#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3drx n LEU 35 N 0.00 0.00 0.00 0.00 4.77 -1.26 -5.13 117.00 115.38 3drx n LEU 35 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3drx n LEU 35 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3drx n LEU 35 CO 0.00 -0.21 0.00 0.00 -1.33 0.00 0.00 177.39 175.85 3drx n ALA 36 N -1.63 0.00 -2.72 -1.18 0.00 -1.26 -5.06 120.51 108.67 3drx n ALA 36 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 3drx n ALA 36 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.52 3drx n ALA 36 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3drx n GLN 37 N 0.00 1.15 -1.86 0.00 -0.06 -1.26 -5.12 117.38 110.23 3drx n GLN 37 Ca 0.00 -2.48 -0.43 0.00 -2.00 0.00 0.00 57.00 52.09 3drx n GLN 37 Cb 0.00 -0.70 -0.03 0.00 -4.06 0.00 0.00 30.24 25.46 3drx n GLN 37 CO 0.00 0.00 0.00 0.50 -0.20 0.00 0.00 177.06 177.36 3drx s ARG 38 N -1.23 3.39 0.75 3.69 3.52 -1.26 -5.02 118.95 122.78 3drx s ARG 38 Ca 0.25 1.76 -0.10 0.00 -0.13 0.00 0.00 55.73 57.51 3drx s ARG 38 Cb 0.41 -4.23 0.06 0.00 -1.56 0.00 0.00 34.95 29.63 3drx s ARG 38 CO -0.04 -1.79 1.10 -2.14 -0.81 0.00 0.00 175.30 171.62 3drx s PRO 39 N 5.67 2.21 -0.02 5.12 0.02 -1.26 -4.17 135.00 142.57 3drx s PRO 39 Ca 0.86 0.03 0.00 0.00 0.02 0.00 0.00 61.00 61.91 3drx s PRO 39 Cb -0.28 -2.05 0.00 0.00 0.02 0.00 0.00 34.50 32.19 3drx s PRO 39 CO 0.34 -1.35 0.00 0.41 -0.33 0.00 0.00 177.00 176.07 3drx n GLY 40 N -3.10 0.42 0.00 0.52 0.00 -1.26 -4.95 105.19 96.82 3drx n GLY 40 Ca 0.08 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3drx n GLY 40 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3drx n SER 41 N -0.11 0.00 -4.15 1.61 2.88 -1.26 -4.56 113.62 108.03 3drx n SER 41 Ca -0.00 0.12 -0.40 0.00 -1.33 0.00 0.00 58.87 57.25 3drx n SER 41 Cb 0.09 -0.20 -0.02 0.00 -0.75 0.00 0.00 64.21 63.33 3drx n SER 41 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3drx n VAL 42 N -1.43 3.05 -4.04 2.46 0.24 -1.26 -4.94 118.33 112.41 3drx n VAL 42 Ca 0.00 -2.95 -0.32 0.00 -2.04 0.00 0.00 64.34 59.03 3drx n VAL 42 Cb 0.00 -2.39 -0.06 0.00 -1.47 0.00 0.00 33.84 29.92 3drx n VAL 42 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3drx s SER 43 N 4.46 5.80 0.29 -1.34 0.15 -1.26 -5.01 113.70 116.79 3drx s SER 43 Ca 0.55 0.14 0.18 0.00 0.70 0.00 0.00 55.95 57.52 3drx s SER 43 Cb 0.08 -1.67 0.11 0.00 -1.71 0.00 0.00 66.02 62.83 3drx s SER 43 CO 0.05 0.23 1.40 0.50 1.20 0.00 0.00 173.24 176.62 3drx h LYS 44 N 3.71 0.00 -6.49 5.44 3.64 -1.97 -3.46 116.57 117.43 3drx h LYS 44 Ca -0.48 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.38 3drx h LYS 44 Cb 1.17 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.98 3drx h LYS 44 CO 0.66 0.33 -0.13 -1.58 -2.27 0.00 0.00 179.45 176.46 3drx s TRP 45 N -3.04 3.47 -0.16 1.91 0.52 -1.26 -0.53 118.94 119.85 3drx s TRP 45 Ca 0.04 0.68 -0.13 0.00 0.02 0.00 0.00 56.10 56.71 3drx s TRP 45 Cb 0.07 -2.13 0.04 0.00 -1.15 0.00 0.00 33.47 30.30 3drx s TRP 45 CO 0.74 0.18 0.41 0.08 0.02 0.00 0.00 176.95 178.37 3drx s VAL 46 N -2.05 -0.01 -0.17 4.03 1.01 0.18 -4.79 120.40 118.59 3drx s VAL 46 Ca 0.44 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.46 3drx s VAL 46 Cb -0.11 -0.58 0.01 0.00 0.00 0.00 0.00 36.38 35.70 3drx s VAL 46 CO 0.29 0.01 -0.17 -0.13 0.00 0.00 0.00 175.10 175.10 3drx s ARG 47 N 0.56 3.10 -0.27 2.72 0.52 -1.26 -1.27 118.95 123.05 3drx s ARG 47 Ca -0.03 -0.79 -0.10 0.00 -0.52 0.00 0.00 55.73 54.29 3drx s ARG 47 Cb -0.04 -2.61 -0.04 0.00 0.52 0.00 0.00 34.95 32.77 3drx s ARG 47 CO -0.03 -0.11 0.16 -0.51 0.02 0.00 0.00 175.30 174.82 3drx s LEU 48 N 1.10 3.87 -0.98 2.53 1.43 0.20 -1.49 118.68 125.34 3drx s LEU 48 Ca 0.00 -0.06 -0.20 0.00 -1.03 0.00 0.00 54.13 52.84 3drx s LEU 48 Cb -0.14 -2.07 0.11 0.00 0.03 0.00 0.00 46.19 44.11 3drx s LEU 48 CO -0.06 -0.04 1.26 0.21 0.23 0.00 0.00 176.35 177.94 3drx s ASN 49 N 1.71 6.62 -0.35 2.29 3.84 -1.06 -0.09 114.94 127.89 3drx s ASN 49 Ca 0.07 -1.92 -0.22 0.00 0.21 0.00 0.00 52.86 51.00 3drx s ASN 49 Cb -0.16 -2.46 0.00 0.00 -0.55 0.00 0.00 41.25 38.09 3drx s ASN 49 CO 0.09 -1.19 0.74 -0.69 -2.79 0.00 0.00 177.10 173.26 3drx s VAL 50 N 3.38 4.80 -0.94 -5.21 1.01 0.44 -1.30 120.40 122.57 3drx s VAL 50 Ca 0.38 0.85 0.00 0.00 0.00 0.00 0.00 61.98 63.21 3drx s VAL 50 Cb -0.03 -4.15 0.00 0.00 0.00 0.00 0.00 36.38 32.20 3drx s VAL 50 CO -0.09 -0.35 0.00 0.61 0.00 0.00 0.00 175.10 175.27 3drx n GLY 51 N 4.51 0.20 0.33 4.51 0.00 0.11 -0.75 105.19 114.09 3drx n GLY 51 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3drx n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3drx n GLY 52 N -0.47 0.92 3.28 -0.02 0.00 -1.26 -4.85 105.19 102.78 3drx n GLY 52 Ca -0.11 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 3drx n GLY 52 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3drx s THR 53 N -2.00 2.07 0.19 2.61 2.01 0.07 -5.11 115.64 115.48 3drx s THR 53 Ca 0.00 -1.07 -0.23 0.00 0.31 0.00 0.00 61.69 60.70 3drx s THR 53 Cb 0.00 -1.74 -0.08 0.00 0.01 0.00 0.00 72.50 70.69 3drx s THR 53 CO 0.00 0.57 0.75 -0.31 -0.69 0.00 0.00 174.62 174.94 3drx s TYR 54 N -0.26 3.79 -0.03 4.92 2.02 -1.26 -0.42 117.35 126.11 3drx s TYR 54 Ca -0.01 1.52 0.03 0.00 -0.37 0.00 0.00 57.07 58.25 3drx s TYR 54 Cb -0.13 -2.70 0.00 0.00 -0.40 0.00 0.00 41.96 38.73 3drx s TYR 54 CO 0.03 0.44 -0.12 -0.06 -1.57 0.00 0.00 175.55 174.26 3drx s PHE 55 N -1.31 1.23 -0.16 2.71 0.08 0.87 -4.94 117.98 116.46 3drx s PHE 55 Ca 0.39 -0.32 -0.05 0.00 0.12 0.00 0.00 56.93 57.07 3drx s PHE 55 Cb -0.20 -0.85 -0.03 0.00 -0.57 0.00 0.00 43.02 41.37 3drx s PHE 55 CO 0.24 -0.12 -0.00 -1.17 -0.10 0.00 0.00 175.22 174.06 3drx s LEU 56 N 0.11 3.45 0.34 -0.37 2.96 -1.26 -0.63 118.68 123.28 3drx s LEU 56 Ca -0.03 -0.05 -0.16 0.00 -0.22 0.00 0.00 54.13 53.68 3drx s LEU 56 Cb -0.09 -1.84 0.03 0.00 0.50 0.00 0.00 46.19 44.79 3drx s LEU 56 CO 0.01 0.18 0.71 0.28 -1.32 0.00 0.00 176.35 176.22 3drx s THR 57 N 0.28 0.00 0.19 3.68 -1.32 -0.39 -5.02 115.64 113.06 3drx s THR 57 Ca -0.01 -1.09 -0.01 0.00 -1.21 0.00 0.00 61.69 59.38 3drx s THR 57 Cb -0.13 -2.54 -0.04 0.00 -1.51 0.00 0.00 72.50 68.28 3drx s THR 57 CO 0.02 0.00 0.38 0.42 -2.21 0.00 0.00 174.62 173.23 3drx s THR 58 N -3.00 5.22 0.44 5.08 -4.23 -1.26 0.49 115.64 118.37 3drx s THR 58 Ca 0.16 -0.38 0.13 0.00 -1.18 0.00 0.00 61.69 60.42 3drx s THR 58 Cb -0.05 -3.73 0.32 0.00 1.34 0.00 0.00 72.50 70.38 3drx s THR 58 CO 0.11 -0.16 2.00 0.03 -0.54 0.00 0.00 174.62 176.07 3drx h ARG 59 N 2.05 0.39 0.22 3.99 3.08 -1.10 -2.53 114.38 120.48 3drx h ARG 59 Ca -0.48 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 59.54 3drx h ARG 59 Cb 1.19 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 3drx h ARG 59 CO 0.68 0.26 -0.16 0.37 -1.07 0.00 0.00 179.97 180.05 3drx h GLN 60 N 0.40 -0.37 -0.44 0.04 4.15 -1.82 -1.64 115.11 115.44 3drx h GLN 60 Ca 0.24 0.03 0.13 0.00 0.77 0.00 0.00 58.65 59.81 3drx h GLN 60 Cb 0.43 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.18 3drx h GLN 60 CO -0.06 -0.25 0.60 1.15 -1.93 0.00 0.00 178.83 178.35 3drx h THR 61 N -0.38 0.21 -0.17 2.39 2.02 -1.77 0.40 112.91 115.62 3drx h THR 61 Ca -0.01 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 3drx h THR 61 Cb 0.33 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 3drx h THR 61 CO 0.00 0.00 0.01 0.18 0.37 0.00 0.00 175.52 176.08 3drx n LEU 62 N -3.41 2.45 -0.01 2.58 4.77 -0.61 -3.57 117.00 119.19 3drx n LEU 62 Ca 0.08 -1.24 0.00 0.00 -0.03 0.00 0.00 56.01 54.83 3drx n LEU 62 Cb 0.78 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 3drx n LEU 62 CO 0.23 0.38 0.23 0.00 -1.33 0.00 0.00 177.39 176.89 3drx h ARG 64 N 0.03 0.34 -3.85 0.00 9.65 -1.72 -3.37 114.38 115.46 3drx h ARG 64 Ca 0.00 -0.02 -0.63 0.00 -1.10 0.00 0.00 59.98 58.23 3drx h ARG 64 Cb 0.01 -0.08 -0.40 0.00 -1.39 0.00 0.00 29.97 28.11 3drx h ARG 64 CO 0.00 0.22 -0.71 0.34 2.80 0.00 0.00 179.97 182.62 3drx s ASP 65 N -5.40 4.31 0.00 -3.80 2.15 -1.26 -4.96 116.67 107.70 3drx s ASP 65 Ca -0.13 -2.33 0.01 0.00 0.43 0.00 0.00 52.55 50.54 3drx s ASP 65 Cb 0.12 -1.36 0.06 0.00 -0.30 0.00 0.00 42.92 41.44 3drx s ASP 65 CO 0.72 -0.33 1.00 -0.81 -0.17 0.00 0.00 175.17 175.57 3drx n PRO 66 N 3.99 0.00 0.08 4.34 -0.04 -1.26 -0.97 135.00 141.15 3drx n PRO 66 Ca 0.04 0.43 0.01 0.00 -0.04 0.00 0.00 63.50 63.93 3drx n PRO 66 Cb 0.38 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.31 3drx n PRO 66 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3drx h LYS 67 N 0.00 0.00 -6.70 0.54 1.57 -1.93 -3.46 116.57 106.59 3drx h LYS 67 Ca 0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 3drx h LYS 67 Cb 0.02 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.35 3drx h LYS 67 CO 0.00 0.43 0.52 0.45 -0.57 0.00 0.00 179.45 180.27 3drx s SER 68 N -6.15 7.17 0.26 0.86 0.15 -0.14 -4.90 113.70 110.95 3drx s SER 68 Ca 0.01 2.21 0.19 0.00 0.70 0.00 0.00 55.95 59.05 3drx s SER 68 Cb 0.08 -2.61 0.98 0.00 -1.71 0.00 0.00 66.02 62.76 3drx s SER 68 CO 0.78 -0.28 1.58 2.22 1.20 0.00 0.00 173.24 178.75 3drx n PHE 69 N 2.14 0.64 0.25 3.44 1.16 -1.24 -0.15 117.46 123.70 3drx n PHE 69 Ca 0.03 0.32 0.08 0.00 -1.87 0.00 0.00 57.45 56.00 3drx n PHE 69 Cb 0.45 -1.00 0.64 0.00 -1.61 0.00 0.00 39.48 37.95 3drx n PHE 69 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 3drx h LEU 70 N 0.00 0.00 -1.86 5.98 3.38 -1.90 -2.62 115.31 118.29 3drx h LEU 70 Ca 0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 3drx h LEU 70 Cb 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 3drx h LEU 70 CO 0.00 0.06 0.41 0.22 0.09 0.00 0.00 178.44 179.22 3drx h TYR 71 N 0.00 0.00 -0.71 1.13 3.20 -0.68 -0.32 116.97 119.59 3drx h TYR 71 Ca -0.00 0.00 0.16 0.00 3.14 0.00 0.00 58.73 62.03 3drx h TYR 71 Cb 0.10 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 3drx h TYR 71 CO 0.00 0.00 0.48 0.00 -1.64 0.00 0.00 178.16 177.00 3drx h ARG 72 N 0.00 0.28 -0.00 1.82 3.08 -1.68 0.20 114.38 118.08 3drx h ARG 72 Ca 0.05 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.08 3drx h ARG 72 Cb 0.87 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.86 3drx h ARG 72 CO -0.00 0.19 -0.71 1.28 -1.07 0.00 0.00 179.97 179.65 3drx n LEU 73 N -4.44 0.97 -0.23 3.04 4.32 -0.13 -4.40 117.00 116.12 3drx n LEU 73 Ca 0.13 -0.35 0.03 0.00 -0.02 0.00 0.00 56.01 55.80 3drx n LEU 73 Cb 0.57 -0.09 0.13 0.00 -1.62 0.00 0.00 43.42 42.41 3drx n LEU 73 CO 0.34 0.22 0.84 0.00 -1.22 0.00 0.00 177.39 177.57 3drx s GLN 75 N -6.13 2.10 -0.69 0.00 0.74 -1.26 -4.26 119.66 110.17 3drx s GLN 75 Ca -0.13 -1.33 -0.26 0.00 0.05 0.00 0.00 55.36 53.69 3drx s GLN 75 Cb 0.21 -2.14 -0.11 0.00 1.10 0.00 0.00 33.01 32.06 3drx s GLN 75 CO 0.75 0.41 2.39 0.00 -0.55 0.00 0.00 175.29 178.29 3drx s ALA 76 N -1.90 1.04 -0.21 1.58 0.00 -1.26 -4.90 121.76 116.11 3drx s ALA 76 Ca 0.27 -0.54 -0.29 0.00 0.00 0.00 0.00 51.96 51.39 3drx s ALA 76 Cb -0.08 -4.50 -0.01 0.00 0.00 0.00 0.00 23.12 18.53 3drx s ALA 76 CO 0.16 -5.39 1.25 0.34 0.00 0.00 0.00 175.76 172.12 3drx s ASP 77 N 11.23 6.89 0.00 0.00 3.68 -1.26 -4.98 116.67 132.22 3drx s ASP 77 Ca 0.93 1.53 0.00 0.00 2.13 0.00 0.00 52.55 57.14 3drx s ASP 77 Cb -0.14 -2.54 0.00 0.00 -1.45 0.00 0.00 42.92 38.79 3drx s ASP 77 CO 0.14 -0.84 0.27 -0.81 0.13 0.00 0.00 175.17 174.06 3drx n PRO 78 N 6.77 0.00 -3.17 4.34 -0.04 -1.26 -4.54 135.00 137.10 3drx n PRO 78 Ca 0.14 0.04 -0.44 0.00 -0.04 0.00 0.00 63.50 63.20 3drx n PRO 78 Cb 0.45 -0.77 -0.06 0.00 -0.04 0.00 0.00 33.50 33.08 3drx n PRO 78 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 3drx s ASP 79 N -2.15 6.23 0.00 3.54 -4.77 -1.26 -4.72 116.67 113.54 3drx s ASP 79 Ca 0.00 -0.87 0.00 0.00 -3.30 0.00 0.00 52.55 48.38 3drx s ASP 79 Cb 0.00 -2.28 0.00 0.00 -1.09 0.00 0.00 42.92 39.55 3drx s ASP 79 CO 0.00 -0.85 0.00 -0.11 0.70 0.00 0.00 175.17 174.91 3drx n LEU 80 N 6.10 0.00 -2.32 2.11 7.94 -1.26 -5.14 117.00 124.43 3drx n LEU 80 Ca -0.06 0.00 -0.00 0.00 -1.11 0.00 0.00 56.01 54.83 3drx n LEU 80 Cb 0.46 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.40 3drx n LEU 80 CO 0.53 0.00 -0.35 -0.67 -1.11 0.00 0.00 177.39 175.79 3drx n ASP 81 N -0.57 -5.83 -4.99 1.96 -0.08 -1.26 -5.06 116.55 100.72 3drx n ASP 81 Ca 0.00 0.98 -0.19 0.00 -1.51 0.00 0.00 54.79 54.07 3drx n ASP 81 Cb 0.00 -3.96 0.02 0.00 2.34 0.00 0.00 41.12 39.52 3drx n ASP 81 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 3drx s SER 82 N -1.08 5.52 -0.14 1.67 0.01 -1.26 -5.04 113.70 113.38 3drx s SER 82 Ca -0.01 -0.23 -0.29 0.00 1.31 0.00 0.00 55.95 56.72 3drx s SER 82 Cb 0.00 -0.79 -0.03 0.00 0.21 0.00 0.00 66.02 65.42 3drx s SER 82 CO 0.54 -0.90 1.44 -1.81 0.41 0.00 0.00 173.24 172.92 3drx s ASP 83 N -4.37 6.76 0.54 2.44 1.11 -1.26 -5.01 116.67 116.88 3drx s ASP 83 Ca 0.55 1.85 0.02 0.00 0.18 0.00 0.00 52.55 55.15 3drx s ASP 83 Cb -0.10 -2.54 0.01 0.00 1.07 0.00 0.00 42.92 41.37 3drx s ASP 83 CO 0.35 -0.90 0.14 -0.54 1.18 0.00 0.00 175.17 175.40 3drx s LYS 84 N 3.87 2.23 0.00 8.23 1.02 -1.26 -2.82 119.74 131.01 3drx s LYS 84 Ca 0.63 -2.32 0.00 0.00 0.02 0.00 0.00 55.97 54.30 3drx s LYS 84 Cb -0.26 -1.70 0.00 0.00 -0.52 0.00 0.00 37.83 35.35 3drx s LYS 84 CO 0.22 -0.50 0.00 -0.40 -0.92 0.00 0.00 175.35 173.75 3drx n ASP 85 N -1.48 0.93 -0.33 2.83 5.75 -1.04 -4.86 116.55 118.36 3drx n ASP 85 Ca -0.15 -0.96 0.21 0.00 -0.01 0.00 0.00 54.79 53.87 3drx n ASP 85 Cb 0.66 0.00 0.40 0.00 -1.03 0.00 0.00 41.12 41.16 3drx n ASP 85 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 3drx h GLU 86 N 0.00 0.05 -0.68 0.11 4.11 -2.02 -1.98 114.58 114.18 3drx h GLU 86 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3drx h GLU 86 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3drx h GLU 86 CO 0.00 0.04 0.00 0.25 0.07 0.00 0.00 179.01 179.37 3drx n THR 87 N -5.34 1.70 -2.21 -1.06 -2.24 -1.26 -4.94 114.28 98.92 3drx n THR 87 Ca 0.29 -1.15 -0.12 0.00 -2.27 0.00 0.00 64.05 60.79 3drx n THR 87 Cb 0.94 0.18 -0.01 0.00 -2.10 0.00 0.00 70.33 69.35 3drx n THR 87 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3drx n GLY 88 N 1.25 -0.11 3.88 3.38 0.00 -0.74 -5.02 105.19 107.82 3drx n GLY 88 Ca 0.26 -0.37 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 3drx n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3drx s ALA 89 N -2.61 3.85 -0.62 4.61 0.00 -1.26 -4.72 121.76 121.00 3drx s ALA 89 Ca 0.00 -0.57 -0.27 0.00 0.00 0.00 0.00 51.96 51.12 3drx s ALA 89 Cb 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 23.12 21.07 3drx s ALA 89 CO 0.00 0.63 1.58 0.71 0.00 0.00 0.00 175.76 178.68 3drx s TYR 90 N -1.18 2.00 0.14 0.00 2.02 -0.56 -2.50 117.35 117.29 3drx s TYR 90 Ca 0.22 0.46 -0.34 0.00 -0.37 0.00 0.00 57.07 57.04 3drx s TYR 90 Cb -0.13 -4.32 -0.14 0.00 -0.40 0.00 0.00 41.96 36.96 3drx s TYR 90 CO 0.12 -2.19 1.55 1.28 -1.57 0.00 0.00 175.55 174.74 3drx n LEU 91 N 10.86 2.86 -3.86 -1.29 4.77 -1.13 -2.56 117.00 126.67 3drx n LEU 91 Ca 0.13 1.09 -0.21 0.00 -0.03 0.00 0.00 56.01 56.99 3drx n LEU 91 Cb 0.50 -1.39 -0.17 0.00 -2.33 0.00 0.00 43.42 40.04 3drx n LEU 91 CO 0.71 -0.41 -0.40 -0.63 -1.33 0.00 0.00 177.39 175.33 3drx s ILE 92 N 0.94 0.49 -1.36 -0.08 1.01 -0.42 -4.95 121.20 116.83 3drx s ILE 92 Ca 0.80 -0.05 -0.07 0.00 0.00 0.00 0.00 60.65 61.33 3drx s ILE 92 Cb -0.73 -0.56 0.10 0.00 0.01 0.00 0.00 42.46 41.29 3drx s ILE 92 CO 0.40 0.24 2.34 -0.67 0.00 0.00 0.00 174.94 177.24 3drx n ASP 93 N 4.38 7.32 -4.21 3.58 2.03 -1.26 0.07 116.55 128.46 3drx n ASP 93 Ca -0.20 -3.05 -0.12 0.00 0.52 0.00 0.00 54.79 51.94 3drx n ASP 93 Cb 0.51 -1.42 -0.10 0.00 -0.72 0.00 0.00 41.12 39.38 3drx n ASP 93 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3drx s ARG 94 N -0.23 1.02 0.02 -0.67 1.81 -1.26 -4.91 118.95 114.72 3drx s ARG 94 Ca 0.53 -1.47 -0.30 0.00 -1.72 0.00 0.00 55.73 52.76 3drx s ARG 94 Cb 0.16 -0.20 -0.06 0.00 -0.45 0.00 0.00 34.95 34.41 3drx s ARG 94 CO -0.07 -0.12 1.42 0.34 -0.68 0.00 0.00 175.30 176.20 3drx s ASP 95 N -3.13 6.83 0.32 0.23 -1.08 -1.26 -2.07 116.67 116.51 3drx s ASP 95 Ca 0.21 2.16 0.24 0.00 -0.52 0.00 0.00 52.55 54.64 3drx s ASP 95 Cb 0.06 -2.56 0.40 0.00 -1.46 0.00 0.00 42.92 39.35 3drx s ASP 95 CO 0.01 -0.73 1.53 1.55 0.52 0.00 0.00 175.17 178.06 3drx h PRO 96 N 7.78 0.00 0.00 4.34 0.13 -1.89 -3.27 132.00 139.08 3drx h PRO 96 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 3drx h PRO 96 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3drx h PRO 96 CO 0.90 0.00 0.00 1.79 -0.23 0.00 0.00 178.00 180.46 3drx h THR 97 N 0.00 0.00 -0.04 1.56 1.35 -1.93 -2.22 112.91 111.64 3drx h THR 97 Ca 0.00 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 3drx h THR 97 Cb 0.91 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.64 3drx h THR 97 CO 0.00 0.00 0.00 -1.22 -0.25 0.00 0.00 175.52 174.05 3drx n TYR 98 N -2.89 0.03 0.09 4.73 4.02 -1.23 -4.54 117.16 117.36 3drx n TYR 98 Ca 0.00 -0.02 -0.11 0.00 -0.01 0.00 0.00 57.90 57.76 3drx n TYR 98 Cb 0.25 -0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.49 3drx n TYR 98 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 3drx h PHE 99 N 2.91 0.30 -0.57 -0.72 -0.00 -1.50 -3.38 116.94 113.99 3drx h PHE 99 Ca 0.00 -0.20 0.08 0.00 -0.00 0.00 0.00 57.97 57.85 3drx h PHE 99 Cb 0.63 -0.02 -0.10 0.00 -0.00 0.00 0.00 35.95 36.46 3drx h PHE 99 CO 0.02 1.09 -0.49 0.78 -0.00 0.00 0.00 178.31 179.71 3drx h GLY 100 N 2.01 -0.66 0.51 2.40 0.00 -1.80 0.11 103.07 105.64 3drx h GLY 100 Ca -0.07 0.63 0.10 0.00 0.00 0.00 0.00 47.33 48.00 3drx h GLY 100 CO 0.16 -0.13 0.55 -2.55 0.00 0.00 0.00 176.54 174.56 3drx h PRO 101 N -0.26 0.87 0.25 4.80 0.11 -1.84 -0.36 132.00 135.57 3drx h PRO 101 Ca 0.15 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.21 3drx h PRO 101 Cb 0.56 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.45 3drx h PRO 101 CO -0.69 0.57 -0.34 0.28 -0.21 0.00 0.00 178.00 177.62 3drx h VAL 102 N 0.90 0.29 -0.22 3.15 2.07 -1.02 -0.01 116.25 121.41 3drx h VAL 102 Ca 0.44 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.99 3drx h VAL 102 Cb 0.40 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 3drx h VAL 102 CO -0.25 0.00 0.02 0.25 0.02 0.00 0.00 177.57 177.61 3drx h LEU 103 N -0.65 -0.04 -1.11 2.57 5.85 -0.74 -1.99 115.31 119.19 3drx h LEU 103 Ca -0.00 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.85 3drx h LEU 103 Cb 0.63 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.65 3drx h LEU 103 CO -0.12 0.01 0.61 0.78 -0.34 0.00 0.00 178.44 179.37 3drx h ASN 104 N 0.09 0.90 -0.50 1.25 2.35 -0.82 0.26 115.58 119.12 3drx h ASN 104 Ca 0.10 0.02 0.05 0.00 -0.55 0.00 0.00 56.30 55.92 3drx h ASN 104 Cb 0.11 -0.17 -0.05 0.00 0.05 0.00 0.00 38.32 38.27 3drx h ASN 104 CO -0.15 0.54 0.24 0.22 -1.65 0.00 0.00 177.43 176.63 3drx h TYR 105 N 1.00 0.44 0.00 1.19 3.20 -0.39 -0.91 116.97 121.50 3drx h TYR 105 Ca 0.43 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.29 3drx h TYR 105 Cb 0.32 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.47 3drx h TYR 105 CO -0.00 0.21 -0.14 -0.07 -1.64 0.00 0.00 178.16 176.52 3drx h LEU 106 N 0.47 0.00 0.00 2.82 3.38 0.08 0.17 115.31 122.22 3drx h LEU 106 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3drx h LEU 106 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3drx h LEU 106 CO -0.17 0.14 0.00 0.54 0.09 0.00 0.00 178.44 179.04 3drx n ARG 107 N -3.83 0.00 -0.03 1.13 1.74 0.36 -4.69 116.66 111.35 3drx n ARG 107 Ca -0.02 0.37 0.04 0.00 -0.77 0.00 0.00 57.85 57.47 3drx n ARG 107 Cb 0.24 -1.08 0.05 0.00 -1.02 0.00 0.00 32.46 30.65 3drx n ARG 107 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 3drx n HIS 108 N -1.61 0.08 0.00 -1.55 1.44 -0.51 -5.00 115.22 108.06 3drx n HIS 108 Ca 0.00 -0.12 0.00 0.00 -2.01 0.00 0.00 57.72 55.59 3drx n HIS 108 Cb 0.00 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.10 3drx n HIS 108 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3drx n GLY 109 N 0.38 2.58 3.79 -1.39 0.00 0.58 -5.01 105.19 106.11 3drx n GLY 109 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 3drx n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3drx s LYS 110 N -0.28 4.08 -0.11 1.61 3.01 -1.26 -4.93 119.74 121.86 3drx s LYS 110 Ca 0.00 0.36 -0.26 0.00 -1.01 0.00 0.00 55.97 55.05 3drx s LYS 110 Cb 0.00 -3.31 -0.02 0.00 -1.01 0.00 0.00 37.83 33.49 3drx s LYS 110 CO 0.00 0.48 0.86 -1.17 0.51 0.00 0.00 175.35 176.02 3drx s LEU 111 N -0.37 4.25 -0.06 3.17 2.96 -1.26 -4.12 118.68 123.25 3drx s LEU 111 Ca 0.23 1.32 -0.02 0.00 -0.22 0.00 0.00 54.13 55.44 3drx s LEU 111 Cb -0.16 -3.31 0.04 0.00 0.50 0.00 0.00 46.19 43.26 3drx s LEU 111 CO 0.11 -0.32 0.10 -0.69 -1.32 0.00 0.00 176.35 174.23 3drx s VAL 112 N 1.63 -0.17 -0.07 1.68 1.01 -1.26 -5.12 120.40 118.10 3drx s VAL 112 Ca 0.42 0.39 0.05 0.00 0.00 0.00 0.00 61.98 62.83 3drx s VAL 112 Cb -0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 36.38 35.98 3drx s VAL 112 CO 0.17 0.16 -0.22 -0.63 0.00 0.00 0.00 175.10 174.59 3drx s ILE 113 N 2.15 2.35 0.38 2.22 1.01 -1.26 -4.71 121.20 123.34 3drx s ILE 113 Ca 0.03 -0.95 -0.28 0.00 0.00 0.00 0.00 60.65 59.45 3drx s ILE 113 Cb -0.12 -1.89 -0.10 0.00 0.01 0.00 0.00 42.46 40.36 3drx s ILE 113 CO -0.04 0.57 1.42 0.20 0.00 0.00 0.00 174.94 177.09 3drx s ASN 114 N -0.12 6.35 0.48 3.58 0.01 -1.26 -4.89 114.94 119.08 3drx s ASN 114 Ca -0.04 2.92 0.19 0.00 -0.71 0.00 0.00 52.86 55.22 3drx s ASN 114 Cb -0.14 -2.66 1.19 0.00 0.41 0.00 0.00 41.25 40.05 3drx s ASN 114 CO 0.04 -0.85 1.98 0.11 -1.51 0.00 0.00 177.10 176.87 3drx h LYS 115 N 2.94 0.22 -0.00 -0.60 1.57 -2.06 0.17 116.57 118.81 3drx h LYS 115 Ca -0.50 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 3drx h LYS 115 Cb 1.24 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.50 3drx h LYS 115 CO 0.64 0.15 -0.01 -0.40 -0.57 0.00 0.00 179.45 179.25 3drx n ASP 116 N -4.44 0.12 -4.91 0.86 3.85 -1.26 -4.89 116.55 105.88 3drx n ASP 116 Ca 0.10 -0.63 -0.27 0.00 -0.71 0.00 0.00 54.79 53.28 3drx n ASP 116 Cb 0.49 -0.12 -0.01 0.00 -1.35 0.00 0.00 41.12 40.13 3drx n ASP 116 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.20 175.97 3drx s LEU 117 N -2.28 3.77 -0.25 -2.12 2.96 0.58 -5.07 118.68 116.26 3drx s LEU 117 Ca 0.38 0.83 -0.05 0.00 -0.22 0.00 0.00 54.13 55.07 3drx s LEU 117 Cb 0.21 -3.75 0.00 0.00 0.50 0.00 0.00 46.19 43.16 3drx s LEU 117 CO 0.42 -0.47 0.01 0.00 -1.32 0.00 0.00 176.35 174.99 3drx s ALA 118 N -2.56 2.92 0.60 5.97 0.00 -1.26 -4.95 121.76 122.48 3drx s ALA 118 Ca 0.46 -1.31 0.31 0.00 0.00 0.00 0.00 51.96 51.42 3drx s ALA 118 Cb -0.10 -1.89 1.84 0.00 0.00 0.00 0.00 23.12 22.97 3drx s ALA 118 CO 0.40 -0.66 2.24 1.05 0.00 0.00 0.00 175.76 178.79 3drx h GLU 119 N 8.15 0.00 -0.58 0.00 9.09 -1.97 0.11 114.58 129.37 3drx h GLU 119 Ca -0.36 0.00 0.06 0.00 0.05 0.00 0.00 59.36 59.10 3drx h GLU 119 Cb 1.14 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 28.19 3drx h GLU 119 CO 0.59 0.00 0.30 0.93 0.05 0.00 0.00 179.01 180.89 3drx h GLU 120 N 0.00 0.55 -0.62 1.06 3.07 -1.98 0.67 114.58 117.33 3drx h GLU 120 Ca 0.01 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 3drx h GLU 120 Cb 0.08 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 27.84 3drx h GLU 120 CO -0.00 0.36 0.40 0.78 -1.40 0.00 0.00 179.01 179.16 3drx h GLY 121 N 0.57 0.87 1.02 -3.84 0.00 -1.21 -0.00 103.07 100.48 3drx h GLY 121 Ca 0.26 -0.33 -0.06 0.00 0.00 0.00 0.00 47.33 47.20 3drx h GLY 121 CO -0.18 0.32 0.12 -2.08 0.00 0.00 0.00 176.54 174.73 3drx h VAL 122 N 0.84 1.25 -0.56 4.60 2.07 -1.29 -2.64 116.25 120.52 3drx h VAL 122 Ca 0.23 -0.94 0.05 0.00 0.82 0.00 0.00 66.70 66.85 3drx h VAL 122 Cb -0.09 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 3drx h VAL 122 CO -0.05 0.35 0.29 0.25 0.02 0.00 0.00 177.57 178.43 3drx h LEU 123 N 0.87 0.42 0.01 2.57 5.85 0.10 0.06 115.31 125.19 3drx h LEU 123 Ca 0.18 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 3drx h LEU 123 Cb 0.38 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.36 3drx h LEU 123 CO 0.01 0.28 -0.00 -0.33 -0.34 0.00 0.00 178.44 178.05 3drx h GLU 124 N 0.55 -0.01 -0.07 1.25 4.39 -0.79 -2.85 114.58 117.05 3drx h GLU 124 Ca 0.25 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.95 3drx h GLU 124 Cb 0.16 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 3drx h GLU 124 CO -0.17 0.05 0.02 0.93 -1.16 0.00 0.00 179.01 178.68 3drx h GLU 125 N -0.06 0.11 -1.15 2.33 4.39 -1.26 -2.36 114.58 116.57 3drx h GLU 125 Ca -0.00 -0.02 0.34 0.00 0.34 0.00 0.00 59.36 60.01 3drx h GLU 125 Cb 0.06 -0.02 -0.11 0.00 -0.10 0.00 0.00 28.75 28.59 3drx h GLU 125 CO 0.00 0.26 0.75 0.00 -1.16 0.00 0.00 179.01 178.86 3drx h ALA 126 N 0.84 2.46 0.02 3.43 0.00 -0.93 0.26 119.26 125.34 3drx h ALA 126 Ca 0.02 0.08 -0.25 0.00 0.00 0.00 0.00 54.91 54.76 3drx h ALA 126 Cb 0.20 0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.11 3drx h ALA 126 CO -0.00 -0.96 -0.97 0.93 0.00 0.00 0.00 179.25 178.25 3drx h GLU 127 N 0.25 0.63 -0.08 0.00 5.08 -1.24 -0.34 114.58 118.88 3drx h GLU 127 Ca 0.68 -0.70 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3drx h GLU 127 Cb 1.96 0.20 -0.00 0.00 0.50 0.00 0.00 28.75 31.41 3drx h GLU 127 CO -0.33 1.29 0.05 0.35 -1.00 0.00 0.00 179.01 179.36 3drx h PHE 128 N 0.27 0.11 0.00 4.33 3.57 -0.06 -2.11 116.94 123.05 3drx h PHE 128 Ca -0.13 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.37 3drx h PHE 128 Cb 1.64 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 40.35 3drx h PHE 128 CO 0.12 0.12 0.00 0.66 -2.23 0.00 0.00 178.31 176.97 3drx n TYR 129 N -5.00 0.15 -2.98 0.41 4.02 -0.15 -4.93 117.16 108.67 3drx n TYR 129 Ca -0.06 0.05 -0.02 0.00 -0.01 0.00 0.00 57.90 57.86 3drx n TYR 129 Cb 0.05 -0.57 0.00 0.00 -0.02 0.00 0.00 39.34 38.80 3drx n TYR 129 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3drx n ASN 130 N -1.62 -7.72 -3.75 7.72 4.05 -0.18 -3.70 115.26 110.06 3drx n ASN 130 Ca 0.06 0.07 -0.28 0.00 0.45 0.00 0.00 54.58 54.88 3drx n ASN 130 Cb 0.32 -5.25 -0.12 0.00 1.23 0.00 0.00 39.78 35.97 3drx n ASN 130 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3drx s ILE 131 N -2.90 2.02 0.17 -1.44 1.01 -0.95 -3.52 121.20 115.59 3drx s ILE 131 Ca 0.06 -3.55 -0.27 0.00 0.00 0.00 0.00 60.65 56.88 3drx s ILE 131 Cb -0.02 -2.35 0.01 0.00 0.01 0.00 0.00 42.46 40.11 3drx s ILE 131 CO 0.74 -1.03 1.55 0.71 0.00 0.00 0.00 174.94 176.91 3drx h THR 132 N 4.66 0.03 -0.26 2.92 1.35 -1.94 0.25 112.91 119.92 3drx h THR 132 Ca 0.14 0.00 0.07 0.00 -0.55 0.00 0.00 66.41 66.07 3drx h THR 132 Cb 0.83 0.03 -0.01 0.00 -1.73 0.00 0.00 68.15 67.26 3drx h THR 132 CO 0.60 0.00 0.19 0.77 -0.25 0.00 0.00 175.52 176.82 3drx h SER 133 N -0.14 0.00 0.14 5.36 4.64 -1.99 -0.06 113.55 121.50 3drx h SER 133 Ca 0.18 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.50 3drx h SER 133 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3drx h SER 133 CO -0.81 0.00 -0.07 0.25 -0.87 0.00 0.00 176.83 175.33 3drx h LEU 134 N 0.00 -0.16 -0.92 5.97 5.85 -0.97 -2.76 115.31 122.32 3drx h LEU 134 Ca 0.12 -0.31 0.25 0.00 0.84 0.00 0.00 57.88 58.77 3drx h LEU 134 Cb 0.50 0.04 -0.17 0.00 0.37 0.00 0.00 40.66 41.40 3drx h LEU 134 CO -0.00 0.43 0.07 0.40 -0.34 0.00 0.00 178.44 178.99 3drx h ILE 135 N -0.95 0.14 -0.26 4.05 2.04 -0.66 0.32 117.51 122.18 3drx h ILE 135 Ca -0.02 -0.02 0.06 0.00 1.00 0.00 0.00 64.86 65.88 3drx h ILE 135 Cb 0.46 0.07 -0.07 0.00 -0.74 0.00 0.00 36.82 36.54 3drx h ILE 135 CO 0.03 0.01 -0.19 0.50 0.00 0.00 0.00 178.15 178.50 3drx h LYS 136 N 0.06 -0.17 -0.47 2.37 3.64 -1.05 -1.44 116.57 119.51 3drx h LYS 136 Ca 0.56 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.95 3drx h LYS 136 Cb 1.12 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 3drx h LYS 136 CO -0.82 -0.11 0.29 -0.07 -2.27 0.00 0.00 179.45 176.47 3drx h LEU 137 N -0.18 0.55 0.23 5.20 3.38 -0.13 -3.18 115.31 121.18 3drx h LEU 137 Ca 0.14 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 3drx h LEU 137 Cb 0.40 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3drx h LEU 137 CO -0.37 0.42 -0.11 0.58 0.09 0.00 0.00 178.44 179.05 3drx h VAL 138 N 0.64 0.85 -0.02 1.22 2.07 -0.12 -2.77 116.25 118.11 3drx h VAL 138 Ca 0.17 -0.57 0.01 0.00 0.82 0.00 0.00 66.70 67.13 3drx h VAL 138 Cb -0.04 1.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 3drx h VAL 138 CO -0.03 0.12 0.03 0.11 0.02 0.00 0.00 177.57 177.82 3drx h LYS 139 N -0.60 0.00 -0.18 1.57 1.57 -1.43 0.56 116.57 118.07 3drx h LYS 139 Ca -0.03 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 3drx h LYS 139 Cb 0.43 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 3drx h LYS 139 CO 0.05 0.00 -0.11 -0.44 -0.57 0.00 0.00 179.45 178.38 3drx h ASP 140 N 0.00 0.40 -0.78 0.86 3.32 -1.50 -2.45 116.42 116.27 3drx h ASP 140 Ca 0.01 -0.43 0.01 0.00 0.02 0.00 0.00 57.03 56.64 3drx h ASP 140 Cb 0.08 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 3drx h ASP 140 CO -0.00 0.75 0.52 0.50 -1.72 0.00 0.00 179.24 179.29 3drx h LYS 141 N 0.06 1.03 0.47 3.56 1.63 -0.64 0.14 116.57 122.82 3drx h LYS 141 Ca 0.04 -0.06 -0.02 0.00 -0.85 0.00 0.00 60.65 59.75 3drx h LYS 141 Cb 0.61 -0.23 0.00 0.00 -0.60 0.00 0.00 32.23 32.01 3drx h LYS 141 CO 0.03 0.68 -0.23 0.82 -3.45 0.00 0.00 179.45 177.30 3drx h ILE 142 N 1.06 0.35 0.00 2.00 2.04 -1.32 -2.65 117.51 118.99 3drx h ILE 142 Ca 0.29 -0.49 -0.06 0.00 1.00 0.00 0.00 64.86 65.59 3drx h ILE 142 Cb -0.12 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 3drx h ILE 142 CO -0.06 0.06 -0.30 0.03 0.00 0.00 0.00 178.15 177.88 3drx h ARG 143 N -1.00 0.00 -0.12 2.37 3.08 -1.39 -2.03 114.38 115.29 3drx h ARG 143 Ca -0.07 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3drx h ARG 143 Cb 0.59 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.63 3drx h ARG 143 CO 0.11 0.30 0.02 1.49 -1.07 0.00 0.00 179.97 180.82 3drx h GLU 144 N 0.00 0.20 -0.05 0.04 4.81 -0.73 -2.16 114.58 116.70 3drx h GLU 144 Ca -0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 3drx h GLU 144 Cb 0.58 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.94 3drx h GLU 144 CO 0.04 0.38 0.00 2.89 -0.73 0.00 0.00 179.01 181.59 3drx n ARG 145 N -4.84 1.33 -0.00 1.92 -4.01 -1.00 -3.44 116.66 106.62 3drx n ARG 145 Ca -0.06 -0.48 -0.16 0.00 -1.04 0.00 0.00 57.85 56.11 3drx n ARG 145 Cb 0.17 -1.41 -0.14 0.00 -3.04 0.00 0.00 32.46 28.04 3drx n ARG 145 CO 0.00 0.00 0.00 -0.25 -3.04 0.00 0.00 177.63 174.34 3drx n ASP 146 N -0.35 1.63 0.00 2.89 10.43 -0.77 -3.49 116.55 126.88 3drx n ASP 146 Ca 0.18 0.30 0.12 0.00 2.57 0.00 0.00 54.79 57.96 3drx n ASP 146 Cb 0.20 -0.55 0.62 0.00 1.84 0.00 0.00 41.12 43.23 3drx n ASP 146 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 3drx n SER 147 N -3.31 0.00 -0.05 -2.24 3.41 -0.84 -3.43 113.62 107.16 3drx n SER 147 Ca -0.25 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.15 3drx n SER 147 Cb 1.05 -0.31 -0.13 0.00 -0.26 0.00 0.00 64.21 64.56 3drx n SER 147 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3drx n LYS 148 N -1.31 0.71 0.34 4.33 4.81 -1.24 -4.55 118.16 121.25 3drx n LYS 148 Ca 0.11 0.25 -0.15 0.00 -0.87 0.00 0.00 58.31 57.65 3drx n LYS 148 Cb 0.21 -1.65 -0.08 0.00 0.02 0.00 0.00 35.03 33.54 3drx n LYS 148 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 3drx h THR 149 N -0.05 0.00 -3.28 3.15 2.02 -1.59 -3.42 112.91 109.73 3drx h THR 149 Ca -0.48 0.00 -0.66 0.00 0.77 0.00 0.00 66.41 66.04 3drx h THR 149 Cb 1.93 0.00 -0.31 0.00 -1.74 0.00 0.00 68.15 68.03 3drx h THR 149 CO -0.00 0.00 -0.78 -0.44 0.37 0.00 0.00 175.52 174.67 3drx s SER 150 N -3.66 3.82 0.00 4.18 0.01 -1.24 -5.08 113.70 111.73 3drx s SER 150 Ca -0.15 -0.57 -0.21 0.00 1.31 0.00 0.00 55.95 56.33 3drx s SER 150 Cb 0.02 -1.62 0.04 0.00 0.21 0.00 0.00 66.02 64.67 3drx s SER 150 CO 0.46 -0.03 0.47 -1.58 0.41 0.00 0.00 173.24 172.98 3drx s GLN 151 N 1.38 0.90 0.12 12.44 -0.44 -1.26 -4.77 119.66 128.03 3drx s GLN 151 Ca 0.05 -0.13 -0.31 0.00 -2.50 0.00 0.00 55.36 52.47 3drx s GLN 151 Cb -0.14 0.41 -0.08 0.00 -1.64 0.00 0.00 33.01 31.56 3drx s GLN 151 CO -0.07 -0.29 1.35 0.08 0.50 0.00 0.00 175.29 176.86 3drx s VAL 152 N -1.81 3.39 0.71 1.34 1.01 -1.26 -4.98 120.40 118.80 3drx s VAL 152 Ca -0.09 1.01 -0.13 0.00 0.00 0.00 0.00 61.98 62.77 3drx s VAL 152 Cb -0.02 -3.65 -0.11 0.00 0.00 0.00 0.00 36.38 32.60 3drx s VAL 152 CO 0.03 0.09 -0.65 -2.65 0.00 0.00 0.00 175.10 171.92 3drx n PRO 153 N 3.77 0.00 -2.73 2.72 -0.02 -1.26 -4.86 135.00 132.62 3drx n PRO 153 Ca 0.10 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.18 3drx n PRO 153 Cb 0.43 -0.71 -0.06 0.00 -0.02 0.00 0.00 33.50 33.14 3drx n PRO 153 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3drx s VAL 154 N -1.43 4.07 -0.24 -1.45 -7.23 -1.26 -5.03 120.40 107.83 3drx s VAL 154 Ca 0.28 2.04 -0.19 0.00 -1.81 0.00 0.00 61.98 62.31 3drx s VAL 154 Cb -0.10 -4.30 -0.03 0.00 0.56 0.00 0.00 36.38 32.51 3drx s VAL 154 CO 0.58 0.47 0.55 -0.54 -0.31 0.00 0.00 175.10 175.85 3drx s LYS 155 N -1.07 4.12 0.69 4.82 1.02 -1.26 -4.97 119.74 123.09 3drx s LYS 155 Ca 0.42 0.43 -0.03 0.00 0.02 0.00 0.00 55.97 56.80 3drx s LYS 155 Cb -0.26 -3.62 0.09 0.00 -0.52 0.00 0.00 37.83 33.51 3drx s LYS 155 CO 0.32 -0.31 0.97 -1.01 -0.92 0.00 0.00 175.35 174.41 3drx s HIS 156 N 2.17 2.33 -0.01 3.18 3.76 -1.26 -2.14 115.29 123.33 3drx s HIS 156 Ca 0.24 0.07 -0.08 0.00 -0.15 0.00 0.00 55.06 55.14 3drx s HIS 156 Cb -0.16 -3.10 0.01 0.00 1.11 0.00 0.00 32.58 30.44 3drx s HIS 156 CO 0.09 -1.49 0.16 0.08 -0.85 0.00 0.00 174.74 172.73 3drx s VAL 157 N -3.15 0.07 0.40 -0.90 1.01 -0.25 -4.92 120.40 112.66 3drx s VAL 157 Ca 0.63 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 62.05 3drx s VAL 157 Cb -0.08 -0.43 -0.06 0.00 0.00 0.00 0.00 36.38 35.81 3drx s VAL 157 CO 0.44 -0.33 0.04 -0.31 0.00 0.00 0.00 175.10 174.93 3drx s TYR 158 N -1.22 2.15 -0.24 5.22 2.02 -1.26 -2.12 117.35 121.89 3drx s TYR 158 Ca -0.13 -0.88 -0.27 0.00 -0.37 0.00 0.00 57.07 55.42 3drx s TYR 158 Cb -0.07 -1.53 0.12 0.00 -0.40 0.00 0.00 41.96 40.08 3drx s TYR 158 CO 0.02 0.19 0.98 0.50 -1.57 0.00 0.00 175.55 175.66 3drx s ARG 159 N -3.80 0.59 -0.29 -0.62 3.52 -0.29 -4.94 118.95 113.13 3drx s ARG 159 Ca 0.29 0.51 -0.00 0.00 -0.13 0.00 0.00 55.73 56.39 3drx s ARG 159 Cb 0.07 0.28 0.05 0.00 -1.56 0.00 0.00 34.95 33.80 3drx s ARG 159 CO 0.14 -0.11 -0.03 0.08 -0.81 0.00 0.00 175.30 174.57 3drx s VAL 160 N -0.15 2.76 0.53 7.11 1.01 -1.26 -0.58 120.40 129.81 3drx s VAL 160 Ca 0.01 -1.43 -0.05 0.00 0.00 0.00 0.00 61.98 60.51 3drx s VAL 160 Cb -0.04 -2.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 3drx s VAL 160 CO -0.03 -0.06 0.84 -0.76 0.00 0.00 0.00 175.10 175.09 3drx s LEU 161 N 1.22 3.44 -0.03 3.92 1.02 0.16 -4.87 118.68 123.55 3drx s LEU 161 Ca -0.06 0.83 -0.11 0.00 0.02 0.00 0.00 54.13 54.81 3drx s LEU 161 Cb -0.20 -3.73 0.02 0.00 0.02 0.00 0.00 46.19 42.30 3drx s LEU 161 CO -0.02 -0.80 0.24 0.00 0.02 0.00 0.00 176.35 175.78 3drx s GLN 162 N -4.86 0.50 -0.09 1.70 -2.07 -1.26 -0.72 119.66 112.86 3drx s GLN 162 Ca 0.50 -0.10 -0.30 0.00 -1.82 0.00 0.00 55.36 53.64 3drx s GLN 162 Cb -0.10 0.22 0.10 0.00 -1.09 0.00 0.00 33.01 32.14 3drx s GLN 162 CO 0.45 -0.12 0.86 0.00 -1.32 0.00 0.00 175.29 175.16 3drx n GLN 164 N 0.64 -1.93 -0.11 0.00 1.13 -1.26 -1.22 117.38 114.63 3drx n GLN 164 Ca -0.13 -0.53 -0.05 0.00 -1.94 0.00 0.00 57.00 54.35 3drx n GLN 164 Cb 0.58 -2.14 0.01 0.00 0.11 0.00 0.00 30.24 28.80 3drx n GLN 164 CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 3drx h GLU 165 N -2.44 -0.02 -0.56 -1.09 4.11 -1.97 -3.03 114.58 109.57 3drx h GLU 165 Ca -0.57 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 58.79 3drx h GLU 165 Cb 1.32 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.56 3drx h GLU 165 CO 0.46 -0.01 0.07 0.93 0.07 0.00 0.00 179.01 180.52 3drx h GLU 166 N -0.02 0.94 -0.83 1.06 3.07 -2.03 -2.98 114.58 113.79 3drx h GLU 166 Ca 0.18 -0.26 0.00 0.00 -0.50 0.00 0.00 59.36 58.78 3drx h GLU 166 Cb 0.30 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 3drx h GLU 166 CO -0.40 0.91 0.00 0.39 -1.40 0.00 0.00 179.01 178.52 3drx n GLU 167 N -4.32 0.76 -0.03 2.33 1.02 -1.15 -3.93 120.64 115.32 3drx n GLU 167 Ca 0.02 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.02 3drx n GLU 167 Cb 0.28 -1.34 -0.10 0.00 -0.02 0.00 0.00 31.44 30.26 3drx n GLU 167 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3drx h LEU 168 N 0.38 0.25 -1.40 -4.62 5.85 -1.60 -1.88 115.31 112.29 3drx h LEU 168 Ca 0.00 -0.65 -0.06 0.00 0.84 0.00 0.00 57.88 58.01 3drx h LEU 168 Cb 0.43 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 3drx h LEU 168 CO 0.00 0.86 -0.28 0.74 -0.34 0.00 0.00 178.44 179.42 3drx h THR 169 N -0.34 1.21 0.00 1.05 2.02 -1.85 -2.27 112.91 112.74 3drx h THR 169 Ca -0.01 -0.99 -0.06 0.00 0.77 0.00 0.00 66.41 66.12 3drx h THR 169 Cb 0.85 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.76 3drx h THR 169 CO 0.04 0.29 -0.27 1.56 0.37 0.00 0.00 175.52 177.51 3drx h GLN 170 N 0.03 0.00 0.08 6.66 4.20 -1.76 -1.18 115.11 123.14 3drx h GLN 170 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 3drx h GLN 170 Cb 0.51 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.29 3drx h GLN 170 CO 0.04 0.27 -0.04 1.98 -0.67 0.00 0.00 178.83 180.40 3drx h MET 171 N 0.00 -0.11 -0.35 1.46 4.05 -0.73 -3.13 114.93 116.12 3drx h MET 171 Ca -0.00 0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.39 3drx h MET 171 Cb 0.72 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.53 3drx h MET 171 CO 0.03 0.44 0.08 -0.39 0.23 0.00 0.00 176.91 177.31 3drx h VAL 172 N -0.83 1.22 0.00 -5.77 -1.51 -1.59 -2.82 116.25 104.95 3drx h VAL 172 Ca -0.01 -0.76 0.00 0.00 -1.23 0.00 0.00 66.70 64.70 3drx h VAL 172 Cb 0.59 1.05 0.00 0.00 -2.13 0.00 0.00 31.29 30.80 3drx h VAL 172 CO 0.02 0.26 0.15 -1.28 -1.23 0.00 0.00 177.57 175.49 3drx h SER 173 N 0.42 0.00 0.00 4.19 0.87 -1.26 -0.74 113.55 117.03 3drx h SER 173 Ca 0.11 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 3drx h SER 173 Cb 0.30 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.26 3drx h SER 173 CO 0.00 0.00 -0.15 0.35 -0.53 0.00 0.00 176.83 176.50 3drx n THR 174 N -2.43 0.68 -1.66 2.23 -2.24 -1.14 -5.04 114.28 104.68 3drx n THR 174 Ca -0.02 -0.78 -0.45 0.00 -2.27 0.00 0.00 64.05 60.53 3drx n THR 174 Cb 0.19 0.43 -0.03 0.00 -2.10 0.00 0.00 70.33 68.83 3drx n THR 174 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 3drx n MET 175 N -0.47 1.92 -0.99 -0.78 1.56 -0.29 -4.87 117.12 113.20 3drx n MET 175 Ca 0.04 0.68 -0.32 0.00 -0.27 0.00 0.00 57.70 57.83 3drx n MET 175 Cb 0.54 -2.30 0.14 0.00 2.15 0.00 0.00 33.22 33.75 3drx n MET 175 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 3drx s SER 176 N 0.16 3.43 0.16 6.12 0.15 -1.26 -4.90 113.70 117.57 3drx s SER 176 Ca 0.67 2.27 -0.21 0.00 0.70 0.00 0.00 55.95 59.37 3drx s SER 176 Cb -0.67 -2.58 0.06 0.00 -1.71 0.00 0.00 66.02 61.13 3drx s SER 176 CO 0.52 -2.77 1.32 -0.67 1.20 0.00 0.00 173.24 172.84 3drx n ASP 177 N -3.62 -0.75 -1.72 5.45 4.64 -1.26 -2.73 116.55 116.56 3drx n ASP 177 Ca 0.13 1.50 0.07 0.00 -1.38 0.00 0.00 54.79 55.11 3drx n ASP 177 Cb 0.51 -0.26 0.37 0.00 -1.04 0.00 0.00 41.12 40.70 3drx n ASP 177 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3drx n GLY 178 N -1.30 2.79 3.69 0.27 0.00 -1.26 -4.99 105.19 104.38 3drx n GLY 178 Ca 0.05 -0.85 -0.35 0.00 0.00 0.00 0.00 46.02 44.87 3drx n GLY 178 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3drx s TRP 179 N -2.39 3.31 0.10 1.61 0.52 -1.10 -4.53 118.94 116.45 3drx s TRP 179 Ca 0.50 0.18 -0.09 0.00 0.02 0.00 0.00 56.10 56.72 3drx s TRP 179 Cb 0.37 -2.04 -0.06 0.00 -1.15 0.00 0.00 33.47 30.59 3drx s TRP 179 CO 0.18 0.28 0.40 0.15 0.02 0.00 0.00 176.95 177.98 3drx s LYS 180 N 0.05 3.73 -0.08 4.98 -0.14 0.27 -4.84 119.74 123.70 3drx s LYS 180 Ca 0.06 0.12 -0.30 0.00 -1.36 0.00 0.00 55.97 54.50 3drx s LYS 180 Cb -0.12 -2.95 -0.04 0.00 -1.68 0.00 0.00 37.83 33.04 3drx s LYS 180 CO 0.00 0.53 1.47 0.12 -0.76 0.00 0.00 175.35 176.72 3drx s PHE 181 N -1.47 2.43 -0.12 3.18 5.36 -1.26 -1.43 117.98 124.66 3drx s PHE 181 Ca 0.35 0.59 -0.09 0.00 -0.96 0.00 0.00 56.93 56.82 3drx s PHE 181 Cb -0.13 -3.73 -0.03 0.00 -0.34 0.00 0.00 43.02 38.79 3drx s PHE 181 CO 0.20 -2.86 -0.18 0.39 -1.46 0.00 0.00 175.22 171.31 3drx n GLU 182 N 6.65 0.38 -3.53 10.12 -0.58 -0.65 -4.94 120.64 128.09 3drx n GLU 182 Ca 0.15 0.39 -0.17 0.00 -0.42 0.00 0.00 57.16 57.11 3drx n GLU 182 Cb 0.44 -1.43 -0.06 0.00 -0.57 0.00 0.00 31.44 29.82 3drx n GLU 182 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 3drx s GLN 183 N -2.15 1.06 -0.15 3.49 0.74 -0.97 -4.98 119.66 116.69 3drx s GLN 183 Ca -0.15 0.14 0.01 0.00 0.05 0.00 0.00 55.36 55.40 3drx s GLN 183 Cb 0.02 0.50 0.02 0.00 1.10 0.00 0.00 33.01 34.65 3drx s GLN 183 CO 0.22 -0.35 -0.15 -1.17 -0.55 0.00 0.00 175.29 173.29 3drx s LEU 184 N -1.39 1.78 -0.16 3.68 2.96 -1.26 -0.33 118.68 123.95 3drx s LEU 184 Ca -0.10 -0.52 -0.03 0.00 -0.22 0.00 0.00 54.13 53.26 3drx s LEU 184 Cb -0.00 -1.24 -0.02 0.00 0.50 0.00 0.00 46.19 45.42 3drx s LEU 184 CO 0.07 -0.04 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.32 3drx s VAL 185 N 1.43 3.77 -0.00 1.68 1.01 0.13 -4.96 120.40 123.46 3drx s VAL 185 Ca 0.05 -0.40 -0.27 0.00 0.00 0.00 0.00 61.98 61.36 3drx s VAL 185 Cb -0.13 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 3drx s VAL 185 CO -0.11 0.49 0.84 -0.55 0.00 0.00 0.00 175.10 175.77 3drx s SER 186 N 0.48 7.23 0.00 3.32 0.15 -1.26 -0.74 113.70 122.88 3drx s SER 186 Ca -0.04 1.48 0.26 0.00 0.70 0.00 0.00 55.95 58.35 3drx s SER 186 Cb -0.14 -2.50 0.75 0.00 -1.71 0.00 0.00 66.02 62.42 3drx s SER 186 CO 0.03 -0.14 1.56 -0.38 1.20 0.00 0.00 173.24 175.52 3drx n ILE 187 N 3.52 0.00 -3.31 6.45 5.41 -0.73 -4.95 119.36 125.75 3drx n ILE 187 Ca 0.02 -0.19 -0.16 0.00 1.00 0.00 0.00 62.75 63.42 3drx n ILE 187 Cb 0.51 0.55 0.08 0.00 -0.71 0.00 0.00 39.64 40.07 3drx n ILE 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3drx n GLY 188 N 1.30 -0.77 3.45 7.39 0.00 -1.26 -4.86 105.19 110.44 3drx n GLY 188 Ca 0.14 0.35 -0.44 0.00 0.00 0.00 0.00 46.02 46.07 3drx n GLY 188 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3drx n SER 189 N -3.16 -0.66 -4.66 1.61 7.64 -1.26 -4.98 113.62 108.16 3drx n SER 189 Ca -0.17 1.04 -0.23 0.00 1.01 0.00 0.00 58.87 60.51 3drx n SER 189 Cb 0.64 -1.08 -0.07 0.00 -1.01 0.00 0.00 64.21 62.69 3drx n SER 189 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3drx s SER 190 N -0.87 4.63 -0.07 6.43 0.15 -1.26 -5.04 113.70 117.67 3drx s SER 190 Ca 0.62 -0.59 0.10 0.00 0.70 0.00 0.00 55.95 56.77 3drx s SER 190 Cb -0.73 -0.90 0.41 0.00 -1.71 0.00 0.00 66.02 63.08 3drx s SER 190 CO 0.58 0.01 1.23 -1.22 1.20 0.00 0.00 173.24 175.05 3drx n TYR 191 N -0.83 0.87 -2.40 3.44 4.02 -1.26 -4.94 117.16 116.06 3drx n TYR 191 Ca -0.07 -0.34 -0.38 0.00 -0.01 0.00 0.00 57.90 57.11 3drx n TYR 191 Cb 0.58 -0.18 -0.03 0.00 -0.02 0.00 0.00 39.34 39.70 3drx n TYR 191 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 3drx s ASN 192 N -0.68 6.65 0.44 7.72 0.01 -1.26 -5.02 114.94 122.80 3drx s ASN 192 Ca 0.28 2.22 -0.24 0.00 -0.71 0.00 0.00 52.86 54.42 3drx s ASN 192 Cb 0.19 -2.60 -0.08 0.00 0.41 0.00 0.00 41.25 39.17 3drx s ASN 192 CO 0.13 -0.58 1.24 -0.47 -1.51 0.00 0.00 177.10 175.91 3drx s TYR 193 N -1.49 2.80 0.00 2.20 5.04 -1.26 -3.51 117.35 121.13 3drx s TYR 193 Ca 0.57 1.48 0.00 0.00 -2.44 0.00 0.00 57.07 56.67 3drx s TYR 193 Cb -0.27 -3.54 0.00 0.00 0.35 0.00 0.00 41.96 38.50 3drx s TYR 193 CO 0.34 -1.86 0.00 0.41 -1.34 0.00 0.00 175.55 173.10 3drx n GLY 194 N 0.59 1.13 2.43 8.97 0.00 -1.26 -4.44 105.19 112.61 3drx n GLY 194 Ca 0.06 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3drx n GLY 194 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3drx n ASN 195 N 2.46 0.00 -0.49 1.61 5.15 -1.26 -4.91 115.26 117.82 3drx n ASN 195 Ca 0.00 -0.91 0.10 0.00 -0.60 0.00 0.00 54.58 53.17 3drx n ASN 195 Cb 0.00 0.00 0.39 0.00 -0.53 0.00 0.00 39.78 39.64 3drx n ASN 195 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 3drx n GLU 196 N 2.34 1.64 -1.54 1.20 0.28 -1.23 -4.36 120.64 118.97 3drx n GLU 196 Ca 0.00 -0.97 0.00 0.00 -0.16 0.00 0.00 57.16 56.03 3drx n GLU 196 Cb 0.00 -1.38 0.00 0.00 1.43 0.00 0.00 31.44 31.49 3drx n GLU 196 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3drx n GLN 198 N 0.20 -2.43 -0.33 3.44 10.64 -1.26 -5.00 117.38 122.63 3drx n GLN 198 Ca 0.16 2.02 0.00 0.00 -1.83 0.00 0.00 57.00 57.35 3drx n GLN 198 Cb 0.30 -2.35 0.00 0.00 -0.86 0.00 0.00 30.24 27.33 3drx n GLN 198 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3drx n ALA 199 N 0.85 -0.34 0.06 2.61 0.00 -1.26 -5.04 120.51 117.39 3drx n ALA 199 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 3drx n ALA 199 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 3drx n ALA 199 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3drx h GLU 200 N 0.00 0.00 -3.90 0.00 5.08 -1.87 -3.46 114.58 110.43 3drx h GLU 200 Ca 0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.13 3drx h GLU 200 Cb 0.22 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 29.20 3drx h GLU 200 CO 0.00 0.98 -0.72 -0.06 -1.00 0.00 0.00 179.01 178.21 3drx s PHE 201 N -2.72 0.15 0.08 4.33 0.40 -0.35 -1.77 117.98 118.10 3drx s PHE 201 Ca 0.01 -0.15 0.08 0.00 -0.60 0.00 0.00 56.93 56.27 3drx s PHE 201 Cb 0.10 -0.10 -0.04 0.00 0.51 0.00 0.00 43.02 43.49 3drx s PHE 201 CO 0.82 -0.05 -0.18 -0.51 0.70 0.00 0.00 175.22 176.00 3drx s LEU 202 N -0.40 2.65 -0.11 -0.37 1.43 0.08 -1.49 118.68 120.48 3drx s LEU 202 Ca -0.04 -0.50 -0.02 0.00 -1.03 0.00 0.00 54.13 52.54 3drx s LEU 202 Cb -0.03 -1.53 0.04 0.00 0.03 0.00 0.00 46.19 44.70 3drx s LEU 202 CO -0.00 0.22 0.03 0.00 0.23 0.00 0.00 176.35 176.82 3drx s VAL 204 N 2.00 4.87 0.09 0.00 1.01 0.55 0.39 120.40 129.31 3drx s VAL 204 Ca 0.03 0.94 -0.18 0.00 0.00 0.00 0.00 61.98 62.77 3drx s VAL 204 Cb -0.14 -3.78 0.04 0.00 0.00 0.00 0.00 36.38 32.50 3drx s VAL 204 CO -0.06 0.42 0.42 0.54 0.00 0.00 0.00 175.10 176.42 3drx s VAL 205 N -1.26 0.06 0.25 2.92 0.11 0.25 -1.64 120.40 121.08 3drx s VAL 205 Ca 0.32 -0.48 -0.14 0.00 -2.93 0.00 0.00 61.98 58.74 3drx s VAL 205 Cb -0.17 -1.07 0.00 0.00 -1.53 0.00 0.00 36.38 33.62 3drx s VAL 205 CO 0.18 -0.26 0.52 -0.94 -3.33 0.00 0.00 175.10 171.26 3drx s SER 206 N -2.44 -0.13 -0.28 3.54 1.04 -0.51 -1.14 113.70 113.79 3drx s SER 206 Ca -0.01 -0.85 -0.24 0.00 0.48 0.00 0.00 55.95 55.33 3drx s SER 206 Cb 0.01 0.61 0.11 0.00 0.10 0.00 0.00 66.02 66.84 3drx s SER 206 CO -0.08 -1.17 0.94 -0.75 0.98 0.00 0.00 173.24 173.17 3drx s LYS 207 N -3.99 0.59 0.88 4.02 2.20 -0.90 0.94 119.74 123.48 3drx s LYS 207 Ca 0.20 0.72 -0.12 0.00 -0.36 0.00 0.00 55.97 56.40 3drx s LYS 207 Cb -0.02 0.28 0.16 0.00 -1.51 0.00 0.00 37.83 36.74 3drx s LYS 207 CO 0.08 -0.07 1.23 -1.21 -0.36 0.00 0.00 175.35 175.02 3drx s GLU 208 N 0.35 1.09 -0.03 4.03 2.02 -1.26 -1.09 118.70 123.80 3drx s GLU 208 Ca 0.02 -0.44 -0.01 0.00 0.02 0.00 0.00 54.97 54.56 3drx s GLU 208 Cb -0.05 -1.96 0.03 0.00 0.10 0.00 0.00 34.13 32.25 3drx s GLU 208 CO -0.05 -2.07 0.03 -0.51 0.02 0.00 0.00 175.26 172.68 3drx s LEU 209 N -5.68 0.69 0.35 1.80 1.43 -0.91 -4.82 118.68 111.53 3drx s LEU 209 Ca 0.70 0.03 0.04 0.00 -1.03 0.00 0.00 54.13 53.87 3drx s LEU 209 Cb -0.05 -0.17 -0.05 0.00 0.03 0.00 0.00 46.19 45.95 3drx s LEU 209 CO 0.50 -0.18 0.07 -1.00 0.23 0.00 0.00 176.35 175.98 3drx s HIS 210 N 1.57 1.92 -0.78 0.29 3.76 -1.26 -4.38 115.29 116.40 3drx s HIS 210 Ca -0.02 -1.03 0.00 0.00 -0.15 0.00 0.00 55.06 53.86 3drx s HIS 210 Cb -0.13 -1.26 0.00 0.00 1.11 0.00 0.00 32.58 32.30 3drx s HIS 210 CO -0.03 -0.05 0.20 -1.71 -0.85 0.00 0.00 174.74 172.29