#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q3t n SER 37 N 0.00 2.88 0.00 1.61 2.88 -1.26 -2.00 113.62 117.73 2q3t n SER 37 Ca 0.00 0.76 0.00 0.00 -1.33 0.00 0.00 58.87 58.30 2q3t n SER 37 Cb 0.00 -1.32 0.00 0.00 -0.75 0.00 0.00 64.21 62.14 2q3t n SER 37 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2q3t n LEU 38 N 7.81 0.00 0.01 2.46 4.77 -1.26 -4.80 117.00 125.99 2q3t n LEU 38 Ca 0.29 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 56.09 2q3t n LEU 38 Cb 0.26 -0.10 -0.10 0.00 -2.33 0.00 0.00 43.42 41.15 2q3t n LEU 38 CO 0.75 0.00 0.22 -0.07 -1.33 0.00 0.00 177.39 176.96 2q3t h LEU 39 N 0.00 0.65 -0.21 2.23 3.38 -1.78 -0.48 115.31 119.10 2q3t h LEU 39 Ca 0.00 -0.74 -0.01 0.00 0.09 0.00 0.00 57.88 57.22 2q3t h LEU 39 Cb 0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2q3t h LEU 39 CO 0.00 1.30 0.10 0.03 0.09 0.00 0.00 178.44 179.96 2q3t h ARG 40 N 0.06 0.30 -0.50 1.13 3.08 -1.92 -1.17 114.38 115.35 2q3t h ARG 40 Ca -0.08 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.82 2q3t h ARG 40 Cb 1.39 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.37 2q3t h ARG 40 CO 0.14 0.31 -0.11 0.07 -1.07 0.00 0.00 179.97 179.31 2q3t h ARG 41 N 0.21 0.96 -0.73 0.04 0.11 -1.95 -1.78 114.38 111.24 2q3t h ARG 41 Ca 0.07 -0.36 0.06 0.00 0.10 0.00 0.00 59.98 59.84 2q3t h ARG 41 Cb 0.11 -0.06 -0.04 0.00 1.11 0.00 0.00 29.97 31.09 2q3t h ARG 41 CO -0.01 1.03 0.48 0.00 0.10 0.00 0.00 179.97 181.57 2q3t h ALA 42 N 0.90 1.66 0.15 0.08 0.00 -0.87 -1.32 119.26 119.87 2q3t h ALA 42 Ca 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2q3t h ALA 42 Cb 0.67 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2q3t h ALA 42 CO 0.05 0.24 -0.07 1.49 0.00 0.00 0.00 179.25 180.95 2q3t h GLU 43 N 0.80 -0.20 -0.84 0.00 4.81 -0.37 -1.60 114.58 117.18 2q3t h GLU 43 Ca 0.31 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.64 2q3t h GLU 43 Cb 0.20 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.55 2q3t h GLU 43 CO -0.10 -0.03 0.49 0.52 -0.73 0.00 0.00 179.01 179.16 2q3t h MET 44 N -0.34 0.82 -0.20 1.92 2.86 -1.04 -1.63 114.93 117.32 2q3t h MET 44 Ca -0.02 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.50 2q3t h MET 44 Cb 0.26 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.74 2q3t h MET 44 CO 0.03 0.54 -0.16 -0.92 1.06 0.00 0.00 176.91 177.47 2q3t h TYR 45 N 0.84 0.55 -0.03 -0.22 3.20 -1.17 -1.50 116.97 118.64 2q3t h TYR 45 Ca 0.40 -0.15 -0.14 0.00 3.14 0.00 0.00 58.73 61.97 2q3t h TYR 45 Cb 0.33 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 2q3t h TYR 45 CO -0.05 0.79 -0.64 0.37 -1.64 0.00 0.00 178.16 176.99 2q3t h GLN 46 N 0.14 0.10 -0.01 1.82 5.75 -1.10 0.96 115.11 122.77 2q3t h GLN 46 Ca 0.04 -0.08 -0.08 0.00 -0.15 0.00 0.00 58.65 58.38 2q3t h GLN 46 Cb 0.68 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.23 2q3t h GLN 46 CO 0.04 0.71 -0.39 -0.44 -2.65 0.00 0.00 178.83 176.11 2q3t h ASP 47 N 0.07 0.02 0.00 -0.69 3.32 -1.31 0.21 116.42 118.05 2q3t h ASP 47 Ca -0.01 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.92 2q3t h ASP 47 Cb 1.15 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.70 2q3t h ASP 47 CO 0.09 0.40 -0.44 0.22 -1.72 0.00 0.00 179.24 177.80 2q3t h TYR 48 N 0.02 0.44 -0.07 4.55 3.20 -0.76 -3.27 116.97 121.07 2q3t h TYR 48 Ca -0.00 -0.24 -0.14 0.00 3.14 0.00 0.00 58.73 61.49 2q3t h TYR 48 Cb 0.69 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 2q3t h TYR 48 CO 0.00 1.06 -0.57 0.52 -1.64 0.00 0.00 178.16 177.52 2q3t h MET 49 N -0.31 0.21 0.00 1.82 2.86 0.22 -2.30 114.93 117.44 2q3t h MET 49 Ca -0.06 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.43 2q3t h MET 49 Cb 1.18 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.85 2q3t h MET 49 CO 0.09 0.73 -0.06 1.57 1.06 0.00 0.00 176.91 180.30 2q3t h LYS 50 N 0.16 0.00 -0.01 1.72 2.10 -0.68 -0.79 116.57 119.07 2q3t h LYS 50 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2q3t h LYS 50 Cb 1.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.39 2q3t h LYS 50 CO 0.09 0.06 -0.11 1.04 -2.00 0.00 0.00 179.45 178.52 2q3t n GLN 51 N -3.72 0.99 -2.97 0.07 6.02 -0.87 -4.81 117.38 112.08 2q3t n GLN 51 Ca -0.02 -0.46 -0.41 0.00 -0.01 0.00 0.00 57.00 56.10 2q3t n GLN 51 Cb 0.16 -1.49 -0.04 0.00 1.02 0.00 0.00 30.24 29.88 2q3t n GLN 51 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2q3t s VAL 52 N -2.33 4.96 0.53 5.09 1.01 -0.31 -5.02 120.40 124.33 2q3t s VAL 52 Ca 0.31 1.53 -0.18 0.00 0.00 0.00 0.00 61.98 63.65 2q3t s VAL 52 Cb 0.20 -4.09 -0.07 0.00 0.00 0.00 0.00 36.38 32.43 2q3t s VAL 52 CO 0.44 0.13 1.04 -2.16 0.00 0.00 0.00 175.10 174.55 2q3t s PRO 53 N 1.53 3.65 -0.05 2.72 0.04 -1.26 -4.99 135.00 136.63 2q3t s PRO 53 Ca 0.38 1.25 -0.30 0.00 0.04 0.00 0.00 61.00 62.37 2q3t s PRO 53 Cb -0.17 -2.08 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 2q3t s PRO 53 CO 0.15 -0.54 1.03 0.42 0.04 0.00 0.00 177.00 178.10 2q3t s ILE 54 N -2.24 4.71 0.18 0.56 -1.09 -1.26 -5.00 121.20 117.06 2q3t s ILE 54 Ca 0.65 1.96 -0.32 0.00 -2.23 0.00 0.00 60.65 60.71 2q3t s ILE 54 Cb -0.15 -4.26 -0.11 0.00 -1.58 0.00 0.00 42.46 36.36 2q3t s ILE 54 CO 0.27 0.07 1.61 -2.84 -1.23 0.00 0.00 174.94 172.82 2q3t s PRO 55 N 1.60 4.19 0.04 2.79 0.02 -1.26 -4.86 135.00 137.52 2q3t s PRO 55 Ca 0.51 2.43 0.17 0.00 0.02 0.00 0.00 61.00 64.13 2q3t s PRO 55 Cb -0.21 -3.13 -0.15 0.00 0.02 0.00 0.00 34.50 31.03 2q3t s PRO 55 CO 0.23 -0.65 0.77 0.25 -0.33 0.00 0.00 177.00 177.27 2q3t n THR 56 N 3.97 1.17 -3.54 0.99 -2.24 -1.26 -4.79 114.28 108.58 2q3t n THR 56 Ca 0.14 -0.69 -0.40 0.00 -2.27 0.00 0.00 64.05 60.83 2q3t n THR 56 Cb 0.37 -0.71 -0.11 0.00 -2.10 0.00 0.00 70.33 67.79 2q3t n THR 56 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2q3t s ASN 57 N -5.73 6.02 0.01 3.42 0.01 -1.26 -5.03 114.94 112.38 2q3t s ASN 57 Ca -0.03 -0.41 -0.01 0.00 -0.71 0.00 0.00 52.86 51.69 2q3t s ASN 57 Cb 0.09 -2.13 -0.04 0.00 0.41 0.00 0.00 41.25 39.58 2q3t s ASN 57 CO 0.82 -0.22 0.16 -0.13 -1.51 0.00 0.00 177.10 176.21 2q3t s ARG 58 N 1.72 3.31 0.00 -0.60 1.81 -1.26 -5.09 118.95 118.84 2q3t s ARG 58 Ca 0.06 -0.40 0.00 0.00 -1.72 0.00 0.00 55.73 53.67 2q3t s ARG 58 Cb -0.17 -3.01 0.00 0.00 -0.45 0.00 0.00 34.95 31.32 2q3t s ARG 58 CO 0.10 0.65 0.00 0.41 -0.68 0.00 0.00 175.30 175.79 2q3t n GLY 59 N 0.89 -1.66 3.77 -3.53 0.00 -1.26 -5.05 105.19 98.35 2q3t n GLY 59 Ca -0.10 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.07 2q3t n GLY 59 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2q3t s SER 60 N -1.24 2.49 0.32 1.61 0.01 -1.26 -5.00 113.70 110.64 2q3t s SER 60 Ca 0.00 0.61 -0.29 0.00 1.31 0.00 0.00 55.95 57.58 2q3t s SER 60 Cb 0.00 -0.90 -0.11 0.00 0.21 0.00 0.00 66.02 65.23 2q3t s SER 60 CO 0.00 -3.15 1.48 -1.48 0.41 0.00 0.00 173.24 170.50 2q3t s LEU 61 N -6.29 4.36 -0.34 2.44 0.05 -1.26 -4.99 118.68 112.64 2q3t s LEU 61 Ca 0.70 2.90 -0.07 0.00 0.05 0.00 0.00 54.13 57.71 2q3t s LEU 61 Cb -0.09 -3.65 0.04 0.00 -2.05 0.00 0.00 46.19 40.44 2q3t s LEU 61 CO 0.54 -0.80 0.12 -0.63 -0.55 0.00 0.00 176.35 175.03 2q3t s ILE 62 N -0.58 3.83 0.61 1.48 1.01 -1.26 -5.05 121.20 121.22 2q3t s ILE 62 Ca 0.56 -1.15 -0.18 0.00 0.00 0.00 0.00 60.65 59.89 2q3t s ILE 62 Cb -0.45 -3.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.81 2q3t s ILE 62 CO 0.53 -0.20 1.19 -2.84 0.00 0.00 0.00 174.94 173.62 2q3t s PRO 63 N 1.41 2.91 -0.08 2.79 0.02 -1.26 -4.72 135.00 136.06 2q3t s PRO 63 Ca -0.01 1.77 -0.30 0.00 0.02 0.00 0.00 61.00 62.48 2q3t s PRO 63 Cb -0.20 -1.93 0.07 0.00 0.02 0.00 0.00 34.50 32.46 2q3t s PRO 63 CO 0.03 -1.24 0.67 -0.59 -0.33 0.00 0.00 177.00 175.54 2q3t s PHE 64 N -1.70 -0.66 0.00 6.54 -0.12 -1.26 -4.92 117.98 115.85 2q3t s PHE 64 Ca 0.76 1.21 0.00 0.00 -0.05 0.00 0.00 56.93 58.84 2q3t s PHE 64 Cb -0.29 0.38 0.00 0.00 -0.63 0.00 0.00 43.02 42.48 2q3t s PHE 64 CO 0.34 -0.57 0.29 0.25 -0.05 0.00 0.00 175.22 175.49 2q3t n THR 65 N 1.16 0.00 -3.66 -4.49 -2.24 -1.26 -0.89 114.28 102.91 2q3t n THR 65 Ca -0.18 -0.38 -0.14 0.00 -2.27 0.00 0.00 64.05 61.07 2q3t n THR 65 Cb 0.57 1.19 -0.08 0.00 -2.10 0.00 0.00 70.33 69.90 2q3t n THR 65 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2q3t s SER 66 N -0.17 -0.57 0.44 3.42 0.15 -1.26 -3.77 113.70 111.94 2q3t s SER 66 Ca 0.00 0.98 0.13 0.00 0.70 0.00 0.00 55.95 57.76 2q3t s SER 66 Cb 0.00 0.98 1.03 0.00 -1.71 0.00 0.00 66.02 66.32 2q3t s SER 66 CO 0.00 -0.30 2.00 -0.50 1.20 0.00 0.00 173.24 175.64 2q3t h TRP 67 N 4.67 0.40 -0.13 3.44 4.06 -1.96 -1.76 115.95 124.68 2q3t h TRP 67 Ca -0.28 0.01 -0.07 0.00 2.06 0.00 0.00 58.89 60.61 2q3t h TRP 67 Cb 1.16 -0.13 -0.00 0.00 -1.00 0.00 0.00 29.16 29.19 2q3t h TRP 67 CO 0.41 0.20 -0.19 0.28 -3.56 0.00 0.00 178.44 175.58 2q3t h VAL 68 N 0.39 1.37 -0.99 1.49 2.07 -1.97 0.36 116.25 118.97 2q3t h VAL 68 Ca 0.24 -1.42 0.14 0.00 0.82 0.00 0.00 66.70 66.48 2q3t h VAL 68 Cb 0.45 1.99 -0.09 0.00 -1.52 0.00 0.00 31.29 32.12 2q3t h VAL 68 CO -0.06 0.42 0.61 1.23 0.02 0.00 0.00 177.57 179.78 2q3t h GLY 69 N -0.05 1.65 0.76 2.17 0.00 -1.87 0.12 103.07 105.86 2q3t h GLY 69 Ca 0.01 -0.39 0.05 0.00 0.00 0.00 0.00 47.33 47.00 2q3t h GLY 69 CO 0.04 0.09 0.51 -2.00 0.00 0.00 0.00 176.54 175.18 2q3t h LEU 70 N 0.90 0.80 -1.85 3.11 5.85 -1.15 0.12 115.31 123.09 2q3t h LEU 70 Ca 0.51 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 59.22 2q3t h LEU 70 Cb 0.60 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 2q3t h LEU 70 CO -0.30 0.53 -0.14 0.77 -0.34 0.00 0.00 178.44 178.96 2q3t h SER 71 N 0.94 0.00 0.00 1.25 4.64 0.16 0.85 113.55 121.40 2q3t h SER 71 Ca 0.35 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.51 2q3t h SER 71 Cb 0.13 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.23 2q3t h SER 71 CO -0.16 0.14 -0.64 0.40 -0.87 0.00 0.00 176.83 175.71 2q3t h ILE 72 N 0.00 1.42 -0.94 0.95 2.04 -0.23 -1.11 117.51 119.64 2q3t h ILE 72 Ca -0.00 -2.11 0.14 0.00 1.00 0.00 0.00 64.86 63.89 2q3t h ILE 72 Cb 0.32 2.61 -0.08 0.00 -0.74 0.00 0.00 36.82 38.93 2q3t h ILE 72 CO 0.02 0.61 0.60 0.28 0.00 0.00 0.00 178.15 179.66 2q3t h SER 73 N -0.08 0.76 -0.31 1.72 0.02 0.07 0.15 113.55 115.88 2q3t h SER 73 Ca -0.08 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 2q3t h SER 73 Cb 1.35 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.77 2q3t h SER 73 CO 0.13 0.39 0.13 0.24 -1.14 0.00 0.00 176.83 176.58 2q3t h MET 74 N 0.81 0.45 -0.29 3.45 2.86 0.76 0.38 114.93 123.35 2q3t h MET 74 Ca 0.47 -0.08 -0.07 0.00 -2.06 0.00 0.00 59.70 57.97 2q3t h MET 74 Cb 0.65 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 2q3t h MET 74 CO -0.24 0.45 -0.13 0.87 1.06 0.00 0.00 176.91 178.92 2q3t h LYS 75 N 0.35 0.49 0.18 1.72 1.57 -0.50 -0.42 116.57 119.97 2q3t h LYS 75 Ca 0.10 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2q3t h LYS 75 Cb 0.15 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.41 2q3t h LYS 75 CO -0.01 0.61 -0.09 1.96 -0.57 0.00 0.00 179.45 181.36 2q3t h GLN 76 N 0.45 -0.23 -0.04 3.15 4.20 -0.56 -2.14 115.11 119.94 2q3t h GLN 76 Ca 0.08 0.02 -0.24 0.00 0.06 0.00 0.00 58.65 58.57 2q3t h GLN 76 Cb 0.49 0.05 0.02 0.00 0.30 0.00 0.00 27.48 28.34 2q3t h GLN 76 CO 0.03 0.17 -0.93 -0.07 -0.67 0.00 0.00 178.83 177.35 2q3t h LEU 77 N -0.75 0.88 -0.10 1.46 3.38 -0.04 -3.29 115.31 116.86 2q3t h LEU 77 Ca -0.02 -0.71 0.00 0.00 0.09 0.00 0.00 57.88 57.23 2q3t h LEU 77 Cb 0.51 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2q3t h LEU 77 CO 0.04 1.47 -0.65 -1.22 0.09 0.00 0.00 178.44 178.17 2q3t n TYR 78 N -3.92 0.00 -2.02 1.13 4.01 -0.18 -4.95 117.16 111.22 2q3t n TYR 78 Ca -0.10 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.48 2q3t n TYR 78 Cb 0.83 -0.14 -0.03 0.00 -0.31 0.00 0.00 39.34 39.69 2q3t n TYR 78 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2q3t n GLY 79 N 1.48 0.33 3.32 2.72 0.00 -0.80 -5.01 105.19 107.23 2q3t n GLY 79 Ca 0.06 -0.24 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 2q3t n GLY 79 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2q3t s GLN 80 N -4.31 1.42 0.50 1.61 -0.21 -1.26 -4.77 119.66 112.64 2q3t s GLN 80 Ca 0.00 -1.15 -0.19 0.00 0.02 0.00 0.00 55.36 54.04 2q3t s GLN 80 Cb 0.00 -1.69 -0.08 0.00 1.00 0.00 0.00 33.01 32.24 2q3t s GLN 80 CO 0.00 0.42 1.03 -1.25 -2.12 0.00 0.00 175.29 173.36 2q3t s PRO 81 N -1.62 3.78 0.30 2.91 0.04 -1.26 -4.40 135.00 134.75 2q3t s PRO 81 Ca 0.10 1.27 0.06 0.00 0.04 0.00 0.00 61.00 62.48 2q3t s PRO 81 Cb -0.10 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.32 2q3t s PRO 81 CO 0.04 -0.43 0.35 -0.51 0.04 0.00 0.00 177.00 176.48 2q3t s LEU 82 N -3.67 3.93 0.52 -3.56 1.43 -1.26 -5.09 118.68 110.98 2q3t s LEU 82 Ca 0.65 -0.21 -0.18 0.00 -1.03 0.00 0.00 54.13 53.36 2q3t s LEU 82 Cb -0.15 -2.57 -0.07 0.00 0.03 0.00 0.00 46.19 43.43 2q3t s LEU 82 CO 0.23 -0.25 1.01 -2.28 0.23 0.00 0.00 176.35 175.29 2q3t s HIS 83 N -2.15 3.19 0.08 0.29 5.65 -1.26 -4.36 115.29 116.73 2q3t s HIS 83 Ca 0.39 1.53 -0.11 0.00 0.25 0.00 0.00 55.06 57.11 2q3t s HIS 83 Cb -0.08 -2.93 0.01 0.00 -1.18 0.00 0.00 32.58 28.40 2q3t s HIS 83 CO 0.28 -0.64 0.64 0.98 -0.65 0.00 0.00 174.74 175.35 2q3t n TYR 84 N -1.42 -0.13 0.18 3.88 9.36 -1.25 -0.58 117.16 127.20 2q3t n TYR 84 Ca 0.08 0.52 0.03 0.00 3.32 0.00 0.00 57.90 61.85 2q3t n TYR 84 Cb 0.53 -0.57 0.34 0.00 -0.63 0.00 0.00 39.34 39.01 2q3t n TYR 84 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 2q3t h LEU 85 N 0.00 0.00 -0.11 2.98 3.38 -1.92 0.16 115.31 119.80 2q3t h LEU 85 Ca 0.09 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.82 2q3t h LEU 85 Cb 0.19 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.96 2q3t h LEU 85 CO -0.40 0.41 -0.89 0.74 0.09 0.00 0.00 178.44 178.39 2q3t h THR 86 N 0.00 1.29 -0.19 0.22 2.02 -1.50 0.58 112.91 115.32 2q3t h THR 86 Ca -0.00 -2.12 -0.10 0.00 0.77 0.00 0.00 66.41 64.96 2q3t h THR 86 Cb 0.78 2.17 -0.01 0.00 -1.74 0.00 0.00 68.15 69.35 2q3t h THR 86 CO 0.05 0.66 -0.31 0.78 0.37 0.00 0.00 175.52 177.08 2q3t h ASN 87 N 0.45 0.39 -0.54 4.18 2.35 -0.42 -0.57 115.58 121.42 2q3t h ASN 87 Ca -0.08 -0.14 -0.10 0.00 -0.55 0.00 0.00 56.30 55.43 2q3t h ASN 87 Cb 1.53 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.77 2q3t h ASN 87 CO 0.18 0.69 -0.03 0.58 -1.65 0.00 0.00 177.43 177.19 2q3t h VAL 88 N 0.33 1.27 -0.20 2.81 2.07 -0.64 -0.73 116.25 121.15 2q3t h VAL 88 Ca 0.04 -1.16 -0.11 0.00 0.82 0.00 0.00 66.70 66.29 2q3t h VAL 88 Cb 0.71 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2q3t h VAL 88 CO 0.05 0.41 -0.35 0.25 0.02 0.00 0.00 177.57 177.96 2q3t h LEU 89 N 0.86 0.44 -0.66 2.57 5.85 -0.24 0.44 115.31 124.57 2q3t h LEU 89 Ca 0.15 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 2q3t h LEU 89 Cb 0.58 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 2q3t h LEU 89 CO 0.03 0.76 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.63 2q3t h LEU 90 N 0.36 0.00 -1.05 2.25 3.38 -0.89 0.44 115.31 119.80 2q3t h LEU 90 Ca 0.04 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 2q3t h LEU 90 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 2q3t h LEU 90 CO 0.06 0.20 -0.35 -0.61 0.09 0.00 0.00 178.44 177.83 2q3t h GLN 91 N 0.00 0.22 -0.03 1.13 4.15 0.61 0.54 115.11 121.74 2q3t h GLN 91 Ca -0.00 -0.09 -0.21 0.00 0.77 0.00 0.00 58.65 59.11 2q3t h GLN 91 Cb 0.91 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.59 2q3t h GLN 91 CO 0.03 0.55 -0.87 0.00 -1.93 0.00 0.00 178.83 176.61 2q3t h ARG 92 N 0.19 0.43 -0.15 1.69 3.08 -1.13 0.94 114.38 119.43 2q3t h ARG 92 Ca 0.02 -0.42 0.02 0.00 0.07 0.00 0.00 59.98 59.67 2q3t h ARG 92 Cb 0.72 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 2q3t h ARG 92 CO 0.05 1.07 0.10 -1.49 -1.07 0.00 0.00 179.97 178.64 2q3t h TRP 93 N 0.26 0.13 -0.09 3.04 6.55 -0.61 -0.56 115.95 124.68 2q3t h TRP 93 Ca -0.06 0.00 -0.16 0.00 0.95 0.00 0.00 58.89 59.62 2q3t h TRP 93 Cb 1.49 -0.04 0.01 0.00 -0.86 0.00 0.00 29.16 29.75 2q3t h TRP 93 CO 0.06 0.08 -0.57 -0.44 -1.05 0.00 0.00 178.44 176.51 2q3t h ASP 94 N 0.14 0.65 -0.44 -3.49 3.32 0.15 -2.82 116.42 113.92 2q3t h ASP 94 Ca 0.06 -0.66 0.13 0.00 0.02 0.00 0.00 57.03 56.58 2q3t h ASP 94 Cb 0.08 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 2q3t h ASP 94 CO -0.01 1.22 0.37 1.56 -1.72 0.00 0.00 179.24 180.65 2q3t h GLN 95 N 0.14 0.00 0.00 3.56 4.20 0.10 -0.87 115.11 122.24 2q3t h GLN 95 Ca -0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2q3t h GLN 95 Cb 1.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.01 2q3t h GLN 95 CO 0.12 0.00 0.00 0.45 -0.67 0.00 0.00 178.83 178.73 2q3t n SER 96 N -4.12 0.00 0.21 1.46 2.88 -0.24 -1.46 113.62 112.35 2q3t n SER 96 Ca 0.08 -0.15 0.11 0.00 -1.33 0.00 0.00 58.87 57.57 2q3t n SER 96 Cb 0.56 -0.28 0.16 0.00 -0.75 0.00 0.00 64.21 63.90 2q3t n SER 96 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2q3t h ARG 97 N 0.00 0.00 -6.36 -1.46 3.08 -1.19 -3.46 114.38 104.99 2q3t h ARG 97 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 2q3t h ARG 97 Cb 0.27 0.00 0.14 0.00 0.08 0.00 0.00 29.97 30.46 2q3t h ARG 97 CO 0.00 0.08 -0.30 1.19 -1.07 0.00 0.00 179.97 179.88 2q3t n PHE 98 N -3.12 -0.14 0.00 3.04 3.01 -0.54 -4.10 117.46 115.61 2q3t n PHE 98 Ca 0.04 0.63 0.00 0.00 1.01 0.00 0.00 57.45 59.12 2q3t n PHE 98 Cb 0.56 -2.04 0.00 0.00 -0.01 0.00 0.00 39.48 37.99 2q3t n PHE 98 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2q3t n GLY 99 N 1.68 0.83 2.86 1.37 0.00 -1.26 -5.03 105.19 105.64 2q3t n GLY 99 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 2q3t n GLY 99 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2q3t s THR 100 N -1.21 0.06 0.06 2.61 -1.32 -1.26 -4.91 115.64 109.67 2q3t s THR 100 Ca 0.00 0.01 0.08 0.00 -1.21 0.00 0.00 61.69 60.57 2q3t s THR 100 Cb 0.00 -0.09 -0.22 0.00 -1.51 0.00 0.00 72.50 70.68 2q3t s THR 100 CO 0.00 0.04 1.05 0.44 -2.21 0.00 0.00 174.62 173.94 2q3t h ASP 101 N 6.39 0.03 -3.83 8.08 3.32 -1.96 -3.49 116.42 124.95 2q3t h ASP 101 Ca -0.29 -0.04 -0.56 0.00 0.02 0.00 0.00 57.03 56.16 2q3t h ASP 101 Cb 1.19 -0.01 0.15 0.00 0.22 0.00 0.00 39.33 40.88 2q3t h ASP 101 CO 0.50 1.03 0.42 -1.54 -1.72 0.00 0.00 179.24 177.93 2q3t n SER 102 N -3.26 1.94 -1.93 6.45 3.41 -1.26 -4.94 113.62 114.03 2q3t n SER 102 Ca -0.07 0.91 0.00 0.00 -0.26 0.00 0.00 58.87 59.45 2q3t n SER 102 Cb 0.98 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.43 2q3t n SER 102 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2q3t n GLU 103 N -1.08 2.63 -2.19 4.33 -0.58 -1.26 -4.42 120.64 118.08 2q3t n GLU 103 Ca 0.12 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.44 2q3t n GLU 103 Cb 0.45 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.33 2q3t n GLU 103 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2q3t n GLU 104 N 0.00 3.54 -2.54 3.49 -0.58 -1.26 -4.85 120.64 118.44 2q3t n GLU 104 Ca 0.00 -3.33 -0.42 0.00 -0.42 0.00 0.00 57.16 52.99 2q3t n GLU 104 Cb 0.00 -2.97 -0.03 0.00 -0.57 0.00 0.00 31.44 27.87 2q3t n GLU 104 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 2q3t s GLN 105 N 0.82 3.40 0.40 3.49 0.74 -1.26 -4.94 119.66 122.32 2q3t s GLN 105 Ca 0.42 0.19 -0.25 0.00 0.05 0.00 0.00 55.36 55.76 2q3t s GLN 105 Cb 0.11 -4.07 -0.11 0.00 1.10 0.00 0.00 33.01 30.04 2q3t s GLN 105 CO -0.02 -1.83 1.12 0.54 -0.55 0.00 0.00 175.29 174.55 2q3t n ARG 106 N 8.68 1.61 -0.30 1.67 1.74 -1.26 -4.92 116.66 123.88 2q3t n ARG 106 Ca 0.08 0.57 -0.03 0.00 -0.77 0.00 0.00 57.85 57.70 2q3t n ARG 106 Cb 0.49 -2.17 0.09 0.00 -1.02 0.00 0.00 32.46 29.85 2q3t n ARG 106 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2q3t h LEU 107 N 1.84 0.93 0.00 0.55 5.85 -1.71 -0.86 115.31 121.91 2q3t h LEU 107 Ca -0.45 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2q3t h LEU 107 Cb 1.32 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.12 2q3t h LEU 107 CO 0.59 0.66 0.00 -0.90 -0.34 0.00 0.00 178.44 178.45 2q3t n ASP 108 N -4.53 0.00 0.04 1.25 5.68 -0.07 -0.35 116.55 118.58 2q3t n ASP 108 Ca 0.09 -0.98 0.12 0.00 -0.50 0.00 0.00 54.79 53.52 2q3t n ASP 108 Cb 0.04 0.00 0.10 0.00 -1.14 0.00 0.00 41.12 40.12 2q3t n ASP 108 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2q3t n SER 109 N -0.60 0.65 -0.12 -1.12 7.64 -0.33 -4.33 113.62 115.41 2q3t n SER 109 Ca 0.03 -0.04 -0.26 0.00 1.01 0.00 0.00 58.87 59.61 2q3t n SER 109 Cb 0.01 0.48 -0.09 0.00 -1.01 0.00 0.00 64.21 63.60 2q3t n SER 109 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2q3t n ILE 110 N -2.04 1.33 -4.60 0.44 5.41 0.08 -4.99 119.36 114.99 2q3t n ILE 110 Ca 0.03 -0.34 -0.33 0.00 1.00 0.00 0.00 62.75 63.10 2q3t n ILE 110 Cb 0.44 -1.82 -0.13 0.00 -0.71 0.00 0.00 39.64 37.42 2q3t n ILE 110 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2q3t s ILE 111 N -2.44 3.45 0.39 1.39 -1.09 0.53 -5.09 121.20 118.33 2q3t s ILE 111 Ca -0.34 -0.52 -0.26 0.00 -2.23 0.00 0.00 60.65 57.30 2q3t s ILE 111 Cb 0.13 -2.48 -0.09 0.00 -1.58 0.00 0.00 42.46 38.44 2q3t s ILE 111 CO 0.43 0.51 1.29 -2.28 -1.23 0.00 0.00 174.94 173.66 2q3t s HIS 112 N 0.36 2.87 0.27 3.97 5.65 -1.26 -4.15 115.29 122.99 2q3t s HIS 112 Ca -0.08 1.42 -0.03 0.00 0.25 0.00 0.00 55.06 56.63 2q3t s HIS 112 Cb -0.15 -3.65 0.38 0.00 -1.18 0.00 0.00 32.58 27.98 2q3t s HIS 112 CO 0.04 -1.99 1.92 -1.35 -0.65 0.00 0.00 174.74 172.71 2q3t h PRO 113 N 2.77 1.18 -0.71 2.88 0.11 -1.84 0.53 132.00 136.91 2q3t h PRO 113 Ca -0.49 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.55 2q3t h PRO 113 Cb 1.24 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 32.05 2q3t h PRO 113 CO 0.63 0.78 0.45 1.15 -0.21 0.00 0.00 178.00 180.80 2q3t h THR 114 N 1.21 1.19 -0.06 -1.15 2.02 -1.91 0.66 112.91 114.88 2q3t h THR 114 Ca 0.39 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 2q3t h THR 114 Cb 0.02 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 66.60 2q3t h THR 114 CO -0.12 0.19 -0.04 0.11 0.37 0.00 0.00 175.52 176.03 2q3t h LYS 115 N 0.97 0.13 -0.83 6.66 1.57 -1.59 -2.38 116.57 121.10 2q3t h LYS 115 Ca 0.26 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 59.00 2q3t h LYS 115 Cb -0.07 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.19 2q3t h LYS 115 CO -0.05 0.55 0.54 0.00 -0.57 0.00 0.00 179.45 179.92 2q3t h ALA 116 N 0.57 1.08 -0.58 3.86 0.00 0.05 -0.30 119.26 123.94 2q3t h ALA 116 Ca 0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2q3t h ALA 116 Cb 0.52 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2q3t h ALA 116 CO 0.01 0.40 0.19 1.49 0.00 0.00 0.00 179.25 181.34 2q3t h GLU 117 N 1.07 0.87 -0.62 0.00 4.81 -0.87 -1.94 114.58 117.89 2q3t h GLU 117 Ca 0.32 -0.16 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2q3t h GLU 117 Cb -0.04 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 2q3t h GLU 117 CO -0.10 0.74 0.33 0.00 -0.73 0.00 0.00 179.01 179.26 2q3t h ALA 118 N 1.36 0.79 -0.29 2.92 0.00 -1.04 -0.22 119.26 122.78 2q3t h ALA 118 Ca 0.19 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.06 2q3t h ALA 118 Cb 0.23 -0.25 -0.08 0.00 0.00 0.00 0.00 17.79 17.70 2q3t h ALA 118 CO -0.01 0.31 -0.32 1.15 0.00 0.00 0.00 179.25 180.38 2q3t h THR 119 N 0.84 0.26 -0.77 0.00 2.02 -0.57 0.47 112.91 115.16 2q3t h THR 119 Ca 0.22 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.38 2q3t h THR 119 Cb 0.05 0.26 -0.04 0.00 -1.74 0.00 0.00 68.15 66.68 2q3t h THR 119 CO -0.03 0.00 0.43 0.40 0.37 0.00 0.00 175.52 176.69 2q3t h ILE 120 N -0.31 1.23 0.00 3.11 2.04 -1.05 0.08 117.51 122.61 2q3t h ILE 120 Ca 0.14 -0.55 -0.07 0.00 1.00 0.00 0.00 64.86 65.38 2q3t h ILE 120 Cb 0.54 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 2q3t h ILE 120 CO -0.46 0.25 -0.35 -0.50 0.00 0.00 0.00 178.15 177.08 2q3t h TRP 121 N 1.06 0.00 -0.25 1.37 -0.00 -0.30 0.29 115.95 118.13 2q3t h TRP 121 Ca 0.27 0.00 -0.10 0.00 -0.00 0.00 0.00 58.89 59.06 2q3t h TRP 121 Cb 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.16 2q3t h TRP 121 CO -0.00 0.35 -0.27 -0.07 -0.00 0.00 0.00 178.44 178.45 2q3t h LEU 122 N 0.00 0.49 -0.22 -4.49 3.38 0.14 -1.63 115.31 112.98 2q3t h LEU 122 Ca -0.00 -0.17 -0.19 0.00 0.09 0.00 0.00 57.88 57.60 2q3t h LEU 122 Cb 0.66 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2q3t h LEU 122 CO 0.05 0.75 -0.60 -0.37 0.09 0.00 0.00 178.44 178.35 2q3t h VAL 123 N 0.42 1.29 -0.60 1.22 -1.51 -0.72 -2.52 116.25 113.84 2q3t h VAL 123 Ca 0.06 -1.80 -0.06 0.00 -1.23 0.00 0.00 66.70 63.67 2q3t h VAL 123 Cb 0.70 1.82 -0.03 0.00 -2.13 0.00 0.00 31.29 31.65 2q3t h VAL 123 CO 0.05 0.58 0.14 -0.08 -1.23 0.00 0.00 177.57 177.03 2q3t h GLU 124 N 0.54 0.93 -0.11 5.19 4.57 -0.34 -1.58 114.58 123.78 2q3t h GLU 124 Ca -0.01 -0.20 -0.05 0.00 -1.18 0.00 0.00 59.36 57.92 2q3t h GLU 124 Cb 1.22 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.67 2q3t h GLU 124 CO 0.13 0.83 -0.14 1.49 -1.18 0.00 0.00 179.01 180.14 2q3t h GLU 125 N 0.89 0.17 -0.19 1.92 4.81 -1.10 -0.46 114.58 120.62 2q3t h GLU 125 Ca 0.19 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.27 2q3t h GLU 125 Cb 0.33 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2q3t h GLU 125 CO 0.00 0.32 -0.38 0.82 -0.73 0.00 0.00 179.01 179.04 2q3t h ILE 126 N 0.16 1.30 0.00 2.32 2.04 -0.94 0.11 117.51 122.49 2q3t h ILE 126 Ca 0.03 -1.51 0.00 0.00 1.00 0.00 0.00 64.86 64.38 2q3t h ILE 126 Cb 0.36 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2q3t h ILE 126 CO 0.02 0.47 -0.25 1.41 0.00 0.00 0.00 178.15 179.80 2q3t n HIS 127 N -4.04 0.08 -0.07 1.37 8.25 -0.43 -1.35 115.22 119.03 2q3t n HIS 127 Ca -0.01 0.02 -0.11 0.00 -0.26 0.00 0.00 57.72 57.36 2q3t n HIS 127 Cb 0.49 -0.42 -0.15 0.00 1.12 0.00 0.00 29.99 31.02 2q3t n HIS 127 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2q3t n ARG 128 N -1.57 0.67 0.00 -0.41 1.74 -0.31 -4.53 116.66 112.25 2q3t n ARG 128 Ca 0.06 0.13 0.07 0.00 -0.77 0.00 0.00 57.85 57.34 2q3t n ARG 128 Cb 0.35 -1.63 -0.03 0.00 -1.02 0.00 0.00 32.46 30.13 2q3t n ARG 128 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2q3t n LEU 129 N -2.96 1.23 0.00 0.55 4.77 0.36 -3.61 117.00 117.34 2q3t n LEU 129 Ca -0.29 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.02 2q3t n LEU 129 Cb 1.10 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.19 2q3t n LEU 129 CO 0.42 0.25 -0.35 0.35 -1.33 0.00 0.00 177.39 176.73 2q3t n THR 130 N -0.57 0.00 -3.02 -5.08 -2.24 -0.45 -5.04 114.28 97.87 2q3t n THR 130 Ca 0.05 -0.02 -0.34 0.00 -2.27 0.00 0.00 64.05 61.47 2q3t n THR 130 Cb 0.28 0.41 -0.06 0.00 -2.10 0.00 0.00 70.33 68.85 2q3t n THR 130 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2q3t s PRO 131 N -1.45 4.19 0.25 -0.78 0.04 -1.26 -5.05 135.00 130.94 2q3t s PRO 131 Ca 0.00 0.89 -0.10 0.00 0.04 0.00 0.00 61.00 61.84 2q3t s PRO 131 Cb 0.00 -2.56 -0.07 0.00 0.04 0.00 0.00 34.50 31.91 2q3t s PRO 131 CO 0.00 0.21 0.58 -1.54 0.04 0.00 0.00 177.00 176.29 2q3t s SER 132 N -1.99 6.62 0.53 6.66 1.04 -1.26 -5.01 113.70 120.29 2q3t s SER 132 Ca 0.52 0.95 0.32 0.00 0.48 0.00 0.00 55.95 58.22 2q3t s SER 132 Cb -0.13 -2.24 1.31 0.00 0.10 0.00 0.00 66.02 65.06 2q3t s SER 132 CO 0.18 -0.11 1.97 1.12 0.98 0.00 0.00 173.24 177.38 2q3t h HIS 133 N 2.39 0.00 -0.66 5.02 2.07 -1.96 -1.41 115.15 120.59 2q3t h HIS 133 Ca -0.47 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.02 2q3t h HIS 133 Cb 1.17 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.12 2q3t h HIS 133 CO 0.61 0.05 0.28 -0.07 -3.07 0.00 0.00 177.93 175.73 2q3t h LEU 134 N 0.00 0.87 -1.04 6.12 4.07 -1.93 0.50 115.31 123.91 2q3t h LEU 134 Ca -0.00 -0.11 -0.09 0.00 0.08 0.00 0.00 57.88 57.76 2q3t h LEU 134 Cb 0.54 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.04 2q3t h LEU 134 CO 0.01 0.77 -0.26 -0.74 -1.08 0.00 0.00 178.44 177.13 2q3t h HIS 135 N 0.95 0.41 -0.15 1.13 2.76 -1.83 0.29 115.15 118.72 2q3t h HIS 135 Ca 0.23 -0.08 -0.11 0.00 -2.20 0.00 0.00 60.37 58.20 2q3t h HIS 135 Cb 0.15 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 2q3t h HIS 135 CO 0.01 0.61 -0.40 0.52 -1.30 0.00 0.00 177.93 177.37 2q3t h MET 136 N 0.33 0.33 -0.32 5.26 2.86 -0.46 0.35 114.93 123.28 2q3t h MET 136 Ca 0.05 -0.16 -0.15 0.00 -2.06 0.00 0.00 59.70 57.39 2q3t h MET 136 Cb 0.64 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.29 2q3t h MET 136 CO 0.05 0.68 -0.39 0.00 1.06 0.00 0.00 176.91 178.31 2q3t h ALA 137 N 1.31 0.71 -0.31 6.32 0.00 0.36 -0.24 119.26 127.40 2q3t h ALA 137 Ca 0.03 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 2q3t h ALA 137 Cb 0.83 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2q3t h ALA 137 CO 0.07 0.66 0.09 1.25 0.00 0.00 0.00 179.25 181.32 2q3t h LEU 138 N 0.63 0.40 -0.28 0.00 5.85 0.20 -0.55 115.31 121.56 2q3t h LEU 138 Ca 0.05 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 2q3t h LEU 138 Cb 0.94 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 2q3t h LEU 138 CO 0.09 0.40 0.17 -0.07 -0.34 0.00 0.00 178.44 178.68 2q3t h LEU 139 N 0.44 0.33 -1.92 2.25 3.38 0.37 -3.00 115.31 117.17 2q3t h LEU 139 Ca 0.11 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2q3t h LEU 139 Cb 0.15 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2q3t h LEU 139 CO -0.01 0.28 -0.02 -0.50 0.09 0.00 0.00 178.44 178.29 2q3t h TRP 140 N 0.36 0.03 0.00 1.13 6.55 -0.60 -1.69 115.95 121.73 2q3t h TRP 140 Ca 0.10 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.94 2q3t h TRP 140 Cb 0.00 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 28.29 2q3t h TRP 140 CO -0.05 0.05 0.00 0.00 -1.05 0.00 0.00 178.44 177.39 2q3t h ARG 141 N 0.03 0.00 -0.36 0.49 3.08 -0.96 -1.74 114.38 114.92 2q3t h ARG 141 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2q3t h ARG 141 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2q3t h ARG 141 CO 0.00 0.00 0.00 0.43 -1.07 0.00 0.00 179.97 179.33 2q3t n SER 142 N -2.92 3.44 -3.91 7.04 7.64 -0.65 -4.82 113.62 119.43 2q3t n SER 142 Ca -0.01 -2.00 -0.29 0.00 1.01 0.00 0.00 58.87 57.58 2q3t n SER 142 Cb 0.14 -0.23 -0.16 0.00 -1.01 0.00 0.00 64.21 62.95 2q3t n SER 142 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2q3t s ASP 143 N -1.54 3.25 0.24 6.43 2.15 -0.66 -4.98 116.67 121.56 2q3t s ASP 143 Ca 0.38 -0.87 0.23 0.00 0.43 0.00 0.00 52.55 52.72 2q3t s ASP 143 Cb 0.23 -1.03 0.95 0.00 -0.30 0.00 0.00 42.92 42.77 2q3t s ASP 143 CO 0.32 -0.20 1.70 -2.65 -0.17 0.00 0.00 175.17 174.17 2q3t n PRO 144 N 4.79 0.18 -0.56 4.34 -0.02 -1.26 -0.79 135.00 141.68 2q3t n PRO 144 Ca -0.12 0.40 0.03 0.00 -2.02 0.00 0.00 63.50 61.79 2q3t n PRO 144 Cb 0.46 -1.84 0.21 0.00 -0.02 0.00 0.00 33.50 32.31 2q3t n PRO 144 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2q3t n MET 145 N -2.19 2.00 -0.22 -0.52 2.81 -1.26 -4.70 117.12 113.05 2q3t n MET 145 Ca 0.02 -3.01 0.16 0.00 -1.81 0.00 0.00 57.70 53.06 2q3t n MET 145 Cb 0.23 -1.75 0.48 0.00 -0.71 0.00 0.00 33.22 31.48 2q3t n MET 145 CO 0.00 0.00 0.00 0.10 1.51 0.00 0.00 175.97 177.58 2q3t h TYR 146 N 1.05 0.57 -0.09 2.03 -0.00 -1.28 1.47 116.97 120.72 2q3t h TYR 146 Ca 0.10 0.02 0.03 0.00 0.00 0.00 0.00 58.73 58.87 2q3t h TYR 146 Cb 1.41 -0.18 -0.00 0.00 0.00 0.00 0.00 36.73 37.96 2q3t h TYR 146 CO 0.69 0.19 0.12 1.12 -0.00 0.00 0.00 178.16 180.28 2q3t h HIS 147 N 0.47 0.00 -0.13 0.10 2.07 -1.84 -1.94 115.15 113.87 2q3t h HIS 147 Ca 0.42 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.94 2q3t h HIS 147 Cb 0.95 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.92 2q3t h HIS 147 CO -0.00 0.00 0.01 -1.13 -3.07 0.00 0.00 177.93 173.74 2q3t n SER 148 N -3.66 2.11 0.00 3.10 3.41 0.50 -3.27 113.62 115.81 2q3t n SER 148 Ca -0.01 -2.21 0.00 0.00 -0.26 0.00 0.00 58.87 56.39 2q3t n SER 148 Cb 0.22 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 2q3t n SER 148 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2q3t n PHE 149 N 0.14 0.00 -3.66 7.33 3.72 -0.73 -5.04 117.46 119.21 2q3t n PHE 149 Ca 0.07 -0.16 -0.37 0.00 -0.05 0.00 0.00 57.45 56.94 2q3t n PHE 149 Cb 0.48 -0.02 -0.11 0.00 -0.94 0.00 0.00 39.48 38.89 2q3t n PHE 149 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2q3t s ILE 150 N -0.31 5.12 0.34 4.37 1.01 -1.20 -3.84 121.20 126.69 2q3t s ILE 150 Ca 0.00 0.10 -0.27 0.00 0.00 0.00 0.00 60.65 60.48 2q3t s ILE 150 Cb 0.00 -3.41 -0.09 0.00 0.01 0.00 0.00 42.46 38.97 2q3t s ILE 150 CO 0.00 0.30 1.14 -1.81 0.00 0.00 0.00 174.94 174.57 2q3t s ASP 151 N 1.46 6.90 1.15 3.58 1.01 -1.26 -5.05 116.67 124.45 2q3t s ASP 151 Ca 0.07 2.31 -0.18 0.00 0.71 0.00 0.00 52.55 55.46 2q3t s ASP 151 Cb -0.15 -2.62 0.17 0.00 1.01 0.00 0.00 42.92 41.33 2q3t s ASP 151 CO 0.07 -0.41 0.27 -0.81 0.21 0.00 0.00 175.17 174.50 2q3t n PRO 152 N 0.60 -2.17 -2.41 8.23 -0.04 -1.26 -4.94 135.00 133.00 2q3t n PRO 152 Ca 0.02 -0.62 -0.40 0.00 -0.04 0.00 0.00 63.50 62.45 2q3t n PRO 152 Cb 0.46 -1.75 -0.04 0.00 -0.04 0.00 0.00 33.50 32.13 2q3t n PRO 152 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2q3t s ILE 153 N -2.22 3.40 0.17 0.52 -1.09 -1.26 -4.86 121.20 115.86 2q3t s ILE 153 Ca 0.56 1.37 0.06 0.00 -2.23 0.00 0.00 60.65 60.41 2q3t s ILE 153 Cb -0.13 -3.87 -0.04 0.00 -1.58 0.00 0.00 42.46 36.84 2q3t s ILE 153 CO 0.60 0.31 0.07 -0.36 -1.23 0.00 0.00 174.94 174.33 2q3t s PHE 154 N -0.98 3.00 0.13 3.97 2.99 -1.26 -5.03 117.98 120.80 2q3t s PHE 154 Ca 0.46 -0.08 -0.34 0.00 0.00 0.00 0.00 56.93 56.98 2q3t s PHE 154 Cb -0.33 -1.44 -0.13 0.00 0.00 0.00 0.00 43.02 41.11 2q3t s PHE 154 CO 0.42 0.52 1.65 -2.30 -0.00 0.00 0.00 175.22 175.51 2q3t n PRO 155 N -0.25 2.26 0.00 0.24 -0.02 -1.26 -5.09 135.00 130.88 2q3t n PRO 155 Ca -0.09 0.82 0.15 0.00 -2.02 0.00 0.00 63.50 62.36 2q3t n PRO 155 Cb 0.55 -2.61 0.78 0.00 -0.02 0.00 0.00 33.50 32.20 2q3t n PRO 155 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57