#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 3.55 0.16 2.62 1.01 -1.26 -4.10 120.40 122.38 3mlt s VAL 2 Ca 0.00 0.33 -0.06 0.00 0.00 0.00 0.00 61.98 62.25 3mlt s VAL 2 Cb 0.00 -4.42 -0.02 0.00 0.00 0.00 0.00 36.38 31.94 3mlt s VAL 2 CO 0.00 -1.35 0.21 0.00 0.00 0.00 0.00 175.10 173.96 3mlt s GLN 3 N 6.33 1.10 -0.11 2.72 -2.07 -1.14 -5.03 119.66 121.46 3mlt s GLN 3 Ca 0.52 -1.29 0.03 0.00 -1.82 0.00 0.00 55.36 52.79 3mlt s GLN 3 Cb -0.10 0.33 0.01 0.00 -1.09 0.00 0.00 33.01 32.15 3mlt s GLN 3 CO 0.19 -0.38 -0.20 -0.51 -1.32 0.00 0.00 175.29 173.07 3mlt s LEU 4 N -3.01 1.94 -0.30 2.60 1.43 -1.26 -2.36 118.68 117.72 3mlt s LEU 4 Ca 0.21 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.83 3mlt s LEU 4 Cb 0.05 -1.26 0.09 0.00 0.03 0.00 0.00 46.19 45.10 3mlt s LEU 4 CO 0.02 0.09 0.02 -0.69 0.23 0.00 0.00 176.35 176.02 3mlt s VAL 5 N 0.65 1.74 0.80 -1.59 1.01 -0.75 -4.17 120.40 118.10 3mlt s VAL 5 Ca -0.13 -1.79 -0.12 0.00 0.00 0.00 0.00 61.98 59.95 3mlt s VAL 5 Cb -0.16 -2.19 0.07 0.00 0.00 0.00 0.00 36.38 34.10 3mlt s VAL 5 CO 0.03 -0.45 1.12 -1.61 0.00 0.00 0.00 175.10 174.19 3mlt s GLU 6 N 1.21 2.05 0.79 2.72 2.02 -1.26 -2.50 118.70 123.72 3mlt s GLU 6 Ca 0.05 0.40 -0.12 0.00 0.02 0.00 0.00 54.97 55.32 3mlt s GLU 6 Cb -0.19 -1.93 0.07 0.00 0.10 0.00 0.00 34.13 32.18 3mlt s GLU 6 CO -0.12 -1.59 1.17 -1.54 0.02 0.00 0.00 175.26 173.20 3mlt s SER 7 N -4.20 4.64 1.04 -0.19 1.04 -0.64 -4.95 113.70 110.44 3mlt s SER 7 Ca 0.61 0.83 -0.12 0.00 0.48 0.00 0.00 55.95 57.75 3mlt s SER 7 Cb -0.13 -1.36 0.21 0.00 0.10 0.00 0.00 66.02 64.84 3mlt s SER 7 CO 0.52 -1.82 1.07 -0.83 0.98 0.00 0.00 173.24 173.16 3mlt s GLY 8 N -4.55 1.58 0.75 7.32 0.00 -1.26 -4.56 107.32 106.61 3mlt s GLY 8 Ca 0.61 -0.07 -0.11 0.00 0.00 0.00 0.00 44.72 45.15 3mlt s GLY 8 CO 0.49 0.53 1.10 -0.32 0.00 0.00 0.00 173.10 174.90 3mlt s GLY 9 N -2.95 1.78 -0.01 0.20 0.00 -1.26 -4.67 107.32 100.41 3mlt s GLY 9 Ca 0.66 0.33 0.02 0.00 0.00 0.00 0.00 44.72 45.73 3mlt s GLY 9 CO 0.60 0.68 -0.06 -0.54 0.00 0.00 0.00 173.10 173.78 3mlt s GLU 10 N -4.73 0.62 -0.13 2.90 0.41 0.12 -4.94 118.70 112.96 3mlt s GLU 10 Ca 0.62 -0.21 0.01 0.00 -0.41 0.00 0.00 54.97 54.98 3mlt s GLU 10 Cb -0.18 -0.61 0.02 0.00 -1.78 0.00 0.00 34.13 31.58 3mlt s GLU 10 CO 0.53 0.10 -0.16 0.08 -0.49 0.00 0.00 175.26 175.32 3mlt s VAL 11 N 0.08 1.62 0.09 2.63 1.01 -1.26 -0.69 120.40 123.89 3mlt s VAL 11 Ca -0.01 -0.69 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 3mlt s VAL 11 Cb -0.05 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.81 3mlt s VAL 11 CO -0.00 0.47 0.07 -0.54 0.00 0.00 0.00 175.10 175.10 3mlt s LYS 12 N 1.19 0.80 0.08 2.72 -0.14 0.15 -4.97 119.74 119.57 3mlt s LYS 12 Ca -0.01 -1.22 0.04 0.00 -1.36 0.00 0.00 55.97 53.42 3mlt s LYS 12 Cb -0.14 0.26 -0.04 0.00 -1.68 0.00 0.00 37.83 36.24 3mlt s LYS 12 CO -0.06 -0.22 0.01 -0.65 -0.76 0.00 0.00 175.35 173.67 3mlt s GLN 13 N -3.95 2.61 0.57 1.68 -1.52 -1.26 -1.45 119.66 116.35 3mlt s GLN 13 Ca 0.12 -0.80 -0.18 0.00 -1.95 0.00 0.00 55.36 52.56 3mlt s GLN 13 Cb 0.07 -2.58 -0.14 0.00 -0.22 0.00 0.00 33.01 30.14 3mlt s GLN 13 CO -0.06 0.55 -0.15 -2.30 -0.25 0.00 0.00 175.29 173.08 3mlt n PRO 14 N 0.62 0.04 0.00 2.91 -0.02 -1.26 -1.28 135.00 136.01 3mlt n PRO 14 Ca -0.11 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 3mlt n PRO 14 Cb 0.52 -1.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.93 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 2.56 1.99 3.78 -1.23 0.00 -0.63 -4.94 105.19 106.72 3mlt n GLY 15 Ca 0.07 0.00 -0.33 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 0.00 3.07 0.31 1.61 -0.21 -0.40 -4.45 119.66 119.59 3mlt s GLN 16 Ca 0.00 1.36 0.04 0.00 0.02 0.00 0.00 55.36 56.79 3mlt s GLN 16 Cb 0.00 -1.99 -0.02 0.00 1.00 0.00 0.00 33.01 32.00 3mlt s GLN 16 CO 0.00 -1.03 0.45 -1.54 -2.12 0.00 0.00 175.29 171.05 3mlt s SER 17 N -2.51 6.17 -0.29 5.90 1.04 -1.26 -0.09 113.70 122.65 3mlt s SER 17 Ca 0.67 0.08 -0.14 0.00 0.48 0.00 0.00 55.95 57.04 3mlt s SER 17 Cb -0.19 -1.67 0.12 0.00 0.10 0.00 0.00 66.02 64.38 3mlt s SER 17 CO 0.37 -0.28 0.77 -0.22 0.98 0.00 0.00 173.24 174.87 3mlt s LEU 18 N -4.15 -0.89 -0.15 2.42 2.96 -1.07 -4.97 118.68 112.83 3mlt s LEU 18 Ca 0.40 1.31 -0.01 0.00 -0.22 0.00 0.00 54.13 55.61 3mlt s LEU 18 Cb -0.09 2.14 -0.01 0.00 0.50 0.00 0.00 46.19 48.73 3mlt s LEU 18 CO 0.32 -0.19 -0.11 -0.75 -1.32 0.00 0.00 176.35 174.29 3mlt s LYS 19 N 2.15 3.40 0.07 1.98 2.20 -1.26 -0.79 119.74 127.49 3mlt s LYS 19 Ca -0.07 -0.66 0.05 0.00 -0.36 0.00 0.00 55.97 54.93 3mlt s LYS 19 Cb -0.07 -2.72 -0.04 0.00 -1.51 0.00 0.00 37.83 33.49 3mlt s LYS 19 CO -0.18 0.14 -0.05 0.96 -0.36 0.00 0.00 175.35 175.85 3mlt s ILE 20 N 0.55 3.70 0.28 5.43 -4.36 -0.55 -4.97 121.20 121.28 3mlt s ILE 20 Ca -0.07 -1.02 0.10 0.00 -0.26 0.00 0.00 60.65 59.40 3mlt s ILE 20 Cb -0.15 -2.71 -0.05 0.00 1.25 0.00 0.00 42.46 40.80 3mlt s ILE 20 CO 0.03 0.19 -0.06 -0.94 0.24 0.00 0.00 174.94 174.40 3mlt s SER 21 N -2.03 4.20 -0.25 4.36 1.04 -1.26 -2.07 113.70 117.70 3mlt s SER 21 Ca 0.22 -0.81 -0.02 0.00 0.48 0.00 0.00 55.95 55.82 3mlt s SER 21 Cb -0.11 -0.63 0.12 0.00 0.10 0.00 0.00 66.02 65.49 3mlt s SER 21 CO 0.14 -0.02 0.27 0.00 0.98 0.00 0.00 173.24 174.61 3mlt s LYS 23 N 2.35 3.68 -0.04 0.00 2.20 -1.04 -0.31 119.74 126.58 3mlt s LYS 23 Ca 0.09 -0.50 -0.07 0.00 -0.36 0.00 0.00 55.97 55.13 3mlt s LYS 23 Cb -0.15 -3.03 -0.04 0.00 -1.51 0.00 0.00 37.83 33.10 3mlt s LYS 23 CO -0.23 0.13 0.22 -1.54 -0.36 0.00 0.00 175.35 173.58 3mlt s SER 24 N 0.67 6.46 0.16 1.43 1.04 0.36 -1.80 113.70 122.01 3mlt s SER 24 Ca -0.01 0.51 0.02 0.00 0.48 0.00 0.00 55.95 56.95 3mlt s SER 24 Cb -0.14 -2.08 -0.04 0.00 0.10 0.00 0.00 66.02 63.86 3mlt s SER 24 CO 0.02 0.31 -0.01 -0.94 0.98 0.00 0.00 173.24 173.61 3mlt s SER 25 N -1.47 1.13 0.00 7.02 1.04 -0.99 -4.82 113.70 115.61 3mlt s SER 25 Ca 0.23 -1.14 0.00 0.00 0.48 0.00 0.00 55.95 55.51 3mlt s SER 25 Cb -0.13 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.12 3mlt s SER 25 CO 0.12 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.39 3mlt n GLY 26 N -0.19 0.73 3.65 7.32 0.00 -1.26 -2.89 105.19 112.56 3mlt n GLY 26 Ca -0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.78 0.55 -0.87 1.61 -0.85 -1.26 -4.57 117.35 109.19 3mlt s TYR 27 Ca 0.00 -0.99 -0.22 0.00 -0.52 0.00 0.00 57.07 55.34 3mlt s TYR 27 Cb 0.00 0.37 0.08 0.00 0.38 0.00 0.00 41.96 42.79 3mlt s TYR 27 CO 0.00 -1.32 1.21 -0.80 -1.52 0.00 0.00 175.55 173.13 3mlt s ASN 28 N -3.13 6.41 0.35 -0.18 0.01 -1.26 -4.86 114.94 112.28 3mlt s ASN 28 Ca 0.22 -1.37 0.15 0.00 -0.71 0.00 0.00 52.86 51.16 3mlt s ASN 28 Cb -0.03 -2.48 1.07 0.00 0.41 0.00 0.00 41.25 40.22 3mlt s ASN 28 CO 0.15 -1.41 1.69 0.15 -1.51 0.00 0.00 177.10 176.17 3mlt h PHE 29 N 9.49 0.88 -0.08 2.20 3.57 -1.95 -2.13 116.94 128.92 3mlt h PHE 29 Ca -0.00 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.55 3mlt h PHE 29 Cb 1.03 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.53 3mlt h PHE 29 CO 1.15 -0.08 0.06 -0.07 -2.23 0.00 0.00 178.31 177.14 3mlt h LEU 30 N 0.38 0.00 -2.66 0.59 3.38 -1.92 -3.28 115.31 111.80 3mlt h LEU 30 Ca 0.70 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.67 3mlt h LEU 30 Cb 1.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.37 3mlt h LEU 30 CO -0.51 0.00 0.00 0.47 0.09 0.00 0.00 178.44 178.49 3mlt n ASP 31 N -4.39 3.22 -4.06 -0.43 10.43 -0.80 -2.62 116.55 117.91 3mlt n ASP 31 Ca -0.01 -1.95 -0.26 0.00 2.57 0.00 0.00 54.79 55.13 3mlt n ASP 31 Cb 0.17 -0.29 -0.17 0.00 1.84 0.00 0.00 41.12 42.67 3mlt n ASP 31 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 3mlt s SER 32 N -1.05 2.06 0.36 -2.24 0.01 -1.24 -5.06 113.70 106.54 3mlt s SER 32 Ca 0.32 -0.35 -0.27 0.00 1.31 0.00 0.00 55.95 56.96 3mlt s SER 32 Cb 0.17 -0.95 -0.12 0.00 0.21 0.00 0.00 66.02 65.34 3mlt s SER 32 CO 0.23 0.05 1.26 0.79 0.41 0.00 0.00 173.24 175.98 3mlt n TRP 33 N 3.82 2.17 -4.20 2.43 7.02 -1.26 -4.46 117.44 122.96 3mlt n TRP 33 Ca -0.22 0.54 -0.34 0.00 -1.02 0.00 0.00 57.50 56.46 3mlt n TRP 33 Cb 0.52 -2.39 -0.10 0.00 -2.42 0.00 0.00 31.31 26.91 3mlt n TRP 33 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 3mlt s ILE 34 N -1.13 4.41 0.31 -0.99 1.01 0.20 -2.01 121.20 123.01 3mlt s ILE 34 Ca 0.57 -0.18 0.08 0.00 0.00 0.00 0.00 60.65 61.13 3mlt s ILE 34 Cb -0.56 -2.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 3mlt s ILE 34 CO 0.61 0.50 0.14 -0.83 0.00 0.00 0.00 174.94 175.36 3mlt s GLY 35 N 0.16 1.80 -0.01 6.18 0.00 0.09 -0.29 107.32 115.26 3mlt s GLY 35 Ca 0.02 -1.72 0.01 0.00 0.00 0.00 0.00 44.72 43.03 3mlt s GLY 35 CO 0.01 -1.69 -0.04 -0.98 0.00 0.00 0.00 173.10 170.41 3mlt s TRP 36 N -2.36 0.39 -0.08 1.90 0.52 -0.07 -0.19 118.94 119.06 3mlt s TRP 36 Ca 0.36 -0.07 -0.07 0.00 0.02 0.00 0.00 56.10 56.34 3mlt s TRP 36 Cb -0.04 -0.29 0.02 0.00 -1.15 0.00 0.00 33.47 32.01 3mlt s TRP 36 CO 0.23 -0.03 0.20 0.08 0.02 0.00 0.00 176.95 177.45 3mlt s VAL 37 N 0.08 -0.00 0.05 4.03 1.01 0.26 -1.70 120.40 124.13 3mlt s VAL 37 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.01 3mlt s VAL 37 Cb -0.04 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 36.02 3mlt s VAL 37 CO -0.00 0.00 -0.00 -0.60 0.00 0.00 0.00 175.10 174.49 3mlt s ARG 38 N 0.12 2.64 -0.14 2.72 3.00 -0.04 0.26 118.95 127.50 3mlt s ARG 38 Ca -0.00 -0.75 -0.04 0.00 -1.00 0.00 0.00 55.73 53.94 3mlt s ARG 38 Cb -0.02 -2.59 0.06 0.00 0.00 0.00 0.00 34.95 32.41 3mlt s ARG 38 CO 0.00 0.58 0.16 -1.14 0.00 0.00 0.00 175.30 174.90 3mlt s GLN 39 N -1.96 0.09 -0.05 5.12 0.74 -0.05 -1.46 119.66 122.09 3mlt s GLN 39 Ca 0.23 0.29 -0.30 0.00 0.05 0.00 0.00 55.36 55.63 3mlt s GLN 39 Cb -0.12 -0.95 -0.02 0.00 1.10 0.00 0.00 33.01 33.02 3mlt s GLN 39 CO 0.15 -0.51 1.02 0.42 -0.55 0.00 0.00 175.29 175.82 3mlt s ILE 40 N 2.26 4.74 -0.05 -2.34 1.01 -1.26 -1.16 121.20 124.40 3mlt s ILE 40 Ca 0.04 1.99 -0.05 0.00 0.00 0.00 0.00 60.65 62.63 3mlt s ILE 40 Cb -0.14 -4.27 -0.02 0.00 0.01 0.00 0.00 42.46 38.03 3mlt s ILE 40 CO -0.08 0.08 0.18 -2.65 0.00 0.00 0.00 174.94 172.46 3mlt n PRO 41 N 4.47 0.00 -0.93 2.79 -0.02 -1.26 0.18 135.00 140.23 3mlt n PRO 41 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 3mlt n PRO 41 Cb 0.49 -0.15 0.00 0.00 -0.02 0.00 0.00 33.50 33.82 3mlt n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mlt n GLY 42 N 0.52 0.16 3.83 -1.23 0.00 -1.26 -5.01 105.19 102.20 3mlt n GLY 42 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.34 2.30 0.85 1.61 -0.14 0.49 -5.15 119.74 118.37 3mlt s LYS 43 Ca 0.00 -1.87 -0.10 0.00 -1.36 0.00 0.00 55.97 52.64 3mlt s LYS 43 Cb 0.00 -2.09 0.16 0.00 -1.68 0.00 0.00 37.83 34.22 3mlt s LYS 43 CO 0.00 -0.33 1.18 0.20 -0.76 0.00 0.00 175.35 175.64 3mlt s GLY 44 N -4.09 1.76 0.37 -3.33 0.00 -1.26 -4.55 107.32 96.21 3mlt s GLY 44 Ca 0.38 -1.31 -0.26 0.00 0.00 0.00 0.00 44.72 43.53 3mlt s GLY 44 CO 0.22 -0.66 1.10 1.08 0.00 0.00 0.00 173.10 174.85 3mlt s LEU 45 N -5.58 4.26 -0.08 0.66 1.43 -1.26 -4.43 118.68 113.69 3mlt s LEU 45 Ca 0.70 2.21 -0.01 0.00 -1.03 0.00 0.00 54.13 55.99 3mlt s LEU 45 Cb -0.05 -3.98 0.03 0.00 0.03 0.00 0.00 46.19 42.21 3mlt s LEU 45 CO 0.49 -0.47 -0.01 -0.70 0.23 0.00 0.00 176.35 175.89 3mlt s GLU 46 N -2.16 0.78 0.22 1.70 2.12 -0.54 -4.99 118.70 115.84 3mlt s GLU 46 Ca 0.54 0.03 -0.30 0.00 0.36 0.00 0.00 54.97 55.61 3mlt s GLU 46 Cb -0.28 -1.08 -0.08 0.00 0.26 0.00 0.00 34.13 32.95 3mlt s GLU 46 CO 0.35 -0.29 0.94 -0.46 -0.54 0.00 0.00 175.26 175.26 3mlt s TRP 47 N 1.87 3.96 -0.11 5.30 -0.00 -1.26 -0.86 118.94 127.84 3mlt s TRP 47 Ca 0.04 1.89 -0.02 0.00 -0.00 0.00 0.00 56.10 58.01 3mlt s TRP 47 Cb -0.12 -2.98 -0.06 0.00 -0.00 0.00 0.00 33.47 30.30 3mlt s TRP 47 CO -0.06 0.42 -0.12 -0.89 -0.00 0.00 0.00 176.95 176.31 3mlt n ILE 48 N 1.69 0.64 0.00 5.86 5.41 -0.69 -4.64 119.36 127.63 3mlt n ILE 48 Ca -0.02 -0.21 0.00 0.00 1.00 0.00 0.00 62.75 63.53 3mlt n ILE 48 Cb 0.47 -1.24 0.00 0.00 -0.71 0.00 0.00 39.64 38.17 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 2.65 1.72 3.32 7.39 0.00 -1.16 0.01 105.19 119.13 3mlt n GLY 49 Ca -0.21 -0.85 -0.23 0.00 0.00 0.00 0.00 46.02 44.73 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 1.79 0.01 -0.61 -4.36 -1.12 -0.89 121.20 114.02 3mlt s ILE 50 Ca 0.00 -1.79 -0.03 0.00 -0.26 0.00 0.00 60.65 58.57 3mlt s ILE 50 Cb 0.00 -1.75 -0.01 0.00 1.25 0.00 0.00 42.46 41.95 3mlt s ILE 50 CO 0.00 -0.22 0.04 -0.51 0.24 0.00 0.00 174.94 174.48 3mlt s ILE 51 N -1.74 0.09 -0.36 8.37 2.07 0.61 -1.08 121.20 129.17 3mlt s ILE 51 Ca 0.13 -0.78 -0.08 0.00 -1.41 0.00 0.00 60.65 58.50 3mlt s ILE 51 Cb -0.07 -0.31 0.04 0.00 0.13 0.00 0.00 42.46 42.24 3mlt s ILE 51 CO 0.06 -0.43 0.15 -0.47 -1.91 0.00 0.00 174.94 172.34 3mlt s TYR 52 N -1.36 3.26 0.63 3.50 5.04 0.12 0.58 117.35 129.12 3mlt s TYR 52 Ca -0.15 -1.29 0.37 0.00 -2.44 0.00 0.00 57.07 53.56 3mlt s TYR 52 Cb -0.09 -2.38 2.10 0.00 0.35 0.00 0.00 41.96 41.94 3mlt s TYR 52 CO -0.00 -0.71 2.30 -1.35 -1.34 0.00 0.00 175.55 174.45 3mlt h PRO 52 N 8.30 0.00 -0.23 4.97 0.11 -1.78 0.60 132.00 143.96 3mlt h PRO 52 Ca -0.24 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.69 3mlt h PRO 52 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3mlt h PRO 52 CO 0.64 0.00 -0.55 0.22 -0.21 0.00 0.00 178.00 178.09 3mlt h ASP 53 N 0.00 0.89 0.00 -2.05 3.58 -1.81 -3.36 116.42 113.66 3mlt h ASP 53 Ca 0.00 -0.56 0.00 0.00 0.42 0.00 0.00 57.03 56.89 3mlt h ASP 53 Cb 0.02 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 40.82 3mlt h ASP 53 CO -0.00 1.29 0.00 -0.90 -2.88 0.00 0.00 179.24 176.75 3mlt n ASP 54 N -4.07 1.00 -1.79 2.28 3.85 -1.12 -5.01 116.55 111.70 3mlt n ASP 54 Ca -0.06 -1.34 -0.19 0.00 -0.71 0.00 0.00 54.79 52.49 3mlt n ASP 54 Cb 0.63 0.00 -0.05 0.00 -1.35 0.00 0.00 41.12 40.35 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 -0.17 -5.39 -4.75 -1.12 7.64 0.21 -4.98 113.62 105.06 3mlt n SER 55 Ca 0.00 0.24 -0.37 0.00 1.01 0.00 0.00 58.87 59.75 3mlt n SER 55 Cb 0.21 -4.50 0.04 0.00 -1.01 0.00 0.00 64.21 58.95 3mlt n SER 55 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3mlt s ASP 56 N -2.49 5.22 -0.02 6.43 -1.08 -1.23 -4.71 116.67 118.80 3mlt s ASP 56 Ca 0.00 2.55 -0.21 0.00 -0.52 0.00 0.00 52.55 54.37 3mlt s ASP 56 Cb 0.00 -2.62 0.04 0.00 -1.46 0.00 0.00 42.92 38.89 3mlt s ASP 56 CO 0.00 -1.58 0.46 0.00 0.52 0.00 0.00 175.17 174.57 3mlt s ALA 57 N -1.45 -1.17 -0.16 3.66 0.00 -1.26 0.11 121.76 121.49 3mlt s ALA 57 Ca 0.75 0.67 -0.04 0.00 0.00 0.00 0.00 51.96 53.34 3mlt s ALA 57 Cb -0.35 0.10 0.06 0.00 0.00 0.00 0.00 23.12 22.93 3mlt s ALA 57 CO 0.39 -0.33 0.11 -1.01 0.00 0.00 0.00 175.76 174.92 3mlt s HIS 58 N -1.48 0.08 0.21 0.00 3.76 -0.24 -5.00 115.29 112.61 3mlt s HIS 58 Ca -0.11 -0.11 -0.16 0.00 -0.15 0.00 0.00 55.06 54.53 3mlt s HIS 58 Cb -0.03 -0.59 -0.08 0.00 1.11 0.00 0.00 32.58 33.00 3mlt s HIS 58 CO 0.05 -0.48 0.64 0.71 -0.85 0.00 0.00 174.74 174.81 3mlt s TYR 59 N 2.18 3.57 0.29 1.40 1.51 -1.26 -2.81 117.35 122.23 3mlt s TYR 59 Ca 0.03 1.19 -0.30 0.00 -1.01 0.00 0.00 57.07 56.98 3mlt s TYR 59 Cb -0.15 -2.48 -0.12 0.00 -0.11 0.00 0.00 41.96 39.10 3mlt s TYR 59 CO -0.09 0.33 1.47 0.45 -1.11 0.00 0.00 175.55 176.61 3mlt n SER 60 N 0.53 3.29 0.31 2.29 2.88 0.10 -4.82 113.62 118.21 3mlt n SER 60 Ca -0.02 1.16 0.20 0.00 -1.33 0.00 0.00 58.87 58.88 3mlt n SER 60 Cb 0.52 -1.52 1.02 0.00 -0.75 0.00 0.00 64.21 63.48 3mlt n SER 60 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3mlt h PRO 61 N 4.03 0.00 0.00 -1.46 0.13 -1.93 0.35 132.00 133.13 3mlt h PRO 61 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3mlt h PRO 61 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3mlt h PRO 61 CO 0.74 0.01 0.00 0.77 -0.23 0.00 0.00 178.00 179.29 3mlt h SER 62 N 0.00 0.00 0.00 1.44 0.02 -1.92 -3.29 113.55 109.80 3mlt h SER 62 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3mlt h SER 62 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 3mlt h SER 62 CO 0.00 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.18 3mlt n PHE 63 N -2.95 0.00 -2.17 3.45 3.72 0.02 -4.94 117.46 114.60 3mlt n PHE 63 Ca -0.01 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.97 3mlt n PHE 63 Cb 0.20 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.71 3mlt n PHE 63 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 3mlt s GLU 64 N -0.30 3.68 0.00 -1.08 2.12 -0.63 -2.35 118.70 120.15 3mlt s GLU 64 Ca 0.00 1.45 0.00 0.00 0.36 0.00 0.00 54.97 56.78 3mlt s GLU 64 Cb 0.00 -4.05 0.00 0.00 0.26 0.00 0.00 34.13 30.34 3mlt s GLU 64 CO 0.00 -1.43 0.00 0.41 -0.54 0.00 0.00 175.26 173.70 3mlt n GLY 65 N 4.84 2.96 0.00 -1.50 0.00 -1.26 -4.78 105.19 105.45 3mlt n GLY 65 Ca 0.19 -0.80 0.06 0.00 0.00 0.00 0.00 46.02 45.46 3mlt n GLY 65 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3mlt n GLN 66 N 0.00 0.11 -3.60 1.61 0.00 -1.02 -4.84 117.38 109.63 3mlt n GLN 66 Ca 0.00 0.22 -0.10 0.00 -0.00 0.00 0.00 57.00 57.12 3mlt n GLN 66 Cb 0.00 -1.50 -0.03 0.00 0.00 0.00 0.00 30.24 28.71 3mlt n GLN 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3mlt s VAL 67 N -2.72 0.01 -0.16 1.69 0.11 -0.99 -4.87 120.40 113.47 3mlt s VAL 67 Ca 0.09 -0.44 -0.02 0.00 -2.93 0.00 0.00 61.98 58.69 3mlt s VAL 67 Cb 0.08 -1.36 0.05 0.00 -1.53 0.00 0.00 36.38 33.62 3mlt s VAL 67 CO 0.18 -0.05 -0.01 -0.89 -3.33 0.00 0.00 175.10 171.00 3mlt s THR 68 N -3.82 0.73 0.16 5.04 2.01 -0.71 -4.84 115.64 114.23 3mlt s THR 68 Ca 0.05 -0.44 -0.19 0.00 0.31 0.00 0.00 61.69 61.42 3mlt s THR 68 Cb -0.02 -1.03 -0.08 0.00 0.01 0.00 0.00 72.50 71.39 3mlt s THR 68 CO -0.06 0.03 0.66 -0.04 -0.69 0.00 0.00 174.62 174.51 3mlt s MET 69 N 1.79 4.22 0.25 4.92 -1.94 -1.26 -1.31 119.30 125.97 3mlt s MET 69 Ca 0.01 0.79 -0.15 0.00 -1.71 0.00 0.00 55.69 54.62 3mlt s MET 69 Cb -0.15 -3.02 0.01 0.00 2.01 0.00 0.00 34.83 33.67 3mlt s MET 69 CO -0.07 0.49 0.55 -1.54 -0.01 0.00 0.00 175.02 174.44 3mlt s SER 70 N -1.48 -0.15 0.04 3.03 1.04 -1.10 -5.02 113.70 110.06 3mlt s SER 70 Ca 0.38 -0.80 -0.14 0.00 0.48 0.00 0.00 55.95 55.87 3mlt s SER 70 Cb -0.18 0.62 0.02 0.00 0.10 0.00 0.00 66.02 66.59 3mlt s SER 70 CO 0.21 -1.19 0.30 0.68 0.98 0.00 0.00 173.24 174.22 3mlt s VAL 71 N -3.98 0.08 -0.33 5.02 -7.23 -1.26 -1.80 120.40 110.90 3mlt s VAL 71 Ca 0.18 -0.68 0.03 0.00 -1.81 0.00 0.00 61.98 59.71 3mlt s VAL 71 Cb -0.02 -0.92 0.10 0.00 0.56 0.00 0.00 36.38 36.10 3mlt s VAL 71 CO 0.07 -0.37 0.05 -0.62 -0.31 0.00 0.00 175.10 173.92 3mlt s ASP 72 N -2.02 4.67 0.35 4.85 3.68 0.46 -4.98 116.67 123.68 3mlt s ASP 72 Ca -0.06 -2.06 0.08 0.00 2.13 0.00 0.00 52.55 52.65 3mlt s ASP 72 Cb -0.01 -1.55 0.79 0.00 -1.45 0.00 0.00 42.92 40.71 3mlt s ASP 72 CO -0.03 -0.37 1.86 0.11 0.13 0.00 0.00 175.17 176.87 3mlt h LYS 73 N 7.67 0.70 0.00 4.34 1.57 -1.88 -1.18 116.57 127.79 3mlt h LYS 73 Ca -0.06 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.63 3mlt h LYS 73 Cb 1.02 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.17 3mlt h LYS 73 CO 0.51 0.46 -0.24 0.66 -0.57 0.00 0.00 179.45 180.27 3mlt h SER 74 N 0.72 0.00 -0.18 0.86 4.64 -1.94 -2.93 113.55 114.71 3mlt h SER 74 Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 3mlt h SER 74 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3mlt h SER 74 CO -0.22 0.24 0.00 2.30 -0.87 0.00 0.00 176.83 178.28 3mlt n ILE 75 N -3.44 0.76 -3.22 0.95 -5.35 -0.76 -4.99 119.36 103.32 3mlt n ILE 75 Ca -0.00 -0.88 -0.23 0.00 -0.27 0.00 0.00 62.75 61.37 3mlt n ILE 75 Cb 0.43 0.66 0.05 0.00 -1.74 0.00 0.00 39.64 39.03 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 0.23 -6.23 -4.22 7.28 7.64 -0.52 -4.71 113.62 113.11 3mlt n SER 76 Ca 0.07 -0.37 -0.30 0.00 1.01 0.00 0.00 58.87 59.28 3mlt n SER 76 Cb 0.32 -4.98 -0.16 0.00 -1.01 0.00 0.00 64.21 58.37 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 -3.23 1.86 0.35 0.44 2.01 -1.10 -0.49 115.64 115.48 3mlt s THR 77 Ca 0.40 -0.95 0.07 0.00 0.31 0.00 0.00 61.69 61.53 3mlt s THR 77 Cb -0.18 -1.59 -0.02 0.00 0.01 0.00 0.00 72.50 70.72 3mlt s THR 77 CO 0.50 0.52 0.36 0.00 -0.69 0.00 0.00 174.62 175.31 3mlt s ALA 78 N 0.02 4.00 -0.03 7.40 0.00 0.58 -0.40 121.76 133.33 3mlt s ALA 78 Ca -0.07 -1.64 -0.10 0.00 0.00 0.00 0.00 51.96 50.15 3mlt s ALA 78 Cb -0.14 -1.30 0.02 0.00 0.00 0.00 0.00 23.12 21.69 3mlt s ALA 78 CO 0.04 -0.05 0.23 0.71 0.00 0.00 0.00 175.76 176.69 3mlt s TYR 79 N -2.30 -0.12 -0.06 0.00 1.51 -0.75 -1.02 117.35 114.62 3mlt s TYR 79 Ca 0.44 0.23 0.02 0.00 -1.01 0.00 0.00 57.07 56.74 3mlt s TYR 79 Cb -0.07 0.04 0.01 0.00 -0.11 0.00 0.00 41.96 41.84 3mlt s TYR 79 CO 0.28 -0.28 -0.11 -1.17 -1.11 0.00 0.00 175.55 173.17 3mlt s LEU 80 N -0.94 1.59 -0.00 -1.29 2.96 -0.88 -2.70 118.68 117.42 3mlt s LEU 80 Ca -0.10 -0.26 0.05 0.00 -0.22 0.00 0.00 54.13 53.60 3mlt s LEU 80 Cb -0.05 -0.74 -0.01 0.00 0.50 0.00 0.00 46.19 45.88 3mlt s LEU 80 CO 0.02 0.02 -0.17 -1.58 -1.32 0.00 0.00 176.35 173.32 3mlt s GLN 81 N 0.69 1.32 0.00 1.98 2.00 -0.43 -1.48 119.66 123.74 3mlt s GLN 81 Ca -0.14 -0.63 0.00 0.00 -2.00 0.00 0.00 55.36 52.59 3mlt s GLN 81 Cb -0.15 -1.29 0.00 0.00 0.80 0.00 0.00 33.01 32.36 3mlt s GLN 81 CO 0.03 0.35 0.00 0.91 -0.50 0.00 0.00 175.29 176.08 3mlt n TRP 82 N 2.55 0.00 -1.50 1.67 8.01 0.03 -1.73 117.44 126.47 3mlt n TRP 82 Ca -0.15 0.00 -0.30 0.00 -1.31 0.00 0.00 57.50 55.74 3mlt n TRP 82 Cb 0.54 0.00 -0.18 0.00 -2.01 0.00 0.00 31.31 29.66 3mlt n TRP 82 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.69 179.09 3mlt n THR 82 N 0.00 -0.00 -1.74 -0.99 -1.04 -1.26 -2.61 114.28 106.64 3mlt n THR 82 Ca 0.00 -0.30 -0.37 0.00 -2.04 0.00 0.00 64.05 61.33 3mlt n THR 82 Cb 0.00 -0.40 0.06 0.00 -1.82 0.00 0.00 70.33 68.18 3mlt n THR 82 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3mlt s LEU 82 N 4.86 3.65 0.19 -4.42 1.43 0.87 -4.80 118.68 120.45 3mlt s LEU 82 Ca 1.31 2.68 0.00 0.00 -1.03 0.00 0.00 54.13 57.09 3mlt s LEU 82 Cb -0.97 -4.52 -0.04 0.00 0.03 0.00 0.00 46.19 40.69 3mlt s LEU 82 CO 0.50 -1.91 0.08 -1.58 0.23 0.00 0.00 176.35 173.67 3mlt s GLN 83 N -3.25 1.14 0.13 1.70 -0.44 -1.26 -1.60 119.66 116.08 3mlt s GLN 83 Ca 0.80 -1.58 -0.28 0.00 -2.50 0.00 0.00 55.36 51.80 3mlt s GLN 83 Cb -0.39 0.04 -0.05 0.00 -1.64 0.00 0.00 33.01 30.97 3mlt s GLN 83 CO 0.42 -0.28 1.60 0.00 0.50 0.00 0.00 175.29 177.54 3mlt h ALA 84 N 2.66 -0.50 0.00 1.58 0.00 -1.96 -1.79 119.26 119.24 3mlt h ALA 84 Ca -0.36 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3mlt h ALA 84 Cb 1.22 0.65 0.00 0.00 0.00 0.00 0.00 17.79 19.66 3mlt h ALA 84 CO 0.58 -0.86 0.00 -1.13 0.00 0.00 0.00 179.25 177.84 3mlt n SER 85 N -5.43 0.00 -0.01 0.00 3.41 -1.26 -1.63 113.62 108.70 3mlt n SER 85 Ca -0.04 -0.23 0.14 0.00 -0.26 0.00 0.00 58.87 58.48 3mlt n SER 85 Cb 0.34 0.00 0.69 0.00 -0.26 0.00 0.00 64.21 64.98 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 -0.76 0.04 -4.71 4.04 8.00 -0.67 -4.93 116.55 117.54 3mlt n ASP 86 Ca 0.02 0.08 -0.40 0.00 0.71 0.00 0.00 54.79 55.20 3mlt n ASP 86 Cb 0.01 -0.35 0.02 0.00 -0.02 0.00 0.00 41.12 40.78 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 -1.36 2.78 -0.35 -3.53 -1.04 -0.65 -4.92 114.28 105.21 3mlt n THR 87 Ca 0.11 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.62 3mlt n THR 87 Cb 0.28 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.18 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 0.78 -0.73 3.69 3.41 0.00 -0.56 -4.80 105.19 106.98 3mlt n GLY 88 Ca 0.07 -1.64 -0.36 0.00 0.00 0.00 0.00 46.02 44.08 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 -1.57 4.16 -0.18 1.61 2.20 -0.31 -0.73 119.74 124.92 3mlt s LYS 89 Ca 0.00 -0.09 -0.03 0.00 -0.36 0.00 0.00 55.97 55.48 3mlt s LYS 89 Cb 0.00 -3.48 -0.02 0.00 -1.51 0.00 0.00 37.83 32.82 3mlt s LYS 89 CO 0.00 0.14 -0.05 0.71 -0.36 0.00 0.00 175.35 175.79 3mlt s TYR 90 N 0.80 2.96 -0.13 4.03 1.51 0.84 -0.87 117.35 126.50 3mlt s TYR 90 Ca 0.12 -0.63 -0.03 0.00 -1.01 0.00 0.00 57.07 55.52 3mlt s TYR 90 Cb -0.13 -2.01 -0.03 0.00 -0.11 0.00 0.00 41.96 39.68 3mlt s TYR 90 CO 0.03 -0.30 -0.02 -0.06 -1.11 0.00 0.00 175.55 174.10 3mlt s PHE 91 N 0.89 3.08 0.15 2.71 0.40 0.14 -0.49 117.98 124.86 3mlt s PHE 91 Ca -0.01 -0.07 -0.02 0.00 -0.60 0.00 0.00 56.93 56.23 3mlt s PHE 91 Cb -0.15 -1.90 -0.05 0.00 0.51 0.00 0.00 43.02 41.44 3mlt s PHE 91 CO 0.01 0.18 0.35 0.00 0.70 0.00 0.00 175.22 176.45 3mlt s THR 93 N -1.70 0.06 -0.27 0.00 -1.32 0.73 -0.84 115.64 112.30 3mlt s THR 93 Ca 0.39 -0.51 -0.14 0.00 -1.21 0.00 0.00 61.69 60.22 3mlt s THR 93 Cb -0.12 -0.81 -0.04 0.00 -1.51 0.00 0.00 72.50 70.02 3mlt s THR 93 CO 0.27 -0.28 0.31 -0.60 -2.21 0.00 0.00 174.62 172.11 3mlt s ARG 94 N -1.93 4.00 -0.37 7.08 3.52 0.17 -0.73 118.95 130.69 3mlt s ARG 94 Ca -0.09 -0.07 -0.29 0.00 -0.13 0.00 0.00 55.73 55.15 3mlt s ARG 94 Cb -0.03 -3.65 -0.00 0.00 -1.56 0.00 0.00 34.95 29.71 3mlt s ARG 94 CO 0.01 -0.24 1.55 -1.17 -0.81 0.00 0.00 175.30 174.64 3mlt s LEU 95 N 1.95 3.58 -0.02 -0.88 2.96 -0.85 -1.46 118.68 123.95 3mlt s LEU 95 Ca 0.12 1.05 -0.13 0.00 -0.22 0.00 0.00 54.13 54.95 3mlt s LEU 95 Cb -0.16 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 42.94 3mlt s LEU 95 CO 0.10 -1.50 0.35 -0.47 -1.32 0.00 0.00 176.35 173.51 3mlt s TYR 96 N 5.87 3.70 -0.38 5.38 5.04 0.01 -4.15 117.35 132.81 3mlt s TYR 96 Ca 0.68 0.89 -0.21 0.00 -2.44 0.00 0.00 57.07 55.99 3mlt s TYR 96 Cb -0.17 -2.21 0.01 0.00 0.35 0.00 0.00 41.96 39.94 3mlt s TYR 96 CO 0.33 0.66 0.67 -1.17 -1.34 0.00 0.00 175.55 174.69 3mlt s LEU 97 N -1.12 4.27 -0.53 6.97 2.96 -1.26 -2.66 118.68 127.32 3mlt s LEU 97 Ca 0.22 0.09 -0.19 0.00 -0.22 0.00 0.00 54.13 54.03 3mlt s LEU 97 Cb -0.16 -2.82 0.06 0.00 0.50 0.00 0.00 46.19 43.78 3mlt s LEU 97 CO 0.12 -0.66 0.67 -0.36 -1.32 0.00 0.00 176.35 174.79 3mlt s PHE 98 N 2.82 3.02 0.26 5.38 0.40 0.39 -4.99 117.98 125.26 3mlt s PHE 98 Ca 0.25 -0.58 -0.04 0.00 -0.60 0.00 0.00 56.93 55.97 3mlt s PHE 98 Cb -0.14 -3.67 -0.05 0.00 0.51 0.00 0.00 43.02 39.67 3mlt s PHE 98 CO 0.16 -1.11 0.50 -1.83 0.70 0.00 0.00 175.22 173.65 3mlt s GLU 99 N 2.75 3.60 0.00 0.44 -1.05 -1.26 -1.13 118.70 122.05 3mlt s GLU 99 Ca 0.16 -0.09 0.00 0.00 -0.15 0.00 0.00 54.97 54.88 3mlt s GLU 99 Cb -0.20 -2.71 0.00 0.00 -0.44 0.00 0.00 34.13 30.79 3mlt s GLU 99 CO 0.11 0.28 0.00 0.41 0.95 0.00 0.00 175.26 177.01 3mlt n GLY 100 N -0.82 -0.47 0.31 -3.83 0.00 -1.26 -4.94 105.19 94.19 3mlt n GLY 100 Ca -0.03 -0.88 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 3mlt n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mlt h ALA 100 N 0.00 -0.46 -5.35 4.61 0.00 -2.08 -3.49 119.26 112.49 3mlt h ALA 100 Ca 0.00 -0.04 -0.51 0.00 0.00 0.00 0.00 54.91 54.36 3mlt h ALA 100 Cb 0.00 0.46 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 3mlt h ALA 100 CO 0.00 -0.81 -0.29 1.04 0.00 0.00 0.00 179.25 179.19 3mlt n GLN 100 N -5.39 0.86 0.00 0.00 6.02 -1.26 -5.30 117.38 112.31 3mlt n GLN 100 Ca -0.06 -2.97 0.00 0.00 -0.01 0.00 0.00 57.00 53.95 3mlt n GLN 100 Cb 0.30 0.48 0.00 0.00 1.02 0.00 0.00 30.24 32.04 3mlt n GLN 100 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 3mlt n SER 100 N -1.67 0.00 -4.48 1.08 3.41 -0.29 -4.82 113.62 106.86 3mlt n SER 100 Ca -0.07 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.22 3mlt n SER 100 Cb 0.53 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.35 3mlt n SER 100 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3mlt s ASN 100 N 0.00 4.03 0.16 4.04 -0.87 -1.26 -0.46 114.94 120.58 3mlt s ASN 100 Ca 0.00 -0.22 -0.17 0.00 -1.57 0.00 0.00 52.86 50.90 3mlt s ASN 100 Cb 0.00 -0.83 0.03 0.00 -0.02 0.00 0.00 41.25 40.43 3mlt s ASN 100 CO 0.00 0.33 0.46 0.00 -2.57 0.00 0.00 177.10 175.32 3mlt s ALA 100 N -0.78 -0.95 -0.63 0.60 0.00 -1.09 -4.97 121.76 113.94 3mlt s ALA 100 Ca 0.12 -0.11 -0.23 0.00 0.00 0.00 0.00 51.96 51.74 3mlt s ALA 100 Cb -0.11 0.78 0.06 0.00 0.00 0.00 0.00 23.12 23.85 3mlt s ALA 100 CO 0.02 -0.72 0.98 -0.06 0.00 0.00 0.00 175.76 175.98 3mlt s PHE 100 N -3.83 2.68 -0.12 0.00 0.08 -1.26 -0.81 117.98 114.72 3mlt s PHE 100 Ca 0.06 -0.33 -0.01 0.00 0.12 0.00 0.00 56.93 56.77 3mlt s PHE 100 Cb 0.01 -4.24 -0.25 0.00 -0.57 0.00 0.00 43.02 37.97 3mlt s PHE 100 CO -0.08 -1.59 0.37 -0.40 -0.10 0.00 0.00 175.22 173.43 3mlt n ASP 101 N 7.77 1.76 -4.53 1.36 5.75 -0.54 -4.91 116.55 123.21 3mlt n ASP 101 Ca -0.01 0.22 -0.34 0.00 -0.01 0.00 0.00 54.79 54.65 3mlt n ASP 101 Cb 0.46 -0.58 -0.11 0.00 -1.03 0.00 0.00 41.12 39.86 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 -6.73 3.39 -0.06 -2.12 0.20 -1.23 -4.99 118.68 107.14 3mlt s LEU 102 Ca -0.19 -0.08 0.04 0.00 0.69 0.00 0.00 54.13 54.59 3mlt s LEU 102 Cb 0.07 -1.83 0.00 0.00 -0.43 0.00 0.00 46.19 44.00 3mlt s LEU 102 CO 0.77 0.17 -0.18 0.26 -0.29 0.00 0.00 176.35 177.08 3mlt s TRP 103 N 0.37 1.89 1.34 5.38 0.52 -1.26 -0.66 118.94 126.52 3mlt s TRP 103 Ca -0.02 -0.64 -0.20 0.00 0.02 0.00 0.00 56.10 55.26 3mlt s TRP 103 Cb -0.14 -1.29 0.34 0.00 -1.15 0.00 0.00 33.47 31.24 3mlt s TRP 103 CO 0.02 -0.25 0.97 0.20 0.02 0.00 0.00 176.95 177.91 3mlt s GLY 104 N 0.24 1.46 0.00 0.98 0.00 -0.02 -4.66 107.32 105.33 3mlt s GLY 104 Ca -0.10 -0.68 0.19 0.00 0.00 0.00 0.00 44.72 44.13 3mlt s GLY 104 CO 0.04 0.25 1.50 0.61 0.00 0.00 0.00 173.10 175.51 3mlt n GLN 105 N -5.39 1.67 -0.09 2.90 0.00 -1.26 -4.85 117.38 110.36 3mlt n GLN 105 Ca 0.10 -1.01 0.00 0.00 0.00 0.00 0.00 57.00 56.09 3mlt n GLN 105 Cb 0.59 -1.36 0.00 0.00 0.00 0.00 0.00 30.24 29.47 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 1.08 -3.05 3.39 2.61 0.00 -1.26 -4.98 105.19 102.97 3mlt n GLY 106 Ca 0.15 -1.16 -0.35 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.33 3.65 0.01 2.61 2.01 0.36 -4.89 115.64 117.06 3mlt s THR 107 Ca 0.00 -0.41 -0.28 0.00 0.31 0.00 0.00 61.69 61.30 3mlt s THR 107 Cb 0.00 -2.65 -0.04 0.00 0.01 0.00 0.00 72.50 69.83 3mlt s THR 107 CO 0.00 0.43 0.91 -0.32 -0.69 0.00 0.00 174.62 174.96 3mlt s MET 108 N 1.13 4.56 -0.13 4.92 1.75 -1.26 -0.11 119.30 130.15 3mlt s MET 108 Ca 0.02 1.31 0.02 0.00 -1.25 0.00 0.00 55.69 55.79 3mlt s MET 108 Cb -0.15 -3.44 0.01 0.00 2.84 0.00 0.00 34.83 34.10 3mlt s MET 108 CO 0.00 0.04 -0.20 0.42 -0.65 0.00 0.00 175.02 174.64 3mlt s ILE 109 N 0.71 1.89 -0.13 10.11 1.01 0.10 0.16 121.20 135.04 3mlt s ILE 109 Ca 0.48 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 60.26 3mlt s ILE 109 Cb -0.21 -1.69 0.02 0.00 0.01 0.00 0.00 42.46 40.59 3mlt s ILE 109 CO 0.26 0.52 -0.16 -0.22 0.00 0.00 0.00 174.94 175.34 3mlt s LEU 110 N 0.87 1.76 -0.31 2.97 2.96 0.14 -1.50 118.68 125.57 3mlt s LEU 110 Ca -0.07 -0.48 -0.07 0.00 -0.22 0.00 0.00 54.13 53.30 3mlt s LEU 110 Cb -0.15 -1.18 0.02 0.00 0.50 0.00 0.00 46.19 45.38 3mlt s LEU 110 CO -0.02 -0.01 0.09 -0.69 -1.32 0.00 0.00 176.35 174.40 3mlt s VAL 111 N 1.19 3.91 -0.06 1.68 1.01 -1.25 0.32 120.40 127.20 3mlt s VAL 111 Ca -0.01 -0.86 -0.07 0.00 0.00 0.00 0.00 61.98 61.03 3mlt s VAL 111 Cb -0.14 -3.09 0.02 0.00 0.00 0.00 0.00 36.38 33.16 3mlt s VAL 111 CO -0.06 -0.02 0.19 -0.55 0.00 0.00 0.00 175.10 174.66 3mlt s SER 112 N 1.46 -0.16 0.01 3.32 0.15 -0.53 -4.79 113.70 113.16 3mlt s SER 112 Ca 0.01 0.27 -0.23 0.00 0.70 0.00 0.00 55.95 56.70 3mlt s SER 112 Cb -0.18 0.36 -0.17 0.00 -1.71 0.00 0.00 66.02 64.32 3mlt s SER 112 CO 0.03 -0.14 1.31 0.77 1.20 0.00 0.00 173.24 176.41 3mlt h SER 113 N 5.47 0.19 0.00 5.45 4.64 -1.93 -3.38 113.55 123.99 3mlt h SER 113 Ca -0.27 -0.48 0.00 0.00 -0.47 0.00 0.00 61.79 60.57 3mlt h SER 113 Cb 1.20 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3mlt h SER 113 CO 0.39 0.63 0.00 0.61 -0.87 0.00 0.00 176.83 177.59 3mlt n GLY 114 N 0.20 0.00 3.47 -0.77 0.00 -1.26 -5.01 105.19 101.82 3mlt n GLY 114 Ca -0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 2.67 -0.47 2.61 -4.23 -1.26 -5.05 115.64 109.90 3mlt s THR 115 Ca 0.00 -1.76 -0.30 0.00 -1.18 0.00 0.00 61.69 58.45 3mlt s THR 115 Cb 0.00 -2.26 -0.10 0.00 1.34 0.00 0.00 72.50 71.48 3mlt s THR 115 CO 0.00 -0.03 2.36 0.41 -0.54 0.00 0.00 174.62 176.82 3mlt n THR 116 N 0.45 0.09 -4.84 3.99 -1.04 -1.26 -4.70 114.28 106.96 3mlt n THR 116 Ca -0.14 -0.46 -0.33 0.00 -2.04 0.00 0.00 64.05 61.09 3mlt n THR 116 Cb 0.54 -2.07 -0.16 0.00 -1.82 0.00 0.00 70.33 66.82 3mlt n THR 116 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3mlt s LYS 117 N 7.42 3.12 0.82 -2.82 2.20 -0.46 -4.91 119.74 125.12 3mlt s LYS 117 Ca 1.08 -0.82 -0.13 0.00 -0.36 0.00 0.00 55.97 55.74 3mlt s LYS 117 Cb -0.57 -2.46 0.09 0.00 -1.51 0.00 0.00 37.83 33.38 3mlt s LYS 117 CO 0.38 0.09 1.16 0.41 -0.36 0.00 0.00 175.35 177.03 3mlt n GLY 118 N 3.81 -0.14 3.93 5.54 0.00 -1.26 -0.04 105.19 117.03 3mlt n GLY 118 Ca -0.19 -0.52 -0.25 0.00 0.00 0.00 0.00 46.02 45.06 3mlt n GLY 118 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3mlt s PRO 119 N -4.13 3.08 -0.19 1.61 0.04 -1.26 -4.42 135.00 129.72 3mlt s PRO 119 Ca 0.72 -0.22 -0.10 0.00 0.04 0.00 0.00 61.00 61.44 3mlt s PRO 119 Cb -0.28 -2.43 -0.05 0.00 0.04 0.00 0.00 34.50 31.78 3mlt s PRO 119 CO 0.52 -0.41 0.13 -1.12 0.04 0.00 0.00 177.00 176.16 3mlt s SER 120 N -4.23 6.22 -0.24 6.66 0.01 0.15 -4.86 113.70 117.41 3mlt s SER 120 Ca 0.50 0.25 -0.09 0.00 1.31 0.00 0.00 55.95 57.91 3mlt s SER 120 Cb -0.10 -2.09 -0.04 0.00 0.21 0.00 0.00 66.02 64.00 3mlt s SER 120 CO 0.41 0.19 0.13 -0.69 0.41 0.00 0.00 173.24 173.69 3mlt s VAL 121 N 0.28 5.00 -0.07 3.43 1.01 -1.26 -1.46 120.40 127.32 3mlt s VAL 121 Ca 0.08 0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.16 3mlt s VAL 121 Cb -0.11 -3.33 -0.00 0.00 0.00 0.00 0.00 36.38 32.94 3mlt s VAL 121 CO -0.02 0.35 -0.21 -0.36 0.00 0.00 0.00 175.10 174.86 3mlt s PHE 122 N 1.18 2.17 0.34 5.22 0.08 -0.54 -4.98 117.98 121.45 3mlt s PHE 122 Ca 0.06 -0.75 -0.28 0.00 0.12 0.00 0.00 56.93 56.08 3mlt s PHE 122 Cb -0.14 -1.46 -0.10 0.00 -0.57 0.00 0.00 43.02 40.75 3mlt s PHE 122 CO 0.05 -0.28 1.26 -1.25 -0.10 0.00 0.00 175.22 174.90 3mlt s PRO 123 N 0.15 4.32 -1.00 0.24 0.04 -1.26 -0.79 135.00 136.70 3mlt s PRO 123 Ca -0.10 2.10 -0.09 0.00 0.04 0.00 0.00 61.00 62.95 3mlt s PRO 123 Cb -0.15 -3.01 0.25 0.00 0.04 0.00 0.00 34.50 31.64 3mlt s PRO 123 CO 0.05 -0.17 0.97 -0.51 0.04 0.00 0.00 177.00 177.38 3mlt s LEU 124 N -1.89 6.32 -0.16 -3.56 1.43 -0.25 -4.82 118.68 115.75 3mlt s LEU 124 Ca 0.50 -3.37 -0.39 0.00 -1.03 0.00 0.00 54.13 49.84 3mlt s LEU 124 Cb -0.37 -2.16 -0.16 0.00 0.03 0.00 0.00 46.19 43.52 3mlt s LEU 124 CO 0.49 -0.35 1.58 0.00 0.23 0.00 0.00 176.35 178.30 3mlt n ALA 125 N 2.99 -0.64 -0.39 4.21 0.00 -1.26 -2.35 120.51 123.06 3mlt n ALA 125 Ca 0.21 0.44 0.00 0.00 0.00 0.00 0.00 53.44 54.09 3mlt n ALA 125 Cb 0.41 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.72 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 4.24 0.82 -0.07 0.00 -0.01 -1.26 -4.85 135.00 133.88 3mlt n PRO 126 Ca 0.24 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.73 3mlt n PRO 126 Cb 0.14 -0.08 0.00 0.00 -0.01 0.00 0.00 33.50 33.55 3mlt n PRO 126 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3mlt n GLY 134 N 0.24 0.67 3.26 -1.23 0.00 -1.26 -4.47 105.19 102.39 3mlt n GLY 134 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 2.15 1.29 0.17 2.61 -4.23 -1.26 -2.53 115.64 113.84 3mlt s THR 135 Ca 0.00 -1.94 0.09 0.00 -1.18 0.00 0.00 61.69 58.65 3mlt s THR 135 Cb 0.00 -1.74 -0.04 0.00 1.34 0.00 0.00 72.50 72.06 3mlt s THR 135 CO 0.00 -0.60 -0.18 0.00 -0.54 0.00 0.00 174.62 173.29 3mlt s ALA 136 N -2.82 2.04 -0.19 3.99 0.00 0.07 -4.76 121.76 120.08 3mlt s ALA 136 Ca 0.14 -1.51 -0.04 0.00 0.00 0.00 0.00 51.96 50.55 3mlt s ALA 136 Cb -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 23.12 22.91 3mlt s ALA 136 CO 0.02 0.23 -0.04 0.00 0.00 0.00 0.00 175.76 175.98 3mlt s ALA 137 N -2.10 2.89 0.37 0.00 0.00 -1.26 -0.47 121.76 121.19 3mlt s ALA 137 Ca 0.17 -1.03 0.05 0.00 0.00 0.00 0.00 51.96 51.15 3mlt s ALA 137 Cb -0.05 -1.65 -0.06 0.00 0.00 0.00 0.00 23.12 21.35 3mlt s ALA 137 CO 0.07 -0.17 0.04 -0.48 0.00 0.00 0.00 175.76 175.22 3mlt s LEU 138 N 1.03 2.41 0.00 0.00 0.05 0.44 -4.06 118.68 118.56 3mlt s LEU 138 Ca 0.01 -1.41 -0.04 0.00 0.05 0.00 0.00 54.13 52.74 3mlt s LEU 138 Cb -0.15 -0.56 0.01 0.00 -2.05 0.00 0.00 46.19 43.45 3mlt s LEU 138 CO 0.01 -0.59 0.19 0.61 -0.55 0.00 0.00 176.35 176.02 3mlt n GLY 139 N -0.83 0.88 3.01 -3.48 0.00 -0.99 0.20 105.19 103.98 3mlt n GLY 139 Ca -0.04 -0.91 -0.19 0.00 0.00 0.00 0.00 46.02 44.88 3mlt n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mlt s LEU 141 N -0.06 4.71 -0.38 0.00 2.96 0.03 -0.70 118.68 125.23 3mlt s LEU 141 Ca 0.01 -0.55 -0.11 0.00 -0.22 0.00 0.00 54.13 53.26 3mlt s LEU 141 Cb -0.05 -2.22 0.03 0.00 0.50 0.00 0.00 46.19 44.45 3mlt s LEU 141 CO -0.00 -0.36 0.22 -0.69 -1.32 0.00 0.00 176.35 174.20 3mlt s VAL 142 N 1.82 4.65 -0.08 1.68 1.01 0.17 -1.47 120.40 128.18 3mlt s VAL 142 Ca 0.08 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.22 3mlt s VAL 142 Cb -0.18 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.59 3mlt s VAL 142 CO 0.11 -0.27 -0.20 -0.75 0.00 0.00 0.00 175.10 173.99 3mlt s LYS 143 N 1.56 2.47 -0.66 2.72 2.47 -0.54 -0.66 119.74 127.11 3mlt s LYS 143 Ca 0.02 -0.70 -0.03 0.00 -1.56 0.00 0.00 55.97 53.70 3mlt s LYS 143 Cb -0.19 -1.93 -0.04 0.00 -1.46 0.00 0.00 37.83 34.21 3mlt s LYS 143 CO 0.07 0.15 0.58 -0.25 0.16 0.00 0.00 175.35 176.06 3mlt n ASP 144 N 3.56 -5.31 -4.36 1.43 8.00 -0.08 0.35 116.55 120.14 3mlt n ASP 144 Ca -0.20 -0.38 -0.19 0.00 0.71 0.00 0.00 54.79 54.73 3mlt n ASP 144 Cb 0.52 -3.72 -0.10 0.00 -0.02 0.00 0.00 41.12 37.80 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 -3.20 1.75 -0.28 1.24 -0.85 -0.97 -4.24 117.35 110.80 3mlt s TYR 145 Ca 0.24 -0.60 -0.23 0.00 -0.52 0.00 0.00 57.07 55.96 3mlt s TYR 145 Cb -0.03 -0.85 0.09 0.00 0.38 0.00 0.00 41.96 41.55 3mlt s TYR 145 CO 0.50 0.34 0.82 0.12 -1.52 0.00 0.00 175.55 175.81 3mlt s PHE 146 N -2.99 -0.73 0.00 -3.49 5.36 0.94 -1.36 117.98 115.71 3mlt s PHE 146 Ca 0.24 1.69 0.00 0.00 -0.96 0.00 0.00 56.93 57.90 3mlt s PHE 146 Cb 0.00 0.36 0.00 0.00 -0.34 0.00 0.00 43.02 43.04 3mlt s PHE 146 CO 0.08 -0.35 0.00 -0.35 -1.46 0.00 0.00 175.22 173.13 3mlt n PRO 147 N 2.86 0.95 -2.28 10.12 -0.04 -1.26 -1.35 135.00 144.00 3mlt n PRO 147 Ca -0.15 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.99 3mlt n PRO 147 Cb 0.56 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 34.00 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 -0.42 3.74 0.32 0.54 2.02 -1.26 -4.77 118.70 118.87 3mlt s GLU 148 Ca 0.00 1.04 0.09 0.00 0.02 0.00 0.00 54.97 56.12 3mlt s GLU 148 Cb 0.00 -2.10 -0.04 0.00 0.10 0.00 0.00 34.13 32.08 3mlt s GLU 148 CO 0.00 -0.45 0.07 -1.25 0.02 0.00 0.00 175.26 173.65 3mlt s PRO 149 N -4.08 2.29 0.22 0.39 0.04 -1.26 -4.95 135.00 127.66 3mlt s PRO 149 Ca 0.60 -1.55 0.08 0.00 0.04 0.00 0.00 61.00 60.17 3mlt s PRO 149 Cb -0.12 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.26 3mlt s PRO 149 CO 0.33 0.19 0.04 0.14 0.04 0.00 0.00 177.00 177.75 3mlt s VAL 150 N -2.41 3.81 0.17 -0.36 -7.23 -1.26 -4.20 120.40 108.91 3mlt s VAL 150 Ca 0.35 -1.58 0.10 0.00 -1.81 0.00 0.00 61.98 59.04 3mlt s VAL 150 Cb -0.03 -2.99 -0.04 0.00 0.56 0.00 0.00 36.38 33.88 3mlt s VAL 150 CO 0.21 -0.25 -0.21 0.42 -0.31 0.00 0.00 175.10 174.96 3mlt s THR 151 N -2.03 2.02 0.05 5.32 -4.23 0.14 -4.97 115.64 111.94 3mlt s THR 151 Ca 0.30 -1.95 0.06 0.00 -1.18 0.00 0.00 61.69 58.92 3mlt s THR 151 Cb -0.08 -1.94 -0.03 0.00 1.34 0.00 0.00 72.50 71.80 3mlt s THR 151 CO 0.21 -0.23 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.20 3mlt s VAL 152 N -1.87 1.30 0.31 2.29 1.01 -1.26 -0.45 120.40 121.74 3mlt s VAL 152 Ca 0.17 -1.16 0.06 0.00 0.00 0.00 0.00 61.98 61.05 3mlt s VAL 152 Cb -0.07 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 3mlt s VAL 152 CO 0.08 0.00 0.24 -0.94 0.00 0.00 0.00 175.10 174.48 3mlt s SER 153 N -1.34 1.51 -0.11 3.32 1.04 0.66 -4.93 113.70 113.85 3mlt s SER 153 Ca 0.03 -1.69 0.02 0.00 0.48 0.00 0.00 55.95 54.78 3mlt s SER 153 Cb -0.09 0.52 0.01 0.00 0.10 0.00 0.00 66.02 66.57 3mlt s SER 153 CO 0.02 -1.02 -0.16 0.26 0.98 0.00 0.00 173.24 173.32 3mlt s TRP 154 N -3.55 2.01 -1.32 5.02 0.52 -1.26 0.20 118.94 120.56 3mlt s TRP 154 Ca 0.39 -0.94 -0.06 0.00 0.02 0.00 0.00 56.10 55.52 3mlt s TRP 154 Cb 0.03 -1.44 -0.00 0.00 -1.15 0.00 0.00 33.47 30.91 3mlt s TRP 154 CO 0.24 -0.47 0.55 0.09 0.02 0.00 0.00 176.95 177.38 3mlt n ASN 155 N 4.14 -1.74 -2.17 2.95 3.02 0.31 -0.35 115.26 121.42 3mlt n ASN 155 Ca -0.19 -0.99 -0.12 0.00 -0.03 0.00 0.00 54.58 53.25 3mlt n ASN 155 Cb 0.51 -3.24 -0.02 0.00 -0.61 0.00 0.00 39.78 36.43 3mlt n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3mlt n SER 156 N -2.90 -3.68 0.00 6.41 7.64 -1.26 -0.68 113.62 119.14 3mlt n SER 156 Ca -0.25 0.23 0.00 0.00 1.01 0.00 0.00 58.87 59.85 3mlt n SER 156 Cb 0.66 -3.21 0.00 0.00 -1.01 0.00 0.00 64.21 60.65 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 -0.65 0.73 0.13 0.23 0.00 0.53 -4.92 105.19 101.24 3mlt n GLY 157 Ca -0.14 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.48 4.61 0.00 -0.74 -3.42 119.26 116.88 3mlt h ALA 158 Ca 0.00 -0.49 -0.68 0.00 0.00 0.00 0.00 54.91 53.74 3mlt h ALA 158 Cb 0.00 -0.09 -0.34 0.00 0.00 0.00 0.00 17.79 17.36 3mlt h ALA 158 CO 0.00 0.67 -0.68 -1.17 0.00 0.00 0.00 179.25 178.07 3mlt s LEU 159 N -6.49 4.20 0.00 0.00 2.96 -1.07 -4.92 118.68 113.36 3mlt s LEU 159 Ca 0.04 -1.51 0.00 0.00 -0.22 0.00 0.00 54.13 52.44 3mlt s LEU 159 Cb 0.08 -1.71 0.00 0.00 0.50 0.00 0.00 46.19 45.05 3mlt s LEU 159 CO 0.75 -0.32 0.00 0.35 -1.32 0.00 0.00 176.35 175.81 3mlt n THR 160 N 4.57 0.00 -2.63 3.68 -2.24 -1.26 -4.17 114.28 112.23 3mlt n THR 160 Ca -0.10 -0.47 -0.43 0.00 -2.27 0.00 0.00 64.05 60.78 3mlt n THR 160 Cb 0.43 0.99 -0.02 0.00 -2.10 0.00 0.00 70.33 69.62 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 -1.00 6.81 0.00 3.42 0.01 -1.26 -3.27 113.70 118.41 3mlt s SER 161 Ca 0.00 0.82 0.00 0.00 1.31 0.00 0.00 55.95 58.08 3mlt s SER 161 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 3mlt s SER 161 CO 0.00 -1.03 0.00 0.61 0.41 0.00 0.00 173.24 173.23 3mlt n GLY 162 N 4.26 0.38 3.71 3.44 0.00 -1.26 -4.62 105.19 111.09 3mlt n GLY 162 Ca 0.12 -1.02 -0.38 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.00 5.17 -0.11 1.61 1.01 -1.20 -1.73 120.40 123.15 3mlt s VAL 163 Ca 0.00 0.94 -0.00 0.00 0.00 0.00 0.00 61.98 62.92 3mlt s VAL 163 Cb 0.00 -3.82 0.02 0.00 0.00 0.00 0.00 36.38 32.58 3mlt s VAL 163 CO 0.00 0.29 -0.08 -2.28 0.00 0.00 0.00 175.10 173.03 3mlt s HIS 164 N 0.88 1.45 -0.28 5.22 2.46 -0.90 -5.02 115.29 119.10 3mlt s HIS 164 Ca 0.25 -0.70 -0.11 0.00 0.47 0.00 0.00 55.06 54.97 3mlt s HIS 164 Cb -0.15 -1.20 -0.05 0.00 -0.13 0.00 0.00 32.58 31.05 3mlt s HIS 164 CO 0.10 -0.48 0.20 0.99 -2.47 0.00 0.00 174.74 173.08 3mlt s THR 165 N 1.59 5.30 0.62 0.89 2.01 -1.26 -2.24 115.64 122.55 3mlt s THR 165 Ca 0.03 0.18 -0.15 0.00 0.31 0.00 0.00 61.69 62.06 3mlt s THR 165 Cb -0.13 -3.54 -0.02 0.00 0.01 0.00 0.00 72.50 68.81 3mlt s THR 165 CO -0.07 0.24 1.06 -0.36 -0.69 0.00 0.00 174.62 174.80 3mlt s PHE 166 N 1.77 2.99 0.80 4.92 0.40 -0.75 -5.02 117.98 123.10 3mlt s PHE 166 Ca 0.07 1.50 -0.13 0.00 -0.60 0.00 0.00 56.93 57.77 3mlt s PHE 166 Cb -0.16 -2.99 0.08 0.00 0.51 0.00 0.00 43.02 40.46 3mlt s PHE 166 CO 0.11 -1.17 1.19 -1.25 0.70 0.00 0.00 175.22 174.80 3mlt s PRO 167 N -4.27 1.72 0.27 0.24 0.04 -1.26 -4.61 135.00 127.13 3mlt s PRO 167 Ca 0.63 1.67 -0.29 0.00 0.04 0.00 0.00 61.00 63.05 3mlt s PRO 167 Cb -0.16 -1.79 -0.09 0.00 0.04 0.00 0.00 34.50 32.50 3mlt s PRO 167 CO 0.41 -2.13 0.97 0.00 0.04 0.00 0.00 177.00 176.29 3mlt s ALA 168 N -2.25 3.31 0.13 8.56 0.00 -1.26 -4.73 121.76 125.52 3mlt s ALA 168 Ca 0.71 0.65 -0.21 0.00 0.00 0.00 0.00 51.96 53.11 3mlt s ALA 168 Cb -0.27 -3.23 -0.07 0.00 0.00 0.00 0.00 23.12 19.55 3mlt s ALA 168 CO 0.51 0.13 0.66 0.14 0.00 0.00 0.00 175.76 177.19 3mlt s VAL 169 N -1.28 4.60 -0.15 0.00 -7.23 0.18 -4.91 120.40 111.62 3mlt s VAL 169 Ca 0.44 1.36 -0.08 0.00 -1.81 0.00 0.00 61.98 61.89 3mlt s VAL 169 Cb -0.25 -3.96 -0.04 0.00 0.56 0.00 0.00 36.38 32.68 3mlt s VAL 169 CO 0.32 0.48 0.13 -0.22 -0.31 0.00 0.00 175.10 175.50 3mlt s LEU 170 N -1.29 4.29 0.32 1.32 2.96 -1.26 -0.37 118.68 124.66 3mlt s LEU 170 Ca 0.33 0.37 0.08 0.00 -0.22 0.00 0.00 54.13 54.70 3mlt s LEU 170 Cb -0.20 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.39 3mlt s LEU 170 CO 0.22 0.33 0.18 -1.10 -1.32 0.00 0.00 176.35 174.66 3mlt s GLN 171 N -0.53 2.54 0.49 1.98 -0.21 -0.02 -4.99 119.66 118.92 3mlt s GLN 171 Ca 0.12 -1.40 0.32 0.00 0.02 0.00 0.00 55.36 54.42 3mlt s GLN 171 Cb -0.12 -2.31 1.42 0.00 1.00 0.00 0.00 33.01 33.00 3mlt s GLN 171 CO 0.02 0.16 1.75 0.77 -2.12 0.00 0.00 175.29 175.87 3mlt h SER 172 N 1.48 0.16 0.55 5.90 0.02 -1.99 0.31 113.55 119.97 3mlt h SER 172 Ca -0.45 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.51 3mlt h SER 172 Cb 1.25 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 3mlt h SER 172 CO 0.61 0.00 -0.18 0.77 -1.14 0.00 0.00 176.83 176.90 3mlt h SER 173 N 0.13 0.00 0.00 3.07 4.64 -2.03 -3.46 113.55 115.89 3mlt h SER 173 Ca 0.64 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.96 3mlt h SER 173 Cb 2.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.30 3mlt h SER 173 CO -0.15 0.18 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 3mlt n GLY 174 N -0.39 0.72 3.74 -0.77 0.00 0.11 -4.73 105.19 103.87 3mlt n GLY 174 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 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 3.58 0.34 0.99 1.02 -1.26 -4.69 118.68 118.66 3mlt s LEU 175 Ca 0.00 -0.30 0.02 0.00 0.02 0.00 0.00 54.13 53.87 3mlt s LEU 175 Cb 0.00 -2.17 -0.02 0.00 0.02 0.00 0.00 46.19 44.01 3mlt s LEU 175 CO 0.00 0.05 0.52 -0.31 0.02 0.00 0.00 176.35 176.63 3mlt s TYR 176 N -1.88 3.38 -0.06 0.29 1.51 -0.47 -0.84 117.35 119.28 3mlt s TYR 176 Ca 0.30 0.16 -0.14 0.00 -1.01 0.00 0.00 57.07 56.38 3mlt s TYR 176 Cb -0.09 -1.92 0.03 0.00 -0.11 0.00 0.00 41.96 39.87 3mlt s TYR 176 CO 0.22 0.08 0.32 -1.12 -1.11 0.00 0.00 175.55 173.93 3mlt s SER 177 N -4.08 -0.25 0.27 2.29 0.01 0.50 -0.90 113.70 111.54 3mlt s SER 177 Ca 0.41 0.32 -0.10 0.00 1.31 0.00 0.00 55.95 57.89 3mlt s SER 177 Cb -0.10 0.46 -0.00 0.00 0.21 0.00 0.00 66.02 66.59 3mlt s SER 177 CO 0.34 -0.32 0.47 -1.48 0.41 0.00 0.00 173.24 172.67 3mlt s LEU 178 N -0.74 0.51 0.14 2.44 0.05 0.16 0.52 118.68 121.76 3mlt s LEU 178 Ca -0.08 -1.10 0.04 0.00 0.05 0.00 0.00 54.13 53.04 3mlt s LEU 178 Cb -0.04 1.67 -0.04 0.00 -2.05 0.00 0.00 46.19 45.73 3mlt s LEU 178 CO 0.03 -1.19 -0.10 -0.44 -0.55 0.00 0.00 176.35 174.09 3mlt s SER 179 N -3.08 1.76 -0.02 1.48 0.01 -1.26 0.43 113.70 113.01 3mlt s SER 179 Ca 0.25 -0.97 0.04 0.00 1.31 0.00 0.00 55.95 56.59 3mlt s SER 179 Cb -0.00 -0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.21 3mlt s SER 179 CO 0.12 -0.31 -0.15 -0.55 0.41 0.00 0.00 173.24 172.76 3mlt s SER 180 N -3.00 1.84 0.13 2.44 0.15 0.12 -1.80 113.70 113.57 3mlt s SER 180 Ca 0.14 -0.29 0.08 0.00 0.70 0.00 0.00 55.95 56.58 3mlt s SER 180 Cb 0.01 -0.35 -0.04 0.00 -1.71 0.00 0.00 66.02 63.93 3mlt s SER 180 CO 0.01 0.16 -0.19 0.54 1.20 0.00 0.00 173.24 174.96 3mlt s VAL 181 N -0.14 1.69 -0.05 4.45 0.11 -0.95 -0.14 120.40 125.37 3mlt s VAL 181 Ca 0.01 -1.72 0.02 0.00 -2.93 0.00 0.00 61.98 57.36 3mlt s VAL 181 Cb -0.08 -1.66 0.02 0.00 -1.53 0.00 0.00 36.38 33.12 3mlt s VAL 181 CO 0.00 -0.23 -0.09 -0.69 -3.33 0.00 0.00 175.10 170.77 3mlt s VAL 182 N -1.69 0.83 -0.24 2.04 1.01 0.54 -2.12 120.40 120.78 3mlt s VAL 182 Ca 0.11 -0.31 -0.22 0.00 0.00 0.00 0.00 61.98 61.55 3mlt s VAL 182 Cb -0.07 -0.78 -0.01 0.00 0.00 0.00 0.00 36.38 35.51 3mlt s VAL 182 CO 0.05 0.28 0.72 -0.89 0.00 0.00 0.00 175.10 175.26 3mlt s THR 183 N 0.68 4.92 0.01 3.92 2.01 -0.71 -0.42 115.64 126.06 3mlt s THR 183 Ca -0.12 1.34 0.00 0.00 0.31 0.00 0.00 61.69 63.22 3mlt s THR 183 Cb -0.14 -4.02 -0.01 0.00 0.01 0.00 0.00 72.50 68.34 3mlt s THR 183 CO 0.02 -0.01 -0.02 0.68 -0.69 0.00 0.00 174.62 174.60 3mlt s VAL 184 N 2.59 0.10 -0.44 3.82 -7.23 0.37 -4.69 120.40 114.92 3mlt s VAL 184 Ca 0.30 -0.34 -0.41 0.00 -1.81 0.00 0.00 61.98 59.72 3mlt s VAL 184 Cb -0.15 -0.14 -0.18 0.00 0.56 0.00 0.00 36.38 36.47 3mlt s VAL 184 CO 0.08 -0.16 1.45 -2.65 -0.31 0.00 0.00 175.10 173.51 3mlt n PRO 185 N 2.55 0.00 0.19 4.82 -0.02 -1.26 -0.75 135.00 140.53 3mlt n PRO 185 Ca -0.16 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.37 3mlt n PRO 185 Cb 0.58 -1.33 0.37 0.00 -0.02 0.00 0.00 33.50 33.11 3mlt n PRO 185 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3mlt h SER 186 N 4.65 0.00 0.07 2.55 4.64 -1.79 -2.33 113.55 121.34 3mlt h SER 186 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3mlt h SER 186 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3mlt h SER 186 CO 0.87 0.36 0.00 -1.54 -0.87 0.00 0.00 176.83 175.66 3mlt n SER 187 N -3.64 0.00 -0.24 4.97 3.41 -1.26 -3.26 113.62 113.60 3mlt n SER 187 Ca -0.01 -0.40 0.06 0.00 -0.26 0.00 0.00 58.87 58.26 3mlt n SER 187 Cb 0.47 -0.06 -0.01 0.00 -0.26 0.00 0.00 64.21 64.35 3mlt n SER 187 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3mlt n SER 188 N -1.06 1.24 0.31 4.04 3.41 -0.88 -4.65 113.62 116.04 3mlt n SER 188 Ca 0.12 -1.12 0.19 0.00 -0.26 0.00 0.00 58.87 57.80 3mlt n SER 188 Cb 0.07 0.55 1.00 0.00 -0.26 0.00 0.00 64.21 65.58 3mlt n SER 188 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3mlt h LEU 189 N 1.16 0.00 0.00 1.04 4.07 -1.68 0.23 115.31 120.13 3mlt h LEU 189 Ca 0.00 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 57.75 3mlt h LEU 189 Cb 0.40 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.10 3mlt h LEU 189 CO 0.00 0.00 -1.76 0.61 -1.08 0.00 0.00 178.44 176.21 3mlt n GLY 190 N -1.20 -1.10 0.13 0.83 0.00 -1.26 -4.41 105.19 98.19 3mlt n GLY 190 Ca -0.02 -0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.80 1.69 -3.65 2.61 -1.04 -0.94 -4.99 114.28 105.16 3mlt n THR 191 Ca -0.16 -0.65 -0.33 0.00 -2.04 0.00 0.00 64.05 60.88 3mlt n THR 191 Cb 0.91 -1.59 -0.05 0.00 -1.82 0.00 0.00 70.33 67.79 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 -2.55 3.65 -0.14 -2.82 2.00 0.78 -5.08 119.66 115.50 3mlt s GLN 192 Ca -0.25 -0.01 0.00 0.00 -2.00 0.00 0.00 55.36 53.11 3mlt s GLN 192 Cb 0.07 -2.92 -0.01 0.00 0.80 0.00 0.00 33.01 30.96 3mlt s GLN 192 CO 0.73 0.52 -0.15 -0.08 -0.50 0.00 0.00 175.29 175.81 3mlt s THR 193 N -1.54 2.81 -0.24 -0.34 -1.32 -1.26 -4.77 115.64 108.98 3mlt s THR 193 Ca 0.37 -0.73 -0.05 0.00 -1.21 0.00 0.00 61.69 60.06 3mlt s THR 193 Cb -0.13 -2.18 -0.01 0.00 -1.51 0.00 0.00 72.50 68.68 3mlt s THR 193 CO 0.22 0.52 0.01 -0.31 -2.21 0.00 0.00 174.62 172.84 3mlt s TYR 194 N 0.56 3.03 -0.13 9.09 2.02 -1.26 -4.95 117.35 125.71 3mlt s TYR 194 Ca -0.09 -0.83 0.02 0.00 -0.37 0.00 0.00 57.07 55.80 3mlt s TYR 194 Cb -0.16 -2.16 0.00 0.00 -0.40 0.00 0.00 41.96 39.24 3mlt s TYR 194 CO 0.04 -0.51 -0.20 0.42 -1.57 0.00 0.00 175.55 173.73 3mlt s ILE 195 N 1.51 2.32 -0.09 2.71 1.01 -1.26 -1.13 121.20 126.27 3mlt s ILE 195 Ca 0.05 -0.91 -0.16 0.00 0.00 0.00 0.00 60.65 59.63 3mlt s ILE 195 Cb -0.15 -1.93 -0.05 0.00 0.01 0.00 0.00 42.46 40.34 3mlt s ILE 195 CO -0.01 0.54 0.42 0.00 0.00 0.00 0.00 174.94 175.90 3mlt s ASN 197 N 0.15 5.55 -0.24 0.00 -0.87 0.13 -1.13 114.94 118.54 3mlt s ASN 197 Ca 0.24 -1.10 -0.07 0.00 -1.57 0.00 0.00 52.86 50.36 3mlt s ASN 197 Cb -0.15 -1.95 -0.03 0.00 -0.02 0.00 0.00 41.25 39.10 3mlt s ASN 197 CO 0.10 -0.37 0.05 -0.69 -2.57 0.00 0.00 177.10 173.61 3mlt s VAL 198 N 1.48 4.18 -0.26 1.60 1.01 0.75 -0.24 120.40 128.91 3mlt s VAL 198 Ca 0.00 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.77 3mlt s VAL 198 Cb -0.20 -2.94 0.05 0.00 0.00 0.00 0.00 36.38 33.29 3mlt s VAL 198 CO 0.05 0.37 -0.07 0.21 0.00 0.00 0.00 175.10 175.65 3mlt s ASN 199 N 1.45 4.46 -0.50 3.32 2.47 0.40 -0.93 114.94 125.62 3mlt s ASN 199 Ca 0.05 -1.21 -0.03 0.00 0.42 0.00 0.00 52.86 52.09 3mlt s ASN 199 Cb -0.15 -1.61 0.13 0.00 -1.45 0.00 0.00 41.25 38.17 3mlt s ASN 199 CO 0.03 -0.19 0.31 -2.28 -3.72 0.00 0.00 177.10 171.25 3mlt s HIS 200 N 1.20 3.51 0.30 0.43 5.65 -0.53 -0.69 115.29 125.16 3mlt s HIS 200 Ca -0.05 -2.53 0.09 0.00 0.25 0.00 0.00 55.06 52.81 3mlt s HIS 200 Cb -0.19 -3.22 0.47 0.00 -1.18 0.00 0.00 32.58 28.46 3mlt s HIS 200 CO -0.04 -0.92 1.69 0.87 -0.65 0.00 0.00 174.74 175.69 3mlt h LYS 201 N 7.62 0.13 -0.88 2.88 1.57 -1.82 -1.78 116.57 124.29 3mlt h LYS 201 Ca -0.08 -0.07 0.23 0.00 -1.87 0.00 0.00 60.65 58.85 3mlt h LYS 201 Cb 1.01 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.19 3mlt h LYS 201 CO 0.71 0.58 0.33 -1.35 -0.57 0.00 0.00 179.45 179.14 3mlt h PRO 202 N 0.11 0.30 -0.53 3.15 0.11 -1.92 -2.43 132.00 130.78 3mlt h PRO 202 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3mlt h PRO 202 Cb 0.88 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3mlt h PRO 202 CO 0.07 0.20 0.00 -1.13 -0.21 0.00 0.00 178.00 176.93 3mlt n SER 203 N -5.12 3.49 -3.98 -2.05 3.41 -1.16 -4.98 113.62 103.24 3mlt n SER 203 Ca 0.22 -1.98 -0.34 0.00 -0.26 0.00 0.00 58.87 56.51 3mlt n SER 203 Cb 0.67 -0.35 0.00 0.00 -0.26 0.00 0.00 64.21 64.27 3mlt n SER 203 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3mlt n ASN 204 N 1.25 -2.56 -4.50 4.04 4.05 -0.92 -4.90 115.26 111.72 3mlt n ASN 204 Ca 0.19 -0.97 -0.35 0.00 0.45 0.00 0.00 54.58 53.90 3mlt n ASN 204 Cb 0.55 -1.17 -0.12 0.00 1.23 0.00 0.00 39.78 40.27 3mlt n ASN 204 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 3mlt s THR 205 N -3.93 4.27 -0.05 -0.44 2.01 -0.69 -5.01 115.64 111.80 3mlt s THR 205 Ca 0.32 -0.20 0.06 0.00 0.31 0.00 0.00 61.69 62.18 3mlt s THR 205 Cb -0.18 -2.95 -0.01 0.00 0.01 0.00 0.00 72.50 69.37 3mlt s THR 205 CO 0.73 0.41 -0.24 -0.54 -0.69 0.00 0.00 174.62 174.29 3mlt s LYS 206 N 0.96 2.51 -0.02 4.92 1.02 -1.26 -1.45 119.74 126.42 3mlt s LYS 206 Ca 0.03 -0.88 0.02 0.00 0.02 0.00 0.00 55.97 55.15 3mlt s LYS 206 Cb -0.14 -2.18 0.01 0.00 -0.52 0.00 0.00 37.83 35.00 3mlt s LYS 206 CO 0.02 0.42 -0.06 0.08 -0.92 0.00 0.00 175.35 174.90 3mlt s VAL 207 N -0.26 0.53 -0.36 3.17 1.01 -0.11 -5.00 120.40 119.39 3mlt s VAL 207 Ca -0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 61.98 61.75 3mlt s VAL 207 Cb -0.13 -0.50 0.08 0.00 0.00 0.00 0.00 36.38 35.83 3mlt s VAL 207 CO 0.03 0.19 0.10 -1.81 0.00 0.00 0.00 175.10 173.60 3mlt s ASP 208 N 0.35 5.04 -0.26 3.32 1.01 -1.26 -0.18 116.67 124.70 3mlt s ASP 208 Ca -0.04 -1.74 -0.10 0.00 0.71 0.00 0.00 52.55 51.38 3mlt s ASP 208 Cb -0.08 -1.75 -0.05 0.00 1.01 0.00 0.00 42.92 42.04 3mlt s ASP 208 CO -0.00 -0.41 0.16 -0.75 0.21 0.00 0.00 175.17 174.38 3mlt s LYS 209 N 1.15 3.92 0.04 8.23 2.47 -0.28 -4.91 119.74 130.36 3mlt s LYS 209 Ca 0.03 -0.34 -0.31 0.00 -1.56 0.00 0.00 55.97 53.79 3mlt s LYS 209 Cb -0.21 -3.56 -0.07 0.00 -1.46 0.00 0.00 37.83 32.54 3mlt s LYS 209 CO -0.03 -0.12 1.46 0.21 0.16 0.00 0.00 175.35 177.03 3mlt s LYS 210 N 1.55 4.27 -0.21 4.03 2.36 -1.26 -1.75 119.74 128.72 3mlt s LYS 210 Ca 0.07 2.08 -0.05 0.00 -2.55 0.00 0.00 55.97 55.52 3mlt s LYS 210 Cb -0.15 -3.51 -0.02 0.00 -1.05 0.00 0.00 37.83 33.10 3mlt s LYS 210 CO 0.08 -0.59 -0.01 0.08 1.55 0.00 0.00 175.35 176.47 3mlt s VAL 211 N 2.18 3.84 0.03 4.02 1.01 -0.28 -4.85 120.40 126.35 3mlt s VAL 211 Ca 0.66 -0.35 0.05 0.00 0.00 0.00 0.00 61.98 62.35 3mlt s VAL 211 Cb -0.35 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 3mlt s VAL 211 CO 0.29 0.42 -0.15 -1.61 0.00 0.00 0.00 175.10 174.05 3mlt s GLU 212 N 1.15 1.00 0.19 2.72 2.02 -1.26 -4.34 118.70 120.18 3mlt s GLU 212 Ca 0.03 -0.73 -0.32 0.00 0.02 0.00 0.00 54.97 53.97 3mlt s GLU 212 Cb -0.14 -1.01 -0.16 0.00 0.10 0.00 0.00 34.13 32.92 3mlt s GLU 212 CO 0.01 0.26 1.08 -0.35 0.02 0.00 0.00 175.26 176.28 3mlt n PRO 213 N 2.03 1.09 -1.34 0.39 -0.04 -1.26 -4.56 135.00 131.32 3mlt n PRO 213 Ca -0.17 0.39 -0.38 0.00 -0.04 0.00 0.00 63.50 63.30 3mlt n PRO 213 Cb 0.55 -1.82 0.04 0.00 -0.04 0.00 0.00 33.50 32.22 3mlt n PRO 213 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3mlt n LYS 214 N 1.49 0.31 0.00 0.54 5.02 -1.26 -5.01 118.16 119.25 3mlt n LYS 214 Ca 0.14 0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.56 3mlt n LYS 214 Cb 0.26 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 3mlt n LYS 214 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75