.16 0.00 -1.03 0.00 0.00 54.13 54.08 1rjd s LEU 33 Cb -0.18 -2.57 0.19 0.00 0.03 0.00 0.00 46.19 43.66 1rjd s LEU 33 CO 0.82 0.30 1.26 -0.94 0.23 0.00 0.00 176.35 178.02 1rjd s SER 34 N -1.29 3.04 0.15 2.29 1.04 -1.26 -4.76 113.70 112.91 1rjd s SER 34 Ca 0.24 0.46 -0.16 0.00 0.48 0.00 0.00 55.95 56.96 1rjd s SER 34 Cb -0.15 -0.64 0.05 0.00 0.10 0.00 0.00 66.02 65.38 1rjd s SER 34 CO 0.13 -2.80 1.76 0.58 0.98 0.00 0.00 173.24 173.89 1rjd h VAL 35 N -1.68 0.92 -0.24 5.02 2.07 -1.99 -0.64 116.25 119.71 1rjd h VAL 35 Ca -0.45 -0.10 -0.08 0.00 0.82 0.00 0.00 66.70 66.89 1rjd h VAL 35 Cb 1.27 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1rjd h VAL 35 CO 0.44 0.05 -0.15 0.44 0.02 0.00 0.00 177.57 178.37 1rjd h ASP 36 N 0.29 0.56 0.92 0.57 3.32 -2.00 -2.79 116.42 117.29 1rjd h ASP 36 Ca 0.15 -0.43 -0.07 0.00 0.02 0.00 0.00 57.03 56.71 1rjd h ASP 36 Cb 0.11 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1rjd h ASP 36 CO -0.14 0.87 -0.31 -0.07 -1.72 0.00 0.00 179.24 177.86 1rjd h LEU 37 N 0.25 0.00 -0.37 1.55 3.38 -1.90 -0.74 115.31 117.47 1rjd h LEU 37 Ca 0.05 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 1rjd h LEU 37 Cb 0.67 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1rjd h LEU 37 CO 0.04 0.31 -0.06 0.28 0.09 0.00 0.00 178.44 179.10 1rjd h SER 38 N 0.00 0.69 -0.19 -0.43 0.02 -1.00 0.11 113.55 112.76 1rjd h SER 38 Ca -0.00 -0.35 -0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1rjd h SER 38 Cb 0.86 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1rjd h SER 38 CO 0.04 0.88 0.10 0.50 -1.14 0.00 0.00 176.83 177.21 1rjd h LYS 39 N 0.49 0.27 -0.60 3.45 3.64 -1.21 -3.07 116.57 119.54 1rjd h LYS 39 Ca 0.10 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.41 1rjd h LYS 39 Cb 0.56 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1rjd h LYS 39 CO 0.03 0.26 0.22 0.87 -2.27 0.00 0.00 179.45 178.56 1rjd h LYS 40 N 0.20 0.88 -0.36 1.90 1.79 -1.03 -1.18 116.57 118.77 1rjd h LYS 40 Ca 0.07 -0.15 0.07 0.00 -2.18 0.00 0.00 60.65 58.46 1rjd h LYS 40 Cb 0.08 -0.15 -0.06 0.00 -1.58 0.00 0.00 32.23 30.51 1rjd h LYS 40 CO -0.01 0.73 -0.05 -0.92 -1.08 0.00 0.00 179.45 178.12 1rjd h TYR 41 N 0.86 -0.12 -0.25 -1.35 3.20 -0.68 0.19 116.97 118.82 1rjd h TYR 41 Ca 0.20 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.07 1rjd h TYR 41 Cb 0.20 0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 1rjd h TYR 41 CO 0.01 -0.12 0.02 1.15 -1.64 0.00 0.00 178.16 177.59 1rjd h THR 42 N 0.04 1.24 -0.64 1.81 2.02 -1.39 -2.87 112.91 113.12 1rjd h THR 42 Ca 0.17 -0.83 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 1rjd h THR 42 Cb 0.26 1.30 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 1rjd h THR 42 CO -0.34 0.26 0.35 -0.33 0.37 0.00 0.00 175.52 175.83 1rjd h GLU 43 N 0.22 0.90 -0.46 6.66 5.08 -0.69 -0.80 114.58 125.48 1rjd h GLU 43 Ca 0.07 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1rjd h GLU 43 Cb 0.37 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1rjd h GLU 43 CO 0.01 0.68 0.24 -1.49 -1.00 0.00 0.00 179.01 177.45 1rjd h TRP 44 N 0.87 0.65 -0.31 4.33 6.55 -0.68 0.62 115.95 127.98 1rjd h TRP 44 Ca 0.23 -0.02 -0.13 0.00 0.95 0.00 0.00 58.89 59.91 1rjd h TRP 44 Cb 0.05 -0.21 -0.00 0.00 -0.86 0.00 0.00 29.16 28.14 1rjd h TRP 44 CO -0.01 0.50 -0.32 0.45 -1.05 0.00 0.00 178.44 178.02 1rjd h HIS 45 N 0.61 0.92 -0.80 0.49 3.86 -1.26 -0.97 115.15 117.99 1rjd h HIS 45 Ca 0.16 -0.28 0.04 0.00 -1.16 0.00 0.00 60.37 59.13 1rjd h HIS 45 Cb 0.08 -0.19 -0.05 0.00 1.06 0.00 0.00 27.41 28.31 1rjd h HIS 45 CO -0.01 1.05 0.51 0.00 0.86 0.00 0.00 177.93 180.33 1rjd h ARG 46 N 0.52 0.94 -0.63 2.45 3.08 -0.91 -2.31 114.38 117.52 1rjd h ARG 46 Ca 0.05 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 1rjd h ARG 46 Cb 0.90 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.71 1rjd h ARG 46 CO 0.08 0.62 0.09 1.03 -1.07 0.00 0.00 179.97 180.72 1rjd h SER 47 N 0.97 0.99 -0.52 7.04 0.87 -0.65 -2.48 113.55 119.77 1rjd h SER 47 Ca 0.33 -0.23 0.07 0.00 -1.23 0.00 0.00 61.79 60.72 1rjd h SER 47 Cb 0.05 -0.26 -0.06 0.00 -0.44 0.00 0.00 62.40 61.69 1rjd h SER 47 CO -0.13 1.00 0.19 0.22 -0.53 0.00 0.00 176.83 177.58 1rjd h TYR 48 N 0.97 0.33 0.02 2.24 3.20 -0.68 0.27 116.97 123.32 1rjd h TYR 48 Ca 0.19 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.09 1rjd h TYR 48 Cb 0.44 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.63 1rjd h TYR 48 CO 0.03 0.11 -0.01 1.25 -1.64 0.00 0.00 178.16 177.90 1rjd h LEU 49 N 0.37 -0.02 -1.07 2.82 5.85 -1.13 0.23 115.31 122.36 1rjd h LEU 49 Ca 0.25 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1rjd h LEU 49 Cb 0.27 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 1rjd h LEU 49 CO -0.25 0.10 0.54 0.40 -0.34 0.00 0.00 178.44 178.89 1rjd h ILE 50 N -0.14 1.24 -0.26 4.05 2.04 -1.22 -2.23 117.51 120.98 1rjd h ILE 50 Ca -0.00 -0.49 -0.17 0.00 1.00 0.00 0.00 64.86 65.20 1rjd h ILE 50 Cb 0.13 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.19 1rjd h ILE 50 CO 0.00 0.24 -0.51 0.74 0.00 0.00 0.00 178.15 178.63 1rjd h THR 51 N 1.20 1.29 -0.78 -0.27 2.02 -0.73 -2.55 112.91 113.09 1rjd h THR 51 Ca 0.32 -1.71 0.12 0.00 0.77 0.00 0.00 66.41 65.91 1rjd h THR 51 Cb -0.08 1.63 -0.08 0.00 -1.74 0.00 0.00 68.15 67.88 1rjd h THR 51 CO -0.06 0.55 0.39 0.25 0.37 0.00 0.00 175.52 177.01 1rjd h LEU 52 N 0.58 0.48 -0.89 2.58 5.85 -0.18 -1.74 115.31 121.98 1rjd h LEU 52 Ca 0.02 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.91 1rjd h LEU 52 Cb 1.08 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.04 1rjd h LEU 52 CO 0.11 0.23 0.54 0.50 -0.34 0.00 0.00 178.44 179.48 1rjd h LYS 53 N 0.60 0.89 -0.60 1.25 3.64 -1.00 -0.70 116.57 120.66 1rjd h LYS 53 Ca 0.41 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 1rjd h LYS 53 Cb 0.51 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 1rjd h LYS 53 CO -0.32 0.59 0.38 -0.22 -2.27 0.00 0.00 179.45 177.61 1rjd h LYS 54 N 0.92 0.79 0.00 1.90 3.64 -1.11 -3.20 116.57 119.50 1rjd h LYS 54 Ca 0.42 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 1rjd h LYS 54 Cb 0.33 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1rjd h LYS 54 CO -0.23 0.54 -1.12 1.19 -2.27 0.00 0.00 179.45 177.56 1rjd n PHE 55 N -4.43 0.71 -3.18 1.91 3.72 -0.60 -4.86 117.46 110.72 1rjd n PHE 55 Ca 0.06 0.21 0.04 0.00 -0.05 0.00 0.00 57.45 57.70 1rjd n PHE 55 Cb 0.05 -0.80 -0.01 0.00 -0.94 0.00 0.00 39.48 37.78 1rjd n PHE 55 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1rjd s SER 56 N -4.96 -1.17 0.24 4.37 0.15 -0.37 -5.01 113.70 106.95 1rjd s SER 56 Ca -0.00 0.80 -0.06 0.00 0.70 0.00 0.00 55.95 57.38 1rjd s SER 56 Cb 0.11 2.01 0.29 0.00 -1.71 0.00 0.00 66.02 66.72 1rjd s SER 56 CO 0.80 -0.22 1.87 -0.09 1.20 0.00 0.00 173.24 176.81 1rjd h ARG 57 N 7.99 1.04 -0.05 5.44 2.43 -1.83 -2.17 114.38 127.23 1rjd h ARG 57 Ca -0.21 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 58.89 1rjd h ARG 57 Cb 1.16 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 30.47 1rjd h ARG 57 CO 0.18 0.69 -0.02 -0.09 -1.51 0.00 0.00 179.97 179.21 1rjd h ARG 58 N 1.07 0.10 -0.52 0.20 2.43 -1.94 -0.82 114.38 114.90 1rjd h ARG 58 Ca 0.36 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.45 1rjd h ARG 58 Cb 0.05 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 1rjd h ARG 58 CO -0.13 0.48 0.18 0.00 -1.51 0.00 0.00 179.97 178.98 1rjd h ALA 59 N 0.62 0.68 -0.60 2.80 0.00 -1.93 -2.23 119.26 118.60 1rjd h ALA 59 Ca 0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1rjd h ALA 59 Cb 0.44 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1rjd h ALA 59 CO 0.01 0.33 0.36 0.35 0.00 0.00 0.00 179.25 180.29 1rjd h PHE 60 N 0.71 0.79 -0.36 0.00 3.57 -1.32 -1.08 116.94 119.24 1rjd h PHE 60 Ca 0.17 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.72 1rjd h PHE 60 Cb 0.25 -0.26 -0.05 0.00 2.79 0.00 0.00 35.95 38.69 1rjd h PHE 60 CO 0.01 0.54 0.09 0.78 -2.23 0.00 0.00 178.31 177.51 1rjd h GLY 61 N 0.80 0.44 0.96 2.40 0.00 -0.95 0.51 103.07 107.24 1rjd h GLY 61 Ca 0.21 -0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.47 1rjd h GLY 61 CO -0.04 -0.01 0.18 0.50 0.00 0.00 0.00 176.54 177.17 1rjd h LYS 62 N 0.23 0.72 0.03 4.80 1.57 -1.08 -1.44 116.57 121.41 1rjd h LYS 62 Ca 0.17 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1rjd h LYS 62 Cb 0.18 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1rjd h LYS 62 CO -0.20 0.66 -0.02 0.28 -0.57 0.00 0.00 179.45 179.60 1rjd h VAL 63 N 0.63 1.24 -0.25 0.50 2.07 -0.86 -2.53 116.25 117.04 1rjd h VAL 63 Ca 0.16 -0.88 0.05 0.00 0.82 0.00 0.00 66.70 66.85 1rjd h VAL 63 Cb 0.22 1.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.76 1rjd h VAL 63 CO -0.01 0.22 -0.07 -0.78 0.02 0.00 0.00 177.57 176.95 1rjd h ASP 64 N -0.43 -0.25 -0.42 0.57 3.58 0.08 -0.20 116.42 119.35 1rjd h ASP 64 Ca -0.00 0.08 -0.10 0.00 0.42 0.00 0.00 57.03 57.42 1rjd h ASP 64 Cb 0.40 0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.60 1rjd h ASP 64 CO 0.01 -0.09 -0.12 0.11 -2.88 0.00 0.00 179.24 176.27 1rjd h LYS 65 N -0.01 0.89 -0.14 0.28 1.57 -1.28 -2.48 116.57 115.41 1rjd h LYS 65 Ca 0.12 -0.32 -0.16 0.00 -1.87 0.00 0.00 60.65 58.43 1rjd h LYS 65 Cb 0.19 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1rjd h LYS 65 CO -0.26 0.96 -0.58 0.00 -0.57 0.00 0.00 179.45 178.99 1rjd h ALA 66 N 1.06 0.74 -0.30 3.86 0.00 -1.11 -2.83 119.26 120.67 1rjd h ALA 66 Ca 0.13 -0.53 -0.18 0.00 0.00 0.00 0.00 54.91 54.33 1rjd h ALA 66 Cb 0.64 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1rjd h ALA 66 CO 0.04 0.70 -0.53 1.98 0.00 0.00 0.00 179.25 181.45 1rjd h MET 67 N 0.33 0.88 0.00 0.00 1.85 -0.86 -2.75 114.93 114.38 1rjd h MET 67 Ca -0.00 -0.55 0.00 0.00 -0.61 0.00 0.00 59.70 58.54 1rjd h MET 67 Cb 1.12 0.06 0.00 0.00 0.43 0.00 0.00 31.60 33.20 1rjd h MET 67 CO 0.10 1.18 0.00 0.00 -0.40 0.00 0.00 176.91 177.80 1rjd h ARG 68 N 0.68 0.00 -0.70 0.39 3.08 -1.47 -3.12 114.38 113.24 1rjd h ARG 68 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1rjd h ARG 68 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1rjd h ARG 68 CO 0.12 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.89 1rjd n SER 69 N -3.04 4.02 -4.74 7.04 3.41 -1.07 -4.99 113.62 114.26 1rjd n SER 69 Ca 0.03 -2.10 -0.41 0.00 -0.26 0.00 0.00 58.87 56.13 1rjd n SER 69 Cb 0.48 -0.50 -0.03 0.00 -0.26 0.00 0.00 64.21 63.90 1rjd n SER 69 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1rjd s SER 70 N -0.97 6.79 0.31 4.04 0.15 -1.05 -5.02 113.70 117.95 1rjd s SER 70 Ca 0.48 2.49 -0.07 0.00 0.70 0.00 0.00 55.95 59.56 1rjd s SER 70 Cb 0.27 -2.61 -0.06 0.00 -1.71 0.00 0.00 66.02 61.91 1rjd s SER 70 CO 0.31 -0.61 0.61 -0.36 1.20 0.00 0.00 173.24 174.38 1rjd s PHE 71 N 0.23 3.47 0.28 3.44 0.08 -1.26 -4.97 117.98 119.25 1rjd s PHE 71 Ca 0.59 0.76 0.03 0.00 0.12 0.00 0.00 56.93 58.43 1rjd s PHE 71 Cb -0.39 -2.20 0.66 0.00 -0.57 0.00 0.00 43.02 40.52 1rjd s PHE 71 CO 0.39 0.11 1.75 -1.35 -0.10 0.00 0.00 175.22 176.02 1rjd h PRO 72 N 1.63 0.61 -1.01 0.24 0.11 -1.96 -1.16 132.00 130.47 1rjd h PRO 72 Ca -0.47 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 65.64 1rjd h PRO 72 Cb 1.19 -0.14 -0.06 0.00 0.11 0.00 0.00 31.00 32.10 1rjd h PRO 72 CO 0.66 0.40 0.66 0.28 -0.21 0.00 0.00 178.00 179.79 1rjd h VAL 73 N 0.63 1.15 -0.30 3.15 2.07 -1.95 0.48 116.25 121.48 1rjd h VAL 73 Ca 0.53 -0.43 -0.13 0.00 0.82 0.00 0.00 66.70 67.50 1rjd h VAL 73 Cb 0.85 -0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1rjd h VAL 73 CO -0.41 0.23 -0.33 0.24 0.02 0.00 0.00 177.57 177.32 1rjd h MET 74 N 1.25 0.65 -0.61 1.57 2.86 -1.63 -2.35 114.93 116.67 1rjd h MET 74 Ca 0.41 -0.30 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1rjd h MET 74 Cb 0.05 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.67 1rjd h MET 74 CO -0.14 0.89 0.11 -0.91 1.06 0.00 0.00 176.91 177.92 1rjd h ASN 75 N 0.55 0.92 -0.75 1.22 2.35 -0.67 -1.62 115.58 117.58 1rjd h ASN 75 Ca 0.06 -0.20 -0.06 0.00 -0.55 0.00 0.00 56.30 55.55 1rjd h ASN 75 Cb 0.84 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.93 1rjd h ASN 75 CO 0.07 0.92 0.24 1.88 -1.65 0.00 0.00 177.43 178.88 1rjd h TYR 76 N 0.92 1.21 -0.49 1.19 -1.99 -0.78 -1.17 116.97 115.86 1rjd h TYR 76 Ca 0.19 -0.12 0.03 0.00 2.00 0.00 0.00 58.73 60.83 1rjd h TYR 76 Cb 0.39 -0.35 -0.04 0.00 2.00 0.00 0.00 36.73 38.73 1rjd h TYR 76 CO 0.03 0.95 0.27 0.78 -0.00 0.00 0.00 178.16 180.19 1rjd h GLY 77 N 1.12 0.70 0.99 3.88 0.00 -0.92 -0.81 103.07 108.04 1rjd h GLY 77 Ca 0.24 -0.20 -0.06 0.00 0.00 0.00 0.00 47.33 47.32 1rjd h GLY 77 CO -0.01 0.15 0.09 -0.84 0.00 0.00 0.00 176.54 175.93 1rjd h THR 78 N 0.54 1.25 -0.09 4.70 2.02 -1.06 -1.32 112.91 118.95 1rjd h THR 78 Ca 0.21 -0.93 0.02 0.00 0.77 0.00 0.00 66.41 66.48 1rjd h THR 78 Cb 0.08 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.32 1rjd h THR 78 CO -0.12 0.33 -0.06 0.22 0.37 0.00 0.00 175.52 176.26 1rjd h TYR 79 N 0.73 -0.15 -0.38 3.16 3.20 -1.00 -1.60 116.97 120.92 1rjd h TYR 79 Ca 0.16 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.00 1rjd h TYR 79 Cb 0.39 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 1rjd h TYR 79 CO 0.03 -0.10 0.10 -0.07 -1.64 0.00 0.00 178.16 176.48 1rjd h LEU 80 N -0.07 0.56 -0.19 2.82 3.38 -0.94 -1.39 115.31 119.48 1rjd h LEU 80 Ca 0.06 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 57.85 1rjd h LEU 80 Cb 0.16 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 1rjd h LEU 80 CO -0.13 0.64 -0.12 -0.09 0.09 0.00 0.00 178.44 178.82 1rjd h ARG 81 N 0.46 -0.12 0.01 1.13 2.43 -1.19 -0.39 114.38 116.72 1rjd h ARG 81 Ca 0.12 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1rjd h ARG 81 Cb 0.28 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1rjd h ARG 81 CO -0.00 -0.08 -0.01 1.15 -1.51 0.00 0.00 179.97 179.52 1rjd h THR 82 N -0.12 1.33 0.00 0.20 2.02 -1.06 -2.29 112.91 112.98 1rjd h THR 82 Ca 0.11 -1.05 -0.08 0.00 0.77 0.00 0.00 66.41 66.16 1rjd h THR 82 Cb 0.28 2.03 -0.01 0.00 -1.74 0.00 0.00 68.15 68.72 1rjd h THR 82 CO -0.26 0.27 -0.38 -0.37 0.37 0.00 0.00 175.52 175.15 1rjd h VAL 83 N -0.47 0.87 -0.20 3.16 -1.51 -1.29 -0.43 116.25 116.38 1rjd h VAL 83 Ca -0.00 -1.54 -0.03 0.00 -1.23 0.00 0.00 66.70 63.90 1rjd h VAL 83 Cb 0.46 1.94 -0.01 0.00 -2.13 0.00 0.00 31.29 31.55 1rjd h VAL 83 CO 0.00 0.37 0.02 1.23 -1.23 0.00 0.00 177.57 177.97 1rjd h GLY 84 N 2.12 0.36 0.81 5.19 0.00 -1.06 0.19 103.07 110.68 1rjd h GLY 84 Ca -0.00 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 1rjd h GLY 84 CO 0.05 0.23 -0.02 -2.22 0.00 0.00 0.00 176.54 174.57 1rjd h ILE 85 N 0.11 1.27 -0.78 2.60 2.04 -1.30 -3.00 117.51 118.45 1rjd h ILE 85 Ca 0.06 -0.95 -0.02 0.00 1.00 0.00 0.00 64.86 64.94 1rjd h ILE 85 Cb 0.33 1.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.88 1rjd h ILE 85 CO 0.01 0.29 0.39 0.44 0.00 0.00 0.00 178.15 179.28 1rjd h ASP 86 N 0.11 1.01 -0.94 1.72 3.32 -1.04 -1.58 116.42 119.02 1rjd h ASP 86 Ca 0.05 -0.12 0.06 0.00 0.02 0.00 0.00 57.03 57.04 1rjd h ASP 86 Cb 0.45 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 39.67 1rjd h ASP 86 CO 0.01 0.85 0.60 0.00 -1.72 0.00 0.00 179.24 178.98 1rjd h ALA 87 N 1.20 1.28 -0.29 3.45 0.00 -0.92 0.39 119.26 124.38 1rjd h ALA 87 Ca 0.27 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.06 1rjd h ALA 87 Cb 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1rjd h ALA 87 CO -0.04 0.39 -0.21 0.00 0.00 0.00 0.00 179.25 179.39 1rjd h ALA 88 N 1.42 0.42 -0.27 0.00 0.00 -1.24 -2.65 119.26 116.93 1rjd h ALA 88 Ca 0.40 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1rjd h ALA 88 Cb 0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1rjd h ALA 88 CO -0.16 0.37 0.15 0.82 0.00 0.00 0.00 179.25 180.43 1rjd h ILE 89 N 0.40 1.02 -0.22 0.00 2.04 -0.92 -3.05 117.51 116.79 1rjd h ILE 89 Ca 0.06 -0.11 -0.16 0.00 1.00 0.00 0.00 64.86 65.64 1rjd h ILE 89 Cb 0.75 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1rjd h ILE 89 CO 0.06 0.06 -0.53 -0.07 0.00 0.00 0.00 178.15 177.66 1rjd h LEU 90 N 0.32 0.70 -0.76 1.44 3.38 -0.84 -1.12 115.31 118.44 1rjd h LEU 90 Ca 0.11 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 57.75 1rjd h LEU 90 Cb 0.00 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 1rjd h LEU 90 CO -0.05 1.10 0.47 -0.33 0.09 0.00 0.00 178.44 179.71 1rjd h GLU 91 N 0.49 0.87 -0.18 1.13 5.08 -1.48 -0.35 114.58 120.15 1rjd h GLU 91 Ca 0.01 -0.05 -0.21 0.00 -1.00 0.00 0.00 59.36 58.11 1rjd h GLU 91 Cb 1.09 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 30.15 1rjd h GLU 91 CO 0.11 0.58 -0.71 0.35 -1.00 0.00 0.00 179.01 178.33 1rjd h PHE 92 N 0.90 0.99 -0.17 4.33 3.57 -1.32 -2.71 116.94 122.53 1rjd h PHE 92 Ca 0.31 -0.42 -0.12 0.00 3.53 0.00 0.00 57.97 61.27 1rjd h PHE 92 Cb 0.07 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 1rjd h PHE 92 CO -0.04 1.23 -0.42 -0.07 -2.23 0.00 0.00 178.31 176.78 1rjd h LEU 93 N 0.53 0.43 -0.94 0.59 3.38 -0.96 -0.55 115.31 117.79 1rjd h LEU 93 Ca -0.03 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 1rjd h LEU 93 Cb 1.32 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1rjd h LEU 93 CO 0.14 0.80 -0.21 0.58 0.09 0.00 0.00 178.44 179.84 1rjd h VAL 94 N 0.33 1.26 0.00 1.22 2.07 -1.03 -3.12 116.25 116.99 1rjd h VAL 94 Ca 0.03 -1.22 -0.12 0.00 0.82 0.00 0.00 66.70 66.20 1rjd h VAL 94 Cb 0.88 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 1rjd h VAL 94 CO 0.07 0.39 -0.77 0.00 0.02 0.00 0.00 177.57 177.29 1rjd h ALA 95 N 1.30 0.65 -3.14 1.67 0.00 -1.14 -3.41 119.26 115.19 1rjd h ALA 95 Ca 0.07 -0.57 -0.60 0.00 0.00 0.00 0.00 54.91 53.81 1rjd h ALA 95 Cb 0.63 0.01 -0.40 0.00 0.00 0.00 0.00 17.79 18.03 1rjd h ALA 95 CO 0.05 0.72 -0.75 -0.80 0.00 0.00 0.00 179.25 178.47 1rjd s ASN 96 N -6.28 3.96 0.16 0.00 0.01 -0.25 -5.02 114.94 107.54 1rjd s ASN 96 Ca 0.02 -2.00 -0.12 0.00 -0.71 0.00 0.00 52.86 50.05 1rjd s ASN 96 Cb 0.08 -0.98 0.06 0.00 0.41 0.00 0.00 41.25 40.82 1rjd s ASN 96 CO 0.77 -0.36 1.68 -0.08 -1.51 0.00 0.00 177.10 177.60 1rjd h GLU 97 N 7.60 0.89 -4.57 -0.60 4.81 -1.81 -3.39 114.58 117.51 1rjd h GLU 97 Ca -0.08 -0.20 -0.71 0.00 -0.13 0.00 0.00 59.36 58.24 1rjd h GLU 97 Cb 0.99 -0.12 -0.20 0.00 0.63 0.00 0.00 28.75 30.04 1rjd h GLU 97 CO 0.48 0.82 -0.44 0.21 -0.73 0.00 0.00 179.01 179.34 1rjd s LYS 98 N -5.36 3.12 0.02 1.92 2.20 -1.26 -4.06 119.74 116.32 1rjd s LYS 98 Ca -0.13 -0.91 -0.12 0.00 -0.36 0.00 0.00 55.97 54.46 1rjd s LYS 98 Cb 0.12 -3.93 0.01 0.00 -1.51 0.00 0.00 37.83 32.53 1rjd s LYS 98 CO 0.80 -0.67 0.25 0.08 -0.36 0.00 0.00 175.35 175.46 1rjd s VAL 99 N 1.70 0.08 -0.06 4.02 1.01 -1.22 -4.22 120.40 121.71 1rjd s VAL 99 Ca 0.05 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.39 1rjd s VAL 99 Cb -0.19 -0.80 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 1rjd s VAL 99 CO 0.10 -0.39 -0.25 0.00 0.00 0.00 0.00 175.10 174.57 1rjd s GLN 100 N -2.13 2.62 -0.15 2.72 -2.07 0.18 -1.73 119.66 119.10 1rjd s GLN 100 Ca -0.08 -0.89 -0.04 0.00 -1.82 0.00 0.00 55.36 52.52 1rjd s GLN 100 Cb -0.03 -2.17 -0.03 0.00 -1.09 0.00 0.00 33.01 29.69 1rjd s GLN 100 CO -0.01 0.34 0.00 0.08 -1.32 0.00 0.00 175.29 174.38 1rjd s VAL 101 N -0.07 4.25 -0.27 3.63 1.01 0.51 -0.49 120.40 128.97 1rjd s VAL 101 Ca -0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 1rjd s VAL 101 Cb -0.14 -2.86 0.04 0.00 0.00 0.00 0.00 36.38 33.41 1rjd s VAL 101 CO 0.05 0.51 -0.04 -0.69 0.00 0.00 0.00 175.10 174.92 1rjd s VAL 102 N 0.08 2.87 -0.48 2.92 1.01 0.34 0.01 120.40 127.15 1rjd s VAL 102 Ca 0.02 -1.20 -0.17 0.00 0.00 0.00 0.00 61.98 60.62 1rjd s VAL 102 Cb -0.13 -2.55 0.06 0.00 0.00 0.00 0.00 36.38 33.76 1rjd s VAL 102 CO 0.02 0.07 0.51 0.21 0.00 0.00 0.00 175.10 175.91 1rjd s ASN 103 N 1.28 6.19 -0.23 3.32 3.84 0.22 -0.92 114.94 128.65 1rjd s ASN 103 Ca -0.03 -1.06 -0.22 0.00 0.21 0.00 0.00 52.86 51.76 1rjd s ASN 103 Cb -0.18 -2.24 -0.02 0.00 -0.55 0.00 0.00 41.25 38.26 1rjd s ASN 103 CO -0.03 -0.76 0.70 -0.76 -2.79 0.00 0.00 177.10 173.46 1rjd s LEU 104 N 2.17 4.10 -0.78 3.21 1.43 0.09 -1.79 118.68 127.11 1rjd s LEU 104 Ca 0.10 0.87 -0.01 0.00 -1.03 0.00 0.00 54.13 54.06 1rjd s LEU 104 Cb -0.21 -2.98 -0.01 0.00 0.03 0.00 0.00 46.19 43.02 1rjd s LEU 104 CO 0.10 -0.38 0.66 0.61 0.23 0.00 0.00 176.35 177.57 1rjd n GLY 105 N 3.89 -0.17 0.24 -3.19 0.00 -0.14 -4.36 105.19 101.45 1rjd n GLY 105 Ca 0.01 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1rjd n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rjd n GLY 107 N -0.01 2.75 0.87 0.00 0.00 -1.26 -1.62 105.19 105.91 1rjd n GLY 107 Ca -0.00 -0.02 0.06 0.00 0.00 0.00 0.00 46.02 46.06 1rjd n GLY 107 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rjd n SER 108 N 1.77 2.50 -4.67 1.61 7.64 -1.26 -4.97 113.62 116.23 1rjd n SER 108 Ca 0.00 -2.11 -0.46 0.00 1.01 0.00 0.00 58.87 57.31 1rjd n SER 108 Cb 0.00 -0.35 -0.04 0.00 -1.01 0.00 0.00 64.21 62.82 1rjd n SER 108 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1rjd n ASP 109 N 0.62 3.01 -0.43 6.43 -0.08 -0.64 -4.90 116.55 120.56 1rjd n ASP 109 Ca 0.14 1.10 0.06 0.00 -1.51 0.00 0.00 54.79 54.58 1rjd n ASP 109 Cb 0.44 -1.43 0.15 0.00 2.34 0.00 0.00 41.12 42.62 1rjd n ASP 109 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1rjd n LEU 110 N 3.11 2.85 0.28 -2.67 4.77 -1.26 -4.72 117.00 119.36 1rjd n LEU 110 Ca 0.16 -2.55 0.14 0.00 -0.03 0.00 0.00 56.01 53.73 1rjd n LEU 110 Cb 0.29 -0.31 0.80 0.00 -2.33 0.00 0.00 43.42 41.87 1rjd n LEU 110 CO 0.63 0.66 1.03 0.08 -1.33 0.00 0.00 177.39 178.45 1rjd h ARG 111 N 1.02 0.00 0.00 3.23 0.11 -2.00 -1.54 114.38 115.20 1rjd h ARG 111 Ca 0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 1rjd h ARG 111 Cb 0.94 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.02 1rjd h ARG 111 CO 0.06 0.08 -0.05 0.00 0.10 0.00 0.00 179.97 180.17 1rjd h MET 112 N 0.00 0.00 0.57 0.08 -0.00 -1.99 -2.83 114.93 110.76 1rjd h MET 112 Ca -0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.67 1rjd h MET 112 Cb 0.24 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 31.84 1rjd h MET 112 CO 0.01 0.05 -0.27 -0.07 -0.00 0.00 0.00 176.91 176.62 1rjd h LEU 113 N 0.00 -0.64 -0.61 -0.10 3.38 -1.65 0.07 115.31 115.75 1rjd h LEU 113 Ca -0.00 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1rjd h LEU 113 Cb 0.09 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1rjd h LEU 113 CO 0.01 -0.41 -0.21 1.55 0.09 0.00 0.00 178.44 179.46 1rjd h PRO 114 N -0.83 0.87 -0.88 1.13 0.13 -1.74 -3.23 132.00 127.44 1rjd h PRO 114 Ca -0.08 -0.36 0.02 0.00 -0.87 0.00 0.00 66.00 64.72 1rjd h PRO 114 Cb 0.61 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 31.66 1rjd h PRO 114 CO 0.13 1.00 0.58 -0.07 -0.23 0.00 0.00 178.00 179.40 1rjd h LEU 115 N 0.75 0.98 -1.01 1.56 3.38 -1.35 0.07 115.31 119.69 1rjd h LEU 115 Ca 0.10 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 1rjd h LEU 115 Cb 0.75 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1rjd h LEU 115 CO 0.06 0.70 -0.35 -0.07 0.09 0.00 0.00 178.44 178.87 1rjd h LEU 116 N 1.16 0.27 -0.28 1.67 3.38 -1.05 -1.00 115.31 119.45 1rjd h LEU 116 Ca 0.33 -0.10 -0.18 0.00 0.09 0.00 0.00 57.88 58.02 1rjd h LEU 116 Cb -0.08 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1rjd h LEU 116 CO -0.09 0.61 -0.52 -0.61 0.09 0.00 0.00 178.44 177.92 1rjd h GLN 117 N 0.22 0.85 -0.00 1.13 5.75 -1.45 -3.33 115.11 118.28 1rjd h GLN 117 Ca 0.03 -0.54 -0.14 0.00 -0.15 0.00 0.00 58.65 57.85 1rjd h GLN 117 Cb 0.73 0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.33 1rjd h GLN 117 CO 0.06 1.17 -0.65 0.52 -2.65 0.00 0.00 178.83 177.28 1rjd h MET 118 N 0.63 0.02 -3.74 1.69 2.86 -0.47 -3.40 114.93 112.52 1rjd h MET 118 Ca 0.01 -0.01 -0.62 0.00 -2.06 0.00 0.00 59.70 57.02 1rjd h MET 118 Cb 1.13 0.00 -0.40 0.00 0.06 0.00 0.00 31.60 32.39 1rjd h MET 118 CO 0.12 0.67 -0.72 -0.06 1.06 0.00 0.00 176.91 177.97 1rjd s PHE 119 N -3.54 2.59 0.59 -0.22 0.08 -0.43 -5.01 117.98 112.05 1rjd s PHE 119 Ca -0.01 -2.47 0.29 0.00 0.12 0.00 0.00 56.93 54.85 1rjd s PHE 119 Cb 0.12 -2.27 1.63 0.00 -0.57 0.00 0.00 43.02 41.94 1rjd s PHE 119 CO 0.77 -0.86 2.05 -1.35 -0.10 0.00 0.00 175.22 175.74 1rjd h PRO 120 N 7.41 0.00 -0.40 0.24 0.11 -1.79 -2.03 132.00 135.54 1rjd h PRO 120 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1rjd h PRO 120 Cb 0.98 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1rjd h PRO 120 CO 0.52 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 179.03 1rjd n HIS 121 N -3.73 0.83 -2.61 0.65 8.25 -1.26 -4.97 115.22 112.38 1rjd n HIS 121 Ca 0.03 -0.63 -0.41 0.00 -0.26 0.00 0.00 57.72 56.45 1rjd n HIS 121 Cb 0.40 -0.15 -0.04 0.00 1.12 0.00 0.00 29.99 31.31 1rjd n HIS 121 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1rjd s LEU 122 N -1.68 4.51 -0.00 2.41 2.96 -0.76 -3.43 118.68 122.68 1rjd s LEU 122 Ca 0.35 1.99 0.07 0.00 -0.22 0.00 0.00 54.13 56.33 1rjd s LEU 122 Cb 0.23 -3.60 -0.02 0.00 0.50 0.00 0.00 46.19 43.30 1rjd s LEU 122 CO 0.17 -0.13 -0.23 0.00 -1.32 0.00 0.00 176.35 174.84 1rjd s ALA 123 N -0.29 2.32 -0.03 5.97 0.00 -0.70 -4.82 121.76 124.21 1rjd s ALA 123 Ca 0.48 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 51.31 1rjd s ALA 123 Cb -0.27 -0.63 0.02 0.00 0.00 0.00 0.00 23.12 22.24 1rjd s ALA 123 CO 0.33 0.54 -0.03 -0.47 0.00 0.00 0.00 175.76 176.13 1rjd s TYR 124 N -0.71 0.50 -0.15 0.00 5.04 0.07 -0.36 117.35 121.75 1rjd s TYR 124 Ca 0.11 -0.10 0.01 0.00 -2.44 0.00 0.00 57.07 54.66 1rjd s TYR 124 Cb -0.10 -0.47 0.02 0.00 0.35 0.00 0.00 41.96 41.76 1rjd s TYR 124 CO 0.01 -0.12 -0.16 0.08 -1.34 0.00 0.00 175.55 174.02 1rjd s VAL 125 N 0.68 1.70 -0.18 3.14 1.01 0.10 -1.42 120.40 125.43 1rjd s VAL 125 Ca -0.08 -0.73 -0.13 0.00 0.00 0.00 0.00 61.98 61.05 1rjd s VAL 125 Cb -0.11 -1.56 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 1rjd s VAL 125 CO -0.01 0.48 0.25 -1.81 0.00 0.00 0.00 175.10 174.01 1rjd s ASP 126 N 1.28 6.35 -0.05 3.32 1.01 0.23 -0.61 116.67 128.21 1rjd s ASP 126 Ca 0.01 0.41 0.02 0.00 0.71 0.00 0.00 52.55 53.70 1rjd s ASP 126 Cb -0.14 -2.16 0.01 0.00 1.01 0.00 0.00 42.92 41.65 1rjd s ASP 126 CO -0.08 0.11 -0.10 -0.63 0.21 0.00 0.00 175.17 174.67 1rjd s ILE 127 N 0.54 0.92 0.39 0.77 1.01 -0.74 -1.09 121.20 123.00 1rjd s ILE 127 Ca 0.14 -0.37 -0.12 0.00 0.00 0.00 0.00 60.65 60.29 1rjd s ILE 127 Cb -0.13 -0.85 0.05 0.00 0.01 0.00 0.00 42.46 41.54 1rjd s ILE 127 CO 0.03 0.30 0.74 -0.62 0.00 0.00 0.00 174.94 175.38 1rjd s ASP 128 N 0.61 0.24 0.60 3.58 -1.08 -1.10 -0.97 116.67 118.55 1rjd s ASP 128 Ca -0.11 -1.27 -0.19 0.00 -0.52 0.00 0.00 52.55 50.45 1rjd s ASP 128 Cb -0.14 0.83 -0.04 0.00 -1.46 0.00 0.00 42.92 42.11 1rjd s ASP 128 CO 0.02 -1.65 1.12 -1.22 0.52 0.00 0.00 175.17 173.96 1rjd n TYR 129 N -0.55 1.39 -0.31 -5.34 4.02 -1.22 -0.72 117.16 114.43 1rjd n TYR 129 Ca -0.07 0.44 0.01 0.00 -0.01 0.00 0.00 57.90 58.26 1rjd n TYR 129 Cb 0.60 -2.22 0.07 0.00 -0.02 0.00 0.00 39.34 37.78 1rjd n TYR 129 CO 0.00 0.00 0.00 -0.97 -1.01 0.00 0.00 176.86 174.88 1rjd h ASN 130 N 0.69 -1.04 -0.23 7.72 -0.73 -1.90 -0.18 115.58 119.93 1rjd h ASN 130 Ca -0.49 0.27 -0.08 0.00 1.87 0.00 0.00 56.30 57.87 1rjd h ASN 130 Cb 1.35 0.60 -0.02 0.00 0.27 0.00 0.00 38.32 40.52 1rjd h ASN 130 CO 0.53 -0.29 -0.10 -0.33 -0.37 0.00 0.00 177.43 176.87 1rjd h GLU 131 N -0.03 0.60 -0.09 6.67 3.07 -1.99 -0.07 114.58 122.74 1rjd h GLU 131 Ca 0.36 -0.18 -0.06 0.00 -0.50 0.00 0.00 59.36 58.99 1rjd h GLU 131 Cb 0.61 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 1rjd h GLU 131 CO -0.88 0.69 -0.16 0.77 -1.40 0.00 0.00 179.01 178.04 1rjd h SER 132 N 0.56 0.30 -0.02 1.42 0.02 -1.59 -2.71 113.55 111.53 1rjd h SER 132 Ca 0.10 -0.55 -0.11 0.00 -0.84 0.00 0.00 61.79 60.40 1rjd h SER 132 Cb 0.50 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 1rjd h SER 132 CO 0.03 0.79 -0.31 -0.37 -1.14 0.00 0.00 176.83 175.83 1rjd h VAL 133 N -0.18 1.28 -0.78 2.27 -1.51 -0.82 -1.78 116.25 114.73 1rjd h VAL 133 Ca 0.01 -1.37 0.02 0.00 -1.23 0.00 0.00 66.70 64.13 1rjd h VAL 133 Cb 0.73 1.44 -0.04 0.00 -2.13 0.00 0.00 31.29 31.29 1rjd h VAL 133 CO 0.04 0.43 0.51 -0.33 -1.23 0.00 0.00 177.57 176.98 1rjd h GLU 134 N 0.41 0.98 -0.30 5.19 4.39 -1.02 0.60 114.58 124.83 1rjd h GLU 134 Ca 0.05 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 1rjd h GLU 134 Cb 0.74 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 1rjd h GLU 134 CO 0.06 0.65 0.01 1.25 -1.16 0.00 0.00 179.01 179.81 1rjd h LEU 135 N 1.01 0.50 -0.49 1.33 5.85 -1.13 -1.81 115.31 120.57 1rjd h LEU 135 Ca 0.30 -0.30 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1rjd h LEU 135 Cb -0.04 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 1rjd h LEU 135 CO -0.09 0.68 0.30 0.50 -0.34 0.00 0.00 178.44 179.48 1rjd h LYS 136 N 0.31 0.58 -0.47 1.25 3.64 -1.02 -1.58 116.57 119.28 1rjd h LYS 136 Ca 0.09 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1rjd h LYS 136 Cb 0.41 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 1rjd h LYS 136 CO 0.01 0.38 0.23 -0.97 -2.27 0.00 0.00 179.45 176.83 1rjd h ASN 137 N 0.60 0.32 -0.48 4.20 -1.24 -0.81 0.14 115.58 118.30 1rjd h ASN 137 Ca 0.19 0.03 0.04 0.00 0.71 0.00 0.00 56.30 57.28 1rjd h ASN 137 Cb -0.00 -0.03 -0.04 0.00 0.73 0.00 0.00 38.32 38.98 1rjd h ASN 137 CO -0.08 0.22 0.24 0.28 -1.29 0.00 0.00 177.43 176.80 1rjd h SER 138 N 0.45 0.34 -0.08 1.15 0.02 -0.87 -2.13 113.55 112.43 1rjd h SER 138 Ca 0.21 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 1rjd h SER 138 Cb 0.13 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.64 1rjd h SER 138 CO -0.16 0.24 -0.01 0.40 -1.14 0.00 0.00 176.83 176.16 1rjd h ILE 139 N 0.47 1.27 -0.53 3.27 2.04 -0.81 -0.85 117.51 122.36 1rjd h ILE 139 Ca 0.21 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.21 1rjd h ILE 139 Cb 0.12 1.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 1rjd h ILE 139 CO -0.15 0.24 0.34 -0.07 0.00 0.00 0.00 178.15 178.50 1rjd h LEU 140 N -0.17 0.62 0.00 1.44 3.38 -0.85 -2.56 115.31 117.17 1rjd h LEU 140 Ca 0.02 -0.02 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 1rjd h LEU 140 Cb 0.38 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1rjd h LEU 140 CO 0.01 0.46 -1.21 0.03 0.09 0.00 0.00 178.44 177.82 1rjd h ARG 141 N 0.73 0.00 -0.03 1.13 3.08 -1.34 -2.53 114.38 115.41 1rjd h ARG 141 Ca 0.19 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 60.00 1rjd h ARG 141 Cb -0.06 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.01 1rjd h ARG 141 CO -0.04 0.45 -0.96 1.49 -1.07 0.00 0.00 179.97 179.84 1rjd h GLU 142 N 0.00 0.63 -6.31 0.04 4.57 -0.87 -3.41 114.58 109.23 1rjd h GLU 142 Ca -0.13 -0.64 -0.55 0.00 -1.18 0.00 0.00 59.36 56.86 1rjd h GLU 142 Cb 1.64 0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 30.37 1rjd h GLU 142 CO 0.07 1.24 0.65 0.45 -1.18 0.00 0.00 179.01 180.24 1rjd s SER 143 N -7.19 7.11 0.19 1.04 0.15 -0.99 -4.95 113.70 109.06 1rjd s SER 143 Ca -0.09 1.74 -0.12 0.00 0.70 0.00 0.00 55.95 58.19 1rjd s SER 143 Cb 0.08 -2.56 0.14 0.00 -1.71 0.00 0.00 66.02 61.97 1rjd s SER 143 CO 0.90 -0.53 1.83 -0.08 1.20 0.00 0.00 173.24 176.56 1rjd h GLU 144 N 7.32 0.72 -0.04 5.44 4.81 -1.89 -0.02 114.58 130.92 1rjd h GLU 144 Ca -0.34 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 58.70 1rjd h GLU 144 Cb 1.16 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.36 1rjd h GLU 144 CO 0.87 0.48 -0.64 0.97 -0.73 0.00 0.00 179.01 179.95 1rjd h ILE 145 N 0.75 1.42 -0.21 2.32 2.10 -1.93 -1.34 117.51 120.61 1rjd h ILE 145 Ca 0.24 -2.11 -0.12 0.00 1.08 0.00 0.00 64.86 63.95 1rjd h ILE 145 Cb 0.01 2.10 -0.00 0.00 -1.09 0.00 0.00 36.82 37.84 1rjd h ILE 145 CO -0.09 0.61 -0.35 -0.07 -1.08 0.00 0.00 178.15 177.17 1rjd h LEU 146 N 0.12 0.67 -0.42 2.19 3.38 -1.76 -2.05 115.31 117.44 1rjd h LEU 146 Ca -0.01 -0.53 0.08 0.00 0.09 0.00 0.00 57.88 57.51 1rjd h LEU 146 Cb 1.16 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 41.63 1rjd h LEU 146 CO 0.09 1.07 -0.12 0.03 0.09 0.00 0.00 178.44 179.60 1rjd h ARG 147 N 0.29 -0.02 -0.70 1.13 3.08 -0.54 -2.38 114.38 115.23 1rjd h ARG 147 Ca 0.02 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 1rjd h ARG 147 Cb 0.94 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.96 1rjd h ARG 147 CO 0.08 -0.01 0.33 0.82 -1.07 0.00 0.00 179.97 180.11 1rjd h ILE 148 N -0.02 1.23 0.00 2.04 2.04 -1.17 -0.40 117.51 121.23 1rjd h ILE 148 Ca 0.20 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.38 1rjd h ILE 148 Cb 0.33 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1rjd h ILE 148 CO -0.44 0.27 -0.12 0.77 0.00 0.00 0.00 178.15 178.63 1rjd h SER 149 N 1.00 0.00 -0.02 1.72 4.64 -0.85 -3.01 113.55 117.03 1rjd h SER 149 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1rjd h SER 149 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1rjd h SER 149 CO -0.03 0.12 0.00 0.18 -0.87 0.00 0.00 176.83 176.23 1rjd n LEU 150 N -4.12 1.60 -2.28 5.97 4.77 -0.96 -4.97 117.00 117.01 1rjd n LEU 150 Ca -0.02 -1.08 -0.14 0.00 -0.03 0.00 0.00 56.01 54.73 1rjd n LEU 150 Cb 0.21 -0.01 0.04 0.00 -2.33 0.00 0.00 43.42 41.33 1rjd n LEU 150 CO 0.33 0.34 0.12 0.61 -1.33 0.00 0.00 177.39 177.46 1rjd n GLY 151 N 0.32 0.01 3.88 -0.72 0.00 -0.26 -4.96 105.19 103.46 1rjd n GLY 151 Ca 0.04 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 1rjd n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rjd s LEU 152 N -4.72 4.30 0.48 0.99 1.43 -0.57 -5.04 118.68 115.55 1rjd s LEU 152 Ca 0.32 0.77 -0.21 0.00 -1.03 0.00 0.00 54.13 53.98 1rjd s LEU 152 Cb -0.14 -3.20 -0.08 0.00 0.03 0.00 0.00 46.19 42.80 1rjd s LEU 152 CO 0.39 0.10 1.06 -0.94 0.23 0.00 0.00 176.35 177.19 1rjd s SER 153 N -2.04 6.29 0.41 2.29 1.04 -1.26 -4.78 113.70 115.64 1rjd s SER 153 Ca 0.38 1.99 0.08 0.00 0.48 0.00 0.00 55.95 58.87 1rjd s SER 153 Cb -0.13 -2.57 0.87 0.00 0.10 0.00 0.00 66.02 64.29 1rjd s SER 153 CO 0.20 -0.82 2.03 0.11 0.98 0.00 0.00 173.24 175.75 1rjd h LYS 154 N 1.62 0.55 -6.93 4.02 1.57 -1.98 -3.44 116.57 111.97 1rjd h LYS 154 Ca -0.49 -0.03 -0.48 0.00 -1.87 0.00 0.00 60.65 57.77 1rjd h LYS 154 Cb 1.23 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.41 1rjd h LYS 154 CO 0.59 0.36 0.21 -1.21 -0.57 0.00 0.00 179.45 178.83 1rjd s GLU 155 N -5.51 3.95 -1.03 3.15 8.01 -1.26 -4.78 118.70 121.23 1rjd s GLU 155 Ca -0.08 0.74 -0.23 0.00 0.01 0.00 0.00 54.97 55.41 1rjd s GLU 155 Cb 0.18 -2.31 0.04 0.00 -4.31 0.00 0.00 34.13 27.74 1rjd s GLU 155 CO 0.74 -0.04 1.50 -0.51 0.01 0.00 0.00 175.26 176.95 1rjd s ASP 156 N -2.76 6.43 0.00 -0.19 1.01 -1.26 -4.81 116.67 115.09 1rjd s ASP 156 Ca 0.55 -1.46 0.25 0.00 0.71 0.00 0.00 52.55 52.60 1rjd s ASP 156 Cb -0.10 -2.57 0.37 0.00 1.01 0.00 0.00 42.92 41.63 1rjd s ASP 156 CO 0.25 -1.57 1.35 0.35 0.21 0.00 0.00 175.17 175.77 1rjd n THR 157 N 6.92 0.00 -3.16 -1.27 -2.24 -1.26 -4.94 114.28 108.32 1rjd n THR 157 Ca 0.34 -0.43 -0.34 0.00 -2.27 0.00 0.00 64.05 61.36 1rjd n THR 157 Cb 0.50 1.26 -0.06 0.00 -2.10 0.00 0.00 70.33 69.93 1rjd n THR 157 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rjd s ALA 158 N -2.04 3.40 0.05 6.98 0.00 -1.26 -5.06 121.76 123.82 1rjd s ALA 158 Ca 0.29 0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.31 1rjd s ALA 158 Cb 0.20 -2.74 -0.04 0.00 0.00 0.00 0.00 23.12 20.54 1rjd s ALA 158 CO 0.33 0.36 0.13 0.15 0.00 0.00 0.00 175.76 176.72 1rjd s LYS 159 N -2.49 3.12 0.26 0.00 1.02 -1.26 -4.86 119.74 115.53 1rjd s LYS 159 Ca 0.48 -0.55 -0.27 0.00 0.02 0.00 0.00 55.97 55.64 1rjd s LYS 159 Cb -0.13 -2.87 -0.15 0.00 -0.52 0.00 0.00 37.83 34.15 1rjd s LYS 159 CO 0.19 0.60 0.74 0.45 -0.92 0.00 0.00 175.35 176.41 1rjd n SER 160 N 0.57 -0.07 -1.58 2.83 2.88 -1.26 -1.97 113.62 115.03 1rjd n SER 160 Ca -0.08 1.13 0.06 0.00 -1.33 0.00 0.00 58.87 58.64 1rjd n SER 160 Cb 0.52 -1.12 0.32 0.00 -0.75 0.00 0.00 64.21 63.18 1rjd n SER 160 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1rjd n PRO 161 N 0.84 3.99 -4.16 -1.46 -0.04 -1.26 -5.10 135.00 127.81 1rjd n PRO 161 Ca 0.13 -2.49 -0.29 0.00 -0.04 0.00 0.00 63.50 60.82 1rjd n PRO 161 Cb 0.30 -2.07 -0.08 0.00 -0.04 0.00 0.00 33.50 31.61 1rjd n PRO 161 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1rjd s PHE 162 N -2.32 2.92 -0.11 0.54 0.40 -0.83 -4.26 117.98 114.32 1rjd s PHE 162 Ca 0.43 -0.08 0.06 0.00 -0.60 0.00 0.00 56.93 56.75 1rjd s PHE 162 Cb 0.32 -1.48 -0.24 0.00 0.51 0.00 0.00 43.02 42.14 1rjd s PHE 162 CO 0.14 0.48 0.41 1.28 0.70 0.00 0.00 175.22 178.23 1rjd n LEU 163 N 0.39 1.53 -4.07 -0.37 4.77 -0.05 -4.09 117.00 115.11 1rjd n LEU 163 Ca -0.11 0.24 -0.24 0.00 -0.03 0.00 0.00 56.01 55.88 1rjd n LEU 163 Cb 0.53 -0.31 -0.16 0.00 -2.33 0.00 0.00 43.42 41.15 1rjd n LEU 163 CO 0.38 0.61 -0.47 -0.63 -1.33 0.00 0.00 177.39 175.94 1rjd s ILE 164 N -2.56 1.15 -0.42 -0.08 1.01 -1.10 -4.42 121.20 114.78 1rjd s ILE 164 Ca -0.14 -0.56 0.07 0.00 0.00 0.00 0.00 60.65 60.03 1rjd s ILE 164 Cb 0.07 -1.01 0.24 0.00 0.01 0.00 0.00 42.46 41.78 1rjd s ILE 164 CO 0.79 0.34 0.59 -0.67 0.00 0.00 0.00 174.94 175.99 1rjd n ASP 165 N 3.26 -0.65 -3.37 3.58 2.03 -1.26 -1.14 116.55 119.00 1rjd n ASP 165 Ca -0.19 -2.80 -0.26 0.00 0.52 0.00 0.00 54.79 52.06 1rjd n ASP 165 Cb 0.53 -0.03 -0.08 0.00 -0.72 0.00 0.00 41.12 40.82 1rjd n ASP 165 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rjd n GLN 166 N 1.63 1.84 0.00 -0.67 1.13 -0.08 -5.01 117.38 116.22 1rjd n GLN 166 Ca 0.19 -4.15 0.00 0.00 -1.94 0.00 0.00 57.00 51.10 1rjd n GLN 166 Cb 0.55 -1.91 0.00 0.00 0.11 0.00 0.00 30.24 28.99 1rjd n GLN 166 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1rjd n GLY 167 N 1.15 2.12 0.37 1.08 0.00 -1.26 -2.99 105.19 105.65 1rjd n GLY 167 Ca 0.27 -0.26 0.03 0.00 0.00 0.00 0.00 46.02 46.06 1rjd n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rjd n ARG 168 N 0.00 2.57 -4.16 1.61 1.74 -1.26 -4.97 116.66 112.19 1rjd n ARG 168 Ca 0.00 -1.72 -0.20 0.00 -0.77 0.00 0.00 57.85 55.16 1rjd n ARG 168 Cb 0.00 -1.16 -0.16 0.00 -1.02 0.00 0.00 32.46 30.12 1rjd n ARG 168 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1rjd s TYR 169 N -0.95 0.74 0.01 -1.55 5.04 -1.16 -0.75 117.35 118.74 1rjd s TYR 169 Ca 0.13 -0.20 0.05 0.00 -2.44 0.00 0.00 57.07 54.61 1rjd s TYR 169 Cb 0.07 -0.66 -0.02 0.00 0.35 0.00 0.00 41.96 41.70 1rjd s TYR 169 CO 0.09 -0.19 -0.17 0.15 -1.34 0.00 0.00 175.55 174.10 1rjd s LYS 170 N 0.92 1.25 -0.14 4.97 1.02 -0.51 -0.90 119.74 126.35 1rjd s LYS 170 Ca -0.11 -0.68 0.00 0.00 0.02 0.00 0.00 55.97 55.21 1rjd s LYS 170 Cb -0.14 -1.24 0.02 0.00 -0.52 0.00 0.00 37.83 35.95 1rjd s LYS 170 CO 0.00 0.33 -0.14 -1.17 -0.92 0.00 0.00 175.35 173.46 1rjd s LEU 171 N -0.67 1.63 0.00 3.17 2.96 -0.29 -0.60 118.68 124.88 1rjd s LEU 171 Ca 0.06 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.52 1rjd s LEU 171 Cb -0.07 -1.14 -0.01 0.00 0.50 0.00 0.00 46.19 45.47 1rjd s LEU 171 CO 0.00 -0.06 -0.05 0.00 -1.32 0.00 0.00 176.35 174.92 1rjd s ALA 172 N 1.49 0.41 0.17 5.97 0.00 -0.25 -0.87 121.76 128.68 1rjd s ALA 172 Ca 0.05 -0.27 -0.30 0.00 0.00 0.00 0.00 51.96 51.44 1rjd s ALA 172 Cb -0.13 -0.08 -0.07 0.00 0.00 0.00 0.00 23.12 22.84 1rjd s ALA 172 CO -0.10 0.08 1.04 0.00 0.00 0.00 0.00 175.76 176.78 1rjd s ALA 173 N -0.26 3.33 -0.20 0.00 0.00 -1.26 -2.70 121.76 120.67 1rjd s ALA 173 Ca 0.00 0.72 -0.27 0.00 0.00 0.00 0.00 51.96 52.41 1rjd s ALA 173 Cb -0.03 -3.31 0.09 0.00 0.00 0.00 0.00 23.12 19.87 1rjd s ALA 173 CO -0.00 -0.10 0.80 0.00 0.00 0.00 0.00 175.76 176.46 1rjd s ASP 175 N -0.25 6.21 0.00 0.00 -1.08 -1.26 -3.39 116.67 116.90 1rjd s ASP 175 Ca -0.03 -0.84 0.18 0.00 -0.52 0.00 0.00 52.55 51.35 1rjd s ASP 175 Cb -0.03 -2.26 0.92 0.00 -1.46 0.00 0.00 42.92 40.09 1rjd s ASP 175 CO 0.02 -0.75 1.54 0.18 0.52 0.00 0.00 175.17 176.69 1rjd n LEU 176 N 5.86 0.00 0.00 -1.34 4.77 -1.26 -1.05 117.00 123.98 1rjd n LEU 176 Ca -0.07 0.27 0.12 0.00 -0.03 0.00 0.00 56.01 56.30 1rjd n LEU 176 Cb 0.46 -0.27 0.61 0.00 -2.33 0.00 0.00 43.42 41.89 1rjd n LEU 176 CO 0.50 -0.11 0.91 0.59 -1.33 0.00 0.00 177.39 177.95 1rjd n ASN 177 N -1.27 0.00 -4.12 -1.43 5.03 -1.26 -4.60 115.26 107.62 1rjd n ASN 177 Ca 0.09 0.06 -0.36 0.00 0.87 0.00 0.00 54.58 55.24 1rjd n ASN 177 Cb 0.14 -0.33 -0.11 0.00 -1.02 0.00 0.00 39.78 38.45 1rjd n ASN 177 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1rjd s ASP 178 N -2.67 5.25 0.36 6.41 -1.08 -0.21 -4.98 116.67 119.75 1rjd s ASP 178 Ca 0.21 -2.17 0.09 0.00 -0.52 0.00 0.00 52.55 50.16 1rjd s ASP 178 Cb 0.17 -1.83 0.67 0.00 -1.46 0.00 0.00 42.92 40.46 1rjd s ASP 178 CO 0.40 -0.52 1.83 -0.29 0.52 0.00 0.00 175.17 177.11 1rjd h ILE 179 N 6.18 1.23 -0.28 4.11 6.09 -1.83 -1.79 117.51 131.23 1rjd h ILE 179 Ca -0.11 -1.09 -0.03 0.00 -1.37 0.00 0.00 64.86 62.26 1rjd h ILE 179 Cb 1.03 1.43 -0.01 0.00 0.47 0.00 0.00 36.82 39.74 1rjd h ILE 179 CO 0.70 0.33 0.05 0.74 -3.07 0.00 0.00 178.15 176.90 1rjd h THR 180 N 0.19 1.23 -0.45 2.19 2.02 -1.94 0.12 112.91 116.26 1rjd h THR 180 Ca 0.03 -0.78 0.03 0.00 0.77 0.00 0.00 66.41 66.46 1rjd h THR 180 Cb 0.55 1.21 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 1rjd h THR 180 CO 0.04 0.25 0.24 -0.08 0.37 0.00 0.00 175.52 176.34 1rjd h GLU 181 N 0.28 0.47 -0.20 6.66 4.81 -1.85 -1.40 114.58 123.35 1rjd h GLU 181 Ca 0.08 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1rjd h GLU 181 Cb 0.33 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 1rjd h GLU 181 CO 0.00 0.31 0.10 1.15 -0.73 0.00 0.00 179.01 179.84 1rjd h THR 182 N 0.48 1.13 -0.22 0.32 2.02 -1.16 -0.44 112.91 115.04 1rjd h THR 182 Ca 0.19 -0.37 -0.12 0.00 0.77 0.00 0.00 66.41 66.89 1rjd h THR 182 Cb 0.07 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1rjd h THR 182 CO -0.12 0.12 -0.36 0.71 0.37 0.00 0.00 175.52 176.25 1rjd h THR 183 N 0.20 1.29 -0.54 3.16 1.35 -0.63 -1.24 112.91 116.49 1rjd h THR 183 Ca 0.07 -1.48 -0.05 0.00 -0.55 0.00 0.00 66.41 64.40 1rjd h THR 183 Cb 0.11 1.52 -0.03 0.00 -1.73 0.00 0.00 68.15 68.02 1rjd h THR 183 CO -0.01 0.46 0.14 0.03 -0.25 0.00 0.00 175.52 175.89 1rjd h ARG 184 N 0.41 0.83 0.08 4.72 3.08 -1.08 -1.54 114.38 120.88 1rjd h ARG 184 Ca 0.04 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.92 1rjd h ARG 184 Cb 0.82 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.74 1rjd h ARG 184 CO 0.07 0.75 -0.04 1.25 -1.07 0.00 0.00 179.97 180.92 1rjd h LEU 185 N 0.80 -0.09 -1.82 3.04 5.85 -0.75 -3.17 115.31 119.17 1rjd h LEU 185 Ca 0.18 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.60 1rjd h LEU 185 Cb 0.29 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1rjd h LEU 185 CO -0.00 0.26 0.12 -0.07 -0.34 0.00 0.00 178.44 178.41 1rjd h LEU 186 N -0.46 0.21 -1.94 2.25 3.38 -1.08 -1.70 115.31 115.97 1rjd h LEU 186 Ca -0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1rjd h LEU 186 Cb 0.39 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 1rjd h LEU 186 CO 0.02 0.15 -0.07 0.44 0.09 0.00 0.00 178.44 179.07 1rjd h ASP 187 N 0.24 0.00 -0.35 -0.43 3.32 -1.25 -2.26 116.42 115.69 1rjd h ASP 187 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1rjd h ASP 187 Cb -0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1rjd h ASP 187 CO -0.01 0.07 0.00 1.33 -1.72 0.00 0.00 179.24 178.91 1rjd n VAL 188 N -3.34 0.86 -0.86 -1.35 0.24 -0.65 -4.58 118.33 108.64 1rjd n VAL 188 Ca -0.01 -0.93 0.00 0.00 -2.04 0.00 0.00 64.34 61.36 1rjd n VAL 188 Cb 0.24 0.61 0.00 0.00 -1.47 0.00 0.00 33.84 33.22 1rjd n VAL 188 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1rjd s THR 190 N -0.12 0.12 0.01 0.00 -4.23 -0.87 -4.97 115.64 105.57 1rjd s THR 190 Ca 0.00 -1.46 0.08 0.00 -1.18 0.00 0.00 61.69 59.13 1rjd s THR 190 Cb 0.00 -1.67 -0.02 0.00 1.34 0.00 0.00 72.50 72.15 1rjd s THR 190 CO 0.00 -0.53 -0.25 -0.54 -0.54 0.00 0.00 174.62 172.76 1rjd s LYS 191 N -3.94 1.92 0.30 3.99 1.02 -1.26 -4.74 119.74 117.03 1rjd s LYS 191 Ca 0.13 -0.97 0.05 0.00 0.02 0.00 0.00 55.97 55.20 1rjd s LYS 191 Cb 0.05 -1.95 0.78 0.00 -0.52 0.00 0.00 37.83 36.20 1rjd s LYS 191 CO -0.05 0.52 1.70 -0.09 -0.92 0.00 0.00 175.35 176.51 1rjd h ARG 192 N 5.24 0.40 0.00 1.68 2.43 -1.97 -3.05 114.38 119.11 1rjd h ARG 192 Ca -0.44 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1rjd h ARG 192 Cb 1.13 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1rjd h ARG 192 CO 0.46 0.26 -0.42 -0.85 -1.51 0.00 0.00 179.97 177.91 1rjd n GLU 193 N -5.03 0.21 -2.85 0.20 0.28 -1.26 -1.85 120.64 110.33 1rjd n GLU 193 Ca 0.24 0.09 -0.41 0.00 -0.16 0.00 0.00 57.16 56.92 1rjd n GLU 193 Cb 0.70 -1.66 -0.05 0.00 1.43 0.00 0.00 31.44 31.86 1rjd n GLU 193 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1rjd s ILE 194 N -3.11 4.65 0.19 3.84 1.01 -1.15 -4.84 121.20 121.79 1rjd s ILE 194 Ca 0.09 1.85 -0.33 0.00 0.00 0.00 0.00 60.65 62.26 1rjd s ILE 194 Cb 0.14 -4.22 -0.14 0.00 0.01 0.00 0.00 42.46 38.25 1rjd s ILE 194 CO 0.67 0.32 1.40 -2.65 0.00 0.00 0.00 174.94 174.69 1rjd n PRO 195 N 2.92 1.81 -4.67 2.79 -0.02 -1.26 -4.72 135.00 131.84 1rjd n PRO 195 Ca 0.00 0.65 -0.25 0.00 -2.02 0.00 0.00 63.50 61.88 1rjd n PRO 195 Cb 0.50 -2.31 -0.16 0.00 -0.02 0.00 0.00 33.50 31.51 1rjd n PRO 195 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1rjd s THR 196 N 0.24 1.23 -0.20 3.45 2.01 -0.55 -0.65 115.64 121.17 1rjd s THR 196 Ca 0.74 -0.57 -0.07 0.00 0.31 0.00 0.00 61.69 62.10 1rjd s THR 196 Cb -0.73 -1.09 -0.04 0.00 0.01 0.00 0.00 72.50 70.66 1rjd s THR 196 CO 0.47 0.37 0.06 -0.63 -0.69 0.00 0.00 174.62 174.19 1rjd s ILE 197 N 0.36 4.62 -0.16 1.82 1.01 0.35 -1.25 121.20 127.94 1rjd s ILE 197 Ca -0.09 -0.09 -0.05 0.00 0.00 0.00 0.00 60.65 60.42 1rjd s ILE 197 Cb -0.13 -3.10 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 1rjd s ILE 197 CO 0.03 0.43 -0.00 -0.69 0.00 0.00 0.00 174.94 174.71 1rjd s VAL 198 N 0.67 4.19 -0.14 2.92 1.01 0.43 -0.51 120.40 128.98 1rjd s VAL 198 Ca 0.03 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.77 1rjd s VAL 198 Cb -0.13 -2.85 -0.01 0.00 0.00 0.00 0.00 36.38 33.39 1rjd s VAL 198 CO 0.02 0.48 -0.16 -0.63 0.00 0.00 0.00 175.10 174.81 1rjd s ILE 199 N 0.37 2.67 -0.40 2.22 1.01 -0.10 -0.00 121.20 126.97 1rjd s ILE 199 Ca -0.02 -0.78 0.01 0.00 0.00 0.00 0.00 60.65 59.86 1rjd s ILE 199 Cb -0.14 -2.11 0.13 0.00 0.01 0.00 0.00 42.46 40.35 1rjd s ILE 199 CO 0.02 0.53 0.21 -0.94 0.00 0.00 0.00 174.94 174.75 1rjd s SER 200 N 0.60 3.58 -0.42 3.58 1.04 -0.39 -0.73 113.70 120.97 1rjd s SER 200 Ca -0.09 -2.34 -0.12 0.00 0.48 0.00 0.00 55.95 53.88 1rjd s SER 200 Cb -0.16 -0.87 0.06 0.00 0.10 0.00 0.00 66.02 65.15 1rjd s SER 200 CO 0.03 -0.30 0.28 -0.70 0.98 0.00 0.00 173.24 173.53 1rjd s GLU 201 N 0.75 2.80 -1.46 4.02 2.12 -1.26 -1.43 118.70 124.23 1rjd s GLU 201 Ca 0.16 -1.28 -0.10 0.00 0.36 0.00 0.00 54.97 54.11 1rjd s GLU 201 Cb -0.23 -3.87 0.06 0.00 0.26 0.00 0.00 34.13 30.35 1rjd s GLU 201 CO -0.04 -0.88 0.96 0.00 -0.54 0.00 0.00 175.26 174.76 1rjd n LEU 203 N -4.64 1.55 0.27 0.00 7.94 -1.26 -4.76 117.00 116.10 1rjd n LEU 203 Ca -0.03 0.25 0.11 0.00 -1.11 0.00 0.00 56.01 55.23 1rjd n LEU 203 Cb 0.56 -0.59 0.73 0.00 0.53 0.00 0.00 43.42 44.65 1rjd n LEU 203 CO 0.73 -0.19 1.06 -0.07 -1.11 0.00 0.00 177.39 177.80 1rjd h LEU 204 N -0.66 0.00 -2.50 -1.96 3.38 -1.88 -2.44 115.31 109.24 1rjd h LEU 204 Ca -0.14 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.84 1rjd h LEU 204 Cb 0.89 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1rjd h LEU 204 CO -0.09 0.04 0.09 0.00 0.09 0.00 0.00 178.44 178.58 1rjd n TYR 206 N -3.52 0.12 -4.11 0.00 4.02 -0.92 -3.50 117.16 109.26 1rjd n TYR 206 Ca -0.02 -0.06 -0.29 0.00 -0.01 0.00 0.00 57.90 57.52 1rjd n TYR 206 Cb 0.18 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.43 1rjd n TYR 206 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 1rjd s MET 207 N -1.88 2.65 0.68 -0.72 -1.94 -0.59 -4.80 119.30 112.70 1rjd s MET 207 Ca 0.35 -0.84 -0.14 0.00 -1.71 0.00 0.00 55.69 53.34 1rjd s MET 207 Cb 0.20 -2.57 0.01 0.00 2.01 0.00 0.00 34.83 34.47 1rjd s MET 207 CO 0.30 0.53 1.10 -1.01 -0.01 0.00 0.00 175.02 175.93 1rjd s HIS 208 N -1.44 2.66 0.27 -0.03 3.76 -1.26 -4.40 115.29 114.85 1rjd s HIS 208 Ca 0.27 1.54 -0.04 0.00 -0.15 0.00 0.00 55.06 56.68 1rjd s HIS 208 Cb -0.11 -3.12 0.33 0.00 1.11 0.00 0.00 32.58 30.78 1rjd s HIS 208 CO 0.20 -1.64 1.92 -0.97 -0.85 0.00 0.00 174.74 173.40 1rjd h ASN 209 N -0.19 1.05 -0.67 1.40 -0.73 -1.94 -1.25 115.58 113.25 1rjd h ASN 209 Ca -0.46 -0.05 0.03 0.00 1.87 0.00 0.00 56.30 57.69 1rjd h ASN 209 Cb 1.24 -0.26 -0.04 0.00 0.27 0.00 0.00 38.32 39.52 1rjd h ASN 209 CO 0.54 0.79 0.41 0.78 -0.37 0.00 0.00 177.43 179.58 1rjd h ASN 210 N 1.21 0.66 -0.19 1.15 -0.26 -1.99 0.06 115.58 116.22 1rjd h ASN 210 Ca 0.32 0.00 -0.11 0.00 -0.56 0.00 0.00 56.30 55.95 1rjd h ASN 210 Cb -0.07 -0.14 -0.00 0.00 -1.06 0.00 0.00 38.32 37.05 1rjd h ASN 210 CO -0.06 0.46 -0.32 -0.33 -1.06 0.00 0.00 177.43 176.11 1rjd h GLU 211 N 0.80 0.56 -0.58 0.81 3.07 -1.77 -1.58 114.58 115.88 1rjd h GLU 211 Ca 0.27 -0.34 -0.11 0.00 -0.50 0.00 0.00 59.36 58.68 1rjd h GLU 211 Cb 0.04 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 1rjd h GLU 211 CO -0.11 0.95 -0.05 0.66 -1.40 0.00 0.00 179.01 179.05 1rjd h SER 212 N 0.23 1.05 -0.31 1.42 4.64 -1.14 -2.22 113.55 117.23 1rjd h SER 212 Ca 0.01 -0.33 -0.17 0.00 -0.47 0.00 0.00 61.79 60.84 1rjd h SER 212 Cb 0.91 -0.29 -0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1rjd h SER 212 CO 0.07 1.13 -0.47 -0.61 -0.87 0.00 0.00 176.83 176.08 1rjd h GLN 213 N 0.96 0.89 -0.30 4.77 5.75 -0.85 -1.05 115.11 125.26 1rjd h GLN 213 Ca 0.16 -0.51 -0.07 0.00 -0.15 0.00 0.00 58.65 58.07 1rjd h GLN 213 Cb 0.62 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.20 1rjd h GLN 213 CO 0.04 1.16 -0.12 1.25 -2.65 0.00 0.00 178.83 178.51 1rjd h LEU 214 N 0.70 0.49 -0.27 -2.39 5.85 -1.28 -0.02 115.31 118.40 1rjd h LEU 214 Ca 0.04 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 1rjd h LEU 214 Cb 1.07 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 1rjd h LEU 214 CO 0.11 0.65 0.02 0.25 -0.34 0.00 0.00 178.44 179.13 1rjd h LEU 215 N 0.47 0.44 0.29 2.25 5.85 -1.02 -0.48 115.31 123.12 1rjd h LEU 215 Ca 0.09 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 1rjd h LEU 215 Cb 0.49 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.41 1rjd h LEU 215 CO 0.03 0.61 -0.14 0.40 -0.34 0.00 0.00 178.44 179.00 1rjd h ILE 216 N 0.25 0.74 -0.80 4.05 2.04 -1.00 -2.12 117.51 120.67 1rjd h ILE 216 Ca 0.08 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1rjd h ILE 216 Cb 0.37 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 1rjd h ILE 216 CO 0.01 0.05 0.49 0.78 0.00 0.00 0.00 178.15 179.48 1rjd h ASN 217 N -0.51 0.95 -0.21 1.72 2.35 -0.93 -1.31 115.58 117.64 1rjd h ASN 217 Ca -0.04 -0.05 -0.07 0.00 -0.55 0.00 0.00 56.30 55.58 1rjd h ASN 217 Cb 0.38 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.51 1rjd h ASN 217 CO 0.07 0.72 -0.15 0.74 -1.65 0.00 0.00 177.43 177.16 1rjd h THR 218 N 1.09 1.32 -0.27 2.81 2.02 -1.07 -2.07 112.91 116.74 1rjd h THR 218 Ca 0.29 -1.26 -0.17 0.00 0.77 0.00 0.00 66.41 66.03 1rjd h THR 218 Cb -0.06 1.69 -0.00 0.00 -1.74 0.00 0.00 68.15 68.04 1rjd h THR 218 CO -0.06 0.38 -0.52 0.40 0.37 0.00 0.00 175.52 176.10 1rjd h ILE 219 N 0.15 1.29 -0.30 3.11 2.04 -1.26 -1.67 117.51 120.86 1rjd h ILE 219 Ca 0.04 -1.72 -0.07 0.00 1.00 0.00 0.00 64.86 64.11 1rjd h ILE 219 Cb 0.67 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.36 1rjd h ILE 219 CO 0.04 0.55 -0.11 0.24 0.00 0.00 0.00 178.15 178.88 1rjd h MET 220 N 0.60 0.51 0.00 2.37 2.86 -1.26 -2.55 114.93 117.46 1rjd h MET 220 Ca 0.02 -0.14 -0.07 0.00 -2.06 0.00 0.00 59.70 57.44 1rjd h MET 220 Cb 1.10 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.70 1rjd h MET 220 CO 0.11 0.62 -0.35 0.77 1.06 0.00 0.00 176.91 179.11 1rjd h SER 221 N 0.47 0.00 1.39 1.22 0.02 -1.16 -3.29 113.55 112.20 1rjd h SER 221 Ca 0.09 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.92 1rjd h SER 221 Cb 0.47 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1rjd h SER 221 CO 0.03 0.35 -0.57 0.50 -1.14 0.00 0.00 176.83 176.01 1rjd h LYS 222 N 0.00 0.00 -5.72 3.45 3.64 -0.87 -3.45 116.57 113.62 1rjd h LYS 222 Ca -0.00 0.00 -0.67 0.00 -1.27 0.00 0.00 60.65 58.70 1rjd h LYS 222 Cb 0.72 0.00 -0.27 0.00 -0.41 0.00 0.00 32.23 32.27 1rjd h LYS 222 CO 0.05 0.57 -0.80 -0.06 -2.27 0.00 0.00 179.45 176.93 1rjd s PHE 223 N -2.96 2.69 0.21 1.91 0.08 -1.18 -4.52 117.98 114.21 1rjd s PHE 223 Ca 0.03 -0.56 -0.09 0.00 0.12 0.00 0.00 56.93 56.44 1rjd s PHE 223 Cb 0.08 -1.73 0.16 0.00 -0.57 0.00 0.00 43.02 40.96 1rjd s PHE 223 CO 0.75 -0.12 1.82 0.77 -0.10 0.00 0.00 175.22 178.35 1rjd h SER 224 N 6.21 0.99 -3.14 1.36 0.02 -1.67 -3.43 113.55 113.90 1rjd h SER 224 Ca -0.32 -0.11 -0.47 0.00 -0.84 0.00 0.00 61.79 60.06 1rjd h SER 224 Cb 1.19 -0.25 -0.40 0.00 0.14 0.00 0.00 62.40 63.07 1rjd h SER 224 CO 0.52 0.81 -0.75 -2.28 -1.14 0.00 0.00 176.83 173.99 1rjd s HIS 225 N -5.82 0.43 0.11 3.45 5.65 -1.26 -3.65 115.29 114.20 1rjd s HIS 225 Ca -0.13 -0.41 -0.05 0.00 0.25 0.00 0.00 55.06 54.72 1rjd s HIS 225 Cb 0.15 -0.77 -0.02 0.00 -1.18 0.00 0.00 32.58 30.76 1rjd s HIS 225 CO 0.81 -0.51 0.12 0.20 -0.65 0.00 0.00 174.74 174.71 1rjd s GLY 226 N 2.06 0.53 -0.05 1.59 0.00 -0.51 -1.48 107.32 109.45 1rjd s GLY 226 Ca 0.02 -1.07 -0.01 0.00 0.00 0.00 0.00 44.72 43.66 1rjd s GLY 226 CO -0.08 -1.10 0.00 -2.27 0.00 0.00 0.00 173.10 169.65 1rjd s LEU 227 N -2.95 0.79 -0.22 0.66 2.96 -0.38 -1.74 118.68 117.79 1rjd s LEU 227 Ca 0.14 -0.05 -0.06 0.00 -0.22 0.00 0.00 54.13 53.93 1rjd s LEU 227 Cb 0.06 -0.34 -0.03 0.00 0.50 0.00 0.00 46.19 46.39 1rjd s LEU 227 CO -0.04 -0.16 0.04 0.86 -1.32 0.00 0.00 176.35 175.73 1rjd s TRP 228 N 1.58 3.08 -0.27 5.38 -0.11 0.54 -0.42 118.94 128.71 1rjd s TRP 228 Ca -0.02 -0.38 -0.05 0.00 1.22 0.00 0.00 56.10 56.87 1rjd s TRP 228 Cb -0.13 -2.15 0.01 0.00 -1.50 0.00 0.00 33.47 29.70 1rjd s TRP 228 CO -0.03 -0.25 0.02 0.42 -4.62 0.00 0.00 176.95 172.49 1rjd s ILE 229 N 1.21 3.60 -0.01 5.86 1.01 0.99 -1.49 121.20 132.38 1rjd s ILE 229 Ca 0.04 -0.74 0.08 0.00 0.00 0.00 0.00 60.65 60.03 1rjd s ILE 229 Cb -0.14 -2.81 -0.02 0.00 0.01 0.00 0.00 42.46 39.49 1rjd s ILE 229 CO 0.02 0.17 -0.24 -0.55 0.00 0.00 0.00 174.94 174.34 1rjd s SER 230 N 1.45 2.85 -0.02 3.58 0.15 -0.24 -1.26 113.70 120.21 1rjd s SER 230 Ca 0.02 -0.46 0.02 0.00 0.70 0.00 0.00 55.95 56.24 1rjd s SER 230 Cb -0.17 -0.31 0.00 0.00 -1.71 0.00 0.00 66.02 63.84 1rjd s SER 230 CO -0.00 0.28 -0.08 -0.47 1.20 0.00 0.00 173.24 174.17 1rjd s TYR 231 N -0.61 0.82 0.04 3.44 5.04 -0.51 -0.67 117.35 124.90 1rjd s TYR 231 Ca 0.09 -0.18 -0.28 0.00 -2.44 0.00 0.00 57.07 54.26 1rjd s TYR 231 Cb -0.09 -0.58 0.09 0.00 0.35 0.00 0.00 41.96 41.73 1rjd s TYR 231 CO -0.00 -0.07 0.99 -0.51 -1.34 0.00 0.00 175.55 174.62 1rjd s ASP 232 N 0.08 -0.23 0.58 4.32 1.01 -1.11 -0.94 116.67 120.38 1rjd s ASP 232 Ca -0.01 -0.18 -0.08 0.00 0.71 0.00 0.00 52.55 52.99 1rjd s ASP 232 Cb -0.07 0.38 -0.02 0.00 1.01 0.00 0.00 42.92 44.23 1rjd s ASP 232 CO 0.00 -0.66 0.93 -2.16 0.21 0.00 0.00 175.17 173.49 1rjd s PRO 233 N -3.04 3.27 0.07 8.23 0.04 -1.26 -1.60 135.00 140.71 1rjd s PRO 233 Ca 0.09 0.32 0.06 0.00 0.04 0.00 0.00 61.00 61.52 1rjd s PRO 233 Cb -0.00 -2.21 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 1rjd s PRO 233 CO -0.03 -0.57 -0.17 0.96 0.04 0.00 0.00 177.00 177.22 1rjd s ILE 234 N -3.02 1.40 0.41 0.56 -4.36 0.56 -4.87 121.20 111.88 1rjd s ILE 234 Ca 0.53 -1.33 0.09 0.00 -0.26 0.00 0.00 60.65 59.67 1rjd s ILE 234 Cb -0.11 -1.29 0.22 0.00 1.25 0.00 0.00 42.46 42.54 1rjd s ILE 234 CO 0.48 -0.08 2.01 1.23 0.24 0.00 0.00 174.94 178.83 1rjd h GLY 235 N 4.38 0.41 0.00 6.27 0.00 -1.31 -3.44 103.07 109.38 1rjd h GLY 235 Ca -0.43 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1rjd h GLY 235 CO 0.41 0.18 0.00 0.61 0.00 0.00 0.00 176.54 177.74 1rjd n GLY 236 N -1.24 2.40 0.06 4.60 0.00 -0.41 -1.65 105.19 108.93 1rjd n GLY 236 Ca 0.01 -1.55 -0.07 0.00 0.00 0.00 0.00 46.02 44.41 1rjd n GLY 236 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1rjd n SER 237 N 0.00 2.94 -4.50 1.61 3.41 -1.13 -4.81 113.62 111.14 1rjd n SER 237 Ca 0.00 -0.05 -0.39 0.00 -0.26 0.00 0.00 58.87 58.17 1rjd n SER 237 Cb 0.00 0.09 0.03 0.00 -0.26 0.00 0.00 64.21 64.07 1rjd n SER 237 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rjd n GLN 238 N -2.70 0.69 -1.84 4.33 1.13 -1.26 -4.90 117.38 112.83 1rjd n GLN 238 Ca -0.20 0.26 -0.34 0.00 -1.94 0.00 0.00 57.00 54.79 1rjd n GLN 238 Cb 0.75 -1.75 0.04 0.00 0.11 0.00 0.00 30.24 29.39 1rjd n GLN 238 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 1rjd s PRO 239 N -2.02 2.87 -1.43 -1.09 0.02 -1.26 -3.19 135.00 128.90 1rjd s PRO 239 Ca 0.67 1.47 0.00 0.00 0.02 0.00 0.00 61.00 63.16 1rjd s PRO 239 Cb -0.50 -1.95 0.00 0.00 0.02 0.00 0.00 34.50 32.07 1rjd s PRO 239 CO 0.55 -1.21 0.00 -1.71 -0.33 0.00 0.00 177.00 174.30 1rjd n ASN 240 N -2.19 -4.89 -4.31 2.53 5.15 -1.26 -4.96 115.26 105.32 1rjd n ASN 240 Ca 0.11 0.01 -0.41 0.00 -0.60 0.00 0.00 54.58 53.70 1rjd n ASN 240 Cb 0.52 -3.99 -0.10 0.00 -0.53 0.00 0.00 39.78 35.68 1rjd n ASN 240 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1rjd s ASP 241 N -2.29 5.69 0.00 1.20 2.15 -1.19 -4.95 116.67 117.28 1rjd s ASP 241 Ca 0.00 -1.30 0.28 0.00 0.43 0.00 0.00 52.55 51.96 1rjd s ASP 241 Cb 0.00 -2.01 1.02 0.00 -0.30 0.00 0.00 42.92 41.63 1rjd s ASP 241 CO 0.00 -0.48 1.72 0.54 -0.17 0.00 0.00 175.17 176.78 1rjd n ARG 242 N 4.96 1.42 -0.16 4.34 1.74 -1.26 -4.56 116.66 123.14 1rjd n ARG 242 Ca -0.11 -0.80 -0.05 0.00 -0.77 0.00 0.00 57.85 56.12 1rjd n ARG 242 Cb 0.44 -1.48 0.02 0.00 -1.02 0.00 0.00 32.46 30.41 1rjd n ARG 242 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1rjd h PHE 243 N 1.96 -0.68 0.08 -1.55 3.57 -1.93 0.18 116.94 118.57 1rjd h PHE 243 Ca 0.00 0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.55 1rjd h PHE 243 Cb 0.48 0.38 0.00 0.00 2.79 0.00 0.00 35.95 39.60 1rjd h PHE 243 CO 0.00 -0.34 -0.04 0.78 -2.23 0.00 0.00 178.31 176.48 1rjd h GLY 244 N -0.14 -0.12 0.37 2.40 0.00 -1.56 -0.21 103.07 103.82 1rjd h GLY 244 Ca 0.23 0.04 0.10 0.00 0.00 0.00 0.00 47.33 47.70 1rjd h GLY 244 CO -0.60 -0.04 0.25 0.00 0.00 0.00 0.00 176.54 176.15 1rjd h ALA 245 N 0.51 0.84 -0.33 3.60 0.00 -1.75 -0.32 119.26 121.81 1rjd h ALA 245 Ca -0.01 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1rjd h ALA 245 Cb 0.32 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1rjd h ALA 245 CO 0.02 -0.17 0.00 0.82 0.00 0.00 0.00 179.25 179.92 1rjd h ILE 246 N 0.44 1.26 -0.51 0.00 2.04 -0.47 -1.93 117.51 118.33 1rjd h ILE 246 Ca 0.32 -0.96 -0.02 0.00 1.00 0.00 0.00 64.86 65.21 1rjd h ILE 246 Cb 0.40 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1rjd h ILE 246 CO -0.31 0.31 0.26 -0.03 0.00 0.00 0.00 178.15 178.38 1rjd h MET 247 N 0.38 0.73 -0.18 2.37 4.05 -0.54 0.24 114.93 121.99 1rjd h MET 247 Ca 0.09 -0.10 -0.01 0.00 -0.28 0.00 0.00 59.70 59.40 1rjd h MET 247 Cb 0.45 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.10 1rjd h MET 247 CO 0.02 0.59 0.07 1.96 0.23 0.00 0.00 176.91 179.78 1rjd h GLN 248 N 0.68 0.27 -0.49 0.39 4.20 -0.99 0.01 115.11 119.18 1rjd h GLN 248 Ca 0.18 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 1rjd h GLN 248 Cb 0.09 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 1rjd h GLN 248 CO -0.02 0.34 0.28 1.03 -0.67 0.00 0.00 178.83 179.79 1rjd h SER 249 N 0.14 0.61 -0.49 1.46 0.87 -1.19 -1.37 113.55 113.57 1rjd h SER 249 Ca 0.06 -0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 1rjd h SER 249 Cb 0.17 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 61.95 1rjd h SER 249 CO -0.00 0.51 0.25 0.78 -0.53 0.00 0.00 176.83 177.83 1rjd h ASN 250 N 0.66 0.66 0.61 6.23 2.35 -0.31 -1.63 115.58 124.13 1rjd h ASN 250 Ca 0.18 -0.06 -0.22 0.00 -0.55 0.00 0.00 56.30 55.64 1rjd h ASN 250 Cb 0.02 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 1rjd h ASN 250 CO -0.03 0.56 -1.00 -0.07 -1.65 0.00 0.00 177.43 175.24 1rjd h LEU 251 N 0.73 0.31 0.03 1.61 3.38 -0.64 -2.28 115.31 118.47 1rjd h LEU 251 Ca 0.18 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1rjd h LEU 251 Cb 0.08 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1rjd h LEU 251 CO -0.03 1.13 -0.02 0.50 0.09 0.00 0.00 178.44 180.12 1rjd h LYS 252 N 0.10 -0.04 0.47 1.13 1.63 -1.11 -1.22 116.57 117.53 1rjd h LYS 252 Ca -0.07 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.72 1rjd h LYS 252 Cb 1.67 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 33.29 1rjd h LYS 252 CO 0.16 0.64 -0.40 1.49 -3.45 0.00 0.00 179.45 177.88 1rjd h GLU 253 N -0.86 -0.84 -0.28 1.90 4.81 -1.44 -0.74 114.58 117.13 1rjd h GLU 253 Ca -0.00 0.06 -0.16 0.00 -0.13 0.00 0.00 59.36 59.13 1rjd h GLU 253 Cb 0.70 0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.27 1rjd h GLU 253 CO 0.01 -0.56 -0.43 0.66 -0.73 0.00 0.00 179.01 177.95 1rjd h SER 254 N -0.87 0.87 0.00 1.04 4.64 -1.55 -3.39 113.55 114.29 1rjd h SER 254 Ca -0.05 -0.52 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 1rjd h SER 254 Cb 0.75 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1rjd h SER 254 CO -0.03 1.22 0.00 0.54 -0.87 0.00 0.00 176.83 177.69 1rjd n ARG 255 N -4.13 -0.24 -3.81 4.77 5.12 -0.81 -5.02 116.66 112.54 1rjd n ARG 255 Ca -0.04 -0.29 -0.27 0.00 -1.93 0.00 0.00 57.85 55.32 1rjd n ARG 255 Cb 0.56 -0.71 0.04 0.00 -1.16 0.00 0.00 32.46 31.19 1rjd n ARG 255 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1rjd n ASN 256 N -0.02 -4.24 -4.46 0.55 4.05 -0.29 -4.95 115.26 105.90 1rjd n ASN 256 Ca 0.00 -0.74 -0.31 0.00 0.45 0.00 0.00 54.58 53.98 1rjd n ASN 256 Cb 0.17 -4.15 -0.13 0.00 1.23 0.00 0.00 39.78 36.91 1rjd n ASN 256 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 177.26 173.99 1rjd s LEU 257 N -7.14 2.64 0.05 1.20 2.96 -0.53 -4.94 118.68 112.92 1rjd s LEU 257 Ca 0.50 -0.41 0.08 0.00 -0.22 0.00 0.00 54.13 54.08 1rjd s LEU 257 Cb -0.24 -1.54 -0.03 0.00 0.50 0.00 0.00 46.19 44.88 1rjd s LEU 257 CO 0.81 0.26 -0.23 -1.61 -1.32 0.00 0.00 176.35 174.26 1rjd s GLU 258 N -1.44 1.50 -0.54 1.98 2.02 -1.26 -3.14 118.70 117.83 1rjd s GLU 258 Ca 0.15 -1.02 0.04 0.00 0.02 0.00 0.00 54.97 54.16 1rjd s GLU 258 Cb -0.11 -1.66 0.14 0.00 0.10 0.00 0.00 34.13 32.61 1rjd s GLU 258 CO 0.05 0.42 0.30 -1.64 0.02 0.00 0.00 175.26 174.41 1rjd s MET 259 N -1.26 1.96 0.45 1.61 -1.94 -1.26 -4.59 119.30 114.27 1rjd s MET 259 Ca 0.09 -2.67 0.15 0.00 -1.71 0.00 0.00 55.69 51.56 1rjd s MET 259 Cb -0.09 -3.19 1.02 0.00 2.01 0.00 0.00 34.83 34.58 1rjd s MET 259 CO 0.02 -1.15 1.99 -1.35 -0.01 0.00 0.00 175.02 174.52 1rjd h PRO 260 N 6.33 0.00 -0.32 2.03 0.11 -1.77 -3.08 132.00 135.30 1rjd h PRO 260 Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1rjd h PRO 260 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1rjd h PRO 260 CO 0.67 0.19 0.00 0.25 -0.21 0.00 0.00 178.00 178.90 1rjd n THR 261 N -4.24 1.78 -0.17 -1.15 -2.24 -1.26 -4.70 114.28 102.30 1rjd n THR 261 Ca -0.02 -1.50 0.00 0.00 -2.27 0.00 0.00 64.05 60.26 1rjd n THR 261 Cb 0.26 0.05 0.26 0.00 -2.10 0.00 0.00 70.33 68.80 1rjd n THR 261 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1rjd h LEU 262 N 2.04 0.78 0.00 3.22 5.85 -1.85 -0.11 115.31 125.25 1rjd h LEU 262 Ca 0.00 -0.04 -0.26 0.00 0.84 0.00 0.00 57.88 58.42 1rjd h LEU 262 Cb 1.18 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 1rjd h LEU 262 CO 0.14 0.61 -1.51 0.24 -0.34 0.00 0.00 178.44 177.58 1rjd h MET 263 N 0.90 0.00 0.08 1.25 2.86 -1.84 -0.99 114.93 117.20 1rjd h MET 263 Ca 0.24 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.87 1rjd h MET 263 Cb -0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.64 1rjd h MET 263 CO -0.04 0.56 -0.04 1.15 1.06 0.00 0.00 176.91 179.60 1rjd h THR 264 N 0.00 0.92 -3.05 2.22 2.02 -1.76 -3.26 112.91 110.00 1rjd h THR 264 Ca -0.21 -0.00 -0.77 0.00 0.77 0.00 0.00 66.41 66.20 1rjd h THR 264 Cb 1.91 0.92 -0.31 0.00 -1.74 0.00 0.00 68.15 68.93 1rjd h THR 264 CO 0.08 0.00 0.43 -1.22 0.37 0.00 0.00 175.52 175.18 1rjd n TYR 265 N -5.14 3.44 1.12 3.16 4.02 -0.09 -4.81 117.16 118.87 1rjd n TYR 265 Ca -0.08 -3.30 0.12 0.00 -0.01 0.00 0.00 57.90 54.63 1rjd n TYR 265 Cb 0.07 -1.27 0.18 0.00 -0.02 0.00 0.00 39.34 38.30 1rjd n TYR 265 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 1rjd n ASN 266 N 1.73 1.75 -4.36 7.72 6.94 -1.23 -4.00 115.26 123.80 1rjd n ASN 266 Ca 0.25 -1.35 -0.19 0.00 -0.02 0.00 0.00 54.58 53.27 1rjd n ASN 266 Cb 0.36 0.28 -0.10 0.00 -2.36 0.00 0.00 39.78 37.96 1rjd n ASN 266 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1rjd s SER 267 N -2.40 2.59 0.42 0.53 1.04 -1.26 -1.29 113.70 113.33 1rjd s SER 267 Ca 0.23 -1.05 0.12 0.00 0.48 0.00 0.00 55.95 55.73 1rjd s SER 267 Cb 0.19 -0.14 0.92 0.00 0.10 0.00 0.00 66.02 67.09 1rjd s SER 267 CO 0.51 -0.21 1.97 0.07 0.98 0.00 0.00 173.24 176.56 1rjd h LYS 268 N 2.51 0.10 -0.10 4.02 2.10 -1.95 -1.50 116.57 121.75 1rjd h LYS 268 Ca -0.38 -0.02 -0.03 0.00 -2.00 0.00 0.00 60.65 58.21 1rjd h LYS 268 Cb 1.22 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.54 1rjd h LYS 268 CO 0.63 0.26 -0.06 0.93 -2.00 0.00 0.00 179.45 179.21 1rjd h GLU 269 N 0.10 0.22 -0.45 0.07 3.07 -1.96 -1.53 114.58 114.10 1rjd h GLU 269 Ca 0.02 -0.10 0.01 0.00 -0.50 0.00 0.00 59.36 58.79 1rjd h GLU 269 Cb 0.33 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.22 1rjd h GLU 269 CO 0.02 0.59 0.30 0.87 -1.40 0.00 0.00 179.01 179.39 1rjd h LYS 270 N -0.16 0.59 -0.41 2.33 1.57 -1.91 -2.22 116.57 116.37 1rjd h LYS 270 Ca 0.02 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.80 1rjd h LYS 270 Cb 0.53 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.67 1rjd h LYS 270 CO 0.02 0.39 0.18 -0.92 -0.57 0.00 0.00 179.45 178.55 1rjd h TYR 271 N 0.60 0.33 0.00 -1.35 3.20 -1.19 -2.42 116.97 116.15 1rjd h TYR 271 Ca 0.17 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.01 1rjd h TYR 271 Cb -0.07 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 1rjd h TYR 271 CO -0.05 0.16 -0.20 0.00 -1.64 0.00 0.00 178.16 176.43 1rjd h ALA 272 N 1.23 1.16 0.00 1.82 0.00 -1.01 -2.76 119.26 119.70 1rjd h ALA 272 Ca 0.18 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1rjd h ALA 272 Cb 0.12 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1rjd h ALA 272 CO -0.15 0.26 -0.01 0.66 0.00 0.00 0.00 179.25 180.01 1rjd h SER 273 N 0.00 0.00 0.21 0.00 4.64 -0.87 -1.42 113.55 116.10 1rjd h SER 273 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1rjd h SER 273 Cb 0.57 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1rjd h SER 273 CO 0.03 0.01 -0.08 0.03 -0.87 0.00 0.00 176.83 175.94 1rjd h ARG 274 N 0.00 0.00 -0.72 4.77 3.08 -1.60 -1.77 114.38 118.15 1rjd h ARG 274 Ca -0.00 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.74 1rjd h ARG 274 Cb 0.04 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 29.91 1rjd h ARG 274 CO 0.00 0.08 0.32 0.91 -1.07 0.00 0.00 179.97 180.21 1rjd n TRP 275 N -3.80 2.28 0.31 3.04 8.01 -0.53 -4.72 117.44 122.03 1rjd n TRP 275 Ca -0.02 -1.52 0.13 0.00 -1.31 0.00 0.00 57.50 54.77 1rjd n TRP 275 Cb 0.18 -0.72 0.57 0.00 -2.01 0.00 0.00 31.31 29.33 1rjd n TRP 275 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1rjd h SER 276 N 1.58 0.00 0.97 -0.99 4.64 -1.42 -1.23 113.55 117.10 1rjd h SER 276 Ca 0.38 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1rjd h SER 276 Cb 2.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 64.42 1rjd h SER 276 CO 0.77 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 176.72 1rjd h ALA 277 N 2.15 1.00 -2.73 5.18 0.00 -1.85 -3.42 119.26 119.59 1rjd h ALA 277 Ca 0.00 -0.01 -0.50 0.00 0.00 0.00 0.00 54.91 54.40 1rjd h ALA 277 Cb 0.26 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1rjd h ALA 277 CO 0.00 0.01 0.38 0.00 0.00 0.00 0.00 179.25 179.64 1rjd s ALA 278 N -3.69 3.34 -0.02 0.00 0.00 -0.46 -4.99 121.76 115.94 1rjd s ALA 278 Ca 0.01 0.67 0.19 0.00 0.00 0.00 0.00 51.96 52.83 1rjd s ALA 278 Cb 0.09 -3.25 0.47 0.00 0.00 0.00 0.00 23.12 20.44 1rjd s ALA 278 CO 0.54 0.09 1.63 -1.00 0.00 0.00 0.00 175.76 177.03 1rjd h PRO 279 N 4.35 0.00 -4.50 0.00 0.13 -1.83 -3.42 132.00 126.74 1rjd h PRO 279 Ca -0.45 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.03 1rjd h PRO 279 Cb 1.20 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.93 1rjd h PRO 279 CO 0.69 0.36 -0.71 1.21 -0.23 0.00 0.00 178.00 179.32 1rjd s ASN 280 N -6.35 4.69 -0.10 1.44 2.47 -1.16 -5.05 114.94 110.88 1rjd s ASN 280 Ca 0.02 -2.25 0.02 0.00 0.42 0.00 0.00 52.86 51.07 1rjd s ASN 280 Cb 0.09 -1.61 0.02 0.00 -1.45 0.00 0.00 41.25 38.30 1rjd s ASN 280 CO 0.69 -0.36 -0.13 -0.69 -3.72 0.00 0.00 177.10 172.89 1rjd s VAL 281 N 0.78 1.33 -0.03 -5.21 1.01 -1.26 -0.34 120.40 116.68 1rjd s VAL 281 Ca 0.12 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 61.60 1rjd s VAL 281 Cb -0.20 -1.23 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1rjd s VAL 281 CO -0.07 0.41 -0.20 -0.63 0.00 0.00 0.00 175.10 174.60 1rjd s ILE 282 N 0.96 1.64 -0.01 2.22 1.01 0.27 -5.00 121.20 122.29 1rjd s ILE 282 Ca -0.08 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 59.70 1rjd s ILE 282 Cb -0.15 -1.38 0.01 0.00 0.01 0.00 0.00 42.46 40.95 1rjd s ILE 282 CO -0.01 0.46 0.03 0.54 0.00 0.00 0.00 174.94 175.97 1rjd s VAL 283 N -0.25 -0.01 0.04 2.92 0.11 -1.26 -0.25 120.40 121.70 1rjd s VAL 283 Ca 0.02 0.04 0.01 0.00 -2.93 0.00 0.00 61.98 59.13 1rjd s VAL 283 Cb -0.10 -0.06 -0.03 0.00 -1.53 0.00 0.00 36.38 34.66 1rjd s VAL 283 CO 0.01 0.02 -0.06 0.20 -3.33 0.00 0.00 175.10 171.94 1rjd s ASN 284 N 0.24 0.67 0.67 3.54 0.01 -0.78 -5.01 114.94 114.29 1rjd s ASN 284 Ca -0.02 -0.60 -0.07 0.00 -0.71 0.00 0.00 52.86 51.46 1rjd s ASN 284 Cb -0.03 0.07 0.04 0.00 0.41 0.00 0.00 41.25 41.74 1rjd s ASN 284 CO -0.01 -0.28 0.99 1.51 -1.51 0.00 0.00 177.10 177.80 1rjd s ASP 285 N -1.75 5.09 0.36 -1.22 3.84 -1.26 -0.83 116.67 120.90 1rjd s ASP 285 Ca -0.09 0.59 0.25 0.00 -0.00 0.00 0.00 52.55 53.29 1rjd s ASP 285 Cb -0.08 -1.35 0.56 0.00 -1.38 0.00 0.00 42.92 40.68 1rjd s ASP 285 CO -0.01 -1.42 1.69 0.24 -0.00 0.00 0.00 175.17 175.66 1rjd h MET 286 N -0.48 0.00 -0.38 2.11 2.86 -0.41 -2.29 114.93 116.34 1rjd h MET 286 Ca -0.45 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.09 1rjd h MET 286 Cb 1.29 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.94 1rjd h MET 286 CO 0.61 0.00 -0.16 2.35 1.06 0.00 0.00 176.91 180.77 1rjd h TRP 287 N 0.00 0.88 -0.74 -0.22 2.91 -1.84 -0.35 115.95 116.58 1rjd h TRP 287 Ca 0.00 -0.21 0.02 0.00 1.13 0.00 0.00 58.89 59.83 1rjd h TRP 287 Cb 0.87 -0.21 -0.04 0.00 -0.51 0.00 0.00 29.16 29.27 1rjd h TRP 287 CO 0.00 0.94 0.48 0.93 -1.03 0.00 0.00 178.44 179.76 1rjd h GLU 288 N 0.57 0.94 -0.67 2.65 5.08 -1.81 -1.12 114.58 120.22 1rjd h GLU 288 Ca 0.09 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1rjd h GLU 288 Cb 0.70 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1rjd h GLU 288 CO 0.05 0.62 0.41 0.82 -1.00 0.00 0.00 179.01 179.91 1rjd h ILE 289 N 0.96 1.19 -0.89 3.13 2.04 -1.27 -1.25 117.51 121.42 1rjd h ILE 289 Ca 0.29 -0.41 0.01 0.00 1.00 0.00 0.00 64.86 65.74 1rjd h ILE 289 Cb -0.05 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 36.24 1rjd h ILE 289 CO -0.08 0.20 0.59 0.15 0.00 0.00 0.00 178.15 179.00 1rjd h PHE 290 N 0.91 1.12 0.00 1.37 3.57 -0.35 0.05 116.94 123.61 1rjd h PHE 290 Ca 0.24 0.02 -0.20 0.00 3.53 0.00 0.00 57.97 61.57 1rjd h PHE 290 Cb -0.04 -0.38 -0.03 0.00 2.79 0.00 0.00 35.95 38.29 1rjd h PHE 290 CO -0.02 0.71 -1.08 -0.91 -2.23 0.00 0.00 178.31 174.79 1rjd h ASN 291 N 1.21 0.00 0.00 0.41 2.35 -1.03 -3.32 115.58 115.19 1rjd h ASN 291 Ca 0.33 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 56.04 1rjd h ASN 291 Cb -0.13 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 1rjd h ASN 291 CO -0.07 0.84 -1.47 0.00 -1.65 0.00 0.00 177.43 175.09 1rjd n ALA 292 N -2.37 2.22 0.03 -0.83 0.00 -0.49 -4.74 120.51 114.33 1rjd n ALA 292 Ca -0.04 -0.30 0.04 0.00 0.00 0.00 0.00 53.44 53.13 1rjd n ALA 292 Cb 0.91 -0.23 -0.05 0.00 0.00 0.00 0.00 19.45 20.07 1rjd n ALA 292 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1rjd n GLN 293 N -1.94 0.66 -3.03 0.00 6.02 -0.01 -4.94 117.38 114.14 1rjd n GLN 293 Ca -0.05 -0.06 -0.40 0.00 -0.01 0.00 0.00 57.00 56.48 1rjd n GLN 293 Cb 0.37 -1.14 -0.05 0.00 1.02 0.00 0.00 30.24 30.44 1rjd n GLN 293 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1rjd s ILE 294 N -2.42 4.99 0.68 5.09 -1.09 -1.14 -5.04 121.20 122.26 1rjd s ILE 294 Ca -0.02 1.39 -0.15 0.00 -2.23 0.00 0.00 60.65 59.64 1rjd s ILE 294 Cb 0.05 -4.03 0.01 0.00 -1.58 0.00 0.00 42.46 36.91 1rjd s ILE 294 CO 0.30 0.13 1.14 -2.84 -1.23 0.00 0.00 174.94 172.43 1rjd s PRO 295 N 1.64 2.60 0.39 2.79 0.02 -1.26 -4.87 135.00 136.32 1rjd s PRO 295 Ca 0.34 1.49 0.11 0.00 0.02 0.00 0.00 61.00 62.97 1rjd s PRO 295 Cb -0.17 -1.92 0.91 0.00 0.02 0.00 0.00 34.50 33.35 1rjd s PRO 295 CO 0.13 -1.42 1.91 1.49 -0.33 0.00 0.00 177.00 178.78 1rjd h GLU 296 N -0.07 0.55 -0.90 5.54 4.57 -1.97 -0.85 114.58 121.46 1rjd h GLU 296 Ca -0.47 -0.03 0.08 0.00 -1.18 0.00 0.00 59.36 57.76 1rjd h GLU 296 Cb 1.26 -0.13 -0.06 0.00 -0.16 0.00 0.00 28.75 29.66 1rjd h GLU 296 CO 0.53 0.37 0.58 0.66 -1.18 0.00 0.00 179.01 179.96 1rjd h SER 297 N 0.57 0.84 -0.21 1.04 4.64 -2.00 -1.46 113.55 116.98 1rjd h SER 297 Ca 0.38 0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 61.60 1rjd h SER 297 Cb 0.68 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1rjd h SER 297 CO -0.14 0.51 -0.34 -0.33 -0.87 0.00 0.00 176.83 175.66 1rjd h GLU 298 N 0.94 0.60 -1.00 4.77 4.39 -1.53 -1.96 114.58 120.78 1rjd h GLU 298 Ca 0.40 -0.37 0.04 0.00 0.34 0.00 0.00 59.36 59.78 1rjd h GLU 298 Cb 0.32 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 28.95 1rjd h GLU 298 CO -0.17 0.98 0.66 0.00 -1.16 0.00 0.00 179.01 179.32 1rjd h ARG 299 N 0.28 1.21 -0.47 2.33 3.08 -1.09 -0.83 114.38 118.89 1rjd h ARG 299 Ca 0.02 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 1rjd h ARG 299 Cb 0.93 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 1rjd h ARG 299 CO 0.08 0.80 0.08 -0.22 -1.07 0.00 0.00 179.97 179.64 1rjd h LYS 300 N 1.25 0.77 -0.19 0.04 3.64 -1.29 -1.91 116.57 118.87 1rjd h LYS 300 Ca 0.41 -0.20 0.02 0.00 -1.27 0.00 0.00 60.65 59.61 1rjd h LYS 300 Cb 0.05 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 1rjd h LYS 300 CO -0.14 0.78 0.05 -0.09 -2.27 0.00 0.00 179.45 177.78 1rjd h ARG 301 N 0.64 0.13 -0.50 1.90 2.43 -0.74 -2.45 114.38 115.79 1rjd h ARG 301 Ca 0.14 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.26 1rjd h ARG 301 Cb 0.38 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 1rjd h ARG 301 CO 0.01 0.08 0.14 -0.07 -1.51 0.00 0.00 179.97 178.62 1rjd h LEU 302 N 0.13 0.69 -2.25 3.80 3.38 -1.09 -1.08 115.31 118.90 1rjd h LEU 302 Ca 0.08 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1rjd h LEU 302 Cb 0.07 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1rjd h LEU 302 CO -0.10 0.67 -0.05 0.03 0.09 0.00 0.00 178.44 179.08 1rjd h ARG 303 N 0.73 0.00 0.00 1.13 3.08 -0.92 -1.85 114.38 116.54 1rjd h ARG 303 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1rjd h ARG 303 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1rjd h ARG 303 CO -0.01 0.05 0.00 0.66 -1.07 0.00 0.00 179.97 179.60 1rjd h SER 304 N 0.00 0.00 0.04 7.04 4.64 -0.74 -3.37 113.55 121.16 1rjd h SER 304 Ca -0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 1rjd h SER 304 Cb 0.14 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.20 1rjd h SER 304 CO 0.01 0.00 -1.40 -0.07 -0.87 0.00 0.00 176.83 174.49 1rjd h LEU 305 N 0.00 0.13 -8.00 5.97 3.38 -1.34 -3.49 115.31 111.95 1rjd h LEU 305 Ca 0.00 -0.66 -0.10 0.00 0.09 0.00 0.00 57.88 57.21 1rjd h LEU 305 Cb 0.58 -0.04 -0.13 0.00 0.09 0.00 0.00 40.66 41.16 1rjd h LEU 305 CO 0.00 1.57 -0.34 -1.10 0.09 0.00 0.00 178.44 178.66 1rjd s GLN 306 N -2.41 1.05 -0.26 1.13 -0.21 -1.24 -5.09 119.66 112.64 1rjd s GLN 306 Ca -0.26 -1.11 -0.27 0.00 0.02 0.00 0.00 55.36 53.74 1rjd s GLN 306 Cb 0.06 0.36 0.00 0.00 1.00 0.00 0.00 33.01 34.43 1rjd s GLN 306 CO 0.65 -0.37 0.94 -0.06 -2.12 0.00 0.00 175.29 174.33 1rjd s PHE 307 N -3.94 3.29 -0.88 0.91 0.40 -1.26 -4.69 117.98 111.81 1rjd s PHE 307 Ca 0.14 1.24 -0.14 0.00 -0.60 0.00 0.00 56.93 57.57 1rjd s PHE 307 Cb 0.04 -3.24 0.22 0.00 0.51 0.00 0.00 43.02 40.54 1rjd s PHE 307 CO -0.03 -0.50 0.85 -1.17 0.70 0.00 0.00 175.22 175.07 1rjd s LEU 308 N 3.11 6.55 0.44 -0.37 2.96 -1.26 -4.78 118.68 125.33 1rjd s LEU 308 Ca 0.40 -2.77 0.29 0.00 -0.22 0.00 0.00 54.13 51.83 1rjd s LEU 308 Cb -0.15 -2.23 1.08 0.00 0.50 0.00 0.00 46.19 45.39 1rjd s LEU 308 CO 0.08 -0.58 1.85 0.44 -1.32 0.00 0.00 176.35 176.83 1rjd h ASP 309 N 7.71 0.00 -2.37 3.68 3.32 -2.01 -3.39 116.42 123.35 1rjd h ASP 309 Ca 0.13 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.59 1rjd h ASP 309 Cb 1.02 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.16 1rjd h ASP 309 CO 0.82 0.00 -0.84 -0.62 -1.72 0.00 0.00 179.24 176.88 1rjd n GLU 310 N -2.83 1.24 -0.21 3.56 -0.58 -1.26 -4.95 120.64 115.60 1rjd n GLU 310 Ca 0.02 -3.82 -0.07 0.00 -0.42 0.00 0.00 57.16 52.87 1rjd n GLU 310 Cb 0.33 -1.81 0.03 0.00 -0.57 0.00 0.00 31.44 29.43 1rjd n GLU 310 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1rjd h LEU 311 N 4.76 0.78 -0.91 -4.62 5.85 -2.01 -2.18 115.31 116.99 1rjd h LEU 311 Ca 0.17 -0.12 0.12 0.00 0.84 0.00 0.00 57.88 58.89 1rjd h LEU 311 Cb 0.81 -0.20 -0.08 0.00 0.37 0.00 0.00 40.66 41.56 1rjd h LEU 311 CO 0.58 0.68 0.53 -0.08 -0.34 0.00 0.00 178.44 179.81 1rjd h GLU 312 N 0.82 0.81 -0.54 1.25 4.57 -1.98 -0.21 114.58 119.30 1rjd h GLU 312 Ca 0.21 -0.05 -0.05 0.00 -1.18 0.00 0.00 59.36 58.29 1rjd h GLU 312 Cb 0.10 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.48 1rjd h GLU 312 CO -0.03 0.53 0.15 0.93 -1.18 0.00 0.00 179.01 179.41 1rjd h GLU 313 N 0.83 0.81 -0.05 1.92 5.08 -1.83 0.63 114.58 121.97 1rjd h GLU 313 Ca 0.46 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.67 1rjd h GLU 313 Cb 0.50 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1rjd h GLU 313 CO -0.29 0.72 0.01 1.25 -1.00 0.00 0.00 179.01 179.70 1rjd h LEU 314 N 0.79 0.01 -0.24 1.33 5.85 -0.73 -2.22 115.31 120.09 1rjd h LEU 314 Ca 0.18 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.95 1rjd h LEU 314 Cb 0.26 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 1rjd h LEU 314 CO -0.01 0.01 -0.06 0.50 -0.34 0.00 0.00 178.44 178.54 1rjd h LYS 315 N 0.03 -0.01 -0.60 1.25 3.64 -0.36 -0.03 116.57 120.50 1rjd h LYS 315 Ca 0.02 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.44 1rjd h LYS 315 Cb 0.01 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.80 1rjd h LYS 315 CO -0.03 -0.00 0.39 0.28 -2.27 0.00 0.00 179.45 177.82 1rjd h VAL 316 N -0.01 1.05 -0.05 2.00 2.07 -0.79 -0.80 116.25 119.73 1rjd h VAL 316 Ca 0.12 -0.23 -0.10 0.00 0.82 0.00 0.00 66.70 67.31 1rjd h VAL 316 Cb 0.19 0.33 0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1rjd h VAL 316 CO -0.25 0.12 -0.35 -0.03 0.02 0.00 0.00 177.57 177.08 1rjd h MET 317 N 0.66 0.32 0.00 1.57 1.85 -0.76 -3.35 114.93 115.22 1rjd h MET 317 Ca 0.24 -0.28 0.00 0.00 -0.61 0.00 0.00 59.70 59.05 1rjd h MET 317 Cb 0.15 0.07 0.00 0.00 0.43 0.00 0.00 31.60 32.24 1rjd h MET 317 CO -0.07 0.94 0.00 1.96 -0.40 0.00 0.00 176.91 179.34 1rjd h GLN 318 N -0.21 0.00 0.00 0.39 1.08 -0.47 -1.19 115.11 114.71 1rjd h GLN 318 Ca -0.03 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 1rjd h GLN 318 Cb 1.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.46 1rjd h GLN 318 CO 0.07 0.00 0.00 0.25 -0.95 0.00 0.00 178.83 178.20 1rjd n THR 319 N -2.98 0.61 -0.11 -0.54 -2.24 -0.36 -2.02 114.28 106.65 1rjd n THR 319 Ca 0.04 0.15 0.11 0.00 -2.27 0.00 0.00 64.05 62.08 1rjd n THR 319 Cb 0.49 -0.87 0.27 0.00 -2.10 0.00 0.00 70.33 68.12 1rjd n THR 319 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1rjd n HIS 320 N -1.36 0.76 -5.09 4.78 8.25 -0.45 -4.87 115.22 117.25 1rjd n HIS 320 Ca 0.07 -0.40 -0.29 0.00 -0.26 0.00 0.00 57.72 56.84 1rjd n HIS 320 Cb 0.16 -0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.10 1rjd n HIS 320 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1rjd s TYR 321 N -1.17 2.05 0.16 4.41 1.51 -1.00 -0.32 117.35 122.99 1rjd s TYR 321 Ca 0.43 -0.50 0.07 0.00 -1.01 0.00 0.00 57.07 56.06 1rjd s TYR 321 Cb 0.23 -1.34 -0.04 0.00 -0.11 0.00 0.00 41.96 40.70 1rjd s TYR 321 CO 0.31 -0.12 -0.14 0.96 -1.11 0.00 0.00 175.55 175.45 1rjd s ILE 322 N -0.29 1.55 -0.20 2.71 -4.36 -0.62 -0.93 121.20 119.06 1rjd s ILE 322 Ca 0.02 -1.98 0.01 0.00 -0.26 0.00 0.00 60.65 58.44 1rjd s ILE 322 Cb -0.11 -1.82 0.04 0.00 1.25 0.00 0.00 42.46 41.83 1rjd s ILE 322 CO 0.01 -0.51 -0.10 -0.22 0.24 0.00 0.00 174.94 174.36 1rjd s LEU 323 N -2.90 2.23 -0.18 0.37 2.96 -0.01 -2.77 118.68 118.38 1rjd s LEU 323 Ca 0.16 -0.87 -0.05 0.00 -0.22 0.00 0.00 54.13 53.15 1rjd s LEU 323 Cb -0.03 -1.22 -0.03 0.00 0.50 0.00 0.00 46.19 45.42 1rjd s LEU 323 CO 0.05 -0.15 0.01 -0.32 -1.32 0.00 0.00 176.35 174.62 1rjd s MET 324 N 1.41 3.75 -0.21 1.98 -2.45 0.15 -1.87 119.30 122.07 1rjd s MET 324 Ca -0.01 -0.46 0.02 0.00 -1.25 0.00 0.00 55.69 53.98 1rjd s MET 324 Cb -0.16 -3.06 0.04 0.00 1.25 0.00 0.00 34.83 32.90 1rjd s MET 324 CO -0.08 0.19 -0.16 0.15 1.05 0.00 0.00 175.02 176.17 1rjd s LYS 325 N 0.55 2.60 -0.11 4.11 1.02 0.65 -1.08 119.74 127.48 1rjd s LYS 325 Ca -0.00 -0.99 0.01 0.00 0.02 0.00 0.00 55.97 55.01 1rjd s LYS 325 Cb -0.14 -2.63 -0.02 0.00 -0.52 0.00 0.00 37.83 34.53 1rjd s LYS 325 CO 0.02 -0.35 -0.14 0.00 -0.92 0.00 0.00 175.35 173.96 1rjd s ALA 326 N 1.25 2.59 -0.00 5.17 0.00 -0.55 -0.57 121.76 129.66 1rjd s ALA 326 Ca -0.00 -0.91 0.05 0.00 0.00 0.00 0.00 51.96 51.10 1rjd s ALA 326 Cb -0.16 -1.14 -0.01 0.00 0.00 0.00 0.00 23.12 21.81 1rjd s ALA 326 CO -0.10 0.31 -0.16 -0.65 0.00 0.00 0.00 175.76 175.16 1rjd s GLN 327 N 0.15 1.27 0.11 0.00 -0.21 0.54 -0.34 119.66 121.18 1rjd s GLN 327 Ca -0.07 -0.62 -0.06 0.00 0.02 0.00 0.00 55.36 54.63 1rjd s GLN 327 Cb -0.15 -1.24 -0.02 0.00 1.00 0.00 0.00 33.01 32.60 1rjd s GLN 327 CO 0.05 0.34 0.14 1.67 -2.12 0.00 0.00 175.29 175.36 1rjd s TRP 328 N -0.46 0.44 0.00 0.91 -2.14 -0.71 -3.00 118.94 113.98 1rjd s TRP 328 Ca 0.06 -0.86 0.00 0.00 2.66 0.00 0.00 56.10 57.95 1rjd s TRP 328 Cb -0.07 -0.22 0.00 0.00 -3.10 0.00 0.00 33.47 30.09 1rjd s TRP 328 CO -0.00 -0.55 0.00 1.58 -2.66 0.00 0.00 176.95 175.32