#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mlt s VAL 2 N 0.00 4.28 0.10 3.84 1.01 -1.26 -4.28 120.40 124.10 3mlt s VAL 2 Ca 0.00 1.54 -0.16 0.00 0.00 0.00 0.00 61.98 63.36 3mlt s VAL 2 Cb 0.00 -4.03 0.03 0.00 0.00 0.00 0.00 36.38 32.38 3mlt s VAL 2 CO 0.00 -0.18 0.38 0.00 0.00 0.00 0.00 175.10 175.30 3mlt s GLN 3 N 3.57 1.01 -0.24 2.72 -2.07 -0.73 -5.01 119.66 118.91 3mlt s GLN 3 Ca 0.54 -0.65 -0.01 0.00 -1.82 0.00 0.00 55.36 53.43 3mlt s GLN 3 Cb -0.21 0.44 0.03 0.00 -1.09 0.00 0.00 33.01 32.18 3mlt s GLN 3 CO 0.15 -0.38 -0.08 -0.51 -1.32 0.00 0.00 175.29 173.15 3mlt s LEU 4 N -2.61 3.09 -0.25 2.60 1.43 -1.26 -0.53 118.68 121.15 3mlt s LEU 4 Ca 0.01 -0.88 -0.04 0.00 -1.03 0.00 0.00 54.13 52.19 3mlt s LEU 4 Cb 0.01 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.60 3mlt s LEU 4 CO -0.10 -0.12 -0.01 -0.69 0.23 0.00 0.00 176.35 175.67 3mlt s VAL 5 N 1.31 3.44 0.34 -1.59 1.01 0.19 -4.09 120.40 121.01 3mlt s VAL 5 Ca 0.00 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.35 3mlt s VAL 5 Cb -0.16 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 3mlt s VAL 5 CO -0.05 0.28 0.52 -1.61 0.00 0.00 0.00 175.10 174.24 3mlt s GLU 6 N 1.45 3.38 0.75 2.72 2.02 -1.26 -0.57 118.70 127.19 3mlt s GLU 6 Ca 0.04 -0.52 -0.08 0.00 0.02 0.00 0.00 54.97 54.43 3mlt s GLU 6 Cb -0.16 -2.71 0.09 0.00 0.10 0.00 0.00 34.13 31.46 3mlt s GLU 6 CO -0.02 0.14 1.07 -1.54 0.02 0.00 0.00 175.26 174.93 3mlt s SER 7 N -4.06 4.45 0.78 -0.19 1.04 -0.67 -4.96 113.70 110.09 3mlt s SER 7 Ca 0.40 0.32 -0.13 0.00 0.48 0.00 0.00 55.95 57.03 3mlt s SER 7 Cb -0.09 -0.83 0.07 0.00 0.10 0.00 0.00 66.02 65.26 3mlt s SER 7 CO 0.34 -1.84 1.17 -0.83 0.98 0.00 0.00 173.24 173.07 3mlt s GLY 8 N -4.61 2.07 0.76 7.32 0.00 -1.26 -4.63 107.32 106.97 3mlt s GLY 8 Ca 0.63 0.71 -0.14 0.00 0.00 0.00 0.00 44.72 45.92 3mlt s GLY 8 CO 0.46 1.11 1.18 -0.32 0.00 0.00 0.00 173.10 175.52 3mlt s GLY 9 N -2.41 2.14 0.01 0.20 0.00 -1.26 -4.75 107.32 101.26 3mlt s GLY 9 Ca 0.70 0.74 0.02 0.00 0.00 0.00 0.00 44.72 46.18 3mlt s GLY 9 CO 0.50 1.14 -0.07 -0.54 0.00 0.00 0.00 173.10 174.13 3mlt s GLU 10 N -4.15 0.50 -0.15 2.90 0.41 0.58 -4.93 118.70 113.85 3mlt s GLU 10 Ca 0.71 -0.37 0.02 0.00 -0.41 0.00 0.00 54.97 54.91 3mlt s GLU 10 Cb -0.26 -0.43 0.02 0.00 -1.78 0.00 0.00 34.13 31.68 3mlt s GLU 10 CO 0.48 0.11 -0.19 0.08 -0.49 0.00 0.00 175.26 175.25 3mlt s VAL 11 N -0.50 1.89 0.06 2.63 1.01 -1.26 -1.47 120.40 122.76 3mlt s VAL 11 Ca -0.01 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.12 3mlt s VAL 11 Cb -0.05 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 3mlt s VAL 11 CO 0.00 0.52 -0.05 -0.54 0.00 0.00 0.00 175.10 175.03 3mlt s LYS 12 N 1.09 0.63 0.26 2.72 -0.14 -0.39 -4.99 119.74 118.92 3mlt s LYS 12 Ca -0.02 -1.10 -0.06 0.00 -1.36 0.00 0.00 55.97 53.43 3mlt s LYS 12 Cb -0.14 -0.02 -0.06 0.00 -1.68 0.00 0.00 37.83 35.93 3mlt s LYS 12 CO -0.06 -0.05 0.53 -0.65 -0.76 0.00 0.00 175.35 174.36 3mlt s GLN 13 N -3.18 3.67 0.35 1.68 -1.52 -1.24 -0.70 119.66 118.71 3mlt s GLN 13 Ca 0.03 0.05 -0.28 0.00 -1.95 0.00 0.00 55.36 53.21 3mlt s GLN 13 Cb 0.02 -2.67 -0.12 0.00 -0.22 0.00 0.00 33.01 30.02 3mlt s GLN 13 CO -0.05 0.26 1.31 -2.30 -0.25 0.00 0.00 175.29 174.26 3mlt n PRO 14 N -0.65 2.19 -0.99 2.91 -0.02 -1.26 -0.84 135.00 136.34 3mlt n PRO 14 Ca -0.01 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 3mlt n PRO 14 Cb 0.53 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 3mlt n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mlt n GLY 15 N 0.74 0.98 3.87 -1.23 0.00 0.21 -4.92 105.19 104.84 3mlt n GLY 15 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 3mlt n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3mlt s GLN 16 N -0.02 3.15 0.24 1.61 -0.21 -0.02 -4.58 119.66 119.84 3mlt s GLN 16 Ca 0.00 0.64 0.06 0.00 0.02 0.00 0.00 55.36 56.07 3mlt s GLN 16 Cb 0.00 -2.04 -0.03 0.00 1.00 0.00 0.00 33.01 31.94 3mlt s GLN 16 CO 0.00 -0.86 0.30 -1.54 -2.12 0.00 0.00 175.29 171.07 3mlt s SER 17 N -4.21 6.04 -0.28 5.90 1.04 -1.26 -0.94 113.70 119.98 3mlt s SER 17 Ca 0.57 -0.04 -0.23 0.00 0.48 0.00 0.00 55.95 56.73 3mlt s SER 17 Cb -0.11 -1.70 0.12 0.00 0.10 0.00 0.00 66.02 64.42 3mlt s SER 17 CO 0.53 -0.06 0.95 -0.22 0.98 0.00 0.00 173.24 175.42 3mlt s LEU 18 N -3.91 -0.55 -0.12 2.42 2.96 -0.49 -4.98 118.68 114.01 3mlt s LEU 18 Ca 0.34 1.00 -0.02 0.00 -0.22 0.00 0.00 54.13 55.23 3mlt s LEU 18 Cb -0.09 1.98 0.04 0.00 0.50 0.00 0.00 46.19 48.62 3mlt s LEU 18 CO 0.28 -0.17 -0.00 -0.75 -1.32 0.00 0.00 176.35 174.39 3mlt s LYS 19 N 0.58 0.78 0.08 1.98 2.20 -1.26 -0.92 119.74 123.18 3mlt s LYS 19 Ca -0.01 -0.13 0.04 0.00 -0.36 0.00 0.00 55.97 55.51 3mlt s LYS 19 Cb -0.05 -1.45 -0.04 0.00 -1.51 0.00 0.00 37.83 34.79 3mlt s LYS 19 CO -0.08 -0.41 0.04 0.96 -0.36 0.00 0.00 175.35 175.50 3mlt s ILE 20 N 1.89 4.27 0.38 5.43 -4.36 -0.51 -4.97 121.20 123.33 3mlt s ILE 20 Ca 0.03 -0.86 0.07 0.00 -0.26 0.00 0.00 60.65 59.63 3mlt s ILE 20 Cb -0.14 -3.04 -0.07 0.00 1.25 0.00 0.00 42.46 40.46 3mlt s ILE 20 CO -0.07 0.14 -0.01 -0.94 0.24 0.00 0.00 174.94 174.30 3mlt s SER 21 N -2.30 3.66 -0.30 4.36 1.04 -1.26 -1.64 113.70 117.26 3mlt s SER 21 Ca 0.27 -1.32 0.02 0.00 0.48 0.00 0.00 55.95 55.40 3mlt s SER 21 Cb -0.12 -0.35 0.16 0.00 0.10 0.00 0.00 66.02 65.81 3mlt s SER 21 CO 0.20 -0.40 0.41 0.00 0.98 0.00 0.00 173.24 174.43 3mlt s LYS 23 N 2.44 4.25 0.06 0.00 2.20 0.26 -0.53 119.74 128.42 3mlt s LYS 23 Ca 0.10 0.24 0.01 0.00 -0.36 0.00 0.00 55.97 55.96 3mlt s LYS 23 Cb -0.12 -3.47 -0.04 0.00 -1.51 0.00 0.00 37.83 32.69 3mlt s LYS 23 CO -0.28 0.11 0.16 -1.54 -0.36 0.00 0.00 175.35 173.44 3mlt s SER 24 N 0.74 6.07 0.07 1.43 1.04 -0.77 0.57 113.70 122.84 3mlt s SER 24 Ca 0.20 0.18 -0.05 0.00 0.48 0.00 0.00 55.95 56.76 3mlt s SER 24 Cb -0.14 -1.80 -0.02 0.00 0.10 0.00 0.00 66.02 64.16 3mlt s SER 24 CO 0.07 0.18 0.09 -0.94 0.98 0.00 0.00 173.24 173.62 3mlt s SER 25 N -2.40 0.28 0.00 7.02 1.04 0.31 -4.85 113.70 115.10 3mlt s SER 25 Ca 0.32 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.96 3mlt s SER 25 Cb -0.13 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.26 3mlt s SER 25 CO 0.25 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.42 3mlt n GLY 26 N 0.09 0.74 3.79 7.32 0.00 -1.26 -1.77 105.19 114.10 3mlt n GLY 26 Ca -0.15 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.81 3mlt n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3mlt s TYR 27 N -2.35 -0.19 -0.70 1.61 -0.85 -1.26 -4.63 117.35 108.98 3mlt s TYR 27 Ca 0.00 -0.19 -0.25 0.00 -0.52 0.00 0.00 57.07 56.11 3mlt s TYR 27 Cb 0.00 0.67 0.05 0.00 0.38 0.00 0.00 41.96 43.06 3mlt s TYR 27 CO 0.00 -1.05 1.15 1.21 -1.52 0.00 0.00 175.55 175.34 3mlt s ASN 28 N -2.90 6.18 0.43 -0.18 3.04 -1.26 -4.81 114.94 115.44 3mlt s ASN 28 Ca 0.11 -0.62 0.29 0.00 0.04 0.00 0.00 52.86 52.68 3mlt s ASN 28 Cb -0.04 -2.50 1.13 0.00 -1.54 0.00 0.00 41.25 38.30 3mlt s ASN 28 CO 0.04 -1.65 1.86 0.15 -3.04 0.00 0.00 177.10 174.45 3mlt h PHE 29 N 9.81 0.00 -0.57 0.43 3.57 -1.97 -1.54 116.94 126.67 3mlt h PHE 29 Ca -0.28 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.22 3mlt h PHE 29 Cb 1.06 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.80 3mlt h PHE 29 CO 1.06 0.00 0.00 1.28 -2.23 0.00 0.00 178.31 178.42 3mlt n LEU 30 N -2.78 4.94 -2.76 0.59 4.77 -1.26 -4.22 117.00 116.28 3mlt n LEU 30 Ca 0.02 -2.66 -0.04 0.00 -0.03 0.00 0.00 56.01 53.30 3mlt n LEU 30 Cb 0.31 -0.60 0.04 0.00 -2.33 0.00 0.00 43.42 40.84 3mlt n LEU 30 CO 0.26 0.73 -0.04 -0.67 -1.33 0.00 0.00 177.39 176.34 3mlt n ASP 31 N 0.75 1.60 -3.70 -1.43 4.64 -0.58 -4.65 116.55 113.19 3mlt n ASP 31 Ca 0.25 -2.30 -0.02 0.00 -1.38 0.00 0.00 54.79 51.35 3mlt n ASP 31 Cb 0.98 -0.50 -0.01 0.00 -1.04 0.00 0.00 41.12 40.55 3mlt n ASP 31 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3mlt s SER 32 N -3.56 -0.13 0.34 1.67 1.04 -1.25 -4.96 113.70 106.83 3mlt s SER 32 Ca 0.28 -0.29 0.07 0.00 0.48 0.00 0.00 55.95 56.48 3mlt s SER 32 Cb 0.37 0.36 -0.02 0.00 0.10 0.00 0.00 66.02 66.83 3mlt s SER 32 CO -0.01 -0.66 0.38 0.26 0.98 0.00 0.00 173.24 174.19 3mlt s TRP 33 N -2.95 3.00 -0.10 5.02 0.52 -0.04 -4.08 118.94 120.31 3mlt s TRP 33 Ca 0.13 -0.26 0.02 0.00 0.02 0.00 0.00 56.10 56.01 3mlt s TRP 33 Cb 0.01 -1.90 -0.01 0.00 -1.15 0.00 0.00 33.47 30.42 3mlt s TRP 33 CO -0.00 0.08 -0.18 0.42 0.02 0.00 0.00 176.95 177.29 3mlt s ILE 34 N -2.24 2.62 0.13 2.03 -1.09 0.13 -2.40 121.20 120.38 3mlt s ILE 34 Ca 0.43 -0.83 0.04 0.00 -2.23 0.00 0.00 60.65 58.06 3mlt s ILE 34 Cb -0.08 -2.05 -0.04 0.00 -1.58 0.00 0.00 42.46 38.71 3mlt s ILE 34 CO 0.29 0.55 0.15 -0.83 -1.23 0.00 0.00 174.94 173.87 3mlt s GLY 35 N 0.18 1.84 0.00 6.18 0.00 0.00 -0.13 107.32 115.39 3mlt s GLY 35 Ca -0.10 -1.09 0.06 0.00 0.00 0.00 0.00 44.72 43.59 3mlt s GLY 35 CO 0.06 -1.09 -0.20 -0.98 0.00 0.00 0.00 173.10 170.89 3mlt s TRP 36 N -1.63 1.77 -0.09 1.90 0.52 -0.03 -1.01 118.94 120.37 3mlt s TRP 36 Ca 0.32 -0.35 -0.04 0.00 0.02 0.00 0.00 56.10 56.05 3mlt s TRP 36 Cb -0.11 -1.12 0.04 0.00 -1.15 0.00 0.00 33.47 31.14 3mlt s TRP 36 CO 0.24 0.00 0.20 0.08 0.02 0.00 0.00 176.95 177.50 3mlt s VAL 37 N -0.56 -0.04 0.08 4.03 1.01 -0.04 -0.81 120.40 124.07 3mlt s VAL 37 Ca 0.07 0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.25 3mlt s VAL 37 Cb -0.08 -0.32 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 3mlt s VAL 37 CO -0.00 0.07 0.03 -0.60 0.00 0.00 0.00 175.10 174.59 3mlt s ARG 38 N 1.21 2.67 -0.08 2.72 3.52 0.26 -0.60 118.95 128.67 3mlt s ARG 38 Ca -0.09 -0.78 -0.02 0.00 -0.13 0.00 0.00 55.73 54.71 3mlt s ARG 38 Cb -0.11 -2.61 0.03 0.00 -1.56 0.00 0.00 34.95 30.70 3mlt s ARG 38 CO -0.07 0.55 0.03 -1.14 -0.81 0.00 0.00 175.30 173.86 3mlt s GLN 39 N -2.30 0.33 -0.03 5.12 0.74 0.27 -0.48 119.66 123.31 3mlt s GLN 39 Ca 0.27 0.15 -0.25 0.00 0.05 0.00 0.00 55.36 55.58 3mlt s GLN 39 Cb -0.12 -0.96 -0.04 0.00 1.10 0.00 0.00 33.01 32.99 3mlt s GLN 39 CO 0.19 -0.36 0.76 0.42 -0.55 0.00 0.00 175.29 175.75 3mlt s ILE 40 N 2.05 4.94 0.11 -2.34 1.01 -1.26 -0.73 121.20 124.98 3mlt s ILE 40 Ca 0.04 1.58 -0.31 0.00 0.00 0.00 0.00 60.65 61.97 3mlt s ILE 40 Cb -0.13 -4.10 -0.09 0.00 0.01 0.00 0.00 42.46 38.15 3mlt s ILE 40 CO -0.05 0.27 1.54 -2.16 0.00 0.00 0.00 174.94 174.54 3mlt s PRO 41 N 0.61 4.24 0.00 2.79 0.04 -1.26 0.57 135.00 141.99 3mlt s PRO 41 Ca 0.40 2.27 0.00 0.00 0.04 0.00 0.00 61.00 63.71 3mlt s PRO 41 Cb -0.19 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.02 3mlt s PRO 41 CO 0.21 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 177.05 3mlt n GLY 42 N 3.76 0.77 3.34 0.56 0.00 -1.26 -5.06 105.19 107.31 3mlt n GLY 42 Ca 0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 3mlt n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mlt s LYS 43 N -0.55 1.68 0.00 1.61 -0.14 0.19 -5.18 119.74 117.35 3mlt s LYS 43 Ca 0.00 -1.97 0.00 0.00 -1.36 0.00 0.00 55.97 52.64 3mlt s LYS 43 Cb 0.00 -0.02 0.00 0.00 -1.68 0.00 0.00 37.83 36.13 3mlt s LYS 43 CO 0.00 -0.52 0.00 0.41 -0.76 0.00 0.00 175.35 174.48 3mlt n GLY 44 N -0.63 -0.24 3.70 -3.33 0.00 -1.26 -4.59 105.19 98.84 3mlt n GLY 44 Ca 0.02 -1.76 -0.38 0.00 0.00 0.00 0.00 46.02 43.90 3mlt n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mlt s LEU 45 N 0.00 4.24 -0.07 0.99 1.43 -1.26 -4.15 118.68 119.86 3mlt s LEU 45 Ca 0.00 0.80 0.02 0.00 -1.03 0.00 0.00 54.13 53.92 3mlt s LEU 45 Cb 0.00 -2.73 -0.03 0.00 0.03 0.00 0.00 46.19 43.46 3mlt s LEU 45 CO 0.00 -0.07 -0.12 -1.61 0.23 0.00 0.00 176.35 174.78 3mlt s GLU 46 N 0.98 2.72 0.09 1.70 2.02 0.37 -4.97 118.70 121.61 3mlt s GLU 46 Ca 0.26 -0.65 -0.30 0.00 0.02 0.00 0.00 54.97 54.30 3mlt s GLU 46 Cb -0.15 -2.48 -0.05 0.00 0.10 0.00 0.00 34.13 31.54 3mlt s GLU 46 CO 0.11 0.56 0.99 -0.46 0.02 0.00 0.00 175.26 176.48 3mlt s TRP 47 N -0.56 3.74 -0.24 1.61 -0.00 -1.26 -0.57 118.94 121.65 3mlt s TRP 47 Ca 0.08 1.73 0.00 0.00 -0.00 0.00 0.00 56.10 57.92 3mlt s TRP 47 Cb -0.12 -3.11 -0.15 0.00 -0.00 0.00 0.00 33.47 30.09 3mlt s TRP 47 CO 0.02 0.00 -0.23 -0.89 -0.00 0.00 0.00 176.95 175.85 3mlt n ILE 48 N 3.05 1.39 0.00 5.86 5.41 0.01 -4.64 119.36 130.44 3mlt n ILE 48 Ca 0.03 -0.51 0.00 0.00 1.00 0.00 0.00 62.75 63.27 3mlt n ILE 48 Cb 0.49 -1.41 0.00 0.00 -0.71 0.00 0.00 39.64 38.01 3mlt n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3mlt n GLY 49 N 2.25 1.38 3.07 7.39 0.00 -1.19 -1.84 105.19 116.25 3mlt n GLY 49 Ca -0.44 -1.01 -0.15 0.00 0.00 0.00 0.00 46.02 44.42 3mlt n GLY 49 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3mlt s ILE 50 N -2.00 0.69 0.01 -0.61 -4.36 -0.56 -0.85 121.20 113.52 3mlt s ILE 50 Ca 0.00 -0.93 0.01 0.00 -0.26 0.00 0.00 60.65 59.47 3mlt s ILE 50 Cb 0.00 -0.69 -0.01 0.00 1.25 0.00 0.00 42.46 43.01 3mlt s ILE 50 CO 0.00 -0.20 -0.05 -0.51 0.24 0.00 0.00 174.94 174.42 3mlt s ILE 51 N -1.04 0.33 -0.52 8.37 2.07 0.81 -1.87 121.20 129.35 3mlt s ILE 51 Ca -0.05 -0.50 -0.15 0.00 -1.41 0.00 0.00 60.65 58.54 3mlt s ILE 51 Cb -0.08 -0.34 0.12 0.00 0.13 0.00 0.00 42.46 42.29 3mlt s ILE 51 CO 0.01 -0.12 0.47 -0.47 -1.91 0.00 0.00 174.94 172.92 3mlt s TYR 52 N -0.61 3.26 0.45 3.50 5.04 -0.33 0.19 117.35 128.85 3mlt s TYR 52 Ca -0.04 -1.28 0.20 0.00 -2.44 0.00 0.00 57.07 53.51 3mlt s TYR 52 Cb -0.05 -3.68 1.17 0.00 0.35 0.00 0.00 41.96 39.74 3mlt s TYR 52 CO -0.00 -0.99 1.88 -1.35 -1.34 0.00 0.00 175.55 173.75 3mlt h PRO 52 N 8.84 0.30 -0.01 4.97 0.11 -1.79 0.55 132.00 144.97 3mlt h PRO 52 Ca -0.29 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3mlt h PRO 52 Cb 1.10 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 3mlt h PRO 52 CO 1.00 0.20 0.01 0.22 -0.21 0.00 0.00 178.00 179.22 3mlt h ASP 53 N 0.31 0.00 0.00 -2.05 3.58 -1.82 -3.26 116.42 113.18 3mlt h ASP 53 Ca 0.44 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.89 3mlt h ASP 53 Cb 1.21 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.26 3mlt h ASP 53 CO -0.13 0.00 0.00 -0.90 -2.88 0.00 0.00 179.24 175.33 3mlt n ASP 54 N -4.53 0.00 -2.34 2.28 3.85 -0.87 -5.02 116.55 109.93 3mlt n ASP 54 Ca -0.03 -1.00 -0.20 0.00 -0.71 0.00 0.00 54.79 52.86 3mlt n ASP 54 Cb 0.10 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 39.85 3mlt n ASP 54 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 3mlt n SER 55 N 0.00 -5.58 -4.75 -1.12 7.64 0.13 -4.99 113.62 104.94 3mlt n SER 55 Ca 0.00 0.05 -0.37 0.00 1.01 0.00 0.00 58.87 59.56 3mlt n SER 55 Cb 0.32 -4.68 0.03 0.00 -1.01 0.00 0.00 64.21 58.87 3mlt n SER 55 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3mlt s ASP 56 N -2.10 5.39 -0.04 6.43 -0.00 -1.24 -4.79 116.67 120.33 3mlt s ASP 56 Ca 0.00 2.55 -0.26 0.00 -0.00 0.00 0.00 52.55 54.83 3mlt s ASP 56 Cb 0.00 -2.62 0.06 0.00 -0.00 0.00 0.00 42.92 40.36 3mlt s ASP 56 CO 0.00 -1.47 0.58 0.00 -0.00 0.00 0.00 175.17 174.27 3mlt s ALA 57 N -1.44 -1.49 -0.10 5.23 0.00 -1.26 -1.18 121.76 121.51 3mlt s ALA 57 Ca 0.72 1.03 -0.02 0.00 0.00 0.00 0.00 51.96 53.70 3mlt s ALA 57 Cb -0.35 0.04 0.03 0.00 0.00 0.00 0.00 23.12 22.85 3mlt s ALA 57 CO 0.40 -0.35 -0.00 -1.01 0.00 0.00 0.00 175.76 174.80 3mlt s HIS 58 N -1.29 0.82 0.10 0.00 3.76 -0.78 -5.00 115.29 112.90 3mlt s HIS 58 Ca -0.11 -0.36 -0.02 0.00 -0.15 0.00 0.00 55.06 54.42 3mlt s HIS 58 Cb -0.01 -0.89 -0.05 0.00 1.11 0.00 0.00 32.58 32.74 3mlt s HIS 58 CO 0.08 -0.40 0.29 0.71 -0.85 0.00 0.00 174.74 174.57 3mlt s TYR 59 N 1.92 3.50 0.33 1.40 1.51 -1.26 -1.49 117.35 123.26 3mlt s TYR 59 Ca 0.04 0.38 -0.29 0.00 -1.01 0.00 0.00 57.07 56.20 3mlt s TYR 59 Cb -0.13 -1.87 -0.11 0.00 -0.11 0.00 0.00 41.96 39.75 3mlt s TYR 59 CO -0.06 0.52 1.40 0.45 -1.11 0.00 0.00 175.55 176.75 3mlt s SER 60 N -2.50 6.59 0.53 2.29 0.15 -0.77 -4.85 113.70 115.14 3mlt s SER 60 Ca 0.38 2.83 0.19 0.00 0.70 0.00 0.00 55.95 60.04 3mlt s SER 60 Cb -0.13 -2.65 1.33 0.00 -1.71 0.00 0.00 66.02 62.86 3mlt s SER 60 CO 0.27 -0.69 2.12 1.55 1.20 0.00 0.00 173.24 177.68 3mlt h PRO 61 N 3.55 0.00 0.00 5.44 0.13 -1.93 0.36 132.00 139.54 3mlt h PRO 61 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3mlt h PRO 61 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3mlt h PRO 61 CO 0.67 0.00 0.00 0.77 -0.23 0.00 0.00 178.00 179.21 3mlt h SER 62 N 0.00 0.00 0.00 1.44 0.02 -1.93 -3.30 113.55 109.78 3mlt h SER 62 Ca 0.05 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 3mlt h SER 62 Cb 0.21 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.75 3mlt h SER 62 CO -0.00 0.00 -1.23 0.49 -1.14 0.00 0.00 176.83 174.95 3mlt n PHE 63 N -2.85 0.00 -1.38 3.45 3.72 0.37 -4.92 117.46 115.85 3mlt n PHE 63 Ca -0.00 0.00 -0.54 0.00 -0.05 0.00 0.00 57.45 56.86 3mlt n PHE 63 Cb 0.20 -0.12 -0.08 0.00 -0.94 0.00 0.00 39.48 38.54 3mlt n PHE 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3mlt n GLU 64 N -1.71 0.00 0.00 -1.08 -0.58 0.97 -1.20 120.64 117.05 3mlt n GLU 64 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 3mlt n GLU 64 Cb 0.17 -1.19 0.00 0.00 -0.57 0.00 0.00 31.44 29.85 3mlt n GLU 64 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3mlt n GLY 65 N 3.06 2.92 0.09 0.62 0.00 -1.26 -4.73 105.19 105.89 3mlt n GLY 65 Ca 0.24 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.16 3mlt n GLY 65 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3mlt n GLN 66 N -2.00 0.66 -3.99 1.61 1.13 -0.34 -4.89 117.38 109.56 3mlt n GLN 66 Ca 0.00 0.22 -0.13 0.00 -1.94 0.00 0.00 57.00 55.15 3mlt n GLN 66 Cb 0.00 -1.71 -0.14 0.00 0.11 0.00 0.00 30.24 28.50 3mlt n GLN 66 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3mlt s VAL 67 N -2.57 0.19 -0.25 5.09 0.11 -1.12 -4.75 120.40 117.10 3mlt s VAL 67 Ca -0.08 -0.25 -0.07 0.00 -2.93 0.00 0.00 61.98 58.64 3mlt s VAL 67 Cb 0.07 -0.19 -0.03 0.00 -1.53 0.00 0.00 36.38 34.70 3mlt s VAL 67 CO 0.81 -0.05 0.08 -0.89 -3.33 0.00 0.00 175.10 171.72 3mlt s THR 68 N -0.30 4.35 0.12 5.04 2.01 0.00 -4.79 115.64 122.07 3mlt s THR 68 Ca -0.02 -0.16 -0.26 0.00 0.31 0.00 0.00 61.69 61.56 3mlt s THR 68 Cb -0.02 -3.04 -0.07 0.00 0.01 0.00 0.00 72.50 69.38 3mlt s THR 68 CO -0.00 0.33 0.82 -0.04 -0.69 0.00 0.00 174.62 175.04 3mlt s MET 69 N 1.62 4.59 0.35 4.92 -1.94 -1.26 -1.15 119.30 126.43 3mlt s MET 69 Ca 0.06 1.20 -0.15 0.00 -1.71 0.00 0.00 55.69 55.09 3mlt s MET 69 Cb -0.15 -3.32 0.04 0.00 2.01 0.00 0.00 34.83 33.41 3mlt s MET 69 CO 0.04 0.40 0.72 -1.54 -0.01 0.00 0.00 175.02 174.63 3mlt s SER 70 N -0.56 0.05 0.17 3.03 1.04 -0.65 -5.01 113.70 111.77 3mlt s SER 70 Ca 0.39 -1.05 -0.08 0.00 0.48 0.00 0.00 55.95 55.69 3mlt s SER 70 Cb -0.22 0.79 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 3mlt s SER 70 CO 0.26 -1.54 0.26 0.68 0.98 0.00 0.00 173.24 173.88 3mlt s VAL 71 N -2.86 0.06 -0.26 5.02 -7.23 -1.26 0.31 120.40 114.19 3mlt s VAL 71 Ca 0.17 -1.49 -0.01 0.00 -1.81 0.00 0.00 61.98 58.83 3mlt s VAL 71 Cb -0.05 -1.92 0.08 0.00 0.56 0.00 0.00 36.38 35.05 3mlt s VAL 71 CO 0.11 -0.29 0.05 -0.62 -0.31 0.00 0.00 175.10 174.05 3mlt s ASP 72 N -2.99 3.57 0.26 4.85 3.68 0.26 -4.95 116.67 121.36 3mlt s ASP 72 Ca 0.19 -1.26 -0.03 0.00 2.13 0.00 0.00 52.55 53.59 3mlt s ASP 72 Cb 0.04 -0.80 0.34 0.00 -1.45 0.00 0.00 42.92 41.05 3mlt s ASP 72 CO 0.01 -0.35 1.83 0.11 0.13 0.00 0.00 175.17 176.90 3mlt h LYS 73 N 8.13 0.96 -0.25 4.34 1.57 -1.90 -2.47 116.57 126.95 3mlt h LYS 73 Ca -0.15 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.41 3mlt h LYS 73 Cb 1.06 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 3mlt h LYS 73 CO 0.41 0.80 -0.05 0.66 -0.57 0.00 0.00 179.45 180.71 3mlt h SER 74 N 0.93 0.36 -0.40 0.86 4.64 -1.96 -2.62 113.55 115.37 3mlt h SER 74 Ca 0.21 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3mlt h SER 74 Cb 0.23 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3mlt h SER 74 CO -0.01 0.47 0.00 2.30 -0.87 0.00 0.00 176.83 178.71 3mlt n ILE 75 N -4.29 1.88 -3.46 0.95 -5.35 -1.19 -5.01 119.36 102.88 3mlt n ILE 75 Ca 0.00 -1.45 -0.25 0.00 -0.27 0.00 0.00 62.75 60.78 3mlt n ILE 75 Cb 0.25 0.04 0.01 0.00 -1.74 0.00 0.00 39.64 38.20 3mlt n ILE 75 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3mlt n SER 76 N 0.24 -4.60 -4.42 7.28 7.64 -0.96 -4.79 113.62 114.00 3mlt n SER 76 Ca 0.20 -0.49 -0.33 0.00 1.01 0.00 0.00 58.87 59.26 3mlt n SER 76 Cb 0.79 -3.74 -0.14 0.00 -1.01 0.00 0.00 64.21 60.12 3mlt n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3mlt s THR 77 N -3.10 3.11 0.02 0.44 2.01 -0.99 -1.85 115.64 115.29 3mlt s THR 77 Ca 0.46 -0.66 0.01 0.00 0.31 0.00 0.00 61.69 61.81 3mlt s THR 77 Cb -0.23 -2.28 -0.04 0.00 0.01 0.00 0.00 72.50 69.96 3mlt s THR 77 CO 0.57 0.55 0.08 0.00 -0.69 0.00 0.00 174.62 175.13 3mlt s ALA 78 N -0.06 3.59 0.16 7.40 0.00 0.31 -0.58 121.76 132.58 3mlt s ALA 78 Ca -0.02 -0.91 0.08 0.00 0.00 0.00 0.00 51.96 51.11 3mlt s ALA 78 Cb -0.14 -1.54 -0.04 0.00 0.00 0.00 0.00 23.12 21.40 3mlt s ALA 78 CO 0.04 0.71 -0.18 0.71 0.00 0.00 0.00 175.76 177.04 3mlt s TYR 79 N -1.26 1.78 -0.02 0.00 1.51 0.15 -0.88 117.35 118.63 3mlt s TYR 79 Ca 0.25 -0.48 0.06 0.00 -1.01 0.00 0.00 57.07 55.89 3mlt s TYR 79 Cb -0.12 -0.89 -0.01 0.00 -0.11 0.00 0.00 41.96 40.82 3mlt s TYR 79 CO 0.17 0.31 -0.19 -1.17 -1.11 0.00 0.00 175.55 173.56 3mlt s LEU 80 N -2.65 2.01 -0.03 -1.29 2.96 -0.65 -1.63 118.68 117.40 3mlt s LEU 80 Ca 0.15 -0.36 -0.00 0.00 -0.22 0.00 0.00 54.13 53.70 3mlt s LEU 80 Cb -0.06 -1.01 0.03 0.00 0.50 0.00 0.00 46.19 45.65 3mlt s LEU 80 CO 0.06 0.22 0.02 -1.58 -1.32 0.00 0.00 176.35 173.75 3mlt s GLN 81 N -0.31 0.11 0.23 1.98 0.74 -0.30 -1.42 119.66 120.70 3mlt s GLN 81 Ca 0.04 0.16 0.02 0.00 0.05 0.00 0.00 55.36 55.63 3mlt s GLN 81 Cb -0.09 -0.39 0.02 0.00 1.10 0.00 0.00 33.01 33.65 3mlt s GLN 81 CO 0.00 -0.18 0.14 0.91 -0.55 0.00 0.00 175.29 175.62 3mlt n TRP 82 N 4.32 -0.83 -1.46 1.67 8.01 -0.10 -0.82 117.44 128.24 3mlt n TRP 82 Ca -0.24 -1.01 -0.46 0.00 -1.31 0.00 0.00 57.50 54.48 3mlt n TRP 82 Cb 0.50 -0.18 -0.09 0.00 -2.01 0.00 0.00 31.31 29.53 3mlt n TRP 82 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.69 176.93 3mlt n THR 82 N -0.97 0.06 -2.08 -0.99 -2.24 -1.25 -1.39 114.28 105.41 3mlt n THR 82 Ca -0.02 -0.26 -0.40 0.00 -2.27 0.00 0.00 64.05 61.09 3mlt n THR 82 Cb 0.27 -1.42 -0.01 0.00 -2.10 0.00 0.00 70.33 67.07 3mlt n THR 82 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3mlt s LEU 82 N 8.62 4.35 0.43 3.22 1.43 -0.12 -4.73 118.68 131.88 3mlt s LEU 82 Ca 1.16 2.69 0.04 0.00 -1.03 0.00 0.00 54.13 56.99 3mlt s LEU 82 Cb -0.91 -3.74 -0.05 0.00 0.03 0.00 0.00 46.19 41.52 3mlt s LEU 82 CO 0.46 -0.65 0.02 0.00 0.23 0.00 0.00 176.35 176.41 3mlt s GLN 83 N -1.96 1.99 0.24 1.70 -2.07 -1.26 0.67 119.66 118.97 3mlt s GLN 83 Ca 0.52 -2.18 -0.05 0.00 -1.82 0.00 0.00 55.36 51.82 3mlt s GLN 83 Cb -0.39 -1.41 0.40 0.00 -1.09 0.00 0.00 33.01 30.51 3mlt s GLN 83 CO 0.52 -0.20 1.77 0.00 -1.32 0.00 0.00 175.29 176.06 3mlt h ALA 84 N 1.69 1.07 0.00 2.60 0.00 -1.97 -1.45 119.26 121.20 3mlt h ALA 84 Ca -0.43 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3mlt h ALA 84 Cb 1.27 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3mlt h ALA 84 CO 0.75 -0.06 0.00 -1.13 0.00 0.00 0.00 179.25 178.82 3mlt n SER 85 N -4.87 0.00 0.03 0.00 3.41 -1.26 -1.63 113.62 109.31 3mlt n SER 85 Ca 0.13 -0.71 0.12 0.00 -0.26 0.00 0.00 58.87 58.16 3mlt n SER 85 Cb 0.32 0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.54 3mlt n SER 85 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3mlt n ASP 86 N -0.75 0.54 -4.66 4.04 8.00 -0.54 -4.94 116.55 118.23 3mlt n ASP 86 Ca 0.05 0.04 -0.50 0.00 0.71 0.00 0.00 54.79 55.10 3mlt n ASP 86 Cb 0.03 0.07 -0.05 0.00 -0.02 0.00 0.00 41.12 41.14 3mlt n ASP 86 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3mlt n THR 87 N -1.80 0.20 -1.65 -3.53 -1.04 -0.64 -4.87 114.28 100.95 3mlt n THR 87 Ca 0.05 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 3mlt n THR 87 Cb 0.38 -1.41 0.00 0.00 -1.82 0.00 0.00 70.33 67.48 3mlt n THR 87 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3mlt n GLY 88 N 3.59 -2.17 3.71 3.41 0.00 0.37 -4.83 105.19 109.27 3mlt n GLY 88 Ca 0.20 -1.25 -0.36 0.00 0.00 0.00 0.00 46.02 44.61 3mlt n GLY 88 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3mlt s LYS 89 N -1.91 4.19 -0.15 1.61 2.20 0.09 -0.73 119.74 125.05 3mlt s LYS 89 Ca 0.00 -0.06 -0.01 0.00 -0.36 0.00 0.00 55.97 55.54 3mlt s LYS 89 Cb 0.00 -3.46 -0.01 0.00 -1.51 0.00 0.00 37.83 32.85 3mlt s LYS 89 CO 0.00 0.19 -0.12 0.71 -0.36 0.00 0.00 175.35 175.78 3mlt s TYR 90 N 0.64 2.84 -0.12 4.03 1.51 0.12 -0.56 117.35 125.81 3mlt s TYR 90 Ca 0.12 -0.77 -0.01 0.00 -1.01 0.00 0.00 57.07 55.40 3mlt s TYR 90 Cb -0.13 -1.91 -0.03 0.00 -0.11 0.00 0.00 41.96 39.79 3mlt s TYR 90 CO 0.03 -0.32 -0.07 -0.06 -1.11 0.00 0.00 175.55 174.02 3mlt s PHE 91 N 0.65 2.96 0.38 2.71 0.40 0.23 -0.38 117.98 124.94 3mlt s PHE 91 Ca -0.06 -0.23 -0.01 0.00 -0.60 0.00 0.00 56.93 56.03 3mlt s PHE 91 Cb -0.15 -1.84 -0.03 0.00 0.51 0.00 0.00 43.02 41.50 3mlt s PHE 91 CO 0.02 0.08 0.62 0.00 0.70 0.00 0.00 175.22 176.64 3mlt s THR 93 N -2.43 0.02 -0.01 0.00 -1.32 -0.18 -0.98 115.64 110.74 3mlt s THR 93 Ca 0.42 -0.18 -0.11 0.00 -1.21 0.00 0.00 61.69 60.61 3mlt s THR 93 Cb -0.10 -0.96 -0.05 0.00 -1.51 0.00 0.00 72.50 69.88 3mlt s THR 93 CO 0.38 -0.10 0.32 -0.60 -2.21 0.00 0.00 174.62 172.42 3mlt s ARG 94 N -2.13 3.73 -0.02 7.08 3.52 0.13 -0.82 118.95 130.44 3mlt s ARG 94 Ca -0.07 0.17 0.00 0.00 -0.13 0.00 0.00 55.73 55.70 3mlt s ARG 94 Cb -0.01 -3.15 0.03 0.00 -1.56 0.00 0.00 34.95 30.25 3mlt s ARG 94 CO 0.01 0.68 0.02 -1.17 -0.81 0.00 0.00 175.30 174.03 3mlt s LEU 95 N -1.32 1.20 -0.17 -0.88 2.96 -1.01 -2.13 118.68 117.34 3mlt s LEU 95 Ca 0.24 0.01 -0.01 0.00 -0.22 0.00 0.00 54.13 54.15 3mlt s LEU 95 Cb -0.15 -0.12 -0.01 0.00 0.50 0.00 0.00 46.19 46.41 3mlt s LEU 95 CO 0.12 -0.10 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.63 3mlt s TYR 96 N 0.94 2.86 -0.06 5.38 1.51 -1.26 -0.86 117.35 125.86 3mlt s TYR 96 Ca -0.08 -0.86 0.05 0.00 -1.01 0.00 0.00 57.07 55.17 3mlt s TYR 96 Cb -0.12 -1.94 -0.01 0.00 -0.11 0.00 0.00 41.96 39.78 3mlt s TYR 96 CO -0.02 -0.39 -0.21 -1.17 -1.11 0.00 0.00 175.55 172.64 3mlt s LEU 97 N 0.84 1.99 -1.11 -1.29 2.96 -1.26 -2.22 118.68 118.58 3mlt s LEU 97 Ca -0.03 -0.44 -0.18 0.00 -0.22 0.00 0.00 54.13 53.26 3mlt s LEU 97 Cb -0.15 -1.19 0.02 0.00 0.50 0.00 0.00 46.19 45.38 3mlt s LEU 97 CO 0.00 0.19 0.33 0.49 -1.32 0.00 0.00 176.35 176.04 3mlt n PHE 98 N 3.13 -1.08 -3.61 5.38 3.72 -1.26 -4.89 117.46 118.86 3mlt n PHE 98 Ca -0.18 0.22 -0.38 0.00 -0.05 0.00 0.00 57.45 57.06 3mlt n PHE 98 Cb 0.52 -2.27 -0.07 0.00 -0.94 0.00 0.00 39.48 36.73 3mlt n PHE 98 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 3mlt s GLU 99 N -6.88 3.09 4.22 -1.08 0.41 -1.26 -5.02 118.70 112.18 3mlt s GLU 99 Ca 0.24 -2.85 0.00 0.00 -0.41 0.00 0.00 54.97 51.96 3mlt s GLU 99 Cb -0.14 -3.97 0.00 0.00 -1.78 0.00 0.00 34.13 28.24 3mlt s GLU 99 CO 0.81 -1.23 0.00 0.41 -0.49 0.00 0.00 175.26 174.76 3mlt n GLY 100 N 3.07 1.38 0.49 -1.39 0.00 -1.26 -2.38 105.19 105.10 3mlt n GLY 100 Ca 0.15 -0.56 0.09 0.00 0.00 0.00 0.00 46.02 45.70 3mlt n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mlt n ALA 100 N 5.64 2.51 -1.86 4.61 0.00 -1.26 -5.08 120.51 125.07 3mlt n ALA 100 Ca 0.00 -0.48 -0.36 0.00 0.00 0.00 0.00 53.44 52.60 3mlt n ALA 100 Cb 0.00 -1.09 -0.02 0.00 0.00 0.00 0.00 19.45 18.34 3mlt n ALA 100 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3mlt n GLN 100 N 0.21 3.96 -0.03 0.00 3.00 -1.00 -5.12 117.38 118.40 3mlt n GLN 100 Ca 0.15 -3.17 -0.02 0.00 -0.01 0.00 0.00 57.00 53.94 3mlt n GLN 100 Cb 0.28 -2.48 -0.06 0.00 0.00 0.00 0.00 30.24 27.99 3mlt n GLN 100 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 3mlt n SER 100 N 1.39 3.24 -2.36 1.08 3.41 -1.26 -5.03 113.62 114.10 3mlt n SER 100 Ca 0.58 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 59.01 3mlt n SER 100 Cb 0.34 0.80 -0.01 0.00 -0.26 0.00 0.00 64.21 65.08 3mlt n SER 100 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3mlt n ASN 100 N -2.17 -5.11 -4.34 4.04 5.03 -0.94 -4.98 115.26 106.79 3mlt n ASN 100 Ca -0.10 0.09 -0.18 0.00 0.87 0.00 0.00 54.58 55.27 3mlt n ASN 100 Cb 0.63 -4.30 -0.10 0.00 -1.02 0.00 0.00 39.78 34.99 3mlt n ASN 100 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3mlt s ALA 100 N -2.85 1.90 -0.60 5.41 0.00 -1.26 -5.00 121.76 119.36 3mlt s ALA 100 Ca 0.00 -1.71 -0.25 0.00 0.00 0.00 0.00 51.96 50.01 3mlt s ALA 100 Cb 0.00 0.18 0.04 0.00 0.00 0.00 0.00 23.12 23.34 3mlt s ALA 100 CO 0.00 -0.10 1.02 -0.06 0.00 0.00 0.00 175.76 176.62 3mlt s PHE 100 N -3.20 2.69 -0.16 0.00 0.08 -1.26 -4.46 117.98 111.67 3mlt s PHE 100 Ca 0.24 -0.06 0.04 0.00 0.12 0.00 0.00 56.93 57.27 3mlt s PHE 100 Cb 0.03 -4.24 -0.23 0.00 -0.57 0.00 0.00 43.02 38.01 3mlt s PHE 100 CO 0.07 -1.52 0.21 -0.40 -0.10 0.00 0.00 175.22 173.48 3mlt n ASP 101 N 7.86 1.49 -4.32 1.36 5.75 -0.91 -4.86 116.55 122.92 3mlt n ASP 101 Ca 0.02 0.12 -0.33 0.00 -0.01 0.00 0.00 54.79 54.59 3mlt n ASP 101 Cb 0.47 -0.28 -0.15 0.00 -1.03 0.00 0.00 41.12 40.14 3mlt n ASP 101 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3mlt s LEU 102 N -6.45 2.52 -0.04 -2.12 0.20 -1.26 -4.98 118.68 106.54 3mlt s LEU 102 Ca -0.20 -0.40 0.04 0.00 0.69 0.00 0.00 54.13 54.26 3mlt s LEU 102 Cb 0.07 -1.55 -0.03 0.00 -0.43 0.00 0.00 46.19 44.26 3mlt s LEU 102 CO 0.74 0.17 -0.15 0.26 -0.29 0.00 0.00 176.35 177.08 3mlt s TRP 103 N 0.33 2.67 1.07 5.38 0.52 -1.26 0.19 118.94 127.84 3mlt s TRP 103 Ca -0.13 -0.18 -0.13 0.00 0.02 0.00 0.00 56.10 55.68 3mlt s TRP 103 Cb -0.17 -1.61 0.23 0.00 -1.15 0.00 0.00 33.47 30.77 3mlt s TRP 103 CO 0.07 0.18 1.08 0.20 0.02 0.00 0.00 176.95 178.50 3mlt s GLY 104 N -0.77 1.55 0.00 0.98 0.00 -0.15 -4.62 107.32 104.32 3mlt s GLY 104 Ca 0.12 -0.41 0.30 0.00 0.00 0.00 0.00 44.72 44.72 3mlt s GLY 104 CO 0.01 0.26 1.95 0.61 0.00 0.00 0.00 173.10 175.94 3mlt n GLN 105 N -4.43 0.98 0.00 2.90 0.00 -1.26 -4.85 117.38 110.73 3mlt n GLN 105 Ca 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 57.00 56.74 3mlt n GLN 105 Cb 0.57 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.32 3mlt n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3mlt n GLY 106 N 1.17 -0.58 2.99 2.61 0.00 -1.26 -5.02 105.19 105.10 3mlt n GLY 106 Ca 0.18 -1.44 -0.27 0.00 0.00 0.00 0.00 46.02 44.49 3mlt n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mlt s THR 107 N -2.51 1.22 -0.13 2.61 2.01 0.49 -4.87 115.64 114.47 3mlt s THR 107 Ca 0.00 -0.46 -0.18 0.00 0.31 0.00 0.00 61.69 61.36 3mlt s THR 107 Cb 0.00 -1.16 -0.04 0.00 0.01 0.00 0.00 72.50 71.31 3mlt s THR 107 CO 0.00 0.39 0.46 -0.32 -0.69 0.00 0.00 174.62 174.46 3mlt s MET 108 N 1.21 4.32 -0.17 4.92 0.00 -1.26 0.10 119.30 128.43 3mlt s MET 108 Ca -0.03 0.42 -0.00 0.00 0.00 0.00 0.00 55.69 56.07 3mlt s MET 108 Cb -0.14 -3.44 -0.00 0.00 0.00 0.00 0.00 34.83 31.24 3mlt s MET 108 CO -0.03 0.14 -0.14 0.42 0.00 0.00 0.00 175.02 175.41 3mlt s ILE 109 N 0.68 2.75 -0.27 10.11 1.01 0.09 -0.31 121.20 135.26 3mlt s ILE 109 Ca 0.25 -0.73 -0.00 0.00 0.00 0.00 0.00 60.65 60.16 3mlt s ILE 109 Cb -0.15 -2.17 0.05 0.00 0.01 0.00 0.00 42.46 40.19 3mlt s ILE 109 CO 0.10 0.50 -0.05 -0.22 0.00 0.00 0.00 174.94 175.27 3mlt s LEU 110 N 0.92 3.55 -0.51 2.97 2.96 -0.54 -0.48 118.68 127.55 3mlt s LEU 110 Ca -0.03 -1.20 -0.19 0.00 -0.22 0.00 0.00 54.13 52.49 3mlt s LEU 110 Cb -0.15 -1.65 0.06 0.00 0.50 0.00 0.00 46.19 44.96 3mlt s LEU 110 CO -0.01 -0.20 0.63 -0.69 -1.32 0.00 0.00 176.35 174.75 3mlt s VAL 111 N 1.22 4.88 0.26 1.68 1.01 -1.26 -1.26 120.40 126.93 3mlt s VAL 111 Ca -0.05 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.32 3mlt s VAL 111 Cb -0.19 -4.31 -0.01 0.00 0.00 0.00 0.00 36.38 31.87 3mlt s VAL 111 CO -0.03 -0.83 0.38 -0.94 0.00 0.00 0.00 175.10 173.67 3mlt s SER 112 N 2.76 0.24 0.00 3.32 1.04 0.13 -4.56 113.70 116.63 3mlt s SER 112 Ca 0.15 -1.20 0.23 0.00 0.48 0.00 0.00 55.95 55.61 3mlt s SER 112 Cb -0.20 0.55 0.12 0.00 0.10 0.00 0.00 66.02 66.58 3mlt s SER 112 CO 0.11 -1.09 1.15 -1.54 0.98 0.00 0.00 173.24 172.85 3mlt n SER 113 N -0.60 1.31 -4.68 7.02 3.41 -1.26 -3.67 113.62 115.15 3mlt n SER 113 Ca 0.00 -1.07 -0.45 0.00 -0.26 0.00 0.00 58.87 57.09 3mlt n SER 113 Cb 0.63 0.56 -0.04 0.00 -0.26 0.00 0.00 64.21 65.11 3mlt n SER 113 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3mlt n GLY 114 N 1.44 1.46 4.00 5.00 0.00 -1.26 -5.01 105.19 110.82 3mlt n GLY 114 Ca 0.07 0.74 -0.20 0.00 0.00 0.00 0.00 46.02 46.64 3mlt n GLY 114 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mlt s THR 115 N 2.61 2.57 0.20 2.61 -4.23 -1.26 -5.02 115.64 113.12 3mlt s THR 115 Ca 0.84 -0.82 -0.32 0.00 -1.18 0.00 0.00 61.69 60.21 3mlt s THR 115 Cb -0.59 -2.75 -0.11 0.00 1.34 0.00 0.00 72.50 70.38 3mlt s THR 115 CO 0.41 0.00 1.63 -0.89 -0.54 0.00 0.00 174.62 175.23 3mlt s THR 116 N -2.68 2.32 -0.16 3.99 2.01 -1.26 -4.71 115.64 115.14 3mlt s THR 116 Ca 0.59 0.23 -0.10 0.00 0.31 0.00 0.00 61.69 62.72 3mlt s THR 116 Cb -0.08 -3.15 0.05 0.00 0.01 0.00 0.00 72.50 69.33 3mlt s THR 116 CO 0.38 0.02 0.41 -0.75 -0.69 0.00 0.00 174.62 173.99 3mlt s LYS 117 N 0.92 0.41 0.65 4.92 2.20 0.93 -4.94 119.74 124.83 3mlt s LYS 117 Ca 0.71 0.72 -0.12 0.00 -0.36 0.00 0.00 55.97 56.92 3mlt s LYS 117 Cb -0.47 0.04 -0.02 0.00 -1.51 0.00 0.00 37.83 35.88 3mlt s LYS 117 CO 0.34 -0.13 1.05 0.20 -0.36 0.00 0.00 175.35 176.44 3mlt s GLY 118 N 1.08 1.78 0.60 5.54 0.00 -1.26 -0.26 107.32 114.80 3mlt s GLY 118 Ca -0.07 0.11 -0.15 0.00 0.00 0.00 0.00 44.72 44.61 3mlt s GLY 118 CO -0.09 0.41 1.05 2.56 0.00 0.00 0.00 173.10 177.04 3mlt s PRO 119 N -4.82 3.30 -0.16 2.90 0.04 -1.26 -4.50 135.00 130.50 3mlt s PRO 119 Ca 0.58 1.16 -0.15 0.00 0.04 0.00 0.00 61.00 62.63 3mlt s PRO 119 Cb -0.13 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 3mlt s PRO 119 CO 0.50 -0.82 0.34 -1.12 0.04 0.00 0.00 177.00 175.94 3mlt s SER 120 N -2.94 6.48 -0.25 6.66 0.01 0.03 -4.91 113.70 118.77 3mlt s SER 120 Ca 0.63 0.56 -0.05 0.00 1.31 0.00 0.00 55.95 58.40 3mlt s SER 120 Cb -0.15 -2.21 -0.00 0.00 0.21 0.00 0.00 66.02 63.86 3mlt s SER 120 CO 0.39 0.05 0.01 -0.69 0.41 0.00 0.00 173.24 173.41 3mlt s VAL 121 N 0.65 3.63 -0.02 3.43 1.01 -1.26 -0.80 120.40 127.04 3mlt s VAL 121 Ca 0.19 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 61.68 3mlt s VAL 121 Cb -0.14 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 3mlt s VAL 121 CO 0.06 0.30 -0.19 -0.36 0.00 0.00 0.00 175.10 174.90 3mlt s PHE 122 N 1.49 2.55 0.10 5.22 0.08 -0.30 -4.98 117.98 122.14 3mlt s PHE 122 Ca 0.04 -0.27 -0.19 0.00 0.12 0.00 0.00 56.93 56.64 3mlt s PHE 122 Cb -0.15 -1.55 -0.07 0.00 -0.57 0.00 0.00 43.02 40.68 3mlt s PHE 122 CO -0.01 0.14 0.59 -1.25 -0.10 0.00 0.00 175.22 174.59 3mlt s PRO 123 N -0.87 4.20 -0.75 0.24 0.04 -1.26 -0.57 135.00 136.02 3mlt s PRO 123 Ca 0.12 0.74 -0.08 0.00 0.04 0.00 0.00 61.00 61.82 3mlt s PRO 123 Cb -0.10 -3.18 0.19 0.00 0.04 0.00 0.00 34.50 31.45 3mlt s PRO 123 CO 0.01 0.60 0.63 -0.51 0.04 0.00 0.00 177.00 177.77 3mlt s LEU 124 N -1.26 5.96 0.26 -3.56 1.43 0.86 -4.89 118.68 117.48 3mlt s LEU 124 Ca 0.31 -2.87 -0.30 0.00 -1.03 0.00 0.00 54.13 50.24 3mlt s LEU 124 Cb -0.19 -2.02 -0.13 0.00 0.03 0.00 0.00 46.19 43.87 3mlt s LEU 124 CO 0.20 -0.44 1.33 0.00 0.23 0.00 0.00 176.35 177.67 3mlt n ALA 125 N 3.58 0.92 -1.00 4.21 0.00 -1.26 -1.73 120.51 125.23 3mlt n ALA 125 Ca 0.12 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.96 3mlt n ALA 125 Cb 0.42 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.64 3mlt n ALA 125 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3mlt n PRO 126 N 1.57 -0.74 0.00 0.00 -0.02 -1.26 -4.85 135.00 129.71 3mlt n PRO 126 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 3mlt n PRO 126 Cb 0.32 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.80 3mlt n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mlt n GLY 134 N 0.00 0.18 3.53 -1.23 0.00 -1.26 -4.74 105.19 101.67 3mlt n GLY 134 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 3mlt n GLY 134 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mlt s THR 135 N 0.75 0.77 -0.12 2.61 -4.23 -1.26 -2.67 115.64 111.49 3mlt s THR 135 Ca 0.00 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.37 3mlt s THR 135 Cb 0.00 -2.41 0.04 0.00 1.34 0.00 0.00 72.50 71.47 3mlt s THR 135 CO 0.00 0.00 0.38 0.00 -0.54 0.00 0.00 174.62 174.46 3mlt s ALA 136 N -3.19 -0.95 -0.20 3.99 0.00 0.14 -4.33 121.76 117.22 3mlt s ALA 136 Ca 0.24 0.95 -0.07 0.00 0.00 0.00 0.00 51.96 53.08 3mlt s ALA 136 Cb 0.04 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.64 3mlt s ALA 136 CO 0.13 -0.21 0.06 0.00 0.00 0.00 0.00 175.76 175.75 3mlt s ALA 137 N -0.14 3.32 0.19 0.00 0.00 -1.26 0.54 121.76 124.40 3mlt s ALA 137 Ca -0.03 -0.87 0.05 0.00 0.00 0.00 0.00 51.96 51.11 3mlt s ALA 137 Cb -0.03 -1.96 -0.05 0.00 0.00 0.00 0.00 23.12 21.08 3mlt s ALA 137 CO 0.02 -0.03 -0.07 -0.48 0.00 0.00 0.00 175.76 175.20 3mlt s LEU 138 N 0.77 2.41 0.34 0.00 0.05 0.12 -4.35 118.68 118.02 3mlt s LEU 138 Ca 0.03 -1.09 -0.17 0.00 0.05 0.00 0.00 54.13 52.95 3mlt s LEU 138 Cb -0.13 -0.37 0.04 0.00 -2.05 0.00 0.00 46.19 43.67 3mlt s LEU 138 CO 0.02 -0.38 0.74 -0.83 -0.55 0.00 0.00 176.35 175.35 3mlt s GLY 139 N -3.25 0.28 -0.11 -3.48 0.00 -0.70 0.94 107.32 101.01 3mlt s GLY 139 Ca 0.22 -0.65 0.03 0.00 0.00 0.00 0.00 44.72 44.32 3mlt s GLY 139 CO 0.05 -0.29 -0.20 0.00 0.00 0.00 0.00 173.10 172.66 3mlt s LEU 141 N 0.64 4.50 -0.41 0.00 2.96 0.26 -0.34 118.68 126.29 3mlt s LEU 141 Ca -0.13 -0.29 -0.15 0.00 -0.22 0.00 0.00 54.13 53.34 3mlt s LEU 141 Cb -0.16 -2.36 0.02 0.00 0.50 0.00 0.00 46.19 44.18 3mlt s LEU 141 CO 0.03 -0.39 0.31 -0.69 -1.32 0.00 0.00 176.35 174.30 3mlt s VAL 142 N 2.06 5.25 0.04 1.68 1.01 0.75 -1.14 120.40 130.05 3mlt s VAL 142 Ca 0.12 -0.66 0.07 0.00 0.00 0.00 0.00 61.98 61.51 3mlt s VAL 142 Cb -0.17 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 3mlt s VAL 142 CO 0.12 -0.33 -0.17 -0.75 0.00 0.00 0.00 175.10 173.97 3mlt s LYS 143 N 1.70 2.09 -1.20 2.72 2.20 0.02 -0.96 119.74 126.32 3mlt s LYS 143 Ca 0.05 -0.97 -0.01 0.00 -0.36 0.00 0.00 55.97 54.68 3mlt s LYS 143 Cb -0.19 -2.21 -0.01 0.00 -1.51 0.00 0.00 37.83 33.91 3mlt s LYS 143 CO 0.10 0.54 0.95 -0.25 -0.36 0.00 0.00 175.35 176.33 3mlt n ASP 144 N 1.48 -2.34 -4.70 1.43 8.00 0.02 -0.79 116.55 119.65 3mlt n ASP 144 Ca -0.16 -0.66 -0.23 0.00 0.71 0.00 0.00 54.79 54.45 3mlt n ASP 144 Cb 0.52 -4.99 -0.07 0.00 -0.02 0.00 0.00 41.12 36.57 3mlt n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3mlt s TYR 145 N -3.40 2.67 -0.28 1.24 -0.85 -0.79 -4.46 117.35 111.49 3mlt s TYR 145 Ca 0.04 -0.36 -0.25 0.00 -0.52 0.00 0.00 57.07 55.98 3mlt s TYR 145 Cb -0.01 -1.53 0.13 0.00 0.38 0.00 0.00 41.96 40.93 3mlt s TYR 145 CO 0.74 0.42 1.06 0.12 -1.52 0.00 0.00 175.55 176.37 3mlt s PHE 146 N -2.43 -0.44 0.12 -3.49 5.36 0.65 -1.48 117.98 116.27 3mlt s PHE 146 Ca 0.36 1.06 -0.02 0.00 -0.96 0.00 0.00 56.93 57.36 3mlt s PHE 146 Cb -0.03 0.38 0.03 0.00 -0.34 0.00 0.00 43.02 43.06 3mlt s PHE 146 CO 0.21 -0.22 0.12 -0.35 -1.46 0.00 0.00 175.22 173.52 3mlt n PRO 147 N 2.08 -1.01 -1.41 10.12 -0.04 -1.26 -0.05 135.00 143.44 3mlt n PRO 147 Ca -0.12 -0.18 -0.32 0.00 -0.04 0.00 0.00 63.50 62.84 3mlt n PRO 147 Cb 0.56 -0.16 0.08 0.00 -0.04 0.00 0.00 33.50 33.94 3mlt n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3mlt s GLU 148 N -3.26 2.41 0.30 0.54 0.41 -1.26 -4.76 118.70 113.07 3mlt s GLU 148 Ca 0.07 1.25 0.07 0.00 -0.41 0.00 0.00 54.97 55.95 3mlt s GLU 148 Cb -0.01 -1.91 -0.03 0.00 -1.78 0.00 0.00 34.13 30.41 3mlt s GLU 148 CO 0.05 -1.54 0.29 -1.25 -0.49 0.00 0.00 175.26 172.33 3mlt s PRO 149 N -4.64 2.94 -0.02 0.39 0.04 -1.26 -4.86 135.00 127.58 3mlt s PRO 149 Ca 0.63 -1.11 0.02 0.00 0.04 0.00 0.00 61.00 60.58 3mlt s PRO 149 Cb -0.18 -2.61 -0.03 0.00 0.04 0.00 0.00 34.50 31.72 3mlt s PRO 149 CO 0.51 0.23 -0.06 0.14 0.04 0.00 0.00 177.00 177.87 3mlt s VAL 150 N -2.19 3.72 0.16 -0.36 -7.23 -1.26 -4.26 120.40 108.99 3mlt s VAL 150 Ca 0.38 -0.64 0.08 0.00 -1.81 0.00 0.00 61.98 59.98 3mlt s VAL 150 Cb -0.07 -2.59 -0.04 0.00 0.56 0.00 0.00 36.38 34.24 3mlt s VAL 150 CO 0.27 0.47 -0.04 0.42 -0.31 0.00 0.00 175.10 175.91 3mlt s THR 151 N -0.94 3.54 0.00 5.32 -4.23 -0.64 -5.00 115.64 113.70 3mlt s THR 151 Ca 0.16 -1.45 -0.01 0.00 -1.18 0.00 0.00 61.69 59.21 3mlt s THR 151 Cb -0.11 -2.75 -0.01 0.00 1.34 0.00 0.00 72.50 70.97 3mlt s THR 151 CO 0.05 -0.07 0.00 0.54 -0.54 0.00 0.00 174.62 174.60 3mlt s VAL 152 N -1.64 0.04 0.32 2.29 0.11 -1.26 -1.19 120.40 119.07 3mlt s VAL 152 Ca 0.26 -0.36 0.07 0.00 -2.93 0.00 0.00 61.98 59.02 3mlt s VAL 152 Cb -0.09 -0.13 -0.03 0.00 -1.53 0.00 0.00 36.38 34.60 3mlt s VAL 152 CO 0.17 -0.20 0.26 -1.54 -3.33 0.00 0.00 175.10 170.47 3mlt n SER 153 N 2.48 -0.56 -4.20 3.54 3.41 -0.78 -4.99 113.62 112.52 3mlt n SER 153 Ca -0.17 -3.10 -0.25 0.00 -0.26 0.00 0.00 58.87 55.10 3mlt n SER 153 Cb 0.58 1.57 -0.15 0.00 -0.26 0.00 0.00 64.21 65.95 3mlt n SER 153 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 3mlt s TRP 154 N -3.28 1.63 -0.66 7.33 0.52 -1.25 -0.68 118.94 122.55 3mlt s TRP 154 Ca 0.37 -0.33 -0.09 0.00 0.02 0.00 0.00 56.10 56.07 3mlt s TRP 154 Cb 0.02 -1.01 0.01 0.00 -1.15 0.00 0.00 33.47 31.34 3mlt s TRP 154 CO 0.26 0.02 0.16 0.09 0.02 0.00 0.00 176.95 177.51 3mlt n ASN 155 N 2.27 -0.75 -3.69 2.95 4.13 -0.38 0.08 115.26 119.86 3mlt n ASN 155 Ca -0.16 -0.62 -0.26 0.00 1.68 0.00 0.00 54.58 55.22 3mlt n ASN 155 Cb 0.54 -0.76 0.06 0.00 -1.54 0.00 0.00 39.78 38.08 3mlt n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3mlt n SER 156 N -0.87 -5.65 0.00 6.41 7.64 -1.26 -1.86 113.62 118.02 3mlt n SER 156 Ca -0.10 -0.62 0.00 0.00 1.01 0.00 0.00 58.87 59.15 3mlt n SER 156 Cb 0.30 -4.68 0.00 0.00 -1.01 0.00 0.00 64.21 58.82 3mlt n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mlt n GLY 157 N -1.88 0.89 0.28 0.23 0.00 0.11 -4.86 105.19 99.97 3mlt n GLY 157 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 3mlt n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mlt h ALA 158 N 0.00 -0.65 -2.32 4.61 0.00 -1.19 -3.41 119.26 116.29 3mlt h ALA 158 Ca 0.00 -0.18 -0.59 0.00 0.00 0.00 0.00 54.91 54.14 3mlt h ALA 158 Cb 0.00 0.25 -0.08 0.00 0.00 0.00 0.00 17.79 17.96 3mlt h ALA 158 CO 0.00 -0.77 0.44 -1.17 0.00 0.00 0.00 179.25 177.75 3mlt s LEU 159 N -9.75 4.12 0.00 0.00 2.96 -1.11 -4.86 118.68 110.04 3mlt s LEU 159 Ca -0.15 1.08 0.00 0.00 -0.22 0.00 0.00 54.13 54.84 3mlt s LEU 159 Cb 0.03 -3.20 0.00 0.00 0.50 0.00 0.00 46.19 43.52 3mlt s LEU 159 CO 0.56 -0.47 0.02 0.35 -1.32 0.00 0.00 176.35 175.49 3mlt n THR 160 N 5.06 0.00 -3.34 3.68 -2.24 -1.26 -3.83 114.28 112.35 3mlt n THR 160 Ca 0.05 -0.06 -0.38 0.00 -2.27 0.00 0.00 64.05 61.39 3mlt n THR 160 Cb 0.48 1.30 -0.06 0.00 -2.10 0.00 0.00 70.33 69.95 3mlt n THR 160 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3mlt s SER 161 N -0.08 6.94 -0.57 3.42 0.01 -1.26 -3.99 113.70 118.17 3mlt s SER 161 Ca 0.00 1.11 0.00 0.00 1.31 0.00 0.00 55.95 58.37 3mlt s SER 161 Cb 0.00 -2.32 0.00 0.00 0.21 0.00 0.00 66.02 63.91 3mlt s SER 161 CO 0.00 0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.50 3mlt n GLY 162 N 2.01 0.79 3.68 3.44 0.00 -1.26 -4.83 105.19 109.02 3mlt n GLY 162 Ca -0.11 -0.81 -0.37 0.00 0.00 0.00 0.00 46.02 44.73 3mlt n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mlt s VAL 163 N -2.20 5.31 -0.07 1.61 1.01 -1.26 -1.90 120.40 122.91 3mlt s VAL 163 Ca 0.00 0.37 -0.01 0.00 0.00 0.00 0.00 61.98 62.34 3mlt s VAL 163 Cb 0.00 -3.58 0.03 0.00 0.00 0.00 0.00 36.38 32.83 3mlt s VAL 163 CO 0.00 0.33 -0.00 -2.28 0.00 0.00 0.00 175.10 173.15 3mlt s HIS 164 N 0.98 0.68 -0.39 5.22 2.46 0.44 -4.99 115.29 119.69 3mlt s HIS 164 Ca 0.12 -0.17 -0.14 0.00 0.47 0.00 0.00 55.06 55.33 3mlt s HIS 164 Cb -0.13 -0.80 0.01 0.00 -0.13 0.00 0.00 32.58 31.52 3mlt s HIS 164 CO 0.05 -0.33 0.28 0.99 -2.47 0.00 0.00 174.74 173.26 3mlt s THR 165 N 1.93 5.26 0.47 0.89 2.01 -1.26 0.85 115.64 125.79 3mlt s THR 165 Ca 0.04 -0.53 -0.21 0.00 0.31 0.00 0.00 61.69 61.31 3mlt s THR 165 Cb -0.12 -3.86 -0.08 0.00 0.01 0.00 0.00 72.50 68.44 3mlt s THR 165 CO -0.05 -0.22 1.05 -0.36 -0.69 0.00 0.00 174.62 174.35 3mlt s PHE 166 N 1.69 3.04 0.77 4.92 0.40 0.10 -5.00 117.98 123.90 3mlt s PHE 166 Ca 0.05 1.59 -0.14 0.00 -0.60 0.00 0.00 56.93 57.83 3mlt s PHE 166 Cb -0.19 -3.11 0.06 0.00 0.51 0.00 0.00 43.02 40.30 3mlt s PHE 166 CO 0.10 -0.85 1.23 -2.14 0.70 0.00 0.00 175.22 174.26 3mlt s PRO 167 N -3.04 1.84 0.53 0.24 0.02 -1.26 -4.34 135.00 128.99 3mlt s PRO 167 Ca 0.65 1.85 -0.20 0.00 0.02 0.00 0.00 61.00 63.32 3mlt s PRO 167 Cb -0.19 -1.79 -0.06 0.00 0.02 0.00 0.00 34.50 32.48 3mlt s PRO 167 CO 0.23 -2.09 1.12 0.00 -0.33 0.00 0.00 177.00 175.93 3mlt s ALA 168 N -1.95 2.72 -0.12 -1.55 0.00 -1.26 -4.73 121.76 114.88 3mlt s ALA 168 Ca 0.76 0.80 -0.10 0.00 0.00 0.00 0.00 51.96 53.42 3mlt s ALA 168 Cb -0.31 -3.35 -0.05 0.00 0.00 0.00 0.00 23.12 19.41 3mlt s ALA 168 CO 0.48 -0.71 0.21 0.14 0.00 0.00 0.00 175.76 175.88 3mlt s VAL 169 N -1.79 5.37 -0.40 0.00 -7.23 0.02 -4.95 120.40 111.43 3mlt s VAL 169 Ca 0.72 0.38 -0.24 0.00 -1.81 0.00 0.00 61.98 61.03 3mlt s VAL 169 Cb -0.23 -3.50 0.02 0.00 0.56 0.00 0.00 36.38 33.22 3mlt s VAL 169 CO 0.26 0.55 0.82 -0.22 -0.31 0.00 0.00 175.10 176.20 3mlt s LEU 170 N -0.61 4.13 0.00 1.32 2.96 -1.26 -1.20 118.68 124.01 3mlt s LEU 170 Ca 0.16 0.21 -0.00 0.00 -0.22 0.00 0.00 54.13 54.28 3mlt s LEU 170 Cb -0.13 -3.05 0.07 0.00 0.50 0.00 0.00 46.19 43.58 3mlt s LEU 170 CO 0.05 -0.84 0.50 0.00 -1.32 0.00 0.00 176.35 174.74 3mlt n GLN 171 N 6.64 0.22 0.24 1.98 10.64 -0.57 -4.94 117.38 131.59 3mlt n GLN 171 Ca 0.04 -1.32 0.14 0.00 -1.83 0.00 0.00 57.00 54.03 3mlt n GLN 171 Cb 0.48 -0.34 0.47 0.00 -0.86 0.00 0.00 30.24 29.99 3mlt n GLN 171 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3mlt h SER 172 N -0.32 0.00 0.61 2.61 4.64 -1.97 -1.18 113.55 117.94 3mlt h SER 172 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 3mlt h SER 172 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3mlt h SER 172 CO 0.17 0.07 0.00 -1.54 -0.87 0.00 0.00 176.83 174.66 3mlt n SER 173 N -3.16 0.23 0.00 4.97 3.41 -1.26 -4.90 113.62 112.91 3mlt n SER 173 Ca 0.01 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 3mlt n SER 173 Cb 0.41 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 3mlt n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3mlt n GLY 174 N 0.07 0.75 3.65 5.00 0.00 -0.45 -4.70 105.19 109.51 3mlt n GLY 174 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 3mlt n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mlt s LEU 175 N 0.00 3.30 0.42 0.99 1.43 -1.26 -4.65 118.68 118.92 3mlt s LEU 175 Ca 0.00 -0.32 -0.01 0.00 -1.03 0.00 0.00 54.13 52.77 3mlt s LEU 175 Cb 0.00 -2.02 -0.02 0.00 0.03 0.00 0.00 46.19 44.18 3mlt s LEU 175 CO 0.00 0.14 0.66 -0.31 0.23 0.00 0.00 176.35 177.07 3mlt s TYR 176 N -1.47 3.42 -0.00 0.29 1.51 -0.55 -1.51 117.35 119.04 3mlt s TYR 176 Ca 0.25 0.43 -0.04 0.00 -1.01 0.00 0.00 57.07 56.71 3mlt s TYR 176 Cb -0.11 -2.16 -0.00 0.00 -0.11 0.00 0.00 41.96 39.58 3mlt s TYR 176 CO 0.17 -0.17 0.07 -1.12 -1.11 0.00 0.00 175.55 173.40 3mlt s SER 177 N -4.12 0.06 0.22 2.29 0.01 -0.34 -0.80 113.70 111.02 3mlt s SER 177 Ca 0.45 -0.18 -0.03 0.00 1.31 0.00 0.00 55.95 57.50 3mlt s SER 177 Cb -0.10 0.17 -0.03 0.00 0.21 0.00 0.00 66.02 66.27 3mlt s SER 177 CO 0.39 -0.25 0.22 -1.48 0.41 0.00 0.00 173.24 172.53 3mlt s LEU 178 N -0.98 1.01 0.16 2.44 0.05 -0.13 -0.80 118.68 120.43 3mlt s LEU 178 Ca -0.11 -1.32 0.10 0.00 0.05 0.00 0.00 54.13 52.85 3mlt s LEU 178 Cb -0.06 0.70 -0.04 0.00 -2.05 0.00 0.00 46.19 44.74 3mlt s LEU 178 CO 0.00 -0.93 -0.23 -0.44 -0.55 0.00 0.00 176.35 174.21 3mlt s SER 179 N -3.15 3.07 -0.08 1.48 0.01 -1.26 -0.18 113.70 113.59 3mlt s SER 179 Ca 0.36 -0.81 0.05 0.00 1.31 0.00 0.00 55.95 56.86 3mlt s SER 179 Cb 0.05 -0.20 -0.00 0.00 0.21 0.00 0.00 66.02 66.07 3mlt s SER 179 CO 0.13 0.09 -0.24 -0.55 0.41 0.00 0.00 173.24 173.07 3mlt s SER 180 N -2.39 3.09 -0.00 2.44 0.15 0.54 -0.73 113.70 116.80 3mlt s SER 180 Ca 0.15 -0.54 0.07 0.00 0.70 0.00 0.00 55.95 56.33 3mlt s SER 180 Cb -0.08 -1.18 -0.02 0.00 -1.71 0.00 0.00 66.02 63.03 3mlt s SER 180 CO 0.07 0.20 -0.21 0.54 1.20 0.00 0.00 173.24 175.03 3mlt s VAL 181 N 0.13 1.69 -0.12 4.45 0.11 0.25 0.00 120.40 126.91 3mlt s VAL 181 Ca -0.13 -0.98 0.01 0.00 -2.93 0.00 0.00 61.98 57.96 3mlt s VAL 181 Cb -0.16 -1.42 0.02 0.00 -1.53 0.00 0.00 36.38 33.29 3mlt s VAL 181 CO 0.07 0.42 -0.14 -0.69 -3.33 0.00 0.00 175.10 171.43 3mlt s VAL 182 N -0.56 1.46 -1.00 2.04 1.01 0.27 -0.42 120.40 123.20 3mlt s VAL 182 Ca 0.08 -0.59 -0.22 0.00 0.00 0.00 0.00 61.98 61.25 3mlt s VAL 182 Cb -0.08 -1.36 0.07 0.00 0.00 0.00 0.00 36.38 35.01 3mlt s VAL 182 CO -0.00 0.44 1.36 0.42 0.00 0.00 0.00 175.10 177.32 3mlt s THR 183 N 1.23 4.15 0.18 3.92 -4.23 -0.80 0.15 115.64 120.25 3mlt s THR 183 Ca -0.01 -1.00 -0.08 0.00 -1.18 0.00 0.00 61.69 59.42 3mlt s THR 183 Cb -0.14 -4.98 -0.06 0.00 1.34 0.00 0.00 72.50 68.66 3mlt s THR 183 CO -0.05 -1.82 0.46 0.68 -0.54 0.00 0.00 174.62 173.35 3mlt s VAL 184 N 4.32 5.04 0.03 2.29 -7.23 0.19 -4.65 120.40 120.39 3mlt s VAL 184 Ca 0.42 0.28 -0.30 0.00 -1.81 0.00 0.00 61.98 60.57 3mlt s VAL 184 Cb -0.01 -3.62 -0.07 0.00 0.56 0.00 0.00 36.38 33.23 3mlt s VAL 184 CO -0.10 0.00 1.67 -2.84 -0.31 0.00 0.00 175.10 173.53 3mlt s PRO 185 N -2.68 4.19 0.56 4.82 0.02 -1.26 0.27 135.00 140.92 3mlt s PRO 185 Ca 0.44 2.31 0.29 0.00 0.02 0.00 0.00 61.00 64.05 3mlt s PRO 185 Cb -0.12 -3.76 1.67 0.00 0.02 0.00 0.00 34.50 32.31 3mlt s PRO 185 CO 0.22 -0.78 2.18 0.66 -0.33 0.00 0.00 177.00 178.95 3mlt h SER 186 N 8.86 0.00 -0.88 2.53 4.64 -1.70 -2.65 113.55 124.35 3mlt h SER 186 Ca -0.42 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.02 3mlt h SER 186 Cb 1.20 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.15 3mlt h SER 186 CO 0.94 0.05 -0.39 -0.24 -0.87 0.00 0.00 176.83 176.32 3mlt n SER 187 N -3.74 -0.66 -4.60 4.97 2.88 -1.26 -4.21 113.62 106.99 3mlt n SER 187 Ca -0.02 1.54 -0.42 0.00 -1.33 0.00 0.00 58.87 58.64 3mlt n SER 187 Cb 0.15 -0.32 -0.05 0.00 -0.75 0.00 0.00 64.21 63.25 3mlt n SER 187 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3mlt s SER 188 N -5.35 6.61 0.00 -3.46 0.15 -1.00 -4.83 113.70 105.81 3mlt s SER 188 Ca -0.12 0.51 0.00 0.00 0.70 0.00 0.00 55.95 57.05 3mlt s SER 188 Cb 0.16 -2.40 0.00 0.00 -1.71 0.00 0.00 66.02 62.07 3mlt s SER 188 CO 0.61 -0.67 0.00 -0.11 1.20 0.00 0.00 173.24 174.27 3mlt n LEU 189 N 6.31 0.00 -1.27 3.45 7.94 -1.26 -4.62 117.00 127.55 3mlt n LEU 189 Ca 0.03 0.00 0.12 0.00 -1.11 0.00 0.00 56.01 55.05 3mlt n LEU 189 Cb 0.48 0.00 0.28 0.00 0.53 0.00 0.00 43.42 44.71 3mlt n LEU 189 CO 0.52 0.00 0.75 0.61 -1.11 0.00 0.00 177.39 178.16 3mlt n GLY 190 N 0.42 2.13 0.07 -3.96 0.00 -1.26 -4.73 105.19 97.86 3mlt n GLY 190 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.25 3mlt n GLY 190 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3mlt n THR 191 N 1.57 0.00 -2.74 2.61 -1.04 -1.26 -4.96 114.28 108.46 3mlt n THR 191 Ca 0.22 0.14 -0.42 0.00 -2.04 0.00 0.00 64.05 61.96 3mlt n THR 191 Cb 0.61 -1.08 -0.03 0.00 -1.82 0.00 0.00 70.33 68.01 3mlt n THR 191 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 3mlt s GLN 192 N -0.36 4.41 -0.04 -2.82 2.00 -1.26 -5.02 119.66 116.56 3mlt s GLN 192 Ca 0.00 1.30 -0.14 0.00 -2.00 0.00 0.00 55.36 54.52 3mlt s GLN 192 Cb 0.00 -3.54 -0.05 0.00 0.80 0.00 0.00 33.01 30.22 3mlt s GLN 192 CO 0.00 -0.29 0.35 0.99 -0.50 0.00 0.00 175.29 175.85 3mlt s THR 193 N 1.93 5.15 -0.23 -0.34 2.01 -1.26 -4.72 115.64 118.18 3mlt s THR 193 Ca 0.46 0.71 0.02 0.00 0.31 0.00 0.00 61.69 63.19 3mlt s THR 193 Cb -0.18 -3.66 0.05 0.00 0.01 0.00 0.00 72.50 68.72 3mlt s THR 193 CO 0.17 0.55 -0.10 -0.31 -0.69 0.00 0.00 174.62 174.24 3mlt s TYR 194 N -0.80 2.78 -0.08 4.92 2.02 -1.26 -4.93 117.35 120.00 3mlt s TYR 194 Ca 0.22 -1.92 0.01 0.00 -0.37 0.00 0.00 57.07 55.00 3mlt s TYR 194 Cb -0.15 -1.76 0.02 0.00 -0.40 0.00 0.00 41.96 39.66 3mlt s TYR 194 CO 0.11 -0.81 -0.09 0.42 -1.57 0.00 0.00 175.55 173.60 3mlt s ILE 195 N 1.27 0.99 -0.03 2.71 1.01 -1.26 0.17 121.20 126.05 3mlt s ILE 195 Ca -0.05 -0.35 -0.14 0.00 0.00 0.00 0.00 60.65 60.11 3mlt s ILE 195 Cb -0.18 -0.95 -0.05 0.00 0.01 0.00 0.00 42.46 41.29 3mlt s ILE 195 CO -0.07 0.34 0.37 0.00 0.00 0.00 0.00 174.94 175.57 3mlt s ASN 197 N -0.87 5.36 -0.28 0.00 -0.87 0.15 -1.76 114.94 116.67 3mlt s ASN 197 Ca 0.22 -0.12 -0.03 0.00 -1.57 0.00 0.00 52.86 51.36 3mlt s ASN 197 Cb -0.16 -1.96 0.03 0.00 -0.02 0.00 0.00 41.25 39.14 3mlt s ASN 197 CO 0.11 0.00 -0.00 -0.69 -2.57 0.00 0.00 177.10 173.95 3mlt s VAL 198 N 1.41 3.19 -0.16 1.60 1.01 0.68 -1.87 120.40 126.27 3mlt s VAL 198 Ca 0.06 -1.10 -0.06 0.00 0.00 0.00 0.00 61.98 60.88 3mlt s VAL 198 Cb -0.15 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 3mlt s VAL 198 CO 0.04 0.04 0.05 0.21 0.00 0.00 0.00 175.10 175.45 3mlt s ASN 199 N 1.34 5.59 -0.47 3.32 3.84 -0.33 -0.95 114.94 127.28 3mlt s ASN 199 Ca -0.01 0.13 0.03 0.00 0.21 0.00 0.00 52.86 53.21 3mlt s ASN 199 Cb -0.18 -1.88 0.15 0.00 -0.55 0.00 0.00 41.25 38.79 3mlt s ASN 199 CO -0.01 0.24 0.30 -2.28 -2.79 0.00 0.00 177.10 172.55 3mlt s HIS 200 N -0.03 1.96 0.29 0.43 5.65 0.21 -1.61 115.29 122.19 3mlt s HIS 200 Ca 0.06 -2.49 -0.00 0.00 0.25 0.00 0.00 55.06 52.88 3mlt s HIS 200 Cb -0.12 -1.75 0.49 0.00 -1.18 0.00 0.00 32.58 30.02 3mlt s HIS 200 CO 0.01 -0.76 1.91 0.87 -0.65 0.00 0.00 174.74 176.12 3mlt h LYS 201 N 6.33 1.04 -0.43 2.88 1.57 -1.80 -1.68 116.57 124.49 3mlt h LYS 201 Ca 0.07 -0.06 0.13 0.00 -1.87 0.00 0.00 60.65 58.92 3mlt h LYS 201 Cb 0.90 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.96 3mlt h LYS 201 CO 0.48 0.69 0.38 -1.35 -0.57 0.00 0.00 179.45 179.08 3mlt h PRO 202 N 1.07 0.00 -0.13 3.15 0.11 -1.89 -0.41 132.00 133.90 3mlt h PRO 202 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 3mlt h PRO 202 Cb 0.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.27 3mlt h PRO 202 CO -0.14 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.52 3mlt n SER 203 N -4.00 2.50 -3.89 -2.05 3.41 -0.99 -4.99 113.62 103.62 3mlt n SER 203 Ca 0.08 -2.24 -0.27 0.00 -0.26 0.00 0.00 58.87 56.18 3mlt n SER 203 Cb 0.58 -0.18 0.01 0.00 -0.26 0.00 0.00 64.21 64.36 3mlt n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3mlt n ASN 204 N -0.31 -2.49 -4.61 4.04 3.02 -0.17 -4.94 115.26 109.80 3mlt n ASN 204 Ca 0.08 -0.87 -0.34 0.00 -0.03 0.00 0.00 54.58 53.41 3mlt n ASN 204 Cb 0.42 -3.63 -0.10 0.00 -0.61 0.00 0.00 39.78 35.85 3mlt n ASN 204 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3mlt s THR 205 N -3.56 4.26 -0.11 3.41 2.01 -0.69 -4.98 115.64 115.97 3mlt s THR 205 Ca 0.32 -0.25 0.02 0.00 0.31 0.00 0.00 61.69 62.09 3mlt s THR 205 Cb -0.16 -2.84 0.02 0.00 0.01 0.00 0.00 72.50 69.52 3mlt s THR 205 CO 0.85 0.54 -0.15 -0.54 -0.69 0.00 0.00 174.62 174.63 3mlt s LYS 206 N -0.23 2.24 -0.01 4.92 1.02 -1.26 -0.62 119.74 125.79 3mlt s LYS 206 Ca 0.05 -0.56 0.05 0.00 0.02 0.00 0.00 55.97 55.53 3mlt s LYS 206 Cb -0.12 -1.93 -0.01 0.00 -0.52 0.00 0.00 37.83 35.25 3mlt s LYS 206 CO 0.02 -0.09 -0.16 0.08 -0.92 0.00 0.00 175.35 174.28 3mlt s VAL 207 N 1.06 1.30 -0.01 3.17 1.01 -0.12 -4.98 120.40 121.83 3mlt s VAL 207 Ca -0.05 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.27 3mlt s VAL 207 Cb -0.15 -1.09 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 3mlt s VAL 207 CO -0.03 0.37 -0.13 -1.81 0.00 0.00 0.00 175.10 173.50 3mlt s ASP 208 N -0.36 4.18 -0.12 3.32 1.01 -1.26 -0.23 116.67 123.21 3mlt s ASP 208 Ca 0.06 -0.23 -0.02 0.00 0.71 0.00 0.00 52.55 53.06 3mlt s ASP 208 Cb -0.07 -0.87 0.04 0.00 1.01 0.00 0.00 42.92 43.03 3mlt s ASP 208 CO -0.00 0.30 0.02 -0.75 0.21 0.00 0.00 175.17 174.94 3mlt s LYS 209 N -1.15 0.63 -0.07 8.23 2.47 -0.72 -4.99 119.74 124.14 3mlt s LYS 209 Ca 0.14 -0.11 -0.30 0.00 -1.56 0.00 0.00 55.97 54.14 3mlt s LYS 209 Cb -0.11 -1.46 -0.04 0.00 -1.46 0.00 0.00 37.83 34.76 3mlt s LYS 209 CO 0.04 -0.45 1.36 0.15 0.16 0.00 0.00 175.35 176.61 3mlt s LYS 210 N 1.93 4.26 -0.27 4.03 1.02 -1.26 -1.11 119.74 128.33 3mlt s LYS 210 Ca 0.03 1.85 -0.14 0.00 0.02 0.00 0.00 55.97 57.73 3mlt s LYS 210 Cb -0.14 -3.69 -0.04 0.00 -0.52 0.00 0.00 37.83 33.43 3mlt s LYS 210 CO -0.07 -0.63 0.31 0.08 -0.92 0.00 0.00 175.35 174.12 3mlt s VAL 211 N 2.95 5.22 0.15 3.17 1.01 0.44 -4.94 120.40 128.40 3mlt s VAL 211 Ca 0.61 0.42 0.07 0.00 0.00 0.00 0.00 61.98 63.09 3mlt s VAL 211 Cb -0.27 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 3mlt s VAL 211 CO 0.22 0.19 -0.17 -1.83 0.00 0.00 0.00 175.10 173.51 3mlt s GLU 212 N 1.96 1.18 -0.01 2.72 -1.05 -1.26 -4.18 118.70 118.05 3mlt s GLU 212 Ca 0.12 -1.34 -0.04 0.00 -0.15 0.00 0.00 54.97 53.55 3mlt s GLU 212 Cb -0.16 -1.16 -0.02 0.00 -0.44 0.00 0.00 34.13 32.35 3mlt s GLU 212 CO 0.10 0.23 0.12 -2.30 0.95 0.00 0.00 175.26 174.37 3mlt n PRO 213 N 0.38 0.00 -0.72 -4.83 -0.02 -1.26 -4.52 135.00 124.02 3mlt n PRO 213 Ca -0.14 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.00 3mlt n PRO 213 Cb 0.57 -0.15 -0.07 0.00 -0.02 0.00 0.00 33.50 33.83 3mlt n PRO 213 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3mlt n LYS 214 N 0.21 0.00 0.00 -0.52 5.02 -1.26 -4.98 118.16 116.63 3mlt n LYS 214 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 3mlt n LYS 214 Cb 0.00 -0.86 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 3mlt n LYS 214 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31