#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3him n GLY 13 N 0.00 1.44 0.00 -3.96 0.00 -1.26 -5.00 105.19 96.42 3him n GLY 13 Ca 0.00 -2.25 0.00 0.00 0.00 0.00 0.00 46.02 43.77 3him n GLY 13 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3him n THR 14 N -0.86 0.00 -1.64 2.61 5.66 -1.26 -5.09 114.28 113.70 3him n THR 14 Ca 0.00 0.00 -0.53 0.00 -3.05 0.00 0.00 64.05 60.47 3him n THR 14 Cb 0.00 0.80 -0.06 0.00 -1.55 0.00 0.00 70.33 69.52 3him n THR 14 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 3him n SER 15 N 0.00 2.18 0.17 1.09 2.88 -1.26 -4.85 113.62 113.83 3him n SER 15 Ca 0.00 1.09 0.02 0.00 -1.33 0.00 0.00 58.87 58.64 3him n SER 15 Cb 0.00 -1.22 0.33 0.00 -0.75 0.00 0.00 64.21 62.57 3him n SER 15 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3him h LYS 16 N 5.92 0.04 -0.31 -1.46 1.79 -1.98 0.53 116.57 121.11 3him h LYS 16 Ca -0.47 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 57.98 3him h LYS 16 Cb 1.32 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.95 3him h LYS 16 CO 0.86 0.42 0.16 0.00 -1.08 0.00 0.00 179.45 179.82 3him h ALA 17 N 1.58 0.40 -0.31 3.86 0.00 -1.99 0.16 119.26 122.95 3him h ALA 17 Ca 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 3him h ALA 17 Cb 0.71 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3him h ALA 17 CO 0.05 -0.06 0.03 0.00 0.00 0.00 0.00 179.25 179.26 3him h ALA 18 N 1.03 0.42 -0.97 0.00 0.00 -1.89 -2.49 119.26 115.36 3him h ALA 18 Ca 0.11 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 54.89 3him h ALA 18 Cb 0.08 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.68 3him h ALA 18 CO -0.02 0.15 0.61 0.00 0.00 0.00 0.00 179.25 179.99 3him h ALA 19 N 0.86 1.39 -0.62 0.00 0.00 -0.71 -0.05 119.26 120.14 3him h ALA 19 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 3him h ALA 19 Cb 0.39 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3him h ALA 19 CO 0.01 0.31 0.04 -0.09 0.00 0.00 0.00 179.25 179.52 3him h ARG 20 N 1.05 1.07 -0.54 0.00 2.43 -0.58 -1.09 114.38 116.71 3him h ARG 20 Ca 0.45 -0.32 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 3him h ARG 20 Cb 0.31 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 3him h ARG 20 CO -0.21 1.02 0.14 0.82 -1.51 0.00 0.00 179.97 180.23 3him h ILE 21 N 0.97 1.24 -0.25 1.20 2.04 -0.80 -1.67 117.51 120.24 3him h ILE 21 Ca 0.18 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 3him h ILE 21 Cb 0.52 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 3him h ILE 21 CO 0.02 0.32 0.11 0.03 0.00 0.00 0.00 178.15 178.63 3him h ARG 22 N 0.77 0.37 -0.39 2.37 3.08 -0.85 0.27 114.38 119.99 3him h ARG 22 Ca 0.17 -0.06 0.04 0.00 0.07 0.00 0.00 59.98 60.20 3him h ARG 22 Cb 0.33 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.28 3him h ARG 22 CO 0.00 0.39 0.16 0.00 -1.07 0.00 0.00 179.97 179.45 3him h ALA 23 N 0.96 0.46 -0.66 0.04 0.00 -1.14 0.11 119.26 119.03 3him h ALA 23 Ca 0.08 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3him h ALA 23 Cb 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3him h ALA 23 CO -0.01 -0.23 0.10 0.00 0.00 0.00 0.00 179.25 179.11 3him h ALA 24 N 1.23 0.93 -0.68 0.00 0.00 -0.99 -2.47 119.26 117.28 3him h ALA 24 Ca 0.17 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3him h ALA 24 Cb 0.13 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3him h ALA 24 CO -0.16 0.66 0.27 0.00 0.00 0.00 0.00 179.25 180.03 3him h ALA 25 N 1.08 1.21 0.13 0.00 0.00 -0.00 -0.68 119.26 121.00 3him h ALA 25 Ca 0.20 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3him h ALA 25 Cb 0.45 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3him h ALA 25 CO 0.01 0.58 -0.09 0.82 0.00 0.00 0.00 179.25 180.57 3him h ILE 26 N 0.97 0.80 -0.37 0.00 2.04 -0.55 0.97 117.51 121.37 3him h ILE 26 Ca 0.23 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.15 3him h ILE 26 Cb 0.18 0.80 -0.05 0.00 -0.74 0.00 0.00 36.82 37.01 3him h ILE 26 CO -0.02 0.00 0.05 -0.33 0.00 0.00 0.00 178.15 177.85 3him h GLU 27 N -0.23 0.16 -0.29 2.37 5.08 -1.24 0.19 114.58 120.63 3him h GLU 27 Ca -0.01 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.25 3him h GLU 27 Cb 0.20 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3him h GLU 27 CO -0.00 0.11 -0.17 0.28 -1.00 0.00 0.00 179.01 178.23 3him h VAL 28 N 0.17 1.30 -0.70 3.13 2.07 -0.76 0.05 116.25 121.51 3him h VAL 28 Ca 0.18 -1.28 0.03 0.00 0.82 0.00 0.00 66.70 66.44 3him h VAL 28 Cb 0.21 1.51 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 3him h VAL 28 CO -0.25 0.41 0.44 -0.26 0.02 0.00 0.00 177.57 177.93 3him h PHE 29 N 0.37 0.83 -0.27 1.57 0.04 0.12 0.10 116.94 119.70 3him h PHE 29 Ca 0.06 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.80 3him h PHE 29 Cb 0.70 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.56 3him h PHE 29 CO 0.06 0.47 -0.07 0.00 -0.60 0.00 0.00 178.31 178.17 3him h ALA 30 N 1.30 1.38 0.01 2.45 0.00 -0.38 -2.28 119.26 121.74 3him h ALA 30 Ca 0.28 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 3him h ALA 30 Cb 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3him h ALA 30 CO -0.11 0.43 -0.39 0.00 0.00 0.00 0.00 179.25 179.18 3him h ALA 31 N 1.52 0.06 -0.01 0.00 0.00 -0.07 -3.40 119.26 117.37 3him h ALA 31 Ca 0.08 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3him h ALA 31 Cb 0.39 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3him h ALA 31 CO 0.02 0.22 -0.61 0.36 0.00 0.00 0.00 179.25 179.23 3him n LYS 32 N -4.51 1.05 0.00 0.00 2.85 0.27 -5.08 118.16 112.74 3him n LYS 32 Ca -0.16 -0.61 0.00 0.00 -1.05 0.00 0.00 58.31 56.49 3him n LYS 32 Cb 0.56 -1.42 0.00 0.00 -0.65 0.00 0.00 35.03 33.52 3him n LYS 32 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3him n GLY 33 N 1.39 -2.49 0.19 2.58 0.00 -0.86 -4.38 105.19 101.62 3him n GLY 33 Ca 0.07 -1.17 -0.03 0.00 0.00 0.00 0.00 46.02 44.89 3him n GLY 33 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3him h TYR 34 N 0.00 0.01 0.00 1.61 3.20 -1.87 -1.81 116.97 118.12 3him h TYR 34 Ca 0.00 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.86 3him h TYR 34 Cb 0.00 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 3him h TYR 34 CO 0.00 -0.08 -0.20 0.78 -1.64 0.00 0.00 178.16 177.02 3him h GLY 35 N 0.14 0.00 0.70 1.82 0.00 -1.94 -3.12 103.07 100.66 3him h GLY 35 Ca 0.24 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.38 3him h GLY 35 CO -0.38 0.00 -1.67 0.00 0.00 0.00 0.00 176.54 174.49 3him n ALA 36 N -2.31 1.94 -1.79 3.60 0.00 -0.97 -4.92 120.51 116.06 3him n ALA 36 Ca -0.01 -0.69 -0.36 0.00 0.00 0.00 0.00 53.44 52.38 3him n ALA 36 Cb 0.31 -0.79 -0.06 0.00 0.00 0.00 0.00 19.45 18.91 3him n ALA 36 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3him s THR 37 N -2.90 4.23 0.25 0.00 -1.32 -0.72 -5.03 115.64 110.16 3him s THR 37 Ca -0.05 1.73 0.11 0.00 -1.21 0.00 0.00 61.69 62.27 3him s THR 37 Cb 0.09 -3.90 -0.05 0.00 -1.51 0.00 0.00 72.50 67.13 3him s THR 37 CO 0.83 0.03 -0.11 0.28 -2.21 0.00 0.00 174.62 173.43 3him s THR 38 N -1.75 2.93 0.47 5.08 -1.32 -1.26 -4.96 115.64 114.84 3him s THR 38 Ca 0.53 -2.09 0.20 0.00 -1.21 0.00 0.00 61.69 59.13 3him s THR 38 Cb -0.16 -2.53 0.38 0.00 -1.51 0.00 0.00 72.50 68.68 3him s THR 38 CO 0.21 -0.33 1.94 0.71 -2.21 0.00 0.00 174.62 174.95 3him h THR 39 N 2.26 0.75 -0.78 5.08 1.35 -1.98 -1.88 112.91 117.70 3him h THR 39 Ca -0.43 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 3him h THR 39 Cb 1.24 0.50 -0.04 0.00 -1.73 0.00 0.00 68.15 68.12 3him h THR 39 CO 0.58 0.04 0.50 0.03 -0.25 0.00 0.00 175.52 176.43 3him h ARG 40 N 0.23 1.05 -0.26 4.72 -0.00 -1.95 0.30 114.38 118.46 3him h ARG 40 Ca 0.34 -0.08 0.06 0.00 -0.50 0.00 0.00 59.98 59.80 3him h ARG 40 Cb 0.99 -0.23 -0.06 0.00 0.00 0.00 0.00 29.97 30.67 3him h ARG 40 CO -0.07 0.71 -0.12 0.93 0.00 0.00 0.00 179.97 181.43 3him h GLU 41 N 1.07 -0.08 0.19 0.04 4.39 -1.75 -1.87 114.58 116.57 3him h GLU 41 Ca 0.28 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.98 3him h GLU 41 Cb -0.09 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 3him h GLU 41 CO -0.06 -0.05 -0.09 0.82 -1.16 0.00 0.00 179.01 178.47 3him h ILE 42 N -0.08 0.88 -0.50 3.13 2.04 -0.76 0.13 117.51 122.35 3him h ILE 42 Ca 0.14 -0.34 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 3him h ILE 42 Cb 0.28 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 3him h ILE 42 CO -0.31 0.08 0.24 0.00 0.00 0.00 0.00 178.15 178.16 3him h ALA 43 N 0.36 1.50 -0.30 1.87 0.00 -0.57 -2.33 119.26 119.79 3him h ALA 43 Ca -0.03 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 3him h ALA 43 Cb 0.32 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3him h ALA 43 CO 0.04 0.40 -0.20 0.00 0.00 0.00 0.00 179.25 179.50 3him h ALA 44 N 1.58 0.43 0.00 0.00 0.00 -0.98 0.28 119.26 120.57 3him h ALA 44 Ca 0.18 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 3him h ALA 44 Cb 0.06 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 3him h ALA 44 CO -0.02 0.37 -0.02 0.66 0.00 0.00 0.00 179.25 180.24 3him h SER 45 N 0.42 0.00 -0.62 0.00 4.64 -0.38 0.89 113.55 118.49 3him h SER 45 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3him h SER 45 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 3him h SER 45 CO 0.05 0.02 0.00 0.18 -0.87 0.00 0.00 176.83 176.21 3him n LEU 46 N -3.29 4.63 -3.18 5.97 4.77 -0.91 -4.95 117.00 120.04 3him n LEU 46 Ca -0.02 -2.34 -0.23 0.00 -0.03 0.00 0.00 56.01 53.39 3him n LEU 46 Cb 0.13 -0.57 0.03 0.00 -2.33 0.00 0.00 43.42 40.68 3him n LEU 46 CO 0.24 0.77 0.03 0.47 -1.33 0.00 0.00 177.39 177.56 3him n ASP 47 N 1.06 -5.72 -4.66 -1.43 8.00 0.31 -5.00 116.55 109.11 3him n ASP 47 Ca 0.25 -0.36 -0.25 0.00 0.71 0.00 0.00 54.79 55.14 3him n ASP 47 Cb 0.87 -4.61 -0.09 0.00 -0.02 0.00 0.00 41.12 37.28 3him n ASP 47 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 3him s MET 48 N -5.87 2.10 0.39 -1.24 -1.94 0.93 -5.00 119.30 108.67 3him s MET 48 Ca 0.37 -1.83 -0.26 0.00 -1.71 0.00 0.00 55.69 52.27 3him s MET 48 Cb -0.17 -1.90 -0.09 0.00 2.01 0.00 0.00 34.83 34.68 3him s MET 48 CO 0.46 0.04 1.21 -1.54 -0.01 0.00 0.00 175.02 175.18 3him s SER 49 N -3.76 6.50 0.43 3.03 1.04 -1.26 -3.89 113.70 115.78 3him s SER 49 Ca 0.36 2.44 0.20 0.00 0.48 0.00 0.00 55.95 59.43 3him s SER 49 Cb 0.02 -2.62 1.14 0.00 0.10 0.00 0.00 66.02 64.67 3him s SER 49 CO 0.20 -0.70 1.82 -0.65 0.98 0.00 0.00 173.24 174.89 3him h PRO 50 N 2.71 0.34 0.00 4.02 0.11 -1.89 0.26 132.00 137.55 3him h PRO 50 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3him h PRO 50 Cb 1.24 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3him h PRO 50 CO 0.63 0.23 0.00 0.41 -0.21 0.00 0.00 178.00 179.05 3him n GLY 51 N -1.53 -0.92 0.26 -0.55 0.00 -1.26 -3.51 105.19 97.68 3him n GLY 51 Ca 0.22 -0.13 0.16 0.00 0.00 0.00 0.00 46.02 46.27 3him n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3him h ALA 52 N 3.27 1.00 0.08 4.61 0.00 -0.85 -2.92 119.26 124.46 3him h ALA 52 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.61 3him h ALA 52 Cb 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3him h ALA 52 CO 0.00 0.00 -1.56 0.28 0.00 0.00 0.00 179.25 177.97 3him h VAL 53 N 0.00 1.10 -1.01 0.00 2.07 -1.74 -3.40 116.25 113.27 3him h VAL 53 Ca 0.00 -2.80 0.24 0.00 0.82 0.00 0.00 66.70 64.96 3him h VAL 53 Cb 0.60 2.68 -0.11 0.00 -1.52 0.00 0.00 31.29 32.94 3him h VAL 53 CO 0.00 0.77 0.62 0.22 0.02 0.00 0.00 177.57 179.21 3him h TYR 54 N 0.05 0.91 -0.06 1.57 3.20 -1.59 0.28 116.97 121.33 3him h TYR 54 Ca -0.24 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.67 3him h TYR 54 Cb 1.99 -0.27 -0.00 0.00 1.54 0.00 0.00 36.73 39.99 3him h TYR 54 CO 0.04 0.11 0.05 -1.35 -1.64 0.00 0.00 178.16 175.37 3him h PRO 55 N 0.56 0.00 0.00 1.82 0.11 -1.77 -3.21 132.00 129.52 3him h PRO 55 Ca 0.61 0.00 -0.40 0.00 0.11 0.00 0.00 66.00 66.32 3him h PRO 55 Cb 1.23 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.27 3him h PRO 55 CO -0.39 0.00 -2.48 0.72 -0.21 0.00 0.00 178.00 175.64 3him n HIS 56 N -4.29 0.00 -3.69 0.65 8.25 0.70 -4.89 115.22 111.95 3him n HIS 56 Ca -0.02 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.17 3him n HIS 56 Cb 0.15 -0.99 -0.17 0.00 1.12 0.00 0.00 29.99 30.10 3him n HIS 56 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3him s TYR 57 N -2.51 0.71 -0.02 4.41 2.02 0.45 -5.00 117.35 117.39 3him s TYR 57 Ca -0.35 -0.65 0.18 0.00 -0.37 0.00 0.00 57.07 55.88 3him s TYR 57 Cb 0.10 -0.90 0.42 0.00 -0.40 0.00 0.00 41.96 41.18 3him s TYR 57 CO 0.58 -0.57 1.61 1.57 -1.57 0.00 0.00 175.55 177.17 3him h LYS 58 N 8.31 0.00 -4.89 -0.62 2.10 -1.81 -3.30 116.57 116.36 3him h LYS 58 Ca -0.16 0.00 -0.29 0.00 -2.00 0.00 0.00 60.65 58.20 3him h LYS 58 Cb 1.13 0.00 -0.16 0.00 -0.90 0.00 0.00 32.23 32.31 3him h LYS 58 CO 0.32 0.39 -0.71 0.95 -2.00 0.00 0.00 179.45 178.39 3him s THR 59 N -3.28 0.94 0.22 0.07 -4.23 -1.26 -4.98 115.64 103.11 3him s THR 59 Ca 0.02 -1.89 -0.08 0.00 -1.18 0.00 0.00 61.69 58.57 3him s THR 59 Cb 0.09 -1.64 0.17 0.00 1.34 0.00 0.00 72.50 72.45 3him s THR 59 CO 0.70 -0.73 1.80 0.50 -0.54 0.00 0.00 174.62 176.34 3him h LYS 60 N 3.08 0.64 -0.20 3.99 3.64 -2.00 -2.76 116.57 122.97 3him h LYS 60 Ca -0.36 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 58.91 3him h LYS 60 Cb 1.18 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 3him h LYS 60 CO 0.61 0.43 -0.18 1.49 -2.27 0.00 0.00 179.45 179.53 3him h GLU 61 N 0.66 0.34 -0.58 1.90 4.22 -1.96 -1.04 114.58 118.13 3him h GLU 61 Ca 0.33 -0.10 -0.04 0.00 0.08 0.00 0.00 59.36 59.63 3him h GLU 61 Cb 0.29 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 3him h GLU 61 CO -0.23 0.51 0.18 1.03 -2.18 0.00 0.00 179.01 178.33 3him h SER 62 N 0.31 0.80 -0.07 1.04 0.87 -1.90 -0.27 113.55 114.33 3him h SER 62 Ca 0.06 -0.13 -0.25 0.00 -1.23 0.00 0.00 61.79 60.24 3him h SER 62 Cb 0.50 -0.21 0.02 0.00 -0.44 0.00 0.00 62.40 62.27 3him h SER 62 CO 0.03 0.76 -0.92 0.25 -0.53 0.00 0.00 176.83 176.42 3him h LEU 63 N 0.84 0.94 -0.41 2.23 5.85 -1.07 -0.98 115.31 122.71 3him h LEU 63 Ca 0.19 -0.69 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 3him h LEU 63 Cb 0.24 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 3him h LEU 63 CO -0.01 1.49 0.21 0.25 -0.34 0.00 0.00 178.44 180.04 3him h LEU 64 N 0.47 0.53 -0.38 2.25 5.85 -1.05 -1.39 115.31 121.59 3him h LEU 64 Ca -0.09 -0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.54 3him h LEU 64 Cb 1.56 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.43 3him h LEU 64 CO 0.19 0.49 0.20 0.22 -0.34 0.00 0.00 178.44 179.19 3him h TYR 65 N 0.52 0.36 -0.41 1.25 3.20 -0.98 0.13 116.97 121.04 3him h TYR 65 Ca 0.14 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.08 3him h TYR 65 Cb 0.10 -0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.21 3him h TYR 65 CO -0.02 0.20 0.13 0.00 -1.64 0.00 0.00 178.16 176.83 3him h ALA 66 N 1.19 0.48 -0.45 1.82 0.00 -1.00 0.16 119.26 121.45 3him h ALA 66 Ca 0.16 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.14 3him h ALA 66 Cb 0.05 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3him h ALA 66 CO -0.10 -0.26 0.27 0.82 0.00 0.00 0.00 179.25 179.98 3him h ILE 67 N 0.29 1.07 -0.30 0.00 2.04 -0.66 -1.10 117.51 118.84 3him h ILE 67 Ca 0.19 -0.19 -0.18 0.00 1.00 0.00 0.00 64.86 65.68 3him h ILE 67 Cb 0.19 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 3him h ILE 67 CO -0.21 0.10 -0.52 -1.28 0.00 0.00 0.00 178.15 176.25 3him h SER 68 N 0.55 0.97 -0.04 1.72 0.87 -0.29 -1.46 113.55 115.88 3him h SER 68 Ca 0.17 -0.52 -0.00 0.00 -1.23 0.00 0.00 61.79 60.21 3him h SER 68 Cb -0.01 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 61.67 3him h SER 68 CO -0.07 1.31 0.02 0.25 -0.53 0.00 0.00 176.83 177.81 3him h LEU 69 N 0.67 0.05 0.02 2.23 5.85 -0.62 0.74 115.31 124.24 3him h LEU 69 Ca 0.02 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.70 3him h LEU 69 Cb 1.12 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.10 3him h LEU 69 CO 0.12 0.10 -0.25 -0.08 -0.34 0.00 0.00 178.44 177.99 3him h GLU 70 N -0.01 -0.38 -0.04 1.25 4.81 -1.08 0.15 114.58 119.28 3him h GLU 70 Ca 0.01 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3him h GLU 70 Cb 0.06 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 3him h GLU 70 CO -0.00 -0.26 0.01 0.78 -0.73 0.00 0.00 179.01 178.81 3him h GLY 71 N -0.40 0.05 0.96 1.92 0.00 -1.18 0.64 103.07 105.05 3him h GLY 71 Ca 0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 3him h GLY 71 CO -0.21 0.00 0.18 0.45 0.00 0.00 0.00 176.54 176.97 3him h HIS 72 N 0.03 0.47 -0.66 5.60 3.86 -0.61 -1.98 115.15 121.86 3him h HIS 72 Ca 0.02 -0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.17 3him h HIS 72 Cb 0.01 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.30 3him h HIS 72 CO -0.09 0.38 0.26 1.25 0.86 0.00 0.00 177.93 180.59 3him h HIS 73 N 0.42 1.01 -0.26 2.45 -0.00 -0.63 -2.35 115.15 115.79 3him h HIS 73 Ca 0.12 -0.08 -0.00 0.00 -0.00 0.00 0.00 60.37 60.41 3him h HIS 73 Cb 0.07 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.17 3him h HIS 73 CO -0.03 0.79 0.15 1.03 -0.00 0.00 0.00 177.93 179.88 3him h SER 74 N 0.93 0.31 -0.35 3.26 0.87 -0.65 0.23 113.55 118.16 3him h SER 74 Ca 0.22 -0.05 -0.12 0.00 -1.23 0.00 0.00 61.79 60.60 3him h SER 74 Cb 0.22 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 3him h SER 74 CO -0.02 0.27 -0.24 1.62 -0.53 0.00 0.00 176.83 177.94 3him h VAL 75 N 0.32 1.27 -0.08 2.23 3.04 -1.34 0.70 116.25 122.38 3him h VAL 75 Ca 0.09 -1.37 0.02 0.00 -1.01 0.00 0.00 66.70 64.43 3him h VAL 75 Cb 0.02 1.21 -0.02 0.00 -2.01 0.00 0.00 31.29 30.49 3him h VAL 75 CO -0.02 0.46 -0.04 0.25 -1.01 0.00 0.00 177.57 177.21 3him h LEU 76 N 0.73 -0.14 -0.98 3.16 5.85 -1.22 -1.80 115.31 120.90 3him h LEU 76 Ca 0.10 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.91 3him h LEU 76 Cb 0.77 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.82 3him h LEU 76 CO 0.06 -0.06 0.63 0.00 -0.34 0.00 0.00 178.44 178.74 3him h ALA 77 N 1.04 1.34 0.40 1.25 0.00 -0.27 -1.14 119.26 121.88 3him h ALA 77 Ca 0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3him h ALA 77 Cb 0.11 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3him h ALA 77 CO -0.11 0.45 -0.19 0.00 0.00 0.00 0.00 179.25 179.40 3him h ALA 78 N 1.43 -0.54 0.00 0.00 0.00 -0.42 -0.98 119.26 118.75 3him h ALA 78 Ca 0.41 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 55.07 3him h ALA 78 Cb 0.11 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3him h ALA 78 CO -0.16 -0.80 -0.61 -0.84 0.00 0.00 0.00 179.25 176.84 3him h ILE 79 N -0.55 1.35 0.10 0.00 3.07 -1.25 -1.64 117.51 118.59 3him h ILE 79 Ca -0.05 -2.16 -0.00 0.00 1.55 0.00 0.00 64.86 64.19 3him h ILE 79 Cb 0.42 2.20 0.00 0.00 -0.27 0.00 0.00 36.82 39.17 3him h ILE 79 CO 0.09 0.60 -0.05 0.74 -1.05 0.00 0.00 178.15 178.48 3him h THR 80 N 0.00 1.07 -0.27 0.16 2.02 -1.14 -1.13 112.91 113.63 3him h THR 80 Ca -0.01 -0.68 0.08 0.00 0.77 0.00 0.00 66.41 66.58 3him h THR 80 Cb 1.15 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 69.05 3him h THR 80 CO 0.08 0.16 0.24 0.00 0.37 0.00 0.00 175.52 176.38 3him h ALA 81 N 0.41 2.02 0.00 6.16 0.00 -1.17 -1.04 119.26 125.65 3him h ALA 81 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3him h ALA 81 Cb 0.37 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3him h ALA 81 CO 0.02 -0.38 -0.13 0.00 0.00 0.00 0.00 179.25 178.76 3him n ALA 82 N -2.43 2.53 -2.58 0.00 0.00 -0.62 -4.84 120.51 112.58 3him n ALA 82 Ca 0.04 -0.12 -0.38 0.00 0.00 0.00 0.00 53.44 52.97 3him n ALA 82 Cb 0.39 -1.39 -0.06 0.00 0.00 0.00 0.00 19.45 18.39 3him n ALA 82 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3him s ASP 83 N -3.58 6.74 -0.32 0.00 2.15 -0.40 -4.26 116.67 117.00 3him s ASP 83 Ca 0.12 0.88 -0.01 0.00 0.43 0.00 0.00 52.55 53.97 3him s ASP 83 Cb 0.16 -2.25 0.11 0.00 -0.30 0.00 0.00 42.92 40.64 3him s ASP 83 CO 0.59 0.23 0.12 -0.36 -0.17 0.00 0.00 175.17 175.59 3him s PHE 84 N -0.54 1.50 -1.49 -5.34 0.08 -1.26 -4.98 117.98 105.95 3him s PHE 84 Ca 0.23 -1.70 0.10 0.00 0.12 0.00 0.00 56.93 55.68 3him s PHE 84 Cb -0.16 -1.58 0.50 0.00 -0.57 0.00 0.00 43.02 41.21 3him s PHE 84 CO 0.12 -0.86 1.18 -2.30 -0.10 0.00 0.00 175.22 173.25 3him n PRO 85 N 4.71 0.16 -0.29 0.24 -0.02 -1.26 -1.66 135.00 136.87 3him n PRO 85 Ca -0.01 0.17 0.08 0.00 -2.02 0.00 0.00 63.50 61.73 3him n PRO 85 Cb 0.41 -1.50 0.24 0.00 -0.02 0.00 0.00 33.50 32.63 3him n PRO 85 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3him n ASP 86 N -1.26 2.95 -4.58 2.55 5.68 -1.26 -4.92 116.55 115.72 3him n ASP 86 Ca 0.05 -2.04 -0.27 0.00 -0.50 0.00 0.00 54.79 52.03 3him n ASP 86 Cb 0.07 -0.37 -0.11 0.00 -1.14 0.00 0.00 41.12 39.57 3him n ASP 86 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 3him s ILE 87 N -1.35 2.15 0.45 2.12 -4.36 -0.67 -5.11 121.20 114.43 3him s ILE 87 Ca 0.36 -2.12 -0.25 0.00 -0.26 0.00 0.00 60.65 58.38 3him s ILE 87 Cb 0.19 -2.79 -0.09 0.00 1.25 0.00 0.00 42.46 41.02 3him s ILE 87 CO 0.23 -0.12 1.39 0.00 0.24 0.00 0.00 174.94 176.68 3him n ALA 88 N -0.87 1.82 -0.27 2.27 0.00 -1.26 -4.78 120.51 117.41 3him n ALA 88 Ca -0.05 0.25 0.08 0.00 0.00 0.00 0.00 53.44 53.72 3him n ALA 88 Cb 0.65 -2.36 0.22 0.00 0.00 0.00 0.00 19.45 17.97 3him n ALA 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3him h ALA 89 N 2.19 1.11 -0.72 0.00 0.00 -1.92 -1.65 119.26 118.28 3him h ALA 89 Ca -0.50 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3him h ALA 89 Cb 1.28 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 19.25 3him h ALA 89 CO 0.60 -0.35 0.46 -1.35 0.00 0.00 0.00 179.25 178.62 3him h PRO 90 N 0.30 0.96 -0.36 0.00 0.11 -1.92 -0.26 132.00 130.82 3him h PRO 90 Ca 0.47 -0.07 -0.13 0.00 0.11 0.00 0.00 66.00 66.38 3him h PRO 90 Cb 0.84 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.72 3him h PRO 90 CO -0.53 0.65 -0.30 -0.44 -0.21 0.00 0.00 178.00 177.16 3him h ASP 91 N 0.98 0.82 -0.74 -2.05 3.32 -1.70 -0.65 116.42 116.41 3him h ASP 91 Ca 0.26 -0.33 0.01 0.00 0.02 0.00 0.00 57.03 56.99 3him h ASP 91 Cb -0.09 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.20 3him h ASP 91 CO -0.05 1.06 0.48 0.03 -1.72 0.00 0.00 179.24 179.04 3him h ARG 92 N 0.67 0.97 -0.26 3.56 3.08 -0.70 -1.93 114.38 119.77 3him h ARG 92 Ca 0.08 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 59.98 3him h ARG 92 Cb 0.84 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 3him h ARG 92 CO 0.07 0.65 -0.15 1.25 -1.07 0.00 0.00 179.97 180.72 3him h LEU 93 N 1.00 0.59 -0.74 3.04 5.85 -0.79 -1.30 115.31 122.95 3him h LEU 93 Ca 0.27 -0.42 0.11 0.00 0.84 0.00 0.00 57.88 58.67 3him h LEU 93 Cb -0.11 -0.16 -0.08 0.00 0.37 0.00 0.00 40.66 40.68 3him h LEU 93 CO -0.06 0.88 0.36 0.24 -0.34 0.00 0.00 178.44 179.53 3him h MET 94 N 0.29 0.57 -0.08 1.25 2.86 -1.08 -1.42 114.93 117.32 3him h MET 94 Ca 0.06 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.59 3him h MET 94 Cb 0.67 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.20 3him h MET 94 CO 0.04 0.38 -0.23 1.03 1.06 0.00 0.00 176.91 179.19 3him h SER 95 N 0.59 0.34 -0.30 1.22 0.87 -1.10 -0.98 113.55 114.20 3him h SER 95 Ca 0.37 -0.60 -0.16 0.00 -1.23 0.00 0.00 61.79 60.16 3him h SER 95 Cb 0.44 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.29 3him h SER 95 CO -0.30 0.89 -0.45 0.71 -0.53 0.00 0.00 176.83 177.15 3him h THR 96 N -0.18 1.28 -0.12 2.23 1.35 -1.24 -1.50 112.91 114.73 3him h THR 96 Ca -0.01 -1.64 -0.00 0.00 -0.55 0.00 0.00 66.41 64.21 3him h THR 96 Cb 0.85 1.59 -0.01 0.00 -1.73 0.00 0.00 68.15 68.86 3him h THR 96 CO 0.05 0.53 0.07 0.58 -0.25 0.00 0.00 175.52 176.51 3him h VAL 97 N 0.62 1.06 -0.23 6.82 2.07 -1.28 0.25 116.25 125.55 3him h VAL 97 Ca 0.03 -0.14 0.06 0.00 0.82 0.00 0.00 66.70 67.46 3him h VAL 97 Cb 1.06 0.94 -0.07 0.00 -1.52 0.00 0.00 31.29 31.69 3him h VAL 97 CO 0.10 0.05 -0.38 0.74 0.02 0.00 0.00 177.57 178.11 3him h THR 98 N 0.13 0.19 -0.82 2.57 2.02 -1.14 0.11 112.91 115.98 3him h THR 98 Ca 0.04 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.23 3him h THR 98 Cb 0.02 0.19 -0.04 0.00 -1.74 0.00 0.00 68.15 66.58 3him h THR 98 CO -0.01 0.00 0.54 0.00 0.37 0.00 0.00 175.52 176.42 3him h ALA 99 N 0.37 1.04 0.14 6.16 0.00 -1.14 -0.97 119.26 124.87 3him h ALA 99 Ca 0.11 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3him h ALA 99 Cb 0.58 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3him h ALA 99 CO -0.44 0.44 -0.07 -0.92 0.00 0.00 0.00 179.25 178.26 3him h TYR 100 N 1.10 -0.17 -0.10 0.00 3.20 -0.05 -0.78 116.97 120.17 3him h TYR 100 Ca 0.30 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.16 3him h TYR 100 Cb -0.12 0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.21 3him h TYR 100 CO -0.02 0.04 0.04 0.28 -1.64 0.00 0.00 178.16 176.86 3him h VAL 101 N -0.36 1.15 -0.53 1.81 2.07 -0.73 -2.24 116.25 117.42 3him h VAL 101 Ca -0.02 -0.45 0.09 0.00 0.82 0.00 0.00 66.70 67.14 3him h VAL 101 Cb 0.29 1.26 -0.07 0.00 -1.52 0.00 0.00 31.29 31.24 3him h VAL 101 CO 0.03 0.13 0.10 0.74 0.02 0.00 0.00 177.57 178.60 3him h THR 102 N 0.01 0.69 -0.52 2.57 2.02 -1.20 -0.73 112.91 115.75 3him h THR 102 Ca 0.03 -0.08 0.05 0.00 0.77 0.00 0.00 66.41 67.18 3him h THR 102 Cb 0.17 0.44 -0.05 0.00 -1.74 0.00 0.00 68.15 66.97 3him h THR 102 CO -0.00 0.04 0.26 -0.25 0.37 0.00 0.00 175.52 175.94 3him h TRP 103 N 0.24 0.47 -0.04 3.16 7.01 -0.97 -0.88 115.95 124.93 3him h TRP 103 Ca 0.27 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 61.20 3him h TRP 103 Cb 0.37 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.28 3him h TRP 103 CO -0.24 0.22 -0.39 0.45 -2.79 0.00 0.00 178.44 175.70 3him h HIS 104 N 0.50 0.10 0.24 2.65 3.86 -0.72 0.18 115.15 121.96 3him h HIS 104 Ca 0.23 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.41 3him h HIS 104 Cb 0.15 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.60 3him h HIS 104 CO -0.11 0.46 -0.12 0.00 0.86 0.00 0.00 177.93 179.03 3him h ALA 105 N 1.54 -0.33 -0.96 2.45 0.00 -0.83 -3.08 119.26 118.05 3him h ALA 105 Ca 0.01 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.73 3him h ALA 105 Cb 0.72 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.59 3him h ALA 105 CO 0.05 -0.40 0.63 -0.44 0.00 0.00 0.00 179.25 179.09 3him h ASP 106 N -0.89 1.08 -0.64 0.00 3.32 -1.11 -3.19 116.42 114.99 3him h ASP 106 Ca -0.03 -0.02 -0.32 0.00 0.02 0.00 0.00 57.03 56.67 3him h ASP 106 Cb 0.51 -0.26 -0.19 0.00 0.22 0.00 0.00 39.33 39.60 3him h ASP 106 CO 0.06 0.77 0.24 0.59 -1.72 0.00 0.00 179.24 179.18 3him n ASN 107 N -4.40 3.10 -0.30 6.45 3.02 0.62 -4.76 115.26 118.99 3him n ASN 107 Ca 0.12 -3.69 0.05 0.00 -0.03 0.00 0.00 54.58 51.03 3him n ASN 107 Cb 0.04 -0.73 0.26 0.00 -0.61 0.00 0.00 39.78 38.74 3him n ASN 107 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 3him h ARG 108 N 1.07 0.96 0.02 3.52 0.11 -1.52 0.31 114.38 118.85 3him h ARG 108 Ca 0.40 -0.06 -0.00 0.00 0.10 0.00 0.00 59.98 60.42 3him h ARG 108 Cb 2.19 -0.22 0.00 0.00 1.11 0.00 0.00 29.97 33.06 3him h ARG 108 CO 0.70 0.64 -0.01 0.00 0.10 0.00 0.00 179.97 181.40 3him h ALA 109 N 1.52 -0.03 -0.88 0.08 0.00 -1.87 0.24 119.26 118.32 3him h ALA 109 Ca 0.40 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 55.12 3him h ALA 109 Cb 0.25 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 3him h ALA 109 CO -0.15 -0.29 0.57 1.03 0.00 0.00 0.00 179.25 180.40 3him h SER 110 N -0.47 0.96 -0.36 0.00 0.87 -1.88 -2.82 113.55 109.84 3him h SER 110 Ca -0.00 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.54 3him h SER 110 Cb 0.45 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.17 3him h SER 110 CO 0.00 0.67 0.21 0.00 -0.53 0.00 0.00 176.83 177.18 3him h ALA 111 N 1.36 0.46 -0.46 6.23 0.00 -0.01 -1.48 119.26 125.36 3him h ALA 111 Ca 0.35 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.24 3him h ALA 111 Cb -0.02 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 3him h ALA 111 CO -0.11 -0.03 0.20 0.00 0.00 0.00 0.00 179.25 179.31 3him h ARG 112 N 0.47 0.38 -0.28 0.00 3.08 -0.43 0.13 114.38 117.72 3him h ARG 112 Ca 0.13 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 3him h ARG 112 Cb 0.02 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 3him h ARG 112 CO -0.02 0.25 0.05 0.28 -1.07 0.00 0.00 179.97 179.46 3him h VAL 113 N 0.40 1.23 -0.68 2.04 2.07 -1.28 0.91 116.25 120.93 3him h VAL 113 Ca 0.21 -0.78 0.05 0.00 0.82 0.00 0.00 66.70 67.00 3him h VAL 113 Cb 0.17 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 3him h VAL 113 CO -0.18 0.25 0.39 1.23 0.02 0.00 0.00 177.57 179.28 3him h GLY 114 N 0.29 1.00 0.91 2.17 0.00 -1.06 -3.17 103.07 103.20 3him h GLY 114 Ca 0.09 -0.28 -0.28 0.00 0.00 0.00 0.00 47.33 46.86 3him h GLY 114 CO 0.01 0.18 -1.27 0.06 0.00 0.00 0.00 176.54 175.52 3him h GLN 115 N 0.73 0.40 0.00 4.80 3.07 -0.45 -3.40 115.11 120.25 3him h GLN 115 Ca 0.30 -0.68 0.00 0.00 0.09 0.00 0.00 58.65 58.36 3him h GLN 115 Cb 0.16 0.25 0.00 0.00 0.08 0.00 0.00 27.48 27.97 3him h GLN 115 CO -0.17 1.32 -0.56 1.88 0.09 0.00 0.00 178.83 181.40 3him h TYR 116 N -0.11 0.00 -0.50 0.06 0.05 -0.90 -3.28 116.97 112.28 3him h TYR 116 Ca -0.23 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.36 3him h TYR 116 Cb 1.92 0.00 -0.11 0.00 1.01 0.00 0.00 36.73 39.54 3him h TYR 116 CO 0.15 0.00 0.12 0.39 -1.05 0.00 0.00 178.16 177.77 3him n GLU 117 N -2.47 2.59 0.19 4.88 -0.58 -1.20 -4.66 120.64 119.39 3him n GLU 117 Ca 0.03 -3.06 0.06 0.00 -0.42 0.00 0.00 57.16 53.77 3him n GLU 117 Cb 0.49 -1.96 0.55 0.00 -0.57 0.00 0.00 31.44 29.94 3him n GLU 117 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3him h LEU 118 N 1.57 0.11 -2.93 -4.62 3.38 -1.76 -0.77 115.31 110.29 3him h LEU 118 Ca 0.23 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 3him h LEU 118 Cb 1.93 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.65 3him h LEU 118 CO 0.53 0.14 -0.00 0.08 0.09 0.00 0.00 178.44 179.27 3him h ARG 119 N 0.13 0.00 -0.01 1.13 0.11 -1.90 -1.86 114.38 111.98 3him h ARG 119 Ca 0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.11 3him h ARG 119 Cb 0.09 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.17 3him h ARG 119 CO 0.00 0.00 -0.31 0.43 0.10 0.00 0.00 179.97 180.19 3him n SER 120 N -3.17 1.06 -4.77 0.08 7.64 -0.29 -4.93 113.62 109.24 3him n SER 120 Ca -0.03 -0.88 -0.38 0.00 1.01 0.00 0.00 58.87 58.58 3him n SER 120 Cb 0.07 0.19 -0.06 0.00 -1.01 0.00 0.00 64.21 63.40 3him n SER 120 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3him s LEU 121 N -2.55 4.44 0.97 -3.43 1.43 -0.70 -4.94 118.68 113.90 3him s LEU 121 Ca 0.22 1.94 -0.12 0.00 -1.03 0.00 0.00 54.13 55.14 3him s LEU 121 Cb 0.19 -3.86 0.10 0.00 0.03 0.00 0.00 46.19 42.66 3him s LEU 121 CO 0.55 -0.04 0.70 -1.54 0.23 0.00 0.00 176.35 176.24 3him n SER 122 N 0.87 -1.19 -0.08 2.29 3.41 -1.26 -4.62 113.62 113.04 3him n SER 122 Ca 0.01 0.29 -0.06 0.00 -0.26 0.00 0.00 58.87 58.84 3him n SER 122 Cb 0.48 -1.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.14 3him n SER 122 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3him h PRO 123 N -1.82 0.09 -0.85 4.33 0.11 -1.98 0.34 132.00 132.21 3him h PRO 123 Ca -0.46 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 3him h PRO 123 Cb 1.29 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.34 3him h PRO 123 CO 0.38 0.06 0.41 0.93 -0.21 0.00 0.00 178.00 179.57 3him h GLU 124 N 0.09 1.22 -0.27 1.05 3.07 -2.00 -1.26 114.58 116.49 3him h GLU 124 Ca 0.15 -0.18 -0.18 0.00 -0.50 0.00 0.00 59.36 58.65 3him h GLU 124 Cb 0.20 -0.22 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 3him h GLU 124 CO -0.25 0.94 -0.52 0.45 -1.40 0.00 0.00 179.01 178.22 3him h HIS 125 N 1.21 1.05 -0.58 4.33 3.86 -1.83 -2.68 115.15 120.52 3him h HIS 125 Ca 0.29 -0.38 0.02 0.00 -1.16 0.00 0.00 60.37 59.15 3him h HIS 125 Cb 0.11 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 28.35 3him h HIS 125 CO 0.01 1.20 0.35 0.35 0.86 0.00 0.00 177.93 180.71 3him h PHE 126 N 0.61 0.66 -0.28 2.45 3.57 -0.04 -2.03 116.94 121.88 3him h PHE 126 Ca 0.01 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 3him h PHE 126 Cb 1.13 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 3him h PHE 126 CO 0.08 0.39 0.03 0.00 -2.23 0.00 0.00 178.31 176.57 3him h ALA 127 N 1.25 1.54 -0.18 2.41 0.00 -1.16 -1.07 119.26 122.05 3him h ALA 127 Ca 0.23 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.83 3him h ALA 127 Cb 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3him h ALA 127 CO -0.09 0.34 -0.53 0.82 0.00 0.00 0.00 179.25 179.79 3him h ILE 128 N 0.41 1.32 -0.42 0.00 2.04 -1.13 -2.50 117.51 117.23 3him h ILE 128 Ca 0.09 -1.77 -0.06 0.00 1.00 0.00 0.00 64.86 64.13 3him h ILE 128 Cb 0.22 1.94 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 3him h ILE 128 CO 0.00 0.55 0.05 0.40 0.00 0.00 0.00 178.15 179.15 3him h ILE 129 N 0.37 1.25 -0.75 -0.67 1.08 -1.13 -2.15 117.51 115.51 3him h ILE 129 Ca -0.02 -0.93 -0.03 0.00 -0.39 0.00 0.00 64.86 63.50 3him h ILE 129 Cb 1.15 1.04 -0.04 0.00 -3.07 0.00 0.00 36.82 35.91 3him h ILE 129 CO 0.11 0.32 0.37 0.00 -0.69 0.00 0.00 178.15 178.26 3him h ALA 130 N 0.92 1.23 -0.59 1.87 0.00 -1.23 -0.41 119.26 121.05 3him h ALA 130 Ca 0.12 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3him h ALA 130 Cb 0.41 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3him h ALA 130 CO 0.01 0.59 0.31 0.22 0.00 0.00 0.00 179.25 180.38 3him h ASP 131 N 1.06 0.76 -0.79 0.00 3.58 -1.22 0.41 116.42 120.22 3him h ASP 131 Ca 0.26 -0.11 -0.04 0.00 0.42 0.00 0.00 57.03 57.56 3him h ASP 131 Cb 0.10 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 40.92 3him h ASP 131 CO -0.03 0.65 0.35 0.40 -2.88 0.00 0.00 179.24 177.73 3him h ILE 132 N 0.81 1.26 -0.59 2.25 2.04 -0.71 -1.91 117.51 120.65 3him h ILE 132 Ca 0.21 -0.76 -0.02 0.00 1.00 0.00 0.00 64.86 65.29 3him h ILE 132 Cb 0.08 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.39 3him h ILE 132 CO -0.03 0.32 0.31 0.03 0.00 0.00 0.00 178.15 178.77 3him h ARG 133 N 1.15 0.84 -0.77 2.37 3.08 -0.67 -1.35 114.38 119.04 3him h ARG 133 Ca 0.27 -0.11 0.02 0.00 0.07 0.00 0.00 59.98 60.23 3him h ARG 133 Cb 0.16 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 3him h ARG 133 CO -0.03 0.66 0.50 0.00 -1.07 0.00 0.00 179.97 180.03 3him h ARG 134 N 0.80 0.96 -0.56 0.04 3.08 -0.63 -2.41 114.38 115.66 3him h ARG 134 Ca 0.21 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.15 3him h ARG 134 Cb 0.08 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 3him h ARG 134 CO -0.03 0.63 0.15 0.77 -1.07 0.00 0.00 179.97 180.42 3him h SER 135 N 0.98 0.79 -0.35 7.04 0.02 -0.98 -1.55 113.55 119.52 3him h SER 135 Ca 0.30 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3him h SER 135 Cb -0.03 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.28 3him h SER 135 CO -0.09 0.77 0.22 0.74 -1.14 0.00 0.00 176.83 177.33 3him h THR 136 N 0.82 1.10 -0.65 -2.27 2.02 -0.89 -2.62 112.91 110.43 3him h THR 136 Ca 0.18 -0.21 -0.07 0.00 0.77 0.00 0.00 66.41 67.08 3him h THR 136 Cb 0.28 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 3him h THR 136 CO -0.00 0.10 0.14 0.74 0.37 0.00 0.00 175.52 176.86 3him h THR 137 N 0.46 1.26 0.00 3.16 2.02 -1.15 -2.91 112.91 115.75 3him h THR 137 Ca 0.13 -0.97 -0.01 0.00 0.77 0.00 0.00 66.41 66.33 3him h THR 137 Cb -0.03 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 3him h THR 137 CO -0.03 0.37 -0.03 0.11 0.37 0.00 0.00 175.52 176.31 3him h LYS 138 N 0.98 0.00 -0.90 6.66 1.57 -0.94 -0.56 116.57 123.38 3him h LYS 138 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 3him h LYS 138 Cb 0.39 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.66 3him h LYS 138 CO 0.01 0.03 0.56 0.28 -0.57 0.00 0.00 179.45 179.76 3him h VAL 139 N 0.00 1.24 0.02 0.50 2.07 -1.27 -0.13 116.25 118.67 3him h VAL 139 Ca -0.00 -0.49 -0.21 0.00 0.82 0.00 0.00 66.70 66.82 3him h VAL 139 Cb 0.08 -0.05 0.02 0.00 -1.52 0.00 0.00 31.29 29.82 3him h VAL 139 CO 0.00 0.24 -0.83 -0.26 0.02 0.00 0.00 177.57 176.75 3him h PHE 140 N 1.22 0.80 -0.88 1.57 0.04 -1.23 -3.01 116.94 115.46 3him h PHE 140 Ca 0.32 -0.45 -0.02 0.00 2.80 0.00 0.00 57.97 60.63 3him h PHE 140 Cb -0.09 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 37.93 3him h PHE 140 CO -0.00 1.28 0.49 1.79 -0.60 0.00 0.00 178.31 181.26 3him h THR 141 N 0.10 1.25 -0.33 -1.55 1.35 -1.11 -0.40 112.91 112.22 3him h THR 141 Ca -0.11 -0.62 0.03 0.00 -0.55 0.00 0.00 66.41 65.17 3him h THR 141 Cb 1.52 0.06 -0.03 0.00 -1.73 0.00 0.00 68.15 67.97 3him h THR 141 CO 0.16 0.28 0.12 0.03 -0.25 0.00 0.00 175.52 175.87 3him h ARG 142 N 1.23 0.27 -0.42 4.72 -0.00 -1.09 0.15 114.38 119.23 3him h ARG 142 Ca 0.31 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.98 59.75 3him h ARG 142 Cb 0.02 -0.06 -0.02 0.00 0.00 0.00 0.00 29.97 29.91 3him h ARG 142 CO -0.05 0.18 0.19 0.82 0.00 0.00 0.00 179.97 181.10 3him h ILE 143 N 0.27 1.19 -0.61 2.04 2.04 -1.26 0.27 117.51 121.46 3him h ILE 143 Ca 0.15 -0.55 -0.05 0.00 1.00 0.00 0.00 64.86 65.41 3him h ILE 143 Cb 0.11 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 3him h ILE 143 CO -0.14 0.21 0.20 0.40 0.00 0.00 0.00 178.15 178.82 3him h ILE 144 N 0.53 1.24 -0.21 -0.67 2.04 -0.81 -1.51 117.51 118.12 3him h ILE 144 Ca 0.14 -0.80 0.01 0.00 1.00 0.00 0.00 64.86 65.20 3him h ILE 144 Cb 0.15 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 3him h ILE 144 CO -0.02 0.31 0.13 -0.33 0.00 0.00 0.00 178.15 178.24 3him h GLU 145 N 0.86 0.26 -0.57 2.37 5.08 -0.39 -1.73 114.58 120.47 3him h GLU 145 Ca 0.20 -0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.64 3him h GLU 145 Cb 0.27 -0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.38 3him h GLU 145 CO -0.01 0.17 0.15 0.00 -1.00 0.00 0.00 179.01 178.33 3him h ALA 146 N 1.09 0.69 -0.20 3.43 0.00 0.16 -0.48 119.26 123.95 3him h ALA 146 Ca 0.08 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 3him h ALA 146 Cb -0.01 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3him h ALA 146 CO -0.03 -0.27 -0.27 0.78 0.00 0.00 0.00 179.25 179.46 3him h GLY 147 N 0.30 0.41 0.87 0.00 0.00 -1.08 -2.15 103.07 101.43 3him h GLY 147 Ca 0.29 -0.33 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 3him h GLY 147 CO -0.35 0.31 0.06 0.00 0.00 0.00 0.00 176.54 176.56 3him h ALA 148 N 1.38 0.34 -0.67 3.60 0.00 -0.55 0.20 119.26 123.56 3him h ALA 148 Ca 0.05 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.85 3him h ALA 148 Cb 0.65 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 3him h ALA 148 CO 0.05 -0.00 0.45 1.15 0.00 0.00 0.00 179.25 180.89 3him h THR 149 N 0.24 1.01 -0.01 0.00 2.02 -0.75 -1.96 112.91 113.45 3him h THR 149 Ca 0.08 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 67.02 3him h THR 149 Cb 0.29 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 3him h THR 149 CO 0.00 0.13 -0.17 0.00 0.37 0.00 0.00 175.52 175.85 3him n ALA 150 N -2.46 2.91 -0.99 6.16 0.00 -0.84 -4.93 120.51 120.35 3him n ALA 150 Ca 0.10 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.14 3him n ALA 150 Cb 0.23 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3him n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3him n GLY 151 N 1.29 0.44 0.16 0.00 0.00 -0.67 -4.90 105.19 101.50 3him n GLY 151 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 3him n GLY 151 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3him h ASP 152 N 0.00 0.39 -3.25 1.61 3.32 -0.90 -3.46 116.42 114.12 3him h ASP 152 Ca 0.00 -0.27 -0.65 0.00 0.02 0.00 0.00 57.03 56.13 3him h ASP 152 Cb 0.17 -0.12 -0.17 0.00 0.22 0.00 0.00 39.33 39.44 3him h ASP 152 CO 0.00 1.01 -0.79 -0.36 -1.72 0.00 0.00 179.24 177.39 3him s PHE 153 N -3.50 2.45 -0.40 4.55 0.08 -0.48 -4.22 117.98 116.46 3him s PHE 153 Ca -0.05 -0.30 0.10 0.00 0.12 0.00 0.00 56.93 56.81 3him s PHE 153 Cb 0.10 -1.23 0.31 0.00 -0.57 0.00 0.00 43.02 41.63 3him s PHE 153 CO 0.83 0.48 0.66 0.72 -0.10 0.00 0.00 175.22 177.80 3him n HIS 154 N 0.31 0.24 -2.12 0.36 8.25 0.27 -4.29 115.22 118.24 3him n HIS 154 Ca -0.13 -3.73 -0.39 0.00 -0.26 0.00 0.00 57.72 53.21 3him n HIS 154 Cb 0.55 -0.40 -0.00 0.00 1.12 0.00 0.00 29.99 31.26 3him n HIS 154 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3him s PRO 155 N -1.98 3.86 0.06 -0.41 0.04 -1.17 -4.49 135.00 130.91 3him s PRO 155 Ca 0.38 2.02 -0.23 0.00 0.04 0.00 0.00 61.00 63.21 3him s PRO 155 Cb 0.27 -2.62 -0.15 0.00 0.04 0.00 0.00 34.50 32.04 3him s PRO 155 CO -0.09 -0.54 1.58 0.74 0.04 0.00 0.00 177.00 178.72 3him h PHE 156 N 2.42 0.06 -2.13 0.56 0.04 -1.90 -3.44 116.94 112.54 3him h PHE 156 Ca -0.49 -0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.13 3him h PHE 156 Cb 1.25 -0.02 -0.29 0.00 2.20 0.00 0.00 35.95 39.09 3him h PHE 156 CO 0.53 0.21 -0.45 0.34 -0.60 0.00 0.00 178.31 178.34 3him s ASP 157 N -5.42 0.11 0.10 2.17 -1.08 -1.26 -5.05 116.67 106.23 3him s ASP 157 Ca -0.14 0.47 -0.20 0.00 -0.52 0.00 0.00 52.55 52.16 3him s ASP 157 Cb 0.05 1.16 -0.09 0.00 -1.46 0.00 0.00 42.92 42.58 3him s ASP 157 CO 0.67 -0.28 1.68 0.40 0.52 0.00 0.00 175.17 178.16 3him h ILE 158 N 6.19 1.12 -0.73 4.11 2.04 -2.00 -1.29 117.51 126.95 3him h ILE 158 Ca -0.18 -0.34 -0.03 0.00 1.00 0.00 0.00 64.86 65.31 3him h ILE 158 Cb 1.14 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 38.21 3him h ILE 158 CO 0.22 0.11 0.34 -0.33 0.00 0.00 0.00 178.15 178.50 3him h GLU 159 N 0.17 1.06 -0.86 2.37 5.08 -1.97 -0.95 114.58 119.47 3him h GLU 159 Ca 0.06 -0.16 0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3him h GLU 159 Cb 0.10 -0.19 -0.05 0.00 0.50 0.00 0.00 28.75 29.12 3him h GLU 159 CO -0.01 0.83 0.56 0.00 -1.00 0.00 0.00 179.01 179.39 3him h ALA 160 N 1.17 1.12 -0.28 3.43 0.00 -1.94 -0.36 119.26 122.39 3him h ALA 160 Ca 0.25 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 3him h ALA 160 Cb 0.13 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3him h ALA 160 CO -0.03 0.43 0.03 0.00 0.00 0.00 0.00 179.25 179.69 3him h ALA 161 N 1.34 0.37 -0.33 0.00 0.00 -0.73 -0.07 119.26 119.84 3him h ALA 161 Ca 0.33 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3him h ALA 161 Cb -0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3him h ALA 161 CO -0.10 0.07 0.15 0.00 0.00 0.00 0.00 179.25 179.38 3him h ALA 162 N 0.86 0.43 -0.16 0.00 0.00 -1.06 -1.73 119.26 117.59 3him h ALA 162 Ca 0.08 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.94 3him h ALA 162 Cb 0.36 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 3him h ALA 162 CO 0.01 -0.00 -0.21 1.25 0.00 0.00 0.00 179.25 180.30 3him h LEU 163 N 0.40 -0.64 -0.93 0.00 5.85 -1.00 -0.87 115.31 118.12 3him h LEU 163 Ca 0.11 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.98 3him h LEU 163 Cb 0.13 0.30 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 3him h LEU 163 CO -0.01 -0.25 0.60 0.00 -0.34 0.00 0.00 178.44 178.44 3him h ALA 164 N 0.78 1.22 -0.43 1.25 0.00 -0.79 0.36 119.26 121.64 3him h ALA 164 Ca 0.11 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3him h ALA 164 Cb 0.41 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3him h ALA 164 CO -0.30 0.49 -0.05 0.82 0.00 0.00 0.00 179.25 180.21 3him h ILE 165 N 1.18 1.27 -0.39 0.00 2.04 -1.04 -0.83 117.51 119.74 3him h ILE 165 Ca 0.36 -1.12 -0.14 0.00 1.00 0.00 0.00 64.86 64.96 3him h ILE 165 Cb -0.02 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 3him h ILE 165 CO -0.11 0.38 -0.32 0.71 0.00 0.00 0.00 178.15 178.80 3him h THR 166 N 0.63 1.28 -0.45 -0.27 1.35 -0.44 -2.46 112.91 112.55 3him h THR 166 Ca 0.12 -1.49 0.01 0.00 -0.55 0.00 0.00 66.41 64.50 3him h THR 166 Cb 0.56 1.32 -0.02 0.00 -1.73 0.00 0.00 68.15 68.27 3him h THR 166 CO 0.03 0.50 0.29 -1.28 -0.25 0.00 0.00 175.52 174.81 3him h SER 167 N 0.73 0.51 -0.34 5.36 0.87 -0.17 -1.76 113.55 118.75 3him h SER 167 Ca 0.08 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.63 3him h SER 167 Cb 0.89 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.70 3him h SER 167 CO 0.08 0.37 0.21 -0.07 -0.53 0.00 0.00 176.83 176.89 3him h LEU 168 N 0.60 0.36 0.02 2.23 3.38 -0.96 -1.17 115.31 119.77 3him h LEU 168 Ca 0.16 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 3him h LEU 168 Cb -0.07 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.60 3him h LEU 168 CO -0.04 0.26 -0.01 1.23 0.09 0.00 0.00 178.44 179.97 3him h GLY 169 N 0.44 -0.02 1.04 0.83 0.00 -1.32 -2.39 103.07 101.64 3him h GLY 169 Ca 0.13 0.01 0.03 0.00 0.00 0.00 0.00 47.33 47.49 3him h GLY 169 CO -0.04 -0.01 0.59 -2.22 0.00 0.00 0.00 176.54 174.86 3him h ILE 170 N -0.04 1.18 0.00 2.60 2.04 -1.24 -2.41 117.51 119.64 3him h ILE 170 Ca -0.00 -0.40 -0.07 0.00 1.00 0.00 0.00 64.86 65.39 3him h ILE 170 Cb 0.04 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.03 3him h ILE 170 CO 0.00 0.21 -0.32 -0.78 0.00 0.00 0.00 178.15 177.26 3him h ASP 171 N 1.16 0.00 -0.97 1.72 3.58 -1.03 -2.37 116.42 118.51 3him h ASP 171 Ca 0.35 0.00 0.22 0.00 0.42 0.00 0.00 57.03 58.01 3him h ASP 171 Cb -0.04 0.00 -0.09 0.00 1.72 0.00 0.00 39.33 40.92 3him h ASP 171 CO -0.09 0.32 0.62 0.58 -2.88 0.00 0.00 179.24 177.79 3him h VAL 172 N 0.00 0.65 0.00 2.25 2.07 -0.91 0.22 116.25 120.53 3him h VAL 172 Ca -0.00 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 3him h VAL 172 Cb 0.91 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3him h VAL 172 CO 0.04 0.09 -0.04 0.28 0.02 0.00 0.00 177.57 177.97 3him h SER 173 N 0.52 0.00 0.02 0.57 0.02 -1.50 -1.33 113.55 111.85 3him h SER 173 Ca 0.54 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.49 3him h SER 173 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 3him h SER 173 CO -0.27 0.04 -0.01 -0.09 -1.14 0.00 0.00 176.83 175.35 3him h ARG 174 N 0.00 -0.03 0.00 3.45 2.43 -1.09 -3.41 114.38 115.73 3him h ARG 174 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3him h ARG 174 Cb 0.39 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 3him h ARG 174 CO 0.00 0.59 -1.43 -2.67 -1.51 0.00 0.00 179.97 174.96 3him n TRP 175 N -4.71 0.41 -2.74 2.20 4.27 -1.06 -4.95 117.44 110.87 3him n TRP 175 Ca -0.07 0.12 -0.38 0.00 -3.89 0.00 0.00 57.50 53.29 3him n TRP 175 Cb 0.31 -0.65 -0.06 0.00 -1.36 0.00 0.00 31.31 29.55 3him n TRP 175 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 3him s PHE 176 N -3.39 3.70 0.41 -2.67 2.19 -0.51 -3.96 117.98 113.73 3him s PHE 176 Ca -0.03 1.79 -0.17 0.00 0.33 0.00 0.00 56.93 58.85 3him s PHE 176 Cb 0.12 -2.97 -0.09 0.00 -1.31 0.00 0.00 43.02 38.77 3him s PHE 176 CO 0.84 0.14 0.86 -1.25 1.83 0.00 0.00 175.22 177.64 3him s PRO 177 N -1.92 4.05 0.50 10.12 0.04 -1.26 -4.94 135.00 141.59 3him s PRO 177 Ca 0.49 0.87 0.06 0.00 0.04 0.00 0.00 61.00 62.45 3him s PRO 177 Cb -0.21 -2.28 0.01 0.00 0.04 0.00 0.00 34.50 32.06 3him s PRO 177 CO 0.26 -0.01 0.32 -1.54 0.04 0.00 0.00 177.00 176.08 3him s SER 178 N -2.47 4.59 0.21 6.66 1.04 0.75 -4.96 113.70 119.52 3him s SER 178 Ca 0.58 -1.21 -0.08 0.00 0.48 0.00 0.00 55.95 55.72 3him s SER 178 Cb -0.10 0.17 0.16 0.00 0.10 0.00 0.00 66.02 66.35 3him s SER 178 CO 0.20 -0.93 1.80 0.45 0.98 0.00 0.00 173.24 175.73 3him h HIS 179 N 0.96 1.15 -0.09 5.02 3.86 -2.03 -3.05 115.15 120.97 3him h HIS 179 Ca -0.39 -0.06 -0.12 0.00 -1.16 0.00 0.00 60.37 58.64 3him h HIS 179 Cb 1.29 -0.36 0.01 0.00 1.06 0.00 0.00 27.41 29.41 3him h HIS 179 CO 0.92 0.84 -0.42 1.15 0.86 0.00 0.00 177.93 181.28 3him h THR 180 N 1.13 1.39 -3.68 2.45 2.02 -2.03 -3.42 112.91 110.77 3him h THR 180 Ca 0.27 -1.78 -0.66 0.00 0.77 0.00 0.00 66.41 65.01 3him h THR 180 Cb 0.13 2.24 -0.39 0.00 -1.74 0.00 0.00 68.15 68.39 3him h THR 180 CO -0.03 0.52 -0.70 -0.31 0.37 0.00 0.00 175.52 175.37 3him s TYR 181 N -3.67 3.72 0.00 3.16 2.02 -1.15 -4.78 117.35 116.64 3him s TYR 181 Ca -0.13 -2.89 0.00 0.00 -0.37 0.00 0.00 57.07 53.67 3him s TYR 181 Cb 0.05 -2.90 0.00 0.00 -0.40 0.00 0.00 41.96 38.71 3him s TYR 181 CO 0.80 -0.95 0.21 -1.13 -1.57 0.00 0.00 175.55 172.92 3him n SER 182 N 4.30 0.42 -4.28 2.29 3.41 -1.24 -0.18 113.62 118.34 3him n SER 182 Ca 0.02 -0.71 -0.37 0.00 -0.26 0.00 0.00 58.87 57.55 3him n SER 182 Cb 0.42 0.40 -0.13 0.00 -0.26 0.00 0.00 64.21 64.64 3him n SER 182 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3him s ASP 183 N -0.40 5.07 0.40 4.04 -1.08 -1.26 -4.98 116.67 118.46 3him s ASP 183 Ca 0.00 -0.93 0.20 0.00 -0.52 0.00 0.00 52.55 51.30 3him s ASP 183 Cb 0.00 -1.83 1.15 0.00 -1.46 0.00 0.00 42.92 40.78 3him s ASP 183 CO 0.00 -0.24 1.75 -0.65 0.52 0.00 0.00 175.17 176.56 3him h PRO 184 N 8.18 0.34 -0.53 4.34 0.11 -1.95 -1.67 132.00 140.81 3him h PRO 184 Ca -0.28 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.73 3him h PRO 184 Cb 1.10 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 3him h PRO 184 CO 0.59 0.22 -0.01 0.00 -0.21 0.00 0.00 178.00 178.59 3him h ARG 185 N 0.35 0.91 -0.06 1.05 3.08 -1.98 -1.11 114.38 116.63 3him h ARG 185 Ca 0.62 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 60.38 3him h ARG 185 Cb 1.64 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 31.59 3him h ARG 185 CO -0.31 0.91 -0.02 0.82 -1.07 0.00 0.00 179.97 180.31 3him h ILE 186 N 0.84 1.30 -0.71 2.04 2.04 -1.74 -2.01 117.51 119.27 3him h ILE 186 Ca 0.15 -0.95 -0.03 0.00 1.00 0.00 0.00 64.86 65.03 3him h ILE 186 Cb 0.52 1.81 -0.03 0.00 -0.74 0.00 0.00 36.82 38.38 3him h ILE 186 CO 0.03 0.26 0.31 -0.29 0.00 0.00 0.00 178.15 178.46 3him h ILE 187 N -0.23 1.24 -0.78 -0.67 6.09 -1.39 -1.54 117.51 120.23 3him h ILE 187 Ca 0.02 -0.72 0.00 0.00 -1.37 0.00 0.00 64.86 62.79 3him h ILE 187 Cb 0.43 0.39 -0.04 0.00 0.47 0.00 0.00 36.82 38.07 3him h ILE 187 CO 0.01 0.29 0.50 0.00 -3.07 0.00 0.00 178.15 175.88 3him h ALA 188 N 1.15 0.99 -0.47 0.18 0.00 -1.19 -0.65 119.26 119.28 3him h ALA 188 Ca 0.24 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3him h ALA 188 Cb 0.16 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3him h ALA 188 CO -0.03 0.43 0.23 0.00 0.00 0.00 0.00 179.25 179.89 3him h ALA 189 N 1.27 0.60 -0.92 0.00 0.00 -0.88 0.40 119.26 119.73 3him h ALA 189 Ca 0.28 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.11 3him h ALA 189 Cb -0.09 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.46 3him h ALA 189 CO -0.06 0.16 0.60 0.00 0.00 0.00 0.00 179.25 179.95 3him h ARG 190 N 0.62 1.17 0.01 0.00 -0.00 -0.86 -2.43 114.38 112.88 3him h ARG 190 Ca 0.16 -0.07 -0.19 0.00 -0.50 0.00 0.00 59.98 59.38 3him h ARG 190 Cb 0.10 -0.26 -0.02 0.00 0.00 0.00 0.00 29.97 29.78 3him h ARG 190 CO -0.02 0.77 -0.88 1.88 0.00 0.00 0.00 179.97 181.72 3him h TYR 191 N 1.21 0.07 -0.27 3.04 -1.99 -0.46 -2.57 116.97 115.99 3him h TYR 191 Ca 0.35 -0.04 0.02 0.00 2.00 0.00 0.00 58.73 61.06 3him h TYR 191 Cb -0.08 -0.01 -0.02 0.00 2.00 0.00 0.00 36.73 38.63 3him h TYR 191 CO -0.01 0.90 0.14 0.28 -0.00 0.00 0.00 178.16 179.47 3him h VAL 192 N 0.02 1.00 -0.87 -2.88 2.07 -0.02 -0.37 116.25 115.20 3him h VAL 192 Ca -0.02 -0.10 0.06 0.00 0.82 0.00 0.00 66.70 67.46 3him h VAL 192 Cb 1.54 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.93 3him h VAL 192 CO 0.12 0.05 0.54 -0.33 0.02 0.00 0.00 177.57 177.98 3him h GLU 193 N 0.29 0.96 -0.21 1.57 5.08 -1.25 -1.89 114.58 119.13 3him h GLU 193 Ca 0.11 -0.06 -0.18 0.00 -1.00 0.00 0.00 59.36 58.23 3him h GLU 193 Cb 0.03 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.06 3him h GLU 193 CO -0.07 0.63 -0.58 -0.07 -1.00 0.00 0.00 179.01 177.92 3him h LEU 194 N 0.98 0.88 -0.54 1.33 3.38 -1.23 -2.32 115.31 117.80 3him h LEU 194 Ca 0.38 -0.58 0.03 0.00 0.09 0.00 0.00 57.88 57.80 3him h LEU 194 Cb 0.18 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 3him h LEU 194 CO -0.18 1.30 0.32 0.00 0.09 0.00 0.00 178.44 179.98 3him h ALA 195 N 0.60 0.70 -0.67 1.53 0.00 -0.86 0.16 119.26 120.72 3him h ALA 195 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3him h ALA 195 Cb 1.20 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 3him h ALA 195 CO 0.13 0.03 0.33 -0.07 0.00 0.00 0.00 179.25 179.67 3him h LEU 196 N 0.64 0.87 -0.66 0.00 3.38 -1.33 -1.87 115.31 116.35 3him h LEU 196 Ca 0.22 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 3him h LEU 196 Cb 0.03 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 3him h LEU 196 CO -0.10 0.75 0.22 0.03 0.09 0.00 0.00 178.44 179.43 3him h ARG 197 N 0.93 1.02 -0.70 1.13 2.47 -0.99 -1.12 114.38 117.12 3him h ARG 197 Ca 0.23 -0.21 0.05 0.00 -1.26 0.00 0.00 59.98 58.79 3him h ARG 197 Cb 0.10 -0.15 -0.05 0.00 -1.65 0.00 0.00 29.97 28.22 3him h ARG 197 CO -0.03 0.89 0.41 0.52 0.56 0.00 0.00 179.97 182.32 3him h MET 198 N 0.96 0.76 -0.28 0.04 2.86 -0.37 -1.86 114.93 117.05 3him h MET 198 Ca 0.22 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 3him h MET 198 Cb 0.28 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.77 3him h MET 198 CO -0.01 0.50 0.00 1.33 1.06 0.00 0.00 176.91 179.79 3him n VAL 199 N -4.72 0.37 -2.25 -2.22 0.24 -0.73 -4.66 118.33 104.36 3him n VAL 199 Ca 0.08 -0.40 -0.12 0.00 -2.04 0.00 0.00 64.34 61.86 3him n VAL 199 Cb 0.14 0.24 -0.00 0.00 -1.47 0.00 0.00 33.84 32.75 3him n VAL 199 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3him n GLY 200 N 1.04 -0.10 3.79 7.63 0.00 -0.70 -0.57 105.19 116.29 3him n GLY 200 Ca 0.12 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 3him n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3him s ALA 202 N -1.75 2.11 -2.00 0.00 0.00 -1.26 -4.57 121.76 114.28 3him s ALA 202 Ca 0.62 0.94 0.28 0.00 0.00 0.00 0.00 51.96 53.80 3him s ALA 202 Cb -0.21 -3.49 1.69 0.00 0.00 0.00 0.00 23.12 21.11 3him s ALA 202 CO 0.26 -1.91 2.03 -0.25 0.00 0.00 0.00 175.76 175.89