#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g3t h LEU 4 N 0.00 0.20 0.17 -2.67 3.38 -2.05 -0.29 115.31 114.06 1g3t h LEU 4 Ca 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1g3t h LEU 4 Cb 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1g3t h LEU 4 CO 0.00 0.19 -0.08 0.58 0.09 0.00 0.00 178.44 179.21 1g3t h VAL 5 N 0.20 0.87 -0.20 1.22 2.07 -2.05 -1.66 116.25 116.70 1g3t h VAL 5 Ca 0.06 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1g3t h VAL 5 Cb 0.02 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1g3t h VAL 5 CO -0.01 0.04 0.01 0.44 0.02 0.00 0.00 177.57 178.08 1g3t h ASP 6 N -0.32 0.26 -0.19 0.57 3.32 -1.95 0.14 116.42 118.25 1g3t h ASP 6 Ca -0.02 -0.03 -0.09 0.00 0.02 0.00 0.00 57.03 56.91 1g3t h ASP 6 Cb 0.25 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 1g3t h ASP 6 CO 0.04 0.31 -0.22 0.74 -1.72 0.00 0.00 179.24 178.39 1g3t h THR 7 N 0.29 1.33 -0.02 0.35 2.02 -0.89 -1.47 112.91 114.52 1g3t h THR 7 Ca 0.07 -1.40 -0.00 0.00 0.77 0.00 0.00 66.41 65.85 1g3t h THR 7 Cb 0.18 1.80 -0.00 0.00 -1.74 0.00 0.00 68.15 68.38 1g3t h THR 7 CO 0.00 0.42 0.01 0.74 0.37 0.00 0.00 175.52 177.07 1g3t h THR 8 N 0.15 1.07 -0.39 3.16 2.02 -0.86 0.19 112.91 118.25 1g3t h THR 8 Ca 0.03 -0.20 0.06 0.00 0.77 0.00 0.00 66.41 67.07 1g3t h THR 8 Cb 0.77 1.16 -0.05 0.00 -1.74 0.00 0.00 68.15 68.29 1g3t h THR 8 CO 0.05 0.05 0.09 -0.33 0.37 0.00 0.00 175.52 175.75 1g3t h GLU 9 N -0.05 0.21 -0.83 6.66 5.08 -0.98 0.20 114.58 124.87 1g3t h GLU 9 Ca 0.01 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1g3t h GLU 9 Cb 0.08 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 1g3t h GLU 9 CO -0.00 0.14 0.48 1.98 -1.00 0.00 0.00 179.01 180.60 1g3t h MET 10 N 0.22 1.15 -0.52 2.33 4.05 -0.99 -0.37 114.93 120.81 1g3t h MET 10 Ca 0.19 -0.12 -0.08 0.00 -0.28 0.00 0.00 59.70 59.41 1g3t h MET 10 Cb 0.21 -0.23 -0.02 0.00 -0.80 0.00 0.00 31.60 30.76 1g3t h MET 10 CO -0.23 0.83 0.03 1.88 0.23 0.00 0.00 176.91 179.64 1g3t h TYR 11 N 1.15 0.98 -0.62 1.39 -1.99 0.37 -1.37 116.97 116.88 1g3t h TYR 11 Ca 0.30 -0.16 -0.05 0.00 2.00 0.00 0.00 58.73 60.82 1g3t h TYR 11 Cb 0.00 -0.26 -0.03 0.00 2.00 0.00 0.00 36.73 38.45 1g3t h TYR 11 CO 0.00 0.90 0.20 -0.07 -0.00 0.00 0.00 178.16 179.19 1g3t h LEU 12 N 0.78 0.90 -0.80 3.88 3.38 -0.25 -1.32 115.31 121.88 1g3t h LEU 12 Ca 0.15 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 1g3t h LEU 12 Cb 0.49 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1g3t h LEU 12 CO 0.02 0.86 -0.28 -0.09 0.09 0.00 0.00 178.44 179.05 1g3t h ARG 13 N 0.88 0.60 -0.27 1.13 2.43 -1.02 -1.53 114.38 116.61 1g3t h ARG 13 Ca 0.20 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1g3t h ARG 13 Cb 0.28 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1g3t h ARG 13 CO -0.01 0.81 0.12 1.15 -1.51 0.00 0.00 179.97 180.54 1g3t h THR 14 N 0.52 1.16 -0.73 0.20 2.02 -0.88 -1.00 112.91 114.20 1g3t h THR 14 Ca 0.07 -0.46 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 1g3t h THR 14 Cb 0.74 0.97 -0.04 0.00 -1.74 0.00 0.00 68.15 68.08 1g3t h THR 14 CO 0.06 0.16 0.44 0.40 0.37 0.00 0.00 175.52 176.95 1g3t h ILE 15 N 0.29 1.20 -0.63 3.11 2.04 -1.01 -1.76 117.51 120.75 1g3t h ILE 15 Ca 0.09 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 1g3t h ILE 15 Cb 0.14 0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 36.36 1g3t h ILE 15 CO -0.01 0.21 0.26 0.22 0.00 0.00 0.00 178.15 178.82 1g3t h TYR 16 N 1.00 0.95 -0.39 1.37 5.03 -0.79 -1.39 116.97 122.74 1g3t h TYR 16 Ca 0.26 -0.07 -0.03 0.00 2.58 0.00 0.00 58.73 61.47 1g3t h TYR 16 Cb -0.05 -0.29 -0.02 0.00 1.55 0.00 0.00 36.73 37.93 1g3t h TYR 16 CO 0.00 0.75 0.11 0.93 -1.32 0.00 0.00 178.16 178.63 1g3t h GLU 17 N 0.88 0.62 -0.47 1.82 5.08 -0.42 0.16 114.58 122.24 1g3t h GLU 17 Ca 0.21 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1g3t h GLU 17 Cb 0.20 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1g3t h GLU 17 CO -0.02 0.64 0.27 -0.07 -1.00 0.00 0.00 179.01 178.83 1g3t h LEU 18 N 0.49 0.58 -0.17 1.33 3.38 -1.22 0.28 115.31 119.98 1g3t h LEU 18 Ca 0.13 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.06 1g3t h LEU 18 Cb 0.28 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1g3t h LEU 18 CO -0.00 0.48 -0.04 -0.33 0.09 0.00 0.00 178.44 178.64 1g3t h GLU 19 N 0.63 0.01 -0.47 1.13 5.08 -0.99 0.48 114.58 120.43 1g3t h GLU 19 Ca 0.17 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1g3t h GLU 19 Cb 0.02 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1g3t h GLU 19 CO -0.03 0.00 0.28 1.49 -1.00 0.00 0.00 179.01 179.75 1g3t h GLU 20 N 0.01 0.64 0.00 2.33 4.81 -0.21 -0.54 114.58 121.61 1g3t h GLU 20 Ca 0.08 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1g3t h GLU 20 Cb 0.12 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1g3t h GLU 20 CO -0.17 0.45 0.00 0.39 -0.73 0.00 0.00 179.01 178.95 1g3t n GLU 21 N -4.43 0.23 -0.81 1.92 1.02 0.96 -4.89 120.64 114.64 1g3t n GLU 21 Ca 0.04 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1g3t n GLU 21 Cb 0.08 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.00 1g3t n GLU 21 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1g3t n GLY 22 N 1.32 0.51 3.91 0.62 0.00 -0.21 -5.05 105.19 106.29 1g3t n GLY 22 Ca 0.11 -0.79 -0.30 0.00 0.00 0.00 0.00 46.02 45.04 1g3t n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g3t s VAL 23 N -2.00 5.22 -0.07 1.61 1.01 0.15 -4.99 120.40 121.33 1g3t s VAL 23 Ca 0.00 -0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.52 1g3t s VAL 23 Cb 0.00 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 1g3t s VAL 23 CO 0.00 -0.01 1.03 -0.89 0.00 0.00 0.00 175.10 175.23 1g3t s THR 24 N -1.70 4.71 -0.91 3.92 2.01 -1.26 -3.80 115.64 118.62 1g3t s THR 24 Ca 0.39 1.97 -0.22 0.00 0.31 0.00 0.00 61.69 64.14 1g3t s THR 24 Cb -0.12 -4.27 -0.14 0.00 0.01 0.00 0.00 72.50 67.99 1g3t s THR 24 CO 0.27 0.05 1.92 -2.65 -0.69 0.00 0.00 174.62 173.51 1g3t n PRO 25 N 4.70 1.53 -3.83 4.92 -0.02 -1.26 -4.91 135.00 136.14 1g3t n PRO 25 Ca 0.08 -2.07 -0.34 0.00 -2.02 0.00 0.00 63.50 59.15 1g3t n PRO 25 Cb 0.49 -3.20 -0.05 0.00 -0.02 0.00 0.00 33.50 30.71 1g3t n PRO 25 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1g3t s LEU 26 N 4.66 4.37 0.25 2.45 1.43 -1.26 -0.16 118.68 130.42 1g3t s LEU 26 Ca 0.61 0.46 -0.03 0.00 -1.03 0.00 0.00 54.13 54.15 1g3t s LEU 26 Cb 0.09 -2.58 0.47 0.00 0.03 0.00 0.00 46.19 44.20 1g3t s LEU 26 CO 0.13 0.27 1.75 0.03 0.23 0.00 0.00 176.35 178.77 1g3t h ARG 27 N 4.03 0.53 -0.51 1.70 3.08 -1.91 0.14 114.38 121.44 1g3t h ARG 27 Ca -0.50 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.52 1g3t h ARG 27 Cb 1.20 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 31.10 1g3t h ARG 27 CO 0.66 0.35 0.33 0.00 -1.07 0.00 0.00 179.97 180.25 1g3t h ALA 28 N 1.53 1.62 0.02 0.04 0.00 -1.95 0.13 119.26 120.65 1g3t h ALA 28 Ca 0.43 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 1g3t h ALA 28 Cb 0.60 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1g3t h ALA 28 CO -0.36 0.35 -0.01 0.00 0.00 0.00 0.00 179.25 179.22 1g3t h ARG 29 N 0.70 -0.02 -0.71 0.00 2.47 -1.13 -0.93 114.38 114.75 1g3t h ARG 29 Ca 0.19 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.91 1g3t h ARG 29 Cb -0.07 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 28.22 1g3t h ARG 29 CO -0.04 0.31 0.43 0.82 0.56 0.00 0.00 179.97 182.06 1g3t h ILE 30 N -0.36 1.20 -0.77 2.04 2.04 -0.66 -0.64 117.51 120.36 1g3t h ILE 30 Ca -0.00 -0.43 -0.04 0.00 1.00 0.00 0.00 64.86 65.39 1g3t h ILE 30 Cb 0.35 0.21 -0.03 0.00 -0.74 0.00 0.00 36.82 36.60 1g3t h ILE 30 CO 0.00 0.21 0.32 0.00 0.00 0.00 0.00 178.15 178.68 1g3t h ALA 31 N 1.23 1.00 0.48 1.87 0.00 -0.70 0.13 119.26 123.27 1g3t h ALA 31 Ca 0.25 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1g3t h ALA 31 Cb -0.04 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.45 1g3t h ALA 31 CO -0.05 0.62 -0.23 1.49 0.00 0.00 0.00 179.25 181.08 1g3t h GLU 32 N 1.11 -0.62 -0.25 0.00 4.81 -0.80 0.84 114.58 119.68 1g3t h GLU 32 Ca 0.26 0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.59 1g3t h GLU 32 Cb 0.20 0.14 -0.08 0.00 0.63 0.00 0.00 28.75 29.64 1g3t h GLU 32 CO -0.02 -0.33 -0.40 -0.09 -0.73 0.00 0.00 179.01 177.43 1g3t h ARG 33 N -0.83 -0.39 0.00 1.92 9.65 -0.89 -0.86 114.38 122.98 1g3t h ARG 33 Ca -0.07 0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1g3t h ARG 33 Cb 0.57 0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.24 1g3t h ARG 33 CO 0.11 -0.26 0.00 1.28 2.80 0.00 0.00 179.97 183.90 1g3t n LEU 34 N -5.42 0.14 -3.38 3.80 4.77 0.43 -4.92 117.00 112.42 1g3t n LEU 34 Ca -0.02 0.52 -0.20 0.00 -0.03 0.00 0.00 56.01 56.28 1g3t n LEU 34 Cb 0.35 -0.49 0.06 0.00 -2.33 0.00 0.00 43.42 41.01 1g3t n LEU 34 CO 0.09 -0.18 0.00 -0.62 -1.33 0.00 0.00 177.39 175.35 1g3t n GLU 35 N -1.64 -2.13 -4.05 3.23 1.02 0.14 -5.01 120.64 112.19 1g3t n GLU 35 Ca 0.05 0.75 -0.11 0.00 -0.02 0.00 0.00 57.16 57.83 1g3t n GLU 35 Cb 0.26 -5.36 -0.11 0.00 -0.02 0.00 0.00 31.44 26.21 1g3t n GLU 35 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1g3t s GLN 36 N -4.88 0.51 0.48 3.49 -1.52 -0.33 -5.05 119.66 112.36 1g3t s GLN 36 Ca 0.44 -0.81 -0.21 0.00 -1.95 0.00 0.00 55.36 52.83 1g3t s GLN 36 Cb -0.09 -0.13 -0.08 0.00 -0.22 0.00 0.00 33.01 32.49 1g3t s GLN 36 CO 0.77 0.00 1.08 -1.54 -0.25 0.00 0.00 175.29 175.36 1g3t s SER 37 N -1.80 6.26 0.30 5.90 1.04 -1.26 -4.45 113.70 119.68 1g3t s SER 37 Ca -0.08 2.07 0.05 0.00 0.48 0.00 0.00 55.95 58.47 1g3t s SER 37 Cb -0.07 -2.58 0.72 0.00 0.10 0.00 0.00 66.02 64.19 1g3t s SER 37 CO -0.01 -0.84 1.77 1.23 0.98 0.00 0.00 173.24 176.37 1g3t h GLY 38 N 1.76 1.75 1.32 7.32 0.00 -1.92 -0.62 103.07 112.69 1g3t h GLY 38 Ca -0.49 -0.35 0.02 0.00 0.00 0.00 0.00 47.33 46.51 1g3t h GLY 38 CO 0.59 -0.07 0.41 -2.55 0.00 0.00 0.00 176.54 174.93 1g3t h PRO 39 N 0.75 0.75 0.09 4.80 0.11 -1.99 -0.78 132.00 135.72 1g3t h PRO 39 Ca 0.57 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.63 1g3t h PRO 39 Cb 0.88 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.82 1g3t h PRO 39 CO -0.38 0.50 -0.04 1.15 -0.21 0.00 0.00 178.00 179.01 1g3t h THR 40 N 0.77 1.15 -0.26 -1.15 2.02 -1.50 -2.15 112.91 111.80 1g3t h THR 40 Ca 0.24 -1.03 0.04 0.00 0.77 0.00 0.00 66.41 66.43 1g3t h THR 40 Cb 0.01 1.80 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1g3t h THR 40 CO -0.06 0.25 0.18 -0.37 0.37 0.00 0.00 175.52 175.88 1g3t h VAL 41 N -0.61 0.95 -0.31 3.16 -1.51 -1.19 0.09 116.25 116.84 1g3t h VAL 41 Ca -0.01 -0.05 -0.03 0.00 -1.23 0.00 0.00 66.70 65.37 1g3t h VAL 41 Cb 0.50 0.79 -0.01 0.00 -2.13 0.00 0.00 31.29 30.43 1g3t h VAL 41 CO 0.02 0.03 0.06 0.28 -1.23 0.00 0.00 177.57 176.73 1g3t h SER 42 N 0.15 0.48 -0.38 4.19 0.02 -1.01 0.12 113.55 117.11 1g3t h SER 42 Ca 0.11 -0.24 -0.07 0.00 -0.84 0.00 0.00 61.79 60.75 1g3t h SER 42 Cb 0.26 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 1g3t h SER 42 CO -0.02 0.60 -0.01 -0.61 -1.14 0.00 0.00 176.83 175.66 1g3t h GLN 43 N 0.33 0.77 -0.08 3.45 4.15 -0.43 -1.68 115.11 121.62 1g3t h GLN 43 Ca 0.09 -0.21 -0.10 0.00 0.77 0.00 0.00 58.65 59.21 1g3t h GLN 43 Cb 0.32 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.92 1g3t h GLN 43 CO 0.00 0.78 -0.32 1.15 -1.93 0.00 0.00 178.83 178.52 1g3t h THR 44 N 0.72 1.41 -0.59 2.39 2.02 -0.79 -2.19 112.91 115.88 1g3t h THR 44 Ca 0.14 -1.69 -0.04 0.00 0.77 0.00 0.00 66.41 65.59 1g3t h THR 44 Cb 0.45 2.26 -0.03 0.00 -1.74 0.00 0.00 68.15 69.09 1g3t h THR 44 CO 0.02 0.49 0.20 0.58 0.37 0.00 0.00 175.52 177.18 1g3t h VAL 45 N -0.11 1.22 -0.61 3.16 2.07 -0.71 0.19 116.25 121.47 1g3t h VAL 45 Ca -0.02 -0.75 -0.07 0.00 0.82 0.00 0.00 66.70 66.69 1g3t h VAL 45 Cb 0.96 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1g3t h VAL 45 CO 0.07 0.29 0.12 0.00 0.02 0.00 0.00 177.57 178.07 1g3t h ALA 46 N 1.36 0.81 -0.31 1.67 0.00 -1.34 0.14 119.26 121.59 1g3t h ALA 46 Ca 0.20 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1g3t h ALA 46 Cb 0.23 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1g3t h ALA 46 CO -0.01 0.54 -0.06 -0.09 0.00 0.00 0.00 179.25 179.63 1g3t h ARG 47 N 0.91 0.49 -0.00 0.00 2.43 -0.64 -1.87 114.38 115.69 1g3t h ARG 47 Ca 0.19 -0.12 -0.16 0.00 -0.81 0.00 0.00 59.98 59.08 1g3t h ARG 47 Cb 0.39 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 1g3t h ARG 47 CO 0.01 0.57 -0.74 0.52 -1.51 0.00 0.00 179.97 178.82 1g3t h MET 48 N 0.47 0.02 -0.21 0.20 2.86 0.28 -2.40 114.93 116.15 1g3t h MET 48 Ca 0.09 -0.02 -0.08 0.00 -2.06 0.00 0.00 59.70 57.64 1g3t h MET 48 Cb 0.40 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.06 1g3t h MET 48 CO 0.02 0.75 -0.16 0.93 1.06 0.00 0.00 176.91 179.50 1g3t h GLU 49 N 0.01 0.48 0.00 1.72 5.08 -0.25 0.81 114.58 122.44 1g3t h GLU 49 Ca -0.01 -0.24 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 1g3t h GLU 49 Cb 1.30 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.55 1g3t h GLU 49 CO 0.10 0.80 -0.08 0.00 -1.00 0.00 0.00 179.01 178.83 1g3t h ARG 50 N 0.17 0.00 -0.00 2.33 3.08 -1.33 0.27 114.38 118.90 1g3t h ARG 50 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1g3t h ARG 50 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.74 1g3t h ARG 50 CO 0.04 0.08 -0.16 -3.47 -1.07 0.00 0.00 179.97 175.40 1g3t n ASP 51 N -3.68 0.33 -0.92 7.04 2.03 -0.77 -4.91 116.55 115.67 1g3t n ASP 51 Ca -0.02 -0.20 -0.10 0.00 0.52 0.00 0.00 54.79 55.00 1g3t n ASP 51 Cb 0.19 -0.13 -0.02 0.00 -0.72 0.00 0.00 41.12 40.43 1g3t n ASP 51 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1g3t n GLY 52 N 1.39 0.59 0.07 0.27 0.00 0.94 -4.90 105.19 103.54 1g3t n GLY 52 Ca 0.11 -0.54 0.09 0.00 0.00 0.00 0.00 46.02 45.68 1g3t n GLY 52 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1g3t n LEU 53 N -1.24 0.46 -3.59 0.99 4.77 0.09 -4.48 117.00 113.99 1g3t n LEU 53 Ca -0.11 0.18 -0.11 0.00 -0.03 0.00 0.00 56.01 55.95 1g3t n LEU 53 Cb 0.45 0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.51 1g3t n LEU 53 CO 0.14 -0.04 0.25 0.54 -1.33 0.00 0.00 177.39 176.95 1g3t s VAL 54 N -3.34 0.04 0.01 4.08 0.11 -1.23 -1.58 120.40 118.49 1g3t s VAL 54 Ca -0.04 -0.45 0.02 0.00 -2.93 0.00 0.00 61.98 58.59 1g3t s VAL 54 Cb 0.11 -1.20 -0.01 0.00 -1.53 0.00 0.00 36.38 33.75 1g3t s VAL 54 CO 0.84 -0.18 -0.08 0.68 -3.33 0.00 0.00 175.10 173.03 1g3t s VAL 55 N -3.80 0.61 -0.52 2.04 -7.23 0.51 -4.19 120.40 107.82 1g3t s VAL 55 Ca 0.04 -0.58 -0.21 0.00 -1.81 0.00 0.00 61.98 59.42 1g3t s VAL 55 Cb 0.00 -0.56 0.05 0.00 0.56 0.00 0.00 36.38 36.44 1g3t s VAL 55 CO -0.10 -0.00 0.73 -0.69 -0.31 0.00 0.00 175.10 174.73 1g3t s VAL 56 N -0.55 4.71 0.98 1.32 1.01 -1.26 -0.31 120.40 126.30 1g3t s VAL 56 Ca -0.01 -0.19 -0.16 0.00 0.00 0.00 0.00 61.98 61.62 1g3t s VAL 56 Cb -0.05 -4.37 0.25 0.00 0.00 0.00 0.00 36.38 32.21 1g3t s VAL 56 CO 0.00 -0.89 0.72 0.00 0.00 0.00 0.00 175.10 174.93 1g3t n ALA 57 N 6.61 -3.13 0.05 5.51 0.00 0.19 -4.83 120.51 124.90 1g3t n ALA 57 Ca -0.03 -1.16 -0.08 0.00 0.00 0.00 0.00 53.44 52.16 1g3t n ALA 57 Cb 0.46 -0.09 -0.05 0.00 0.00 0.00 0.00 19.45 19.77 1g3t n ALA 57 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1g3t h SER 58 N -2.70 -0.80 0.00 0.00 4.64 -1.97 -0.67 113.55 112.05 1g3t h SER 58 Ca -0.30 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1g3t h SER 58 Cb 0.94 0.30 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1g3t h SER 58 CO 0.19 -0.27 0.00 -0.90 -0.87 0.00 0.00 176.83 174.97 1g3t n ASP 59 N -3.95 0.00 -0.18 4.97 5.75 -1.26 -4.70 116.55 117.19 1g3t n ASP 59 Ca -0.04 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.72 1g3t n ASP 59 Cb 0.20 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.28 1g3t n ASP 59 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1g3t n ARG 60 N -0.95 -0.23 -2.44 0.11 0.00 -0.26 -5.03 116.66 107.87 1g3t n ARG 60 Ca 0.00 0.48 -0.28 0.00 -0.00 0.00 0.00 57.85 58.05 1g3t n ARG 60 Cb 0.00 -4.01 0.01 0.00 -0.00 0.00 0.00 32.46 28.46 1g3t n ARG 60 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1g3t s SER 61 N -2.74 6.03 -0.30 2.89 1.04 -1.26 -4.41 113.70 114.95 1g3t s SER 61 Ca 0.00 0.94 -0.10 0.00 0.48 0.00 0.00 55.95 57.26 1g3t s SER 61 Cb 0.00 -2.10 -0.02 0.00 0.10 0.00 0.00 66.02 63.99 1g3t s SER 61 CO 0.00 -0.79 0.17 -0.76 0.98 0.00 0.00 173.24 172.84 1g3t s LEU 62 N -4.90 4.10 -0.24 2.42 1.43 0.78 0.53 118.68 122.80 1g3t s LEU 62 Ca 0.51 -0.33 -0.10 0.00 -1.03 0.00 0.00 54.13 53.17 1g3t s LEU 62 Cb -0.10 -2.05 -0.05 0.00 0.03 0.00 0.00 46.19 44.01 1g3t s LEU 62 CO 0.46 -0.15 0.16 -1.10 0.23 0.00 0.00 176.35 175.96 1g3t s GLN 63 N 1.68 4.08 0.02 1.70 -0.21 0.58 -4.75 119.66 122.75 1g3t s GLN 63 Ca 0.06 -0.26 -0.29 0.00 0.02 0.00 0.00 55.36 54.89 1g3t s GLN 63 Cb -0.17 -3.53 -0.04 0.00 1.00 0.00 0.00 33.01 30.28 1g3t s GLN 63 CO 0.08 0.08 0.93 -1.64 -2.12 0.00 0.00 175.29 172.61 1g3t s MET 64 N 1.01 4.57 1.00 2.91 -1.94 -1.26 -0.36 119.30 125.22 1g3t s MET 64 Ca 0.08 1.33 -0.12 0.00 -1.71 0.00 0.00 55.69 55.27 1g3t s MET 64 Cb -0.13 -3.44 0.19 0.00 2.01 0.00 0.00 34.83 33.46 1g3t s MET 64 CO 0.04 0.04 1.09 0.95 -0.01 0.00 0.00 175.02 177.12 1g3t s THR 65 N 0.72 2.20 0.31 2.05 -4.23 -0.61 -4.59 115.64 111.48 1g3t s THR 65 Ca 0.48 0.06 0.06 0.00 -1.18 0.00 0.00 61.69 61.12 1g3t s THR 65 Cb -0.21 -2.50 0.31 0.00 1.34 0.00 0.00 72.50 71.44 1g3t s THR 65 CO 0.27 -0.08 1.79 -0.65 -0.54 0.00 0.00 174.62 175.40 1g3t h PRO 66 N -1.91 0.74 -0.51 3.99 0.11 -1.89 -0.28 132.00 132.25 1g3t h PRO 66 Ca -0.54 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.43 1g3t h PRO 66 Cb 1.32 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1g3t h PRO 66 CO 0.56 0.49 -0.06 1.79 -0.21 0.00 0.00 178.00 180.57 1g3t h THR 67 N 0.76 1.27 -0.57 -1.15 1.35 -1.89 -0.77 112.91 111.91 1g3t h THR 67 Ca 0.56 -1.18 -0.03 0.00 -0.55 0.00 0.00 66.41 65.21 1g3t h THR 67 Cb 0.89 0.99 -0.02 0.00 -1.73 0.00 0.00 68.15 68.28 1g3t h THR 67 CO -0.35 0.41 0.22 1.23 -0.25 0.00 0.00 175.52 176.79 1g3t h GLY 68 N 0.81 0.91 1.29 5.82 0.00 -1.38 -2.40 103.07 108.11 1g3t h GLY 68 Ca 0.14 -0.50 -0.07 0.00 0.00 0.00 0.00 47.33 46.90 1g3t h GLY 68 CO 0.04 0.47 0.04 -0.09 0.00 0.00 0.00 176.54 177.00 1g3t h ARG 69 N 0.78 0.87 -0.77 4.80 2.43 -0.85 0.85 114.38 122.49 1g3t h ARG 69 Ca 0.19 -0.23 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 1g3t h ARG 69 Cb 0.20 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.61 1g3t h ARG 69 CO -0.02 0.84 0.38 1.15 -1.51 0.00 0.00 179.97 180.82 1g3t h THR 70 N 0.81 1.24 -0.07 0.20 2.02 -0.97 -1.25 112.91 114.89 1g3t h THR 70 Ca 0.16 -0.67 -0.10 0.00 0.77 0.00 0.00 66.41 66.57 1g3t h THR 70 Cb 0.43 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1g3t h THR 70 CO 0.02 0.28 -0.35 0.25 0.37 0.00 0.00 175.52 176.09 1g3t h LEU 71 N 1.08 0.44 -0.72 2.58 5.85 -1.04 -2.34 115.31 121.17 1g3t h LEU 71 Ca 0.27 -0.65 0.10 0.00 0.84 0.00 0.00 57.88 58.44 1g3t h LEU 71 Cb 0.10 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 40.92 1g3t h LEU 71 CO -0.04 1.02 0.34 0.00 -0.34 0.00 0.00 178.44 179.42 1g3t h ALA 72 N 0.44 1.00 -0.71 1.25 0.00 -0.74 0.43 119.26 120.92 1g3t h ALA 72 Ca -0.02 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1g3t h ALA 72 Cb 1.00 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1g3t h ALA 72 CO 0.07 -0.08 0.27 1.15 0.00 0.00 0.00 179.25 180.66 1g3t h THR 73 N 0.57 1.25 0.12 0.00 2.02 -1.25 -0.25 112.91 115.37 1g3t h THR 73 Ca 0.36 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 1g3t h THR 73 Cb 0.43 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 1g3t h THR 73 CO -0.30 0.32 -0.06 0.00 0.37 0.00 0.00 175.52 175.86 1g3t h ALA 74 N 1.13 -0.17 -0.97 6.16 0.00 -0.69 0.10 119.26 124.82 1g3t h ALA 74 Ca 0.23 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 55.07 1g3t h ALA 74 Cb 0.24 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 1g3t h ALA 74 CO -0.02 -0.47 0.62 0.28 0.00 0.00 0.00 179.25 179.67 1g3t h VAL 75 N -0.41 1.06 -0.05 0.00 2.07 -0.85 0.22 116.25 118.29 1g3t h VAL 75 Ca -0.02 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 67.03 1g3t h VAL 75 Cb 0.34 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 29.94 1g3t h VAL 75 CO 0.03 0.20 -0.41 -0.03 0.02 0.00 0.00 177.57 177.38 1g3t h MET 76 N 1.11 0.11 0.05 1.57 4.05 -0.90 -1.18 114.93 119.74 1g3t h MET 76 Ca 0.43 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.80 1g3t h MET 76 Cb 0.20 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.00 1g3t h MET 76 CO -0.18 0.50 -0.02 -0.09 0.23 0.00 0.00 176.91 177.34 1g3t h ARG 77 N 0.09 -0.07 -0.50 0.39 2.43 0.96 -1.51 114.38 116.17 1g3t h ARG 77 Ca 0.01 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1g3t h ARG 77 Cb 0.77 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.31 1g3t h ARG 77 CO 0.06 0.31 0.28 0.87 -1.51 0.00 0.00 179.97 179.98 1g3t h LYS 78 N -0.46 0.69 -0.12 0.20 1.57 -1.10 -0.43 116.57 116.92 1g3t h LYS 78 Ca -0.01 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1g3t h LYS 78 Cb 0.41 -0.14 -0.06 0.00 0.08 0.00 0.00 32.23 32.52 1g3t h LYS 78 CO 0.01 0.52 -0.27 1.25 -0.57 0.00 0.00 179.45 180.40 1g3t h HIS 79 N 0.66 -0.73 -0.14 -1.35 2.76 -1.20 0.16 115.15 115.31 1g3t h HIS 79 Ca 0.18 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.26 1g3t h HIS 79 Cb 0.03 0.34 -0.01 0.00 1.55 0.00 0.00 27.41 29.31 1g3t h HIS 79 CO -0.02 -0.35 -0.44 0.00 -1.30 0.00 0.00 177.93 175.82 1g3t h ARG 80 N -0.34 0.34 -0.04 5.26 3.08 -1.02 -1.17 114.38 120.50 1g3t h ARG 80 Ca 0.10 -0.18 -0.09 0.00 0.07 0.00 0.00 59.98 59.88 1g3t h ARG 80 Cb 0.49 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 1g3t h ARG 80 CO -0.32 0.72 -0.42 -0.07 -1.07 0.00 0.00 179.97 178.81 1g3t h LEU 81 N 0.28 0.08 -0.56 3.04 3.38 -0.78 -1.23 115.31 119.52 1g3t h LEU 81 Ca 0.02 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 1g3t h LEU 81 Cb 0.89 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1g3t h LEU 81 CO 0.07 0.49 -0.28 0.00 0.09 0.00 0.00 178.44 178.82 1g3t h ALA 82 N 1.51 0.74 -0.54 1.53 0.00 -0.19 -1.30 119.26 121.01 1g3t h ALA 82 Ca 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 1g3t h ALA 82 Cb 0.77 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1g3t h ALA 82 CO 0.06 0.66 0.20 0.93 0.00 0.00 0.00 179.25 181.10 1g3t h GLU 83 N 0.74 0.82 -0.56 0.00 5.08 -0.41 0.11 114.58 120.35 1g3t h GLU 83 Ca 0.09 -0.16 -0.07 0.00 -1.00 0.00 0.00 59.36 58.21 1g3t h GLU 83 Cb 0.83 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 1g3t h GLU 83 CO 0.07 0.72 0.05 0.00 -1.00 0.00 0.00 179.01 178.86 1g3t h ARG 84 N 0.74 0.92 -0.33 2.33 2.47 -1.12 -1.74 114.38 117.65 1g3t h ARG 84 Ca 0.18 -0.24 -0.03 0.00 -1.26 0.00 0.00 59.98 58.63 1g3t h ARG 84 Cb 0.23 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.42 1g3t h ARG 84 CO -0.01 0.88 0.10 1.25 0.56 0.00 0.00 179.97 182.75 1g3t h LEU 85 N 0.86 0.49 -1.20 3.04 5.85 -0.90 0.17 115.31 123.63 1g3t h LEU 85 Ca 0.17 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 1g3t h LEU 85 Cb 0.44 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1g3t h LEU 85 CO 0.02 0.58 0.09 -0.07 -0.34 0.00 0.00 178.44 178.71 1g3t h LEU 86 N 0.39 0.59 0.02 2.25 3.38 -0.69 -0.99 115.31 120.26 1g3t h LEU 86 Ca 0.11 -0.10 -0.40 0.00 0.09 0.00 0.00 57.88 57.59 1g3t h LEU 86 Cb 0.27 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.80 1g3t h LEU 86 CO -0.00 0.61 -2.37 0.35 0.09 0.00 0.00 178.44 177.12 1g3t n THR 87 N -4.30 1.54 -0.09 0.22 -2.24 -0.68 -0.46 114.28 108.27 1g3t n THR 87 Ca 0.03 -0.52 -0.10 0.00 -2.27 0.00 0.00 64.05 61.19 1g3t n THR 87 Cb 0.21 -1.59 0.05 0.00 -2.10 0.00 0.00 70.33 66.90 1g3t n THR 87 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1g3t h ASP 88 N -0.24 0.85 0.00 3.42 5.19 -0.73 -3.30 116.42 121.61 1g3t h ASP 88 Ca -0.57 -0.35 -0.15 0.00 -0.62 0.00 0.00 57.03 55.34 1g3t h ASP 88 Cb 1.84 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 41.09 1g3t h ASP 88 CO -0.14 1.09 -1.40 -0.38 -3.12 0.00 0.00 179.24 175.29 1g3t n ILE 89 N -4.08 0.66 -0.01 0.35 5.41 -0.58 -4.75 119.36 116.36 1g3t n ILE 89 Ca -0.01 -0.08 -0.09 0.00 1.00 0.00 0.00 62.75 63.57 1g3t n ILE 89 Cb 0.49 -1.67 0.06 0.00 -0.71 0.00 0.00 39.64 37.81 1g3t n ILE 89 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1g3t h ILE 90 N -0.36 1.31 -0.01 1.39 2.04 -1.32 -3.48 117.51 117.09 1g3t h ILE 90 Ca -0.22 -1.72 -0.00 0.00 1.00 0.00 0.00 64.86 63.92 1g3t h ILE 90 Cb 1.11 1.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.87 1g3t h ILE 90 CO -0.14 0.54 -0.00 0.61 0.00 0.00 0.00 178.15 179.16 1g3t n GLY 91 N 0.18 0.37 3.76 5.37 0.00 0.23 -4.99 105.19 110.10 1g3t n GLY 91 Ca -0.03 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.67 1g3t n GLY 91 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1g3t s LEU 92 N -0.02 4.44 -0.16 0.99 2.96 0.39 -4.88 118.68 122.41 1g3t s LEU 92 Ca 0.00 2.54 -0.42 0.00 -0.22 0.00 0.00 54.13 56.03 1g3t s LEU 92 Cb 0.00 -3.63 -0.20 0.00 0.50 0.00 0.00 46.19 42.86 1g3t s LEU 92 CO 0.00 -0.47 1.26 -0.67 -1.32 0.00 0.00 176.35 175.15 1g3t n ASP 93 N 1.44 0.49 0.11 3.68 2.03 -1.26 -4.69 116.55 118.34 1g3t n ASP 93 Ca 0.02 1.17 0.19 0.00 0.52 0.00 0.00 54.79 56.69 1g3t n ASP 93 Cb 0.42 -0.92 0.76 0.00 -0.72 0.00 0.00 41.12 40.66 1g3t n ASP 93 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1g3t h ILE 94 N 3.70 0.47 0.00 5.18 6.09 -1.96 0.29 117.51 131.28 1g3t h ILE 94 Ca -0.49 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.00 1g3t h ILE 94 Cb 1.40 0.72 0.00 0.00 0.47 0.00 0.00 36.82 39.41 1g3t h ILE 94 CO 0.77 0.00 0.00 0.59 -3.07 0.00 0.00 178.15 176.44 1g3t n ASN 95 N -3.87 0.00 -0.04 2.19 3.02 -1.26 -2.65 115.26 112.65 1g3t n ASN 95 Ca 0.06 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.86 1g3t n ASN 95 Cb 0.53 -0.40 0.01 0.00 -0.61 0.00 0.00 39.78 39.31 1g3t n ASN 95 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1g3t n LYS 96 N -1.40 0.85 -0.01 3.52 5.02 0.10 -4.71 118.16 121.53 1g3t n LYS 96 Ca 0.08 -0.99 -0.11 0.00 -2.02 0.00 0.00 58.31 55.26 1g3t n LYS 96 Cb 0.22 -1.02 0.02 0.00 -0.02 0.00 0.00 35.03 34.23 1g3t n LYS 96 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1g3t h VAL 97 N 0.15 1.31 0.34 -0.18 2.07 -1.34 -3.08 116.25 115.52 1g3t h VAL 97 Ca 0.00 -1.84 -0.02 0.00 0.82 0.00 0.00 66.70 65.66 1g3t h VAL 97 Cb 0.25 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.82 1g3t h VAL 97 CO 0.00 0.58 -0.16 -0.74 0.02 0.00 0.00 177.57 177.27 1g3t h HIS 98 N 0.47 -0.42 -0.14 1.57 -0.00 -1.84 -0.97 115.15 113.83 1g3t h HIS 98 Ca -0.00 -0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.38 1g3t h HIS 98 Cb 1.16 0.14 -0.02 0.00 -0.00 0.00 0.00 27.41 28.69 1g3t h HIS 98 CO 0.05 -0.20 0.02 -0.44 -0.00 0.00 0.00 177.93 177.36 1g3t h ASP 99 N -0.54 -0.01 -0.48 3.26 3.45 -1.89 -1.36 116.42 118.84 1g3t h ASP 99 Ca -0.05 0.02 0.07 0.00 0.43 0.00 0.00 57.03 57.51 1g3t h ASP 99 Cb 0.41 0.03 -0.06 0.00 -0.56 0.00 0.00 39.33 39.15 1g3t h ASP 99 CO 0.08 0.02 0.15 -0.08 -1.57 0.00 0.00 179.24 177.83 1g3t h GLU 100 N 0.07 0.30 -0.26 3.56 4.57 -1.48 -2.25 114.58 119.09 1g3t h GLU 100 Ca 0.06 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.19 1g3t h GLU 100 Cb 0.06 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.57 1g3t h GLU 100 CO -0.09 0.20 0.01 0.00 -1.18 0.00 0.00 179.01 177.95 1g3t h ALA 101 N 1.34 1.53 0.00 2.92 0.00 -0.78 -1.44 119.26 122.83 1g3t h ALA 101 Ca 0.24 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1g3t h ALA 101 Cb 0.27 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1g3t h ALA 101 CO -0.26 0.34 0.00 0.43 0.00 0.00 0.00 179.25 179.76 1g3t n SER 102 N -4.34 0.57 -0.13 0.00 7.64 -0.55 -1.14 113.62 115.67 1g3t n SER 102 Ca 0.01 0.65 -0.27 0.00 1.01 0.00 0.00 58.87 60.28 1g3t n SER 102 Cb 0.20 -0.77 -0.11 0.00 -1.01 0.00 0.00 64.21 62.53 1g3t n SER 102 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1g3t n ARG 103 N -2.14 0.60 0.27 1.43 1.74 -0.83 -4.45 116.66 113.28 1g3t n ARG 103 Ca 0.02 0.31 0.12 0.00 -0.77 0.00 0.00 57.85 57.52 1g3t n ARG 103 Cb 0.20 -1.55 0.77 0.00 -1.02 0.00 0.00 32.46 30.85 1g3t n ARG 103 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1g3t h TRP 104 N -0.83 0.00 0.00 -1.55 4.06 -1.13 -2.62 115.95 113.88 1g3t h TRP 104 Ca -0.61 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.34 1g3t h TRP 104 Cb 1.61 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.77 1g3t h TRP 104 CO -0.03 0.05 -0.00 1.05 -3.56 0.00 0.00 178.44 175.95 1g3t h GLU 105 N 0.00 0.00 0.00 0.49 4.11 -1.35 -1.70 114.58 116.14 1g3t h GLU 105 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1g3t h GLU 105 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1g3t h GLU 105 CO 0.01 0.00 -0.71 0.72 0.07 0.00 0.00 179.01 179.10 1g3t n HIS 106 N -3.62 0.35 0.17 2.06 8.25 -0.99 -4.41 115.22 117.03 1g3t n HIS 106 Ca -0.03 0.10 0.03 0.00 -0.26 0.00 0.00 57.72 57.56 1g3t n HIS 106 Cb 0.08 -0.50 -0.04 0.00 1.12 0.00 0.00 29.99 30.65 1g3t n HIS 106 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1g3t n VAL 107 N -1.93 0.00 -2.43 1.59 0.24 -0.71 -5.01 118.33 110.07 1g3t n VAL 107 Ca 0.03 -0.26 -0.42 0.00 -2.04 0.00 0.00 64.34 61.65 1g3t n VAL 107 Cb 0.41 0.71 -0.03 0.00 -1.47 0.00 0.00 33.84 33.47 1g3t n VAL 107 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1g3t s MET 108 N -1.98 4.36 0.59 7.34 -1.94 -0.79 -5.03 119.30 121.85 1g3t s MET 108 Ca 0.00 1.71 -0.09 0.00 -1.71 0.00 0.00 55.69 55.60 1g3t s MET 108 Cb 0.05 -3.53 -0.03 0.00 2.01 0.00 0.00 34.83 33.32 1g3t s MET 108 CO 0.27 -0.43 0.97 -1.54 -0.01 0.00 0.00 175.02 174.28 1g3t s SER 109 N 1.46 6.16 0.46 3.03 1.04 -1.26 -4.94 113.70 119.65 1g3t s SER 109 Ca 0.57 1.26 0.12 0.00 0.48 0.00 0.00 55.95 58.37 1g3t s SER 109 Cb -0.26 -2.35 1.04 0.00 0.10 0.00 0.00 66.02 64.54 1g3t s SER 109 CO 0.23 -0.84 2.08 0.44 0.98 0.00 0.00 173.24 176.13 1g3t h ASP 110 N -0.21 0.21 -0.98 7.02 3.32 -1.99 -0.76 116.42 123.03 1g3t h ASP 110 Ca -0.45 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 56.61 1g3t h ASP 110 Cb 1.20 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.65 1g3t h ASP 110 CO 0.62 0.19 0.65 -0.33 -1.72 0.00 0.00 179.24 178.64 1g3t h GLU 111 N 0.24 1.26 0.00 3.56 3.07 -2.00 -0.24 114.58 120.48 1g3t h GLU 111 Ca 0.06 -0.08 -0.13 0.00 -0.50 0.00 0.00 59.36 58.71 1g3t h GLU 111 Cb 0.05 -0.28 -0.02 0.00 -0.84 0.00 0.00 28.75 27.65 1g3t h GLU 111 CO -0.01 0.84 -0.62 0.28 -1.40 0.00 0.00 179.01 178.09 1g3t h VAL 112 N 1.30 1.42 -0.19 3.13 2.07 -1.53 -2.88 116.25 119.57 1g3t h VAL 112 Ca 0.37 -2.16 -0.09 0.00 0.82 0.00 0.00 66.70 65.64 1g3t h VAL 112 Cb -0.11 2.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1g3t h VAL 112 CO -0.09 0.61 -0.22 -0.33 0.02 0.00 0.00 177.57 177.56 1g3t h GLU 113 N 0.00 0.49 -0.20 1.57 5.08 -0.59 -0.67 114.58 120.27 1g3t h GLU 113 Ca -0.01 -0.27 -0.05 0.00 -1.00 0.00 0.00 59.36 58.03 1g3t h GLU 113 Cb 1.12 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1g3t h GLU 113 CO 0.08 0.86 -0.09 0.00 -1.00 0.00 0.00 179.01 178.86 1g3t h ARG 114 N 0.16 0.30 -0.09 2.33 3.08 -1.10 -1.43 114.38 117.64 1g3t h ARG 114 Ca 0.03 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1g3t h ARG 114 Cb 0.78 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.79 1g3t h ARG 114 CO 0.05 0.41 -0.09 0.00 -1.07 0.00 0.00 179.97 179.27 1g3t h ARG 115 N 0.29 0.21 -0.93 0.04 2.47 -1.38 -2.88 114.38 112.21 1g3t h ARG 115 Ca 0.06 -0.11 0.06 0.00 -1.26 0.00 0.00 59.98 58.73 1g3t h ARG 115 Cb 0.34 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.60 1g3t h ARG 115 CO 0.02 0.64 0.59 -0.07 0.56 0.00 0.00 179.97 181.71 1g3t h LEU 116 N -0.21 0.94 -1.83 3.04 3.38 -0.78 0.28 115.31 120.13 1g3t h LEU 116 Ca 0.01 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1g3t h LEU 116 Cb 0.61 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1g3t h LEU 116 CO 0.02 0.60 -0.04 0.58 0.09 0.00 0.00 178.44 179.69 1g3t h VAL 117 N 1.08 1.06 0.11 1.22 2.07 -1.27 0.36 116.25 120.88 1g3t h VAL 117 Ca 0.40 -0.24 -0.28 0.00 0.82 0.00 0.00 66.70 67.40 1g3t h VAL 117 Cb 0.17 1.08 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1g3t h VAL 117 CO -0.17 0.07 -1.36 0.11 0.02 0.00 0.00 177.57 176.24 1g3t h LYS 118 N 0.05 0.23 0.00 1.57 1.57 -0.72 -3.36 116.57 115.91 1g3t h LYS 118 Ca 0.01 -0.40 -0.03 0.00 -1.87 0.00 0.00 60.65 58.36 1g3t h LYS 118 Cb 0.11 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1g3t h LYS 118 CO 0.01 1.13 -0.94 -0.39 -0.57 0.00 0.00 179.45 178.69 1g3t h VAL 119 N 0.06 0.11 -4.00 0.50 -1.51 0.19 -3.47 116.25 108.13 1g3t h VAL 119 Ca -0.18 -1.20 -0.48 0.00 -1.23 0.00 0.00 66.70 63.61 1g3t h VAL 119 Cb 1.98 1.67 0.02 0.00 -2.13 0.00 0.00 31.29 32.83 1g3t h VAL 119 CO 0.18 0.06 0.27 -0.76 -1.23 0.00 0.00 177.57 176.09 1g3t s LEU 120 N -5.57 3.67 0.02 4.19 1.43 0.12 -5.00 118.68 117.54 1g3t s LEU 120 Ca 0.00 1.37 -0.21 0.00 -1.03 0.00 0.00 54.13 54.26 1g3t s LEU 120 Cb 0.09 -4.30 -0.17 0.00 0.03 0.00 0.00 46.19 41.84 1g3t s LEU 120 CO 0.78 -0.54 1.25 0.07 0.23 0.00 0.00 176.35 178.14 1g3t h LYS 121 N 0.92 0.34 -2.80 1.70 5.09 -1.91 -3.46 116.57 116.46 1g3t h LYS 121 Ca -0.47 -0.23 -0.18 0.00 0.09 0.00 0.00 60.65 59.86 1g3t h LYS 121 Cb 1.19 0.03 -0.31 0.00 0.10 0.00 0.00 32.23 33.24 1g3t h LYS 121 CO 0.62 0.84 -0.48 0.34 -2.09 0.00 0.00 179.45 178.68 1g3t s ASP 122 N -6.27 0.13 -0.35 7.07 -1.08 -1.26 -5.05 116.67 109.86 1g3t s ASP 122 Ca -0.14 0.68 0.07 0.00 -0.52 0.00 0.00 52.55 52.64 1g3t s ASP 122 Cb 0.04 0.81 0.49 0.00 -1.46 0.00 0.00 42.92 42.79 1g3t s ASP 122 CO 0.76 -0.23 1.47 1.33 0.52 0.00 0.00 175.17 179.02 1g3t n VAL 123 N 5.20 2.70 -0.04 1.11 0.24 -1.26 -4.71 118.33 121.57 1g3t n VAL 123 Ca -0.09 -3.20 -0.14 0.00 -2.04 0.00 0.00 64.34 58.86 1g3t n VAL 123 Cb 0.50 -0.66 -0.09 0.00 -1.47 0.00 0.00 33.84 32.12 1g3t n VAL 123 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1g3t h SER 124 N 1.47 0.36 -5.56 -1.34 0.02 -1.96 -3.38 113.55 103.15 1g3t h SER 124 Ca 0.32 -0.58 -0.23 0.00 -0.84 0.00 0.00 61.79 60.46 1g3t h SER 124 Cb 1.50 -0.11 -0.14 0.00 0.14 0.00 0.00 62.40 63.79 1g3t h SER 124 CO 0.66 0.88 -0.56 0.00 -1.14 0.00 0.00 176.83 176.67 1g3t s ARG 125 N -3.89 1.26 0.67 3.45 1.70 -1.26 0.14 118.95 121.02 1g3t s ARG 125 Ca -0.14 -1.60 -0.11 0.00 -0.47 0.00 0.00 55.73 53.41 1g3t s ARG 125 Cb 0.04 0.29 0.00 0.00 -0.57 0.00 0.00 34.95 34.72 1g3t s ARG 125 CO 0.76 -0.43 1.06 -1.54 -1.08 0.00 0.00 175.30 174.07 1g3t s SER 126 N -3.15 5.62 0.00 -2.89 1.04 0.35 -4.72 113.70 109.95 1g3t s SER 126 Ca 0.37 1.13 0.03 0.00 0.48 0.00 0.00 55.95 57.96 1g3t s SER 126 Cb 0.06 -2.00 0.16 0.00 0.10 0.00 0.00 66.02 64.33 1g3t s SER 126 CO 0.12 -1.21 0.98 -0.81 0.98 0.00 0.00 173.24 173.30 1g3t n PRO 127 N -2.90 0.03 -0.29 4.02 -0.04 -1.26 -1.12 135.00 133.44 1g3t n PRO 127 Ca 0.06 0.31 0.11 0.00 -0.04 0.00 0.00 63.50 63.95 1g3t n PRO 127 Cb 0.57 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.81 1g3t n PRO 127 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1g3t n PHE 128 N -1.35 0.77 0.00 0.54 3.72 -1.26 -4.97 117.46 114.91 1g3t n PHE 128 Ca 0.01 -0.38 0.00 0.00 -0.05 0.00 0.00 57.45 57.03 1g3t n PHE 128 Cb 0.03 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 1g3t n PHE 128 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1g3t n GLY 129 N 1.53 2.87 3.74 1.37 0.00 -0.28 -5.06 105.19 109.36 1g3t n GLY 129 Ca 0.21 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1g3t n GLY 129 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1g3t s ASN 130 N 0.77 7.42 0.52 1.61 0.02 -1.26 -4.66 114.94 119.36 1g3t s ASN 130 Ca 0.00 2.02 -0.22 0.00 -1.02 0.00 0.00 52.86 53.64 1g3t s ASN 130 Cb 0.00 -2.61 -0.06 0.00 0.02 0.00 0.00 41.25 38.61 1g3t s ASN 130 CO 0.00 -0.07 1.26 -2.16 0.02 0.00 0.00 177.10 176.15 1g3t s PRO 131 N -0.71 3.36 -0.48 -0.60 0.04 -1.26 0.13 135.00 135.48 1g3t s PRO 131 Ca 0.46 2.00 -0.26 0.00 0.04 0.00 0.00 61.00 63.23 1g3t s PRO 131 Cb -0.28 -2.27 0.03 0.00 0.04 0.00 0.00 34.50 32.02 1g3t s PRO 131 CO 0.34 -0.94 0.98 0.42 0.04 0.00 0.00 177.00 177.84 1g3t s ILE 132 N -1.44 4.39 0.74 0.56 1.01 0.12 -4.72 121.20 121.87 1g3t s ILE 132 Ca 0.69 0.81 -0.11 0.00 0.00 0.00 0.00 60.65 62.04 1g3t s ILE 132 Cb -0.34 -4.49 0.04 0.00 0.01 0.00 0.00 42.46 37.67 1g3t s ILE 132 CO 0.41 -0.91 1.08 -2.16 0.00 0.00 0.00 174.94 173.35 1g3t s PRO 133 N 3.96 2.55 -1.83 2.79 0.04 -1.26 -4.43 135.00 136.82 1g3t s PRO 133 Ca 0.39 0.75 0.00 0.00 0.04 0.00 0.00 61.00 62.18 1g3t s PRO 133 Cb -0.10 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.48 1g3t s PRO 133 CO 0.27 -1.32 0.00 0.41 0.04 0.00 0.00 177.00 176.40 1g3t n GLY 134 N -2.16 0.53 0.26 0.56 0.00 -1.26 -4.52 105.19 98.60 1g3t n GLY 134 Ca 0.07 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 1g3t n GLY 134 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1g3t h LEU 135 N 0.00 0.76 -0.63 0.99 3.38 -1.92 -1.55 115.31 116.35 1g3t h LEU 135 Ca -0.43 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.24 1g3t h LEU 135 Cb 1.30 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.81 1g3t h LEU 135 CO 0.56 1.00 0.39 0.44 0.09 0.00 0.00 178.44 180.92 1g3t h ASP 136 N 0.63 0.74 0.86 -0.43 3.32 -1.90 0.15 116.42 119.79 1g3t h ASP 136 Ca 0.08 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1g3t h ASP 136 Cb 0.80 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1g3t h ASP 136 CO 0.07 0.56 0.00 -0.62 -1.72 0.00 0.00 179.24 177.53 1g3t n GLU 137 N -4.62 0.21 0.07 3.56 4.71 -1.06 -0.92 120.64 122.60 1g3t n GLU 137 Ca 0.05 0.39 0.12 0.00 -0.01 0.00 0.00 57.16 57.71 1g3t n GLU 137 Cb 0.04 -1.86 0.25 0.00 -1.01 0.00 0.00 31.44 28.86 1g3t n GLU 137 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1g3t n LEU 138 N -2.24 0.72 0.00 -4.62 7.94 -0.04 -4.91 117.00 113.85 1g3t n LEU 138 Ca 0.03 0.33 0.00 0.00 -1.11 0.00 0.00 56.01 55.25 1g3t n LEU 138 Cb 0.26 -0.23 0.00 0.00 0.53 0.00 0.00 43.42 43.99 1g3t n LEU 138 CO 0.22 -0.09 0.00 0.61 -1.11 0.00 0.00 177.39 177.02 1g3t n GLY 139 N 1.34 1.25 0.64 -3.96 0.00 -0.09 -4.93 105.19 99.43 1g3t n GLY 139 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1g3t n GLY 139 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1g3t n VAL 140 N -2.00 0.27 -3.62 1.61 0.24 -1.00 -5.00 118.33 108.83 1g3t n VAL 140 Ca 0.00 -0.03 -0.08 0.00 -2.04 0.00 0.00 64.34 62.19 1g3t n VAL 140 Cb 0.00 -0.60 -0.06 0.00 -1.47 0.00 0.00 33.84 31.71 1g3t n VAL 140 CO 0.00 0.00 0.00 0.57 -2.14 0.00 0.00 176.83 175.26 1g3t s PRO 148 N -0.82 0.45 2.23 7.34 0.08 -1.26 -4.27 135.00 138.75 1g3t s PRO 148 Ca 0.01 0.31 0.00 0.00 0.08 0.00 0.00 61.00 61.40 1g3t s PRO 148 Cb 0.01 0.21 0.00 0.00 0.08 0.00 0.00 34.50 34.80 1g3t s PRO 148 CO 0.00 -0.10 0.00 0.41 0.08 0.00 0.00 177.00 177.39 1g3t n GLY 149 N 1.42 -1.24 3.11 0.57 0.00 -1.26 -4.62 105.19 103.17 1g3t n GLY 149 Ca -0.10 -1.27 -0.24 0.00 0.00 0.00 0.00 46.02 44.41 1g3t n GLY 149 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1g3t s THR 150 N 0.00 1.27 -0.05 2.61 2.01 0.14 -4.86 115.64 116.75 1g3t s THR 150 Ca 0.00 -0.65 -0.34 0.00 0.31 0.00 0.00 61.69 61.01 1g3t s THR 150 Cb 0.00 -1.08 -0.12 0.00 0.01 0.00 0.00 72.50 71.30 1g3t s THR 150 CO 0.00 0.37 1.81 -2.11 -0.69 0.00 0.00 174.62 174.00 1g3t n ARG 151 N 3.01 2.11 0.31 4.92 1.85 -1.26 -0.80 116.66 126.81 1g3t n ARG 151 Ca -0.17 0.77 0.10 0.00 -1.00 0.00 0.00 57.85 57.55 1g3t n ARG 151 Cb 0.54 -2.60 0.47 0.00 -1.05 0.00 0.00 32.46 29.83 1g3t n ARG 151 CO 0.00 0.00 0.00 -0.24 -0.01 0.00 0.00 177.63 177.38 1g3t h VAL 152 N 5.08 0.01 -0.65 8.89 3.04 -0.27 0.85 116.25 133.21 1g3t h VAL 152 Ca -0.48 0.00 -0.07 0.00 -1.01 0.00 0.00 66.70 65.14 1g3t h VAL 152 Cb 1.27 0.38 -0.03 0.00 -2.01 0.00 0.00 31.29 30.90 1g3t h VAL 152 CO 0.94 0.00 0.13 -0.29 -1.01 0.00 0.00 177.57 177.34 1g3t h ILE 153 N 0.00 1.26 0.03 3.17 2.10 -1.66 0.24 117.51 122.65 1g3t h ILE 153 Ca 0.02 -0.97 -0.00 0.00 1.08 0.00 0.00 64.86 64.99 1g3t h ILE 153 Cb 1.29 0.61 0.00 0.00 -1.09 0.00 0.00 36.82 37.63 1g3t h ILE 153 CO -0.00 0.36 -0.01 0.44 -1.08 0.00 0.00 178.15 177.86 1g3t h ASP 154 N 0.99 -0.03 -0.50 2.19 3.45 -1.14 -3.35 116.42 118.02 1g3t h ASP 154 Ca 0.20 -0.12 0.15 0.00 0.43 0.00 0.00 57.03 57.69 1g3t h ASP 154 Cb 0.38 0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 39.14 1g3t h ASP 154 CO 0.01 0.52 0.39 0.00 -1.57 0.00 0.00 179.24 178.59 1g3t h ALA 155 N -0.88 2.40 -0.95 3.45 0.00 -1.57 -3.40 119.26 118.31 1g3t h ALA 155 Ca -0.00 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.65 1g3t h ALA 155 Cb 0.15 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1g3t h ALA 155 CO 0.01 -0.65 0.80 0.00 0.00 0.00 0.00 179.25 179.40 1g3t s ALA 156 N -4.91 1.19 0.51 0.00 0.00 0.07 -4.93 121.76 113.70 1g3t s ALA 156 Ca -0.05 -0.48 -0.19 0.00 0.00 0.00 0.00 51.96 51.24 1g3t s ALA 156 Cb 0.19 -4.47 -0.07 0.00 0.00 0.00 0.00 23.12 18.77 1g3t s ALA 156 CO 0.68 -5.17 1.04 0.99 0.00 0.00 0.00 175.76 173.30 1g3t s THR 157 N 13.25 3.83 -1.99 0.00 2.01 -1.26 -3.92 115.64 127.56 1g3t s THR 157 Ca 0.92 1.06 0.07 0.00 0.31 0.00 0.00 61.69 64.05 1g3t s THR 157 Cb -0.14 -3.45 0.20 0.00 0.01 0.00 0.00 72.50 69.12 1g3t s THR 157 CO 0.16 -0.33 0.89 -1.20 -0.69 0.00 0.00 174.62 173.45 1g3t n SER 158 N -1.26 0.00 -4.27 3.53 7.64 -1.26 0.42 113.62 118.42 1g3t n SER 158 Ca 0.09 -0.22 -0.33 0.00 1.01 0.00 0.00 58.87 59.42 1g3t n SER 158 Cb 0.53 -0.01 -0.15 0.00 -1.01 0.00 0.00 64.21 63.57 1g3t n SER 158 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1g3t s MET 159 N -2.01 3.23 -0.84 1.43 0.23 -1.26 -4.55 119.30 115.53 1g3t s MET 159 Ca 0.11 -0.74 -0.22 0.00 -1.03 0.00 0.00 55.69 53.81 1g3t s MET 159 Cb 0.05 -2.66 -0.18 0.00 -1.53 0.00 0.00 34.83 30.51 1g3t s MET 159 CO 0.08 0.00 2.20 -2.30 -2.03 0.00 0.00 175.02 172.98 1g3t n PRO 160 N 4.11 0.32 -4.04 3.16 -0.02 -1.26 -4.58 135.00 132.69 1g3t n PRO 160 Ca -0.19 -0.91 -0.34 0.00 -2.02 0.00 0.00 63.50 60.04 1g3t n PRO 160 Cb 0.52 -3.22 -0.06 0.00 -0.02 0.00 0.00 33.50 30.71 1g3t n PRO 160 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1g3t s ARG 161 N 8.31 3.22 -0.02 -0.52 3.52 -0.30 -4.84 118.95 128.32 1g3t s ARG 161 Ca 0.89 -0.38 -0.19 0.00 -0.13 0.00 0.00 55.73 55.91 1g3t s ARG 161 Cb -0.20 -2.97 -0.05 0.00 -1.56 0.00 0.00 34.95 30.17 1g3t s ARG 161 CO 0.17 0.68 0.54 0.21 -0.81 0.00 0.00 175.30 176.09 1g3t s LYS 162 N -1.62 4.25 0.00 5.12 2.20 -1.26 -0.21 119.74 128.22 1g3t s LYS 162 Ca 0.22 0.63 0.00 0.00 -0.36 0.00 0.00 55.97 56.47 1g3t s LYS 162 Cb -0.12 -3.33 0.00 0.00 -1.51 0.00 0.00 37.83 32.87 1g3t s LYS 162 CO 0.13 0.40 0.00 1.33 -0.36 0.00 0.00 175.35 176.85 1g3t n VAL 163 N 2.69 0.00 -3.68 4.02 0.24 -0.26 -4.50 118.33 116.83 1g3t n VAL 163 Ca -0.08 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.07 1g3t n VAL 163 Cb 0.51 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 32.74 1g3t n VAL 163 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1g3t s ARG 164 N 1.81 0.09 -0.02 7.34 3.52 -0.36 -2.93 118.95 128.41 1g3t s ARG 164 Ca 0.00 0.61 -0.30 0.00 -0.13 0.00 0.00 55.73 55.91 1g3t s ARG 164 Cb 0.00 -0.17 -0.07 0.00 -1.56 0.00 0.00 34.95 33.16 1g3t s ARG 164 CO 0.00 -0.27 1.71 0.42 -0.81 0.00 0.00 175.30 176.34 1g3t s ILE 165 N 2.15 3.40 -0.18 4.11 -1.09 0.13 -0.70 121.20 129.02 1g3t s ILE 165 Ca 0.00 0.55 -0.05 0.00 -2.23 0.00 0.00 60.65 58.93 1g3t s ILE 165 Cb -0.12 -3.36 -0.22 0.00 -1.58 0.00 0.00 42.46 37.19 1g3t s ILE 165 CO -0.07 -0.04 0.13 0.52 -1.23 0.00 0.00 174.94 174.24 1g3t n VAL 166 N 5.37 1.66 -3.57 2.92 0.31 0.55 -0.82 118.33 124.75 1g3t n VAL 166 Ca 0.17 -0.58 -0.16 0.00 -0.01 0.00 0.00 64.34 63.76 1g3t n VAL 166 Cb 0.42 -1.65 -0.06 0.00 -0.91 0.00 0.00 33.84 31.64 1g3t n VAL 166 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1g3t s GLN 167 N -2.53 0.94 -0.17 5.55 -2.07 -0.80 -4.78 119.66 115.80 1g3t s GLN 167 Ca -0.28 0.57 0.13 0.00 -1.82 0.00 0.00 55.36 53.97 1g3t s GLN 167 Cb 0.08 0.45 -0.23 0.00 -1.09 0.00 0.00 33.01 32.21 1g3t s GLN 167 CO 0.69 -0.22 0.18 -0.89 -1.32 0.00 0.00 175.29 173.73 1g3t n ILE 168 N 1.68 1.48 -2.88 3.63 2.08 -1.26 -0.57 119.36 123.52 1g3t n ILE 168 Ca -0.17 -0.79 -0.21 0.00 0.56 0.00 0.00 62.75 62.15 1g3t n ILE 168 Cb 0.56 -0.81 0.03 0.00 -0.75 0.00 0.00 39.64 38.67 1g3t n ILE 168 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 1g3t n ASN 169 N -2.94 -5.82 0.19 4.38 3.02 -1.26 -4.00 115.26 108.82 1g3t n ASN 169 Ca -0.31 -0.23 0.13 0.00 -0.03 0.00 0.00 54.58 54.14 1g3t n ASN 169 Cb 1.10 -4.68 0.67 0.00 -0.61 0.00 0.00 39.78 36.27 1g3t n ASN 169 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1g3t h GLU 170 N -1.11 0.00 -0.01 3.52 3.07 -1.95 -2.07 114.58 116.03 1g3t h GLU 170 Ca -0.49 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.25 1g3t h GLU 170 Cb 1.34 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.24 1g3t h GLU 170 CO 0.54 0.00 -0.55 0.97 -1.40 0.00 0.00 179.01 178.56 1g3t h ILE 171 N 0.00 1.40 0.00 3.13 2.10 -2.04 -2.84 117.51 119.26 1g3t h ILE 171 Ca 0.00 -1.90 0.00 0.00 1.08 0.00 0.00 64.86 64.04 1g3t h ILE 171 Cb 0.08 2.02 0.00 0.00 -1.09 0.00 0.00 36.82 37.83 1g3t h ILE 171 CO 0.00 0.54 -0.34 0.49 -1.08 0.00 0.00 178.15 177.76 1g3t n PHE 172 N -3.88 0.31 -2.50 2.19 3.72 -0.78 -4.87 117.46 111.64 1g3t n PHE 172 Ca -0.01 0.09 -0.42 0.00 -0.05 0.00 0.00 57.45 57.06 1g3t n PHE 172 Cb 0.56 -0.54 -0.03 0.00 -0.94 0.00 0.00 39.48 38.53 1g3t n PHE 172 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1g3t s GLN 173 N -3.06 4.47 -0.21 -1.08 -1.52 -1.07 -4.92 119.66 112.26 1g3t s GLN 173 Ca 0.10 1.68 -0.05 0.00 -1.95 0.00 0.00 55.36 55.14 1g3t s GLN 173 Cb 0.16 -3.38 -0.20 0.00 -0.22 0.00 0.00 33.01 29.38 1g3t s GLN 173 CO 0.65 -0.20 -0.02 0.28 -0.25 0.00 0.00 175.29 175.75 1g3t n VAL 174 N 3.91 1.59 -2.73 1.09 0.31 -1.26 -4.78 118.33 116.46 1g3t n VAL 174 Ca 0.08 -0.53 -0.42 0.00 -0.01 0.00 0.00 64.34 63.45 1g3t n VAL 174 Cb 0.48 -1.63 -0.03 0.00 -0.91 0.00 0.00 33.84 31.74 1g3t n VAL 174 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1g3t s GLU 175 N -2.52 3.34 0.00 5.55 0.41 -1.26 -4.86 118.70 119.36 1g3t s GLU 175 Ca -0.31 -0.18 0.21 0.00 -0.41 0.00 0.00 54.97 54.28 1g3t s GLU 175 Cb 0.09 -4.08 0.57 0.00 -1.78 0.00 0.00 34.13 28.93 1g3t s GLU 175 CO 0.64 -1.66 1.46 0.25 -0.49 0.00 0.00 175.26 175.46 1g3t n THR 176 N 6.32 0.38 -0.27 3.63 -2.24 -1.26 -4.62 114.28 116.22 1g3t n THR 176 Ca 0.03 -0.54 -0.05 0.00 -2.27 0.00 0.00 64.05 61.22 1g3t n THR 176 Cb 0.48 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 1g3t n THR 176 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1g3t h ASP 177 N 3.21 -1.36 -0.24 3.42 3.32 -2.01 -1.56 116.42 121.19 1g3t h ASP 177 Ca 0.00 0.26 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1g3t h ASP 177 Cb 0.71 0.67 0.00 0.00 0.22 0.00 0.00 39.33 40.93 1g3t h ASP 177 CO 0.00 -0.30 0.00 0.00 -1.72 0.00 0.00 179.24 177.22 1g3t n GLN 178 N -5.43 1.59 -0.18 3.56 6.02 -1.26 -4.25 117.38 117.42 1g3t n GLN 178 Ca 0.05 -0.87 -0.06 0.00 -0.01 0.00 0.00 57.00 56.11 1g3t n GLN 178 Cb 0.36 -1.21 0.04 0.00 1.02 0.00 0.00 30.24 30.45 1g3t n GLN 178 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 1g3t h PHE 179 N 1.40 0.61 0.04 1.08 -1.00 -1.61 -0.10 116.94 117.36 1g3t h PHE 179 Ca 0.00 0.02 -0.22 0.00 2.81 0.00 0.00 57.97 60.58 1g3t h PHE 179 Cb 0.35 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 39.69 1g3t h PHE 179 CO 0.17 0.36 -1.02 1.15 -1.61 0.00 0.00 178.31 177.36 1g3t h THR 180 N 0.65 1.59 -0.82 -1.55 2.02 -1.79 -2.53 112.91 110.48 1g3t h THR 180 Ca 0.21 -3.08 0.09 0.00 0.77 0.00 0.00 66.41 64.40 1g3t h THR 180 Cb -0.01 2.76 -0.07 0.00 -1.74 0.00 0.00 68.15 69.09 1g3t h THR 180 CO -0.08 0.89 0.47 -0.61 0.37 0.00 0.00 175.52 176.56 1g3t h GLN 181 N 0.05 0.78 -0.01 6.66 4.15 -1.66 0.34 115.11 125.42 1g3t h GLN 181 Ca -0.05 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.32 1g3t h GLN 181 Cb 1.73 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 29.25 1g3t h GLN 181 CO 0.15 0.52 -0.00 -0.07 -1.93 0.00 0.00 178.83 177.49 1g3t h LEU 182 N 0.81 0.01 -0.83 -2.39 3.38 -1.00 -2.57 115.31 112.71 1g3t h LEU 182 Ca 0.39 -0.42 0.06 0.00 0.09 0.00 0.00 57.88 58.01 1g3t h LEU 182 Cb 0.34 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 1g3t h LEU 182 CO -0.24 0.43 0.51 -0.07 0.09 0.00 0.00 178.44 179.16 1g3t h LEU 183 N -0.41 0.79 -0.72 1.67 3.38 -0.96 -1.33 115.31 117.73 1g3t h LEU 183 Ca 0.00 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1g3t h LEU 183 Cb 0.42 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 1g3t h LEU 183 CO 0.00 0.50 0.47 0.44 0.09 0.00 0.00 178.44 179.94 1g3t h ASP 184 N 0.92 0.79 -0.08 -0.43 3.32 -0.30 0.58 116.42 121.22 1g3t h ASP 184 Ca 0.37 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1g3t h ASP 184 Cb 0.19 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1g3t h ASP 184 CO -0.18 0.56 0.00 0.00 -1.72 0.00 0.00 179.24 177.90 1g3t n ALA 185 N -2.31 2.62 -2.85 3.45 0.00 -0.82 -4.86 120.51 115.74 1g3t n ALA 185 Ca 0.07 -0.21 -0.14 0.00 0.00 0.00 0.00 53.44 53.16 1g3t n ALA 185 Cb 0.05 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.48 1g3t n ALA 185 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1g3t n ASP 186 N -0.01 -2.89 -4.48 0.00 9.92 0.19 -4.09 116.55 115.19 1g3t n ASP 186 Ca 0.03 0.03 -0.43 0.00 -0.53 0.00 0.00 54.79 53.89 1g3t n ASP 186 Cb 0.28 -2.48 -0.06 0.00 -0.64 0.00 0.00 41.12 38.22 1g3t n ASP 186 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1g3t s ILE 187 N -2.57 4.84 0.33 0.53 1.01 -0.57 -4.92 121.20 119.85 1g3t s ILE 187 Ca 0.17 -0.19 0.06 0.00 0.00 0.00 0.00 60.65 60.69 1g3t s ILE 187 Cb -0.09 -4.26 -0.03 0.00 0.01 0.00 0.00 42.46 38.09 1g3t s ILE 187 CO 0.20 -0.72 0.23 -0.13 0.00 0.00 0.00 174.94 174.53 1g3t s ARG 188 N 2.76 1.72 0.16 2.79 0.52 -1.26 -4.43 118.95 121.21 1g3t s ARG 188 Ca 0.19 -2.00 -0.31 0.00 -0.52 0.00 0.00 55.73 53.09 1g3t s ARG 188 Cb -0.16 0.16 -0.10 0.00 0.52 0.00 0.00 34.95 35.36 1g3t s ARG 188 CO 0.15 -0.59 1.61 0.08 0.02 0.00 0.00 175.30 176.57 1g3t s VAL 189 N -3.49 2.60 0.00 3.52 1.01 -1.26 -0.77 120.40 122.00 1g3t s VAL 189 Ca 0.38 0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.74 1g3t s VAL 189 Cb 0.03 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.16 1g3t s VAL 189 CO 0.24 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.97 1g3t n GLY 190 N 3.83 0.90 3.74 4.51 0.00 -0.00 -5.00 105.19 113.17 1g3t n GLY 190 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1g3t n GLY 190 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1g3t s SER 191 N -1.78 7.35 -0.29 1.61 0.01 0.05 -4.71 113.70 115.94 1g3t s SER 191 Ca 0.00 2.02 -0.23 0.00 1.31 0.00 0.00 55.95 59.05 1g3t s SER 191 Cb 0.00 -2.60 -0.00 0.00 0.21 0.00 0.00 66.02 63.62 1g3t s SER 191 CO 0.00 -0.15 0.75 -1.61 0.41 0.00 0.00 173.24 172.64 1g3t s GLU 192 N -0.41 3.99 0.02 12.44 8.01 -1.26 -0.69 118.70 140.80 1g3t s GLU 192 Ca 0.48 0.57 0.04 0.00 0.01 0.00 0.00 54.97 56.06 1g3t s GLU 192 Cb -0.28 -3.71 -0.02 0.00 -4.31 0.00 0.00 34.13 25.81 1g3t s GLU 192 CO 0.34 -0.61 -0.13 0.14 0.01 0.00 0.00 175.26 175.01 1g3t s VAL 193 N 2.83 0.98 -0.11 2.63 -7.23 -1.15 -4.84 120.40 113.52 1g3t s VAL 193 Ca 0.31 -0.82 -0.26 0.00 -1.81 0.00 0.00 61.98 59.39 1g3t s VAL 193 Cb -0.15 -0.88 -0.02 0.00 0.56 0.00 0.00 36.38 35.89 1g3t s VAL 193 CO 0.11 0.06 0.85 -0.70 -0.31 0.00 0.00 175.10 175.11 1g3t s GLU 194 N -0.87 4.39 0.08 4.82 2.12 -0.64 -1.10 118.70 127.50 1g3t s GLU 194 Ca 0.02 1.10 0.09 0.00 0.36 0.00 0.00 54.97 56.53 1g3t s GLU 194 Cb -0.07 -3.52 -0.03 0.00 0.26 0.00 0.00 34.13 30.77 1g3t s GLU 194 CO 0.01 -0.18 -0.23 0.96 -0.54 0.00 0.00 175.26 175.28 1g3t s ILE 195 N 1.61 1.86 -0.06 -3.70 -4.36 0.71 -0.82 121.20 116.45 1g3t s ILE 195 Ca 0.42 -1.47 -0.30 0.00 -0.26 0.00 0.00 60.65 59.04 1g3t s ILE 195 Cb -0.18 -1.65 0.09 0.00 1.25 0.00 0.00 42.46 41.97 1g3t s ILE 195 CO 0.17 0.10 0.76 0.54 0.24 0.00 0.00 174.94 176.75 1g3t s VAL 196 N -0.99 0.00 -0.07 8.37 0.11 -1.23 -1.15 120.40 125.44 1g3t s VAL 196 Ca 0.09 0.00 -0.19 0.00 -2.93 0.00 0.00 61.98 58.95 1g3t s VAL 196 Cb -0.10 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.71 1g3t s VAL 196 CO 0.04 0.00 0.52 -0.62 -3.33 0.00 0.00 175.10 171.71 1g3t s ASP 197 N -1.37 6.80 0.00 3.54 -1.08 0.17 -3.31 116.67 121.42 1g3t s ASP 197 Ca -0.07 0.96 0.00 0.00 -0.52 0.00 0.00 52.55 52.92 1g3t s ASP 197 Cb -0.00 -2.32 0.00 0.00 -1.46 0.00 0.00 42.92 39.14 1g3t s ASP 197 CO 0.05 0.05 0.00 0.54 0.52 0.00 0.00 175.17 176.33 1g3t n ARG 198 N 3.25 0.00 0.00 4.34 5.12 -1.26 -4.50 116.66 123.61 1g3t n ARG 198 Ca -0.07 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.85 1g3t n ARG 198 Cb 0.51 -0.16 0.00 0.00 -1.16 0.00 0.00 32.46 31.65 1g3t n ARG 198 CO 0.00 0.00 0.00 -2.39 -1.93 0.00 0.00 177.63 173.31 1g3t n HIS 201 N -1.78 0.00 -3.26 -1.55 -0.00 -1.26 -5.10 115.22 102.26 1g3t n HIS 201 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 57.72 57.33 1g3t n HIS 201 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 29.93 1g3t n HIS 201 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1g3t s ILE 202 N 0.00 5.13 0.06 0.61 1.01 -1.26 -4.99 121.20 121.76 1g3t s ILE 202 Ca 0.00 0.97 0.04 0.00 0.00 0.00 0.00 60.65 61.66 1g3t s ILE 202 Cb 0.00 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 1g3t s ILE 202 CO 0.00 0.23 0.01 -0.89 0.00 0.00 0.00 174.94 174.29 1g3t s THR 203 N 1.25 4.10 0.20 2.92 2.01 -1.21 -0.37 115.64 124.54 1g3t s THR 203 Ca 0.25 -0.85 0.09 0.00 0.31 0.00 0.00 61.69 61.49 1g3t s THR 203 Cb -0.15 -2.92 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 1g3t s THR 203 CO 0.10 0.20 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.38 1g3t s LEU 204 N -2.08 2.98 -0.09 4.42 1.43 0.11 -3.56 118.68 121.89 1g3t s LEU 204 Ca 0.24 -0.61 -0.04 0.00 -1.03 0.00 0.00 54.13 52.69 1g3t s LEU 204 Cb -0.12 -1.64 0.05 0.00 0.03 0.00 0.00 46.19 44.51 1g3t s LEU 204 CO 0.16 0.09 0.20 -0.44 0.23 0.00 0.00 176.35 176.59 1g3t s SER 205 N -2.98 0.00 -0.17 2.29 0.01 0.00 -0.58 113.70 112.28 1g3t s SER 205 Ca 0.26 0.43 -0.30 0.00 1.31 0.00 0.00 55.95 57.65 1g3t s SER 205 Cb -0.08 0.35 0.13 0.00 0.21 0.00 0.00 66.02 66.63 1g3t s SER 205 CO 0.16 -0.18 1.03 -2.28 0.41 0.00 0.00 173.24 172.37 1g3t s HIS 206 N 1.51 -0.35 -1.51 2.43 5.04 -0.45 -1.63 115.29 120.34 1g3t s HIS 206 Ca -0.06 0.60 -0.14 0.00 -1.54 0.00 0.00 55.06 53.92 1g3t s HIS 206 Cb -0.11 0.45 0.10 0.00 0.04 0.00 0.00 32.58 33.06 1g3t s HIS 206 CO -0.07 -0.32 0.77 0.09 -2.34 0.00 0.00 174.74 172.87 1g3t n ASN 207 N 0.74 -4.13 0.00 9.88 4.13 -1.26 -0.66 115.26 123.97 1g3t n ASN 207 Ca -0.09 -0.72 0.00 0.00 1.68 0.00 0.00 54.58 55.45 1g3t n ASN 207 Cb 0.58 -3.35 0.00 0.00 -1.54 0.00 0.00 39.78 35.47 1g3t n ASN 207 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1g3t n GLY 208 N -1.44 2.23 3.77 7.41 0.00 -1.26 -4.95 105.19 110.94 1g3t n GLY 208 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1g3t n GLY 208 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g3t s LYS 209 N 0.00 4.22 0.11 1.61 3.01 0.17 -5.08 119.74 123.79 1g3t s LYS 209 Ca 0.00 0.55 0.02 0.00 -1.01 0.00 0.00 55.97 55.53 1g3t s LYS 209 Cb 0.00 -3.34 -0.04 0.00 -1.01 0.00 0.00 37.83 33.44 1g3t s LYS 209 CO 0.00 0.38 0.21 -0.51 0.51 0.00 0.00 175.35 175.95 1g3t s ASP 210 N -0.15 6.12 -0.27 2.83 1.01 -1.26 -1.34 116.67 123.62 1g3t s ASP 210 Ca 0.27 0.14 -0.04 0.00 0.71 0.00 0.00 52.55 53.63 1g3t s ASP 210 Cb -0.17 -1.80 0.09 0.00 1.01 0.00 0.00 42.92 42.05 1g3t s ASP 210 CO 0.14 0.11 0.13 -0.69 0.21 0.00 0.00 175.17 175.06 1g3t s VAL 211 N -1.63 -0.08 -0.43 -1.27 1.01 0.25 -4.94 120.40 113.31 1g3t s VAL 211 Ca 0.33 -0.64 -0.26 0.00 0.00 0.00 0.00 61.98 61.41 1g3t s VAL 211 Cb -0.12 -0.91 0.02 0.00 0.00 0.00 0.00 36.38 35.38 1g3t s VAL 211 CO 0.27 -0.64 0.97 -0.70 0.00 0.00 0.00 175.10 175.00 1g3t s GLU 212 N 2.12 3.69 0.72 2.72 2.12 -1.26 0.06 118.70 128.87 1g3t s GLU 212 Ca 0.08 0.42 -0.11 0.00 0.36 0.00 0.00 54.97 55.71 1g3t s GLU 212 Cb -0.16 -3.87 0.03 0.00 0.26 0.00 0.00 34.13 30.39 1g3t s GLU 212 CO -0.32 -1.15 1.10 -0.51 -0.54 0.00 0.00 175.26 173.84 1g3t s LEU 213 N 3.79 2.83 0.19 2.70 1.43 0.50 -4.96 118.68 125.16 1g3t s LEU 213 Ca 0.40 1.01 0.08 0.00 -1.03 0.00 0.00 54.13 54.59 1g3t s LEU 213 Cb -0.10 -3.73 -0.04 0.00 0.03 0.00 0.00 46.19 42.34 1g3t s LEU 213 CO 0.24 -1.46 -0.05 -0.76 0.23 0.00 0.00 176.35 174.56 1g3t s LEU 214 N -5.38 3.13 0.00 1.79 1.43 -1.26 -4.36 118.68 114.03 1g3t s LEU 214 Ca 0.59 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 1g3t s LEU 214 Cb -0.11 -1.78 0.00 0.00 0.03 0.00 0.00 46.19 44.33 1g3t s LEU 214 CO 0.51 0.08 0.00 0.47 0.23 0.00 0.00 176.35 177.64 1g3t n ASP 215 N -0.15 0.00 -0.14 2.29 9.92 -1.26 -0.98 116.55 126.23 1g3t n ASP 215 Ca -0.10 0.00 -0.04 0.00 -0.53 0.00 0.00 54.79 54.12 1g3t n ASP 215 Cb 0.56 0.00 0.04 0.00 -0.64 0.00 0.00 41.12 41.08 1g3t n ASP 215 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 1g3t h ASP 216 N 0.00 0.22 0.24 -2.24 5.19 -1.98 -0.49 116.42 117.37 1g3t h ASP 216 Ca 0.00 0.04 -0.10 0.00 -0.62 0.00 0.00 57.03 56.35 1g3t h ASP 216 Cb 0.00 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.51 1g3t h ASP 216 CO 0.00 0.16 -0.39 -0.07 -3.12 0.00 0.00 179.24 175.83 1g3t h LEU 217 N 0.37 0.21 -0.34 1.55 3.38 -1.45 -2.60 115.31 116.44 1g3t h LEU 217 Ca 0.21 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 1g3t h LEU 217 Cb 0.18 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1g3t h LEU 217 CO -0.19 0.59 -0.12 0.00 0.09 0.00 0.00 178.44 178.80 1g3t h ALA 218 N 1.43 0.48 0.00 1.53 0.00 -0.93 -1.08 119.26 120.68 1g3t h ALA 218 Ca 0.02 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1g3t h ALA 218 Cb 0.77 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1g3t h ALA 218 CO 0.06 0.36 0.00 0.72 0.00 0.00 0.00 179.25 180.39 1g3t n HIS 219 N -4.37 0.80 -0.04 0.00 8.25 -0.23 -1.99 115.22 117.64 1g3t n HIS 219 Ca -0.02 0.31 -0.04 0.00 -0.26 0.00 0.00 57.72 57.70 1g3t n HIS 219 Cb 0.37 -1.00 -0.05 0.00 1.12 0.00 0.00 29.99 30.43 1g3t n HIS 219 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1g3t n THR 220 N -2.22 0.47 -1.90 1.59 -2.24 -1.00 -4.82 114.28 104.16 1g3t n THR 220 Ca 0.02 -0.25 -0.43 0.00 -2.27 0.00 0.00 64.05 61.13 1g3t n THR 220 Cb 0.24 -0.82 -0.03 0.00 -2.10 0.00 0.00 70.33 67.63 1g3t n THR 220 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1g3t s ILE 221 N -2.16 3.39 -0.24 2.28 1.01 -0.42 -4.57 121.20 120.48 1g3t s ILE 221 Ca -0.06 0.45 -0.07 0.00 0.00 0.00 0.00 60.65 60.97 1g3t s ILE 221 Cb 0.02 -3.37 -0.03 0.00 0.01 0.00 0.00 42.46 39.10 1g3t s ILE 221 CO 0.24 -0.13 0.06 -0.13 0.00 0.00 0.00 174.94 174.99 1g3t s ARG 222 N 4.79 3.65 0.14 2.79 0.52 0.27 0.18 118.95 131.29 1g3t s ARG 222 Ca 0.81 -0.48 0.07 0.00 -0.52 0.00 0.00 55.73 55.61 1g3t s ARG 222 Cb -0.32 -3.29 -0.04 0.00 0.52 0.00 0.00 34.95 31.81 1g3t s ARG 222 CO 0.33 -0.17 -0.02 0.96 0.02 0.00 0.00 175.30 176.42 1g3t s ILE 223 N 1.54 3.71 0.08 1.52 -5.25 0.02 -0.33 121.20 122.50 1g3t s ILE 223 Ca 0.06 -1.30 0.07 0.00 -0.99 0.00 0.00 60.65 58.49 1g3t s ILE 223 Cb -0.15 -2.82 -0.03 0.00 2.95 0.00 0.00 42.46 42.41 1g3t s ILE 223 CO 0.03 -0.02 -0.18 -1.61 -1.79 0.00 0.00 174.94 171.37 1g3t s GLU 224 N -2.66 1.05 0.30 0.37 0.41 0.12 0.25 118.70 118.55 1g3t s GLU 224 Ca 0.26 -1.05 -0.30 0.00 -0.41 0.00 0.00 54.97 53.47 1g3t s GLU 224 Cb -0.10 -1.21 -0.12 0.00 -1.78 0.00 0.00 34.13 30.93 1g3t s GLU 224 CO 0.17 0.28 1.58 0.39 -0.49 0.00 0.00 175.26 177.20 1g3t n GLU 225 N 1.29 2.69 0.00 1.61 1.02 -1.26 -1.22 120.64 124.76 1g3t n GLU 225 Ca -0.20 0.96 0.04 0.00 -0.02 0.00 0.00 57.16 57.94 1g3t n GLU 225 Cb 0.54 -2.73 0.24 0.00 -0.02 0.00 0.00 31.44 29.46 1g3t n GLU 225 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59