#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6s n PRO 2 N 0.00 1.31 0.02 3.23 -0.02 -1.26 -4.89 135.00 133.39 3h6s n PRO 2 Ca 0.00 0.49 0.13 0.00 -2.02 0.00 0.00 63.50 62.11 3h6s n PRO 2 Cb 0.00 -2.46 0.46 0.00 -0.02 0.00 0.00 33.50 31.48 3h6s n PRO 2 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3h6s n LYS 3 N -1.29 0.06 -3.80 -0.52 5.02 -1.26 -4.86 118.16 111.52 3h6s n LYS 3 Ca 0.13 0.04 -0.12 0.00 -2.02 0.00 0.00 58.31 56.33 3h6s n LYS 3 Cb 0.46 -1.56 -0.10 0.00 -0.02 0.00 0.00 35.03 33.81 3h6s n LYS 3 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3h6s s SER 4 N -3.33 -0.17 -0.10 4.39 0.01 -1.26 -4.41 113.70 108.83 3h6s s SER 4 Ca 0.12 0.22 -0.11 0.00 1.31 0.00 0.00 55.95 57.49 3h6s s SER 4 Cb 0.17 0.39 0.03 0.00 0.21 0.00 0.00 66.02 66.82 3h6s s SER 4 CO 0.60 -0.26 0.30 -0.69 0.41 0.00 0.00 173.24 173.61 3h6s s VAL 5 N -0.64 0.01 -0.37 3.43 1.01 -0.13 -4.94 120.40 118.77 3h6s s VAL 5 Ca -0.07 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 61.87 3h6s s VAL 5 Cb -0.04 -0.46 0.17 0.00 0.00 0.00 0.00 36.38 36.05 3h6s s VAL 5 CO 0.02 -0.05 0.49 -0.62 0.00 0.00 0.00 175.10 174.94 3h6s s ASP 6 N -0.08 -0.15 0.03 3.32 3.68 -1.26 -1.72 116.67 120.50 3h6s s ASP 6 Ca -0.02 -1.02 0.02 0.00 2.13 0.00 0.00 52.55 53.66 3h6s s ASP 6 Cb -0.03 1.26 0.12 0.00 -1.45 0.00 0.00 42.92 42.83 3h6s s ASP 6 CO 0.01 -0.24 1.04 0.79 0.13 0.00 0.00 175.17 176.90 3h6s n TRP 7 N 4.51 0.07 -0.12 -5.34 7.02 0.13 -1.34 117.44 122.38 3h6s n TRP 7 Ca 0.09 0.04 -0.11 0.00 -1.02 0.00 0.00 57.50 56.50 3h6s n TRP 7 Cb 0.51 -0.54 -0.02 0.00 -2.42 0.00 0.00 31.31 28.84 3h6s n TRP 7 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3h6s h ARG 8 N 0.00 0.64 -0.03 -0.99 3.08 -1.95 -2.19 114.38 112.94 3h6s h ARG 8 Ca 0.00 -0.22 0.01 0.00 0.07 0.00 0.00 59.98 59.84 3h6s h ARG 8 Cb 0.06 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 3h6s h ARG 8 CO 0.00 0.77 0.14 0.87 -1.07 0.00 0.00 179.97 180.68 3h6s h LYS 9 N 0.44 0.00 -0.48 0.04 1.57 -1.61 -2.01 116.57 114.51 3h6s h LYS 9 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3h6s h LYS 9 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 3h6s h LYS 9 CO 0.02 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.53 3h6s n LYS 10 N -3.15 3.35 -2.10 3.15 4.76 -0.86 -4.94 118.16 118.36 3h6s n LYS 10 Ca -0.02 -2.67 -0.12 0.00 -2.87 0.00 0.00 58.31 52.62 3h6s n LYS 10 Cb 0.21 -1.73 -0.01 0.00 -1.84 0.00 0.00 35.03 31.66 3h6s n LYS 10 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3h6s n GLY 11 N 0.58 0.08 0.26 0.72 0.00 -0.76 -4.91 105.19 101.17 3h6s n GLY 11 Ca 0.21 -0.38 0.13 0.00 0.00 0.00 0.00 46.02 45.98 3h6s n GLY 11 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3h6s n TYR 12 N -3.80 0.00 -4.29 1.61 4.02 -0.96 -4.80 117.16 108.95 3h6s n TYR 12 Ca -0.14 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.48 3h6s n TYR 12 Cb 0.58 -0.11 -0.17 0.00 -0.02 0.00 0.00 39.34 39.62 3h6s n TYR 12 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 3h6s s VAL 13 N -2.52 1.17 1.05 -0.72 1.01 -1.26 -3.88 120.40 115.26 3h6s s VAL 13 Ca 0.23 -0.44 -0.16 0.00 0.00 0.00 0.00 61.98 61.61 3h6s s VAL 13 Cb 0.19 -1.12 0.22 0.00 0.00 0.00 0.00 36.38 35.68 3h6s s VAL 13 CO 0.53 0.38 1.18 0.42 0.00 0.00 0.00 175.10 177.61 3h6s s THR 14 N 1.14 1.83 0.72 3.92 -4.23 -1.26 -5.00 115.64 112.76 3h6s s THR 14 Ca -0.05 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.32 3h6s s THR 14 Cb -0.14 -2.70 0.03 0.00 1.34 0.00 0.00 72.50 71.03 3h6s s THR 14 CO -0.02 0.00 1.13 -2.84 -0.54 0.00 0.00 174.62 172.35 3h6s s PRO 15 N -5.50 2.37 0.22 3.99 0.02 -1.26 -4.93 135.00 129.92 3h6s s PRO 15 Ca 0.70 1.43 -0.31 0.00 0.02 0.00 0.00 61.00 62.83 3h6s s PRO 15 Cb -0.10 -1.89 -0.11 0.00 0.02 0.00 0.00 34.50 32.42 3h6s s PRO 15 CO 0.55 -1.59 1.62 0.08 -0.33 0.00 0.00 177.00 177.32 3h6s s VAL 16 N -2.43 2.27 0.44 3.83 1.01 -1.26 -5.02 120.40 119.25 3h6s s VAL 16 Ca 0.67 0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.92 3h6s s VAL 16 Cb -0.22 -3.13 0.06 0.00 0.00 0.00 0.00 36.38 33.09 3h6s s VAL 16 CO 0.47 0.02 0.52 0.29 0.00 0.00 0.00 175.10 176.40 3h6s n LYS 17 N 3.38 0.75 -3.69 2.72 5.02 -1.26 -4.53 118.16 120.56 3h6s n LYS 17 Ca 0.13 -2.48 -0.25 0.00 -2.02 0.00 0.00 58.31 53.69 3h6s n LYS 17 Cb 0.37 -0.03 -0.17 0.00 -0.02 0.00 0.00 35.03 35.18 3h6s n LYS 17 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3h6s s ASN 18 N -3.67 2.10 0.47 4.39 3.84 -1.26 -0.22 114.94 120.59 3h6s s ASN 18 Ca 0.39 -0.42 0.26 0.00 0.21 0.00 0.00 52.86 53.30 3h6s s ASN 18 Cb -0.03 -0.36 1.02 0.00 -0.55 0.00 0.00 41.25 41.33 3h6s s ASN 18 CO 0.25 -0.28 1.87 0.06 -2.79 0.00 0.00 177.10 176.20 3h6s h GLN 19 N 8.35 0.00 0.00 0.43 3.07 -1.45 -3.48 115.11 122.04 3h6s h GLN 19 Ca -0.16 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.58 3h6s h GLN 19 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.69 3h6s h GLN 19 CO 0.27 0.18 0.00 1.63 0.09 0.00 0.00 178.83 181.00 3h6s n LYS 20 N -3.34 0.00 -0.10 0.06 4.76 -1.26 -3.22 118.16 115.06 3h6s n LYS 20 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3h6s n LYS 20 Cb 0.40 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.59 3h6s n LYS 20 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 3h6s n GLN 21 N 14.00 0.93 -3.97 1.97 6.02 -1.26 -4.76 117.38 130.31 3h6s n GLN 21 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.80 3h6s n GLN 21 Cb 0.00 -1.04 -0.16 0.00 1.02 0.00 0.00 30.24 30.06 3h6s n GLN 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3h6s n GLY 23 N 4.31 3.06 3.35 0.00 0.00 -0.16 -4.89 105.19 110.86 3h6s n GLY 23 Ca -0.22 -1.06 -0.41 0.00 0.00 0.00 0.00 46.02 44.32 3h6s n GLY 23 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h6s s SER 24 N 2.41 5.82 0.00 1.61 1.04 -1.26 -3.73 113.70 119.59 3h6s s SER 24 Ca 0.55 -1.23 0.00 0.00 0.48 0.00 0.00 55.95 55.75 3h6s s SER 24 Cb 0.21 -2.05 0.00 0.00 0.10 0.00 0.00 66.02 64.28 3h6s s SER 24 CO -0.02 -0.50 0.00 -2.67 0.98 0.00 0.00 173.24 171.03 3h6s n TRP 26 N 5.03 0.00 -0.19 5.02 4.27 -1.26 -2.42 117.44 127.89 3h6s n TRP 26 Ca -0.11 0.00 -0.10 0.00 -3.89 0.00 0.00 57.50 53.40 3h6s n TRP 26 Cb 0.45 0.00 0.01 0.00 -1.36 0.00 0.00 31.31 30.41 3h6s n TRP 26 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3h6s h ALA 27 N 0.00 0.74 -0.42 -1.67 0.00 -1.93 -1.82 119.26 114.16 3h6s h ALA 27 Ca 0.00 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.45 3h6s h ALA 27 Cb 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3h6s h ALA 27 CO 0.00 0.62 -0.26 0.74 0.00 0.00 0.00 179.25 180.35 3h6s h PHE 28 N 0.88 1.03 -0.05 0.00 -1.00 -1.84 -0.65 116.94 115.32 3h6s h PHE 28 Ca 0.15 -0.26 -0.00 0.00 2.81 0.00 0.00 57.97 60.67 3h6s h PHE 28 Cb 0.62 -0.24 -0.00 0.00 3.61 0.00 0.00 35.95 39.94 3h6s h PHE 28 CO 0.04 1.05 0.03 1.03 -1.61 0.00 0.00 178.31 178.85 3h6s h SER 29 N 0.77 0.06 -0.53 2.17 0.87 -1.78 -1.31 113.55 113.80 3h6s h SER 29 Ca 0.09 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 3h6s h SER 29 Cb 0.82 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.74 3h6s h SER 29 CO 0.07 0.12 0.35 0.00 -0.53 0.00 0.00 176.83 176.85 3h6s h ALA 30 N 0.94 0.67 -0.52 6.23 0.00 -1.15 -2.14 119.26 123.29 3h6s h ALA 30 Ca 0.02 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 3h6s h ALA 30 Cb 0.08 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3h6s h ALA 30 CO -0.00 0.12 -0.08 1.79 0.00 0.00 0.00 179.25 181.07 3h6s h THR 31 N 0.72 1.26 -0.33 0.00 1.35 -1.10 0.06 112.91 114.87 3h6s h THR 31 Ca 0.19 -1.21 0.04 0.00 -0.55 0.00 0.00 66.41 64.88 3h6s h THR 31 Cb -0.08 0.95 -0.04 0.00 -1.73 0.00 0.00 68.15 67.25 3h6s h THR 31 CO -0.04 0.43 0.12 1.23 -0.25 0.00 0.00 175.52 177.01 3h6s h GLY 32 N 0.97 0.42 1.10 5.82 0.00 -1.04 0.45 103.07 110.79 3h6s h GLY 32 Ca 0.14 -0.07 -0.07 0.00 0.00 0.00 0.00 47.33 47.33 3h6s h GLY 32 CO 0.04 0.04 0.16 0.00 0.00 0.00 0.00 176.54 176.77 3h6s h ALA 33 N 1.21 0.97 -0.04 3.60 0.00 -1.12 -1.95 119.26 121.93 3h6s h ALA 33 Ca 0.15 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.64 3h6s h ALA 33 Cb 0.11 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3h6s h ALA 33 CO -0.15 0.66 -0.72 1.25 0.00 0.00 0.00 179.25 180.29 3h6s h LEU 34 N 1.05 0.26 -0.90 0.00 5.85 -0.28 -2.41 115.31 118.88 3h6s h LEU 34 Ca 0.22 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.69 3h6s h LEU 34 Cb 0.38 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 3h6s h LEU 34 CO 0.00 0.90 0.01 -0.33 -0.34 0.00 0.00 178.44 178.68 3h6s h GLU 35 N 0.15 0.82 -0.33 1.25 5.08 0.01 0.33 114.58 121.88 3h6s h GLU 35 Ca -0.02 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.07 3h6s h GLU 35 Cb 1.28 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 3h6s h GLU 35 CO 0.11 0.82 0.01 0.78 -1.00 0.00 0.00 179.01 179.73 3h6s h GLY 36 N 0.98 0.63 1.49 -3.84 0.00 -1.20 -2.49 103.07 98.64 3h6s h GLY 36 Ca 0.15 -0.46 -0.23 0.00 0.00 0.00 0.00 47.33 46.80 3h6s h GLY 36 CO 0.02 0.42 -0.92 1.46 0.00 0.00 0.00 176.54 177.52 3h6s h GLN 37 N 0.39 0.47 -0.65 4.80 1.08 -0.77 -1.81 115.11 118.61 3h6s h GLN 37 Ca 0.10 -0.48 0.01 0.00 -1.45 0.00 0.00 58.65 56.82 3h6s h GLN 37 Cb 0.43 0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.96 3h6s h GLN 37 CO 0.02 1.13 0.43 0.52 -0.95 0.00 0.00 178.83 179.97 3h6s h MET 38 N 0.27 0.86 -0.09 1.46 2.86 -0.46 -2.10 114.93 117.73 3h6s h MET 38 Ca -0.08 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.44 3h6s h MET 38 Cb 1.55 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 33.02 3h6s h MET 38 CO 0.16 0.57 -0.22 0.35 1.06 0.00 0.00 176.91 178.83 3h6s h PHE 39 N 0.89 0.40 -0.78 -0.22 3.57 -1.28 0.03 116.94 119.55 3h6s h PHE 39 Ca 0.24 -0.15 0.11 0.00 3.53 0.00 0.00 57.97 61.70 3h6s h PHE 39 Cb -0.10 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.51 3h6s h PHE 39 CO 0.00 0.83 0.51 -0.09 -2.23 0.00 0.00 178.31 177.33 3h6s h ARG 40 N -0.14 0.63 0.10 1.11 2.43 -1.08 0.51 114.38 117.94 3h6s h ARG 40 Ca -0.00 -0.04 -0.29 0.00 -0.81 0.00 0.00 59.98 58.84 3h6s h ARG 40 Cb 0.82 -0.14 0.02 0.00 -0.42 0.00 0.00 29.97 30.25 3h6s h ARG 40 CO 0.05 0.42 -1.21 -0.22 -1.51 0.00 0.00 179.97 177.50 3h6s h LYS 41 N 0.65 0.57 0.00 0.20 3.64 -1.22 -3.40 116.57 117.01 3h6s h LYS 41 Ca 0.37 -0.75 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 3h6s h LYS 41 Cb 0.55 0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 3h6s h LYS 41 CO -0.14 1.33 -0.18 0.25 -2.27 0.00 0.00 179.45 178.44 3h6s n THR 42 N -3.76 0.00 0.00 1.00 -2.24 -0.02 -4.99 114.28 104.28 3h6s n THR 42 Ca -0.12 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 3h6s n THR 42 Cb 0.97 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 70.13 3h6s n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h6s n GLY 43 N 1.20 2.96 3.68 3.38 0.00 0.18 -4.99 105.19 111.59 3h6s n GLY 43 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3h6s n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h6s s LYS 44 N -0.02 4.10 -0.35 1.61 1.02 -1.26 -5.02 119.74 119.82 3h6s s LYS 44 Ca 0.00 -0.25 -0.20 0.00 0.02 0.00 0.00 55.97 55.54 3h6s s LYS 44 Cb 0.00 -3.51 0.00 0.00 -0.52 0.00 0.00 37.83 33.80 3h6s s LYS 44 CO 0.00 0.11 0.62 -1.17 -0.92 0.00 0.00 175.35 173.99 3h6s s LEU 45 N 0.91 4.26 -0.08 3.17 2.96 -1.26 -4.01 118.68 124.63 3h6s s LEU 45 Ca 0.08 0.14 0.01 0.00 -0.22 0.00 0.00 54.13 54.14 3h6s s LEU 45 Cb -0.13 -2.76 0.02 0.00 0.50 0.00 0.00 46.19 43.82 3h6s s LEU 45 CO 0.03 -0.57 -0.07 -0.69 -1.32 0.00 0.00 176.35 173.73 3h6s s VAL 46 N 2.66 0.87 0.11 1.68 1.01 -1.26 -5.12 120.40 120.35 3h6s s VAL 46 Ca 0.24 -0.25 -0.31 0.00 0.00 0.00 0.00 61.98 61.65 3h6s s VAL 46 Cb -0.15 -0.88 -0.09 0.00 0.00 0.00 0.00 36.38 35.27 3h6s s VAL 46 CO 0.14 0.32 1.64 -0.55 0.00 0.00 0.00 175.10 176.66 3h6s s SER 47 N 1.29 6.58 0.35 3.32 0.15 -1.26 -4.86 113.70 119.26 3h6s s SER 47 Ca -0.04 2.56 0.02 0.00 0.70 0.00 0.00 55.95 59.19 3h6s s SER 47 Cb -0.14 -2.57 -0.02 0.00 -1.71 0.00 0.00 66.02 61.58 3h6s s SER 47 CO -0.03 -0.88 0.53 -0.76 1.20 0.00 0.00 173.24 173.30 3h6s s LEU 48 N 2.14 3.99 -0.42 3.45 1.43 -1.26 -0.34 118.68 127.67 3h6s s LEU 48 Ca 0.73 0.27 -0.19 0.00 -1.03 0.00 0.00 54.13 53.91 3h6s s LEU 48 Cb -0.42 -3.13 0.02 0.00 0.03 0.00 0.00 46.19 42.69 3h6s s LEU 48 CO 0.32 -0.35 0.53 -0.55 0.23 0.00 0.00 176.35 176.53 3h6s s SER 49 N -4.08 6.26 0.31 2.29 0.15 -0.37 -3.90 113.70 114.37 3h6s s SER 49 Ca 0.41 -0.45 0.12 0.00 0.70 0.00 0.00 55.95 56.72 3h6s s SER 49 Cb -0.10 -2.27 0.50 0.00 -1.71 0.00 0.00 66.02 62.45 3h6s s SER 49 CO 0.34 -0.65 1.69 -0.33 1.20 0.00 0.00 173.24 175.50 3h6s h GLU 50 N 8.76 0.00 -0.70 5.44 3.07 -1.88 -2.76 114.58 126.51 3h6s h GLU 50 Ca -0.26 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.59 3h6s h GLU 50 Cb 1.11 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.98 3h6s h GLU 50 CO 0.83 0.52 0.39 0.37 -1.40 0.00 0.00 179.01 179.72 3h6s h GLN 51 N 0.00 0.96 -0.43 2.33 5.75 -1.86 0.21 115.11 122.08 3h6s h GLN 51 Ca -0.01 -0.10 -0.01 0.00 -0.15 0.00 0.00 58.65 58.39 3h6s h GLN 51 Cb 0.93 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 29.26 3h6s h GLN 51 CO 0.07 0.70 0.23 -0.97 -2.65 0.00 0.00 178.83 176.21 3h6s h ASN 52 N 0.97 0.54 -0.62 -0.69 -0.00 -1.74 0.17 115.58 114.22 3h6s h ASN 52 Ca 0.25 -0.10 0.03 0.00 -0.00 0.00 0.00 56.30 56.48 3h6s h ASN 52 Cb 0.01 -0.14 -0.04 0.00 -0.00 0.00 0.00 38.32 38.15 3h6s h ASN 52 CO -0.04 0.48 0.38 -0.07 -0.00 0.00 0.00 177.43 178.18 3h6s h LEU 53 N 0.56 0.61 0.01 0.34 3.38 -1.12 -1.22 115.31 117.87 3h6s h LEU 53 Ca 0.15 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.86 3h6s h LEU 53 Cb 0.06 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 40.70 3h6s h LEU 53 CO -0.02 0.43 -1.13 -0.37 0.09 0.00 0.00 178.44 177.43 3h6s h VAL 54 N 0.74 1.39 0.00 1.22 -1.51 0.24 -2.76 116.25 115.57 3h6s h VAL 54 Ca 0.25 -2.64 -0.08 0.00 -1.23 0.00 0.00 66.70 63.00 3h6s h VAL 54 Cb 0.03 2.67 -0.01 0.00 -2.13 0.00 0.00 31.29 31.85 3h6s h VAL 54 CO -0.11 0.79 -0.39 0.44 -1.23 0.00 0.00 177.57 177.08 3h6s h ASP 55 N 0.19 0.00 0.00 4.19 3.32 -0.59 -3.37 116.42 120.17 3h6s h ASP 55 Ca -0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.92 3h6s h ASP 55 Cb 1.81 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.36 3h6s h ASP 55 CO 0.20 0.39 -0.20 0.00 -1.72 0.00 0.00 179.24 177.91 3h6s n SER 57 N -1.10 4.67 0.04 0.00 3.41 -1.04 -4.16 113.62 115.43 3h6s n SER 57 Ca 0.00 -2.64 0.03 0.00 -0.26 0.00 0.00 58.87 56.00 3h6s n SER 57 Cb 0.03 -0.61 0.41 0.00 -0.26 0.00 0.00 64.21 63.78 3h6s n SER 57 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3h6s h ARG 58 N 3.38 0.45 -0.32 4.33 3.08 -1.85 -1.31 114.38 122.14 3h6s h ARG 58 Ca 0.00 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 3h6s h ARG 58 Cb 1.58 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 31.52 3h6s h ARG 58 CO 0.34 0.37 0.11 -1.35 -1.07 0.00 0.00 179.97 178.37 3h6s h PRO 59 N 0.46 0.45 0.00 0.04 0.11 -1.86 -0.64 132.00 130.55 3h6s h PRO 59 Ca 0.12 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.17 3h6s h PRO 59 Cb 0.08 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.10 3h6s h PRO 59 CO -0.01 0.39 0.00 1.04 -0.21 0.00 0.00 178.00 179.21 3h6s n GLN 60 N -4.39 0.96 -0.47 1.05 3.00 -0.53 -4.85 117.38 112.15 3h6s n GLN 60 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 3h6s n GLN 60 Cb 0.15 -1.13 0.00 0.00 0.00 0.00 0.00 30.24 29.26 3h6s n GLN 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3h6s n GLY 61 N 0.58 0.72 3.95 1.08 0.00 -0.25 -4.86 105.19 106.42 3h6s n GLY 61 Ca 0.06 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.40 3h6s n GLY 61 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3h6s s ASN 62 N -2.40 6.32 -0.18 1.61 0.01 -0.97 -4.78 114.94 114.55 3h6s s ASN 62 Ca 0.00 0.24 0.16 0.00 -0.71 0.00 0.00 52.86 52.54 3h6s s ASN 62 Cb 0.00 -1.94 0.44 0.00 0.41 0.00 0.00 41.25 40.17 3h6s s ASN 62 CO 0.00 -0.12 1.19 1.67 -1.51 0.00 0.00 177.10 178.33 3h6s n GLN 63 N -1.33 1.66 0.00 -0.60 -0.06 0.40 -3.91 117.38 113.54 3h6s n GLN 63 Ca -0.07 -3.20 0.00 0.00 -2.00 0.00 0.00 57.00 51.73 3h6s n GLN 63 Cb 0.56 -1.36 0.00 0.00 -4.06 0.00 0.00 30.24 25.38 3h6s n GLN 63 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3h6s n GLY 64 N -0.55 3.03 0.33 1.69 0.00 -1.20 -1.44 105.19 107.05 3h6s n GLY 64 Ca 0.20 -0.29 0.21 0.00 0.00 0.00 0.00 46.02 46.13 3h6s n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6s n ASN 66 N -2.99 0.59 0.00 0.00 5.03 -0.52 -0.98 115.26 116.39 3h6s n ASN 66 Ca -0.03 -1.20 0.00 0.00 0.87 0.00 0.00 54.58 54.23 3h6s n ASN 66 Cb 0.13 -0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.89 3h6s n ASN 66 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h6s n GLY 67 N 1.07 2.76 0.00 7.41 0.00 -0.47 -4.90 105.19 111.06 3h6s n GLY 67 Ca 0.22 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 44.20 3h6s n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6s n GLY 68 N -1.24 -1.33 3.06 -0.02 0.00 -1.26 -0.45 105.19 103.94 3h6s n GLY 68 Ca 0.00 -1.00 -0.20 0.00 0.00 0.00 0.00 46.02 44.82 3h6s n GLY 68 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h6s s PHE 69 N -2.97 0.98 0.18 1.61 0.40 -1.26 -4.81 117.98 112.11 3h6s s PHE 69 Ca 0.00 -0.19 -0.13 0.00 -0.60 0.00 0.00 56.93 56.01 3h6s s PHE 69 Cb 0.00 -0.63 0.08 0.00 0.51 0.00 0.00 43.02 42.98 3h6s s PHE 69 CO 0.00 -0.02 1.81 0.52 0.70 0.00 0.00 175.22 178.24 3h6s h MET 70 N 5.85 0.81 -0.72 0.44 2.86 -1.98 -1.39 114.93 120.80 3h6s h MET 70 Ca -0.32 -0.08 0.10 0.00 -2.06 0.00 0.00 59.70 57.34 3h6s h MET 70 Cb 1.17 -0.17 -0.07 0.00 0.06 0.00 0.00 31.60 32.59 3h6s h MET 70 CO 0.49 0.59 0.36 0.00 1.06 0.00 0.00 176.91 179.41 3h6s h ALA 71 N 1.17 1.00 -0.36 6.32 0.00 -1.96 0.74 119.26 126.19 3h6s h ALA 71 Ca 0.21 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 3h6s h ALA 71 Cb -0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3h6s h ALA 71 CO -0.04 -0.05 -0.06 0.00 0.00 0.00 0.00 179.25 179.11 3h6s h ARG 72 N 0.61 0.58 0.03 0.00 3.08 -1.69 -0.84 114.38 116.15 3h6s h ARG 72 Ca 0.36 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 60.25 3h6s h ARG 72 Cb 0.39 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3h6s h ARG 72 CO -0.28 0.65 -0.02 0.00 -1.07 0.00 0.00 179.97 179.26 3h6s h ALA 73 N 1.40 -0.05 -0.85 0.04 0.00 0.15 -1.21 119.26 118.75 3h6s h ALA 73 Ca 0.11 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.04 3h6s h ALA 73 Cb 0.43 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 3h6s h ALA 73 CO 0.02 -0.48 0.55 0.74 0.00 0.00 0.00 179.25 180.08 3h6s h PHE 74 N -0.15 0.91 -0.18 0.00 0.04 -0.73 -0.48 116.94 116.36 3h6s h PHE 74 Ca -0.00 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.78 3h6s h PHE 74 Cb 0.13 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 3h6s h PHE 74 CO -0.04 0.45 0.09 0.37 -0.60 0.00 0.00 178.31 178.57 3h6s h GLN 75 N 0.87 0.25 -0.60 1.51 5.75 -0.98 -2.25 115.11 119.65 3h6s h GLN 75 Ca 0.38 -0.04 0.02 0.00 -0.15 0.00 0.00 58.65 58.87 3h6s h GLN 75 Cb 0.33 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.80 3h6s h GLN 75 CO -0.15 0.28 0.40 -0.92 -2.65 0.00 0.00 178.83 175.79 3h6s h TYR 76 N 0.16 0.71 -0.45 3.99 3.20 0.06 -1.41 116.97 123.24 3h6s h TYR 76 Ca 0.06 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.80 3h6s h TYR 76 Cb 0.11 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 3h6s h TYR 76 CO -0.03 0.42 -0.29 0.28 -1.64 0.00 0.00 178.16 176.91 3h6s h VAL 77 N 0.74 1.27 0.76 1.81 2.07 -0.81 -0.81 116.25 121.29 3h6s h VAL 77 Ca 0.24 -1.46 -0.03 0.00 0.82 0.00 0.00 66.70 66.26 3h6s h VAL 77 Cb 0.03 1.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3h6s h VAL 77 CO -0.06 0.50 -0.45 0.50 0.02 0.00 0.00 177.57 178.08 3h6s h LYS 78 N 0.82 -1.09 -0.12 1.57 3.64 -0.97 -1.16 116.57 119.27 3h6s h LYS 78 Ca 0.09 0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 3h6s h LYS 78 Cb 0.88 0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.94 3h6s h LYS 78 CO 0.08 -0.73 0.05 0.93 -2.27 0.00 0.00 179.45 177.51 3h6s h GLU 79 N -1.13 0.16 0.00 1.90 5.08 -1.31 -2.17 114.58 117.12 3h6s h GLU 79 Ca -0.10 -0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.11 3h6s h GLU 79 Cb 0.90 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 3h6s h GLU 79 CO 0.11 0.14 -0.64 -0.97 -1.00 0.00 0.00 179.01 176.66 3h6s h ASN 80 N 0.17 0.00 0.00 1.42 -0.00 -0.88 -3.48 115.58 112.80 3h6s h ASN 80 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.34 3h6s h ASN 80 Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.36 3h6s h ASN 80 CO -0.00 0.64 0.00 0.61 -0.00 0.00 0.00 177.43 178.67 3h6s n GLY 81 N 0.83 1.06 0.00 1.57 0.00 -0.46 -5.00 105.19 103.19 3h6s n GLY 81 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.28 3h6s n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6s n GLY 82 N 0.00 4.61 3.52 -0.02 0.00 -1.25 -4.36 105.19 107.68 3h6s n GLY 82 Ca 0.00 -1.78 -0.12 0.00 0.00 0.00 0.00 46.02 44.12 3h6s n GLY 82 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h6s s LEU 83 N 0.00 -0.44 0.58 0.99 2.96 -1.16 -4.68 118.68 116.92 3h6s s LEU 83 Ca 0.00 1.26 -0.15 0.00 -0.22 0.00 0.00 54.13 55.02 3h6s s LEU 83 Cb 0.00 2.09 -0.05 0.00 0.50 0.00 0.00 46.19 48.73 3h6s s LEU 83 CO 0.00 -0.22 1.02 -1.81 -1.32 0.00 0.00 176.35 174.03 3h6s s ASP 84 N 0.66 6.17 0.86 3.68 1.01 -1.26 -1.87 116.67 125.92 3h6s s ASP 84 Ca -0.03 1.62 -0.12 0.00 0.71 0.00 0.00 52.55 54.74 3h6s s ASP 84 Cb -0.05 -2.51 0.11 0.00 1.01 0.00 0.00 42.92 41.48 3h6s s ASP 84 CO -0.04 -0.90 1.10 -0.94 0.21 0.00 0.00 175.17 174.60 3h6s s SER 85 N -3.26 3.89 0.28 0.27 1.04 -1.24 -1.23 113.70 113.45 3h6s s SER 85 Ca 0.59 1.32 -0.02 0.00 0.48 0.00 0.00 55.95 58.33 3h6s s SER 85 Cb -0.12 -2.02 0.39 0.00 0.10 0.00 0.00 66.02 64.37 3h6s s SER 85 CO 0.39 -2.35 1.84 -0.08 0.98 0.00 0.00 173.24 174.02 3h6s h GLU 86 N -1.35 0.89 -0.22 4.02 4.57 -0.80 -2.15 114.58 119.54 3h6s h GLU 86 Ca -0.49 -0.16 -0.04 0.00 -1.18 0.00 0.00 59.36 57.49 3h6s h GLU 86 Cb 1.29 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.72 3h6s h GLU 86 CO 0.58 0.76 -0.02 1.49 -1.18 0.00 0.00 179.01 180.64 3h6s h GLU 87 N 0.87 0.40 0.00 1.92 4.81 -1.92 -1.51 114.58 119.15 3h6s h GLU 87 Ca 0.20 -0.14 -0.06 0.00 -0.13 0.00 0.00 59.36 59.23 3h6s h GLU 87 Cb 0.24 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 3h6s h GLU 87 CO -0.01 0.61 -0.27 0.66 -0.73 0.00 0.00 179.01 179.28 3h6s h SER 88 N 0.15 0.00 -1.87 1.04 4.64 -1.91 -3.38 113.55 112.23 3h6s h SER 88 Ca 0.06 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.92 3h6s h SER 88 Cb 0.45 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.22 3h6s h SER 88 CO 0.02 0.27 -0.86 0.00 -0.87 0.00 0.00 176.83 175.39 3h6s n TYR 89 N -3.27 -1.68 -1.70 4.77 4.19 -0.82 -4.98 117.16 113.67 3h6s n TYR 89 Ca 0.01 -2.80 -0.36 0.00 3.31 0.00 0.00 57.90 58.07 3h6s n TYR 89 Cb 0.54 0.55 0.07 0.00 0.49 0.00 0.00 39.34 40.98 3h6s n TYR 89 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 3h6s s PRO 90 N 0.13 2.51 -0.14 2.98 0.04 -0.58 -4.50 135.00 135.44 3h6s s PRO 90 Ca 0.32 1.87 -0.29 0.00 0.04 0.00 0.00 61.00 62.94 3h6s s PRO 90 Cb 0.06 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.72 3h6s s PRO 90 CO -0.16 -1.58 1.20 -0.47 0.04 0.00 0.00 177.00 176.03 3h6s s TYR 91 N -1.70 3.05 -0.89 0.56 5.04 -1.26 -4.75 117.35 117.40 3h6s s TYR 91 Ca 0.78 1.17 0.09 0.00 -2.44 0.00 0.00 57.07 56.67 3h6s s TYR 91 Cb -0.32 -3.43 0.01 0.00 0.35 0.00 0.00 41.96 38.58 3h6s s TYR 91 CO 0.40 -1.32 0.63 1.33 -1.34 0.00 0.00 175.55 175.26 3h6s n VAL 92 N 5.11 0.00 -2.98 3.14 0.24 -1.26 -5.04 118.33 117.54 3h6s n VAL 92 Ca 0.12 -0.43 -0.22 0.00 -2.04 0.00 0.00 64.34 61.78 3h6s n VAL 92 Cb 0.46 1.12 0.02 0.00 -1.47 0.00 0.00 33.84 33.97 3h6s n VAL 92 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h6s n ALA 93 N -0.10 -0.94 -3.15 2.33 0.00 -1.26 -4.97 120.51 112.41 3h6s n ALA 93 Ca 0.04 0.21 -0.12 0.00 0.00 0.00 0.00 53.44 53.57 3h6s n ALA 93 Cb 0.20 -3.26 -0.10 0.00 0.00 0.00 0.00 19.45 16.28 3h6s n ALA 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3h6s s VAL 94 N -3.06 0.05 0.13 0.00 -7.23 -1.26 -4.40 120.40 104.63 3h6s s VAL 94 Ca 0.26 -0.43 -0.31 0.00 -1.81 0.00 0.00 61.98 59.70 3h6s s VAL 94 Cb -0.12 -0.46 -0.08 0.00 0.56 0.00 0.00 36.38 36.27 3h6s s VAL 94 CO 0.33 -0.24 1.39 -1.81 -0.31 0.00 0.00 175.10 174.46 3h6s s ASP 95 N -0.94 6.82 0.20 4.85 1.01 -1.26 -4.93 116.67 122.43 3h6s s ASP 95 Ca -0.10 2.36 -0.01 0.00 0.71 0.00 0.00 52.55 55.51 3h6s s ASP 95 Cb -0.05 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 3h6s s ASP 95 CO 0.02 -0.64 0.12 -1.61 0.21 0.00 0.00 175.17 173.27 3h6s s GLU 96 N 0.89 1.21 0.43 8.23 2.02 -1.26 -5.10 118.70 125.12 3h6s s GLU 96 Ca 0.63 -1.63 -0.23 0.00 0.02 0.00 0.00 54.97 53.76 3h6s s GLU 96 Cb -0.37 0.22 -0.08 0.00 0.10 0.00 0.00 34.13 34.00 3h6s s GLU 96 CO 0.32 -0.38 1.09 0.96 0.02 0.00 0.00 175.26 177.27 3h6s s ILE 97 N -4.12 3.49 0.27 -1.63 -4.36 -1.26 -4.59 121.20 109.00 3h6s s ILE 97 Ca 0.38 1.10 -0.30 0.00 -0.26 0.00 0.00 60.65 61.57 3h6s s ILE 97 Cb 0.07 -3.55 -0.13 0.00 1.25 0.00 0.00 42.46 40.10 3h6s s ILE 97 CO 0.12 -0.03 1.43 0.00 0.24 0.00 0.00 174.94 176.70 3h6s n LYS 99 N 1.79 0.34 -1.72 0.00 5.02 -1.26 -5.07 118.16 117.25 3h6s n LYS 99 Ca 0.10 -2.26 -0.42 0.00 -2.02 0.00 0.00 58.31 53.71 3h6s n LYS 99 Cb 0.34 -0.35 -0.03 0.00 -0.02 0.00 0.00 35.03 34.96 3h6s n LYS 99 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3h6s s TYR 100 N -0.69 1.99 -0.31 2.13 6.14 -1.26 -4.97 117.35 120.38 3h6s s TYR 100 Ca 0.34 -0.09 -0.03 0.00 0.64 0.00 0.00 57.07 57.94 3h6s s TYR 100 Cb 0.38 -4.18 0.05 0.00 0.42 0.00 0.00 41.96 38.63 3h6s s TYR 100 CO -0.15 -4.93 0.03 1.03 0.64 0.00 0.00 175.55 172.17 3h6s s ARG 101 N 3.08 2.44 0.55 4.97 3.00 -1.26 -5.00 118.95 126.74 3h6s s ARG 101 Ca 0.82 -1.28 0.25 0.00 0.00 0.00 0.00 55.73 55.51 3h6s s ARG 101 Cb -0.45 -3.25 1.49 0.00 0.00 0.00 0.00 34.95 32.74 3h6s s ARG 101 CO 0.37 -0.65 2.09 -1.35 0.00 0.00 0.00 175.30 175.75 3h6s h PRO 102 N 8.04 0.00 0.00 3.54 0.11 -1.99 -0.85 132.00 140.84 3h6s h PRO 102 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 3h6s h PRO 102 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3h6s h PRO 102 CO 0.55 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.49 3h6s n GLU 103 N -4.15 0.06 0.00 1.05 0.00 -1.26 -2.63 120.64 113.71 3h6s n GLU 103 Ca 0.03 0.28 0.00 0.00 0.00 0.00 0.00 57.16 57.47 3h6s n GLU 103 Cb 0.35 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.29 3h6s n GLU 103 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3h6s n ASN 104 N -1.38 1.33 -4.77 -1.84 4.13 -0.33 -5.05 115.26 107.35 3h6s n ASN 104 Ca 0.03 -1.40 -0.40 0.00 1.68 0.00 0.00 54.58 54.49 3h6s n ASN 104 Cb 0.08 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.30 3h6s n ASN 104 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 3h6s s SER 105 N -0.40 6.60 -0.03 6.41 0.15 -1.08 -3.63 113.70 121.71 3h6s s SER 105 Ca 0.00 2.65 0.05 0.00 0.70 0.00 0.00 55.95 59.35 3h6s s SER 105 Cb 0.00 -2.64 0.09 0.00 -1.71 0.00 0.00 66.02 61.75 3h6s s SER 105 CO 0.00 -0.65 1.04 1.33 1.20 0.00 0.00 173.24 176.16 3h6s n VAL 106 N 0.51 0.46 -3.55 4.45 0.24 -0.78 -4.92 118.33 114.73 3h6s n VAL 106 Ca 0.02 -0.59 -0.15 0.00 -2.04 0.00 0.00 64.34 61.58 3h6s n VAL 106 Cb 0.43 0.34 -0.05 0.00 -1.47 0.00 0.00 33.84 33.08 3h6s n VAL 106 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h6s s ALA 107 N -0.70 -1.46 0.23 2.33 0.00 -1.24 -5.02 121.76 115.91 3h6s s ALA 107 Ca 0.09 0.79 -0.10 0.00 0.00 0.00 0.00 51.96 52.74 3h6s s ALA 107 Cb 0.08 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 23.50 3h6s s ALA 107 CO 0.00 -0.48 0.40 -0.65 0.00 0.00 0.00 175.76 175.04 3h6s s GLN 108 N -2.14 1.46 0.26 0.00 -0.21 -1.26 -2.99 119.66 114.77 3h6s s GLN 108 Ca -0.07 -1.32 -0.16 0.00 0.02 0.00 0.00 55.36 53.84 3h6s s GLN 108 Cb -0.01 0.43 0.00 0.00 1.00 0.00 0.00 33.01 34.44 3h6s s GLN 108 CO 0.01 -0.59 0.56 0.16 -2.12 0.00 0.00 175.29 173.31 3h6s s ASP 109 N -3.04 -0.15 -0.04 5.90 3.84 -1.26 -4.72 116.67 117.19 3h6s s ASP 109 Ca 0.25 -0.81 0.09 0.00 -0.00 0.00 0.00 52.55 52.08 3h6s s ASP 109 Cb 0.01 0.63 0.24 0.00 -1.38 0.00 0.00 42.92 42.42 3h6s s ASP 109 CO 0.09 -1.21 1.19 0.35 -0.00 0.00 0.00 175.17 175.59 3h6s n THR 110 N -0.41 1.29 0.00 2.11 -2.24 0.11 -4.04 114.28 111.11 3h6s n THR 110 Ca -0.03 -1.27 0.00 0.00 -2.27 0.00 0.00 64.05 60.48 3h6s n THR 110 Cb 0.61 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.14 3h6s n THR 110 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h6s n GLY 111 N -0.18 0.52 3.76 3.38 0.00 -1.26 -4.95 105.19 106.46 3h6s n GLY 111 Ca 0.10 -1.83 -0.09 0.00 0.00 0.00 0.00 46.02 44.20 3h6s n GLY 111 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h6s s PHE 112 N -2.07 0.23 0.03 1.61 -0.12 -1.26 0.38 117.98 116.78 3h6s s PHE 112 Ca 0.00 -0.81 0.04 0.00 -0.05 0.00 0.00 56.93 56.12 3h6s s PHE 112 Cb 0.00 0.67 -0.02 0.00 -0.63 0.00 0.00 43.02 43.04 3h6s s PHE 112 CO 0.00 -1.45 -0.13 0.99 -0.05 0.00 0.00 175.22 174.58 3h6s s THR 113 N -2.66 0.98 -0.08 -4.49 2.01 -0.49 -4.85 115.64 106.06 3h6s s THR 113 Ca 0.17 -0.90 -0.02 0.00 0.31 0.00 0.00 61.69 61.25 3h6s s THR 113 Cb -0.04 -0.89 -0.03 0.00 0.01 0.00 0.00 72.50 71.54 3h6s s THR 113 CO 0.12 -0.00 0.01 -0.69 -0.69 0.00 0.00 174.62 173.37 3h6s s VAL 114 N -0.79 4.37 0.28 3.82 1.01 -1.26 -1.71 120.40 126.11 3h6s s VAL 114 Ca 0.01 -0.24 -0.27 0.00 0.00 0.00 0.00 61.98 61.48 3h6s s VAL 114 Cb -0.07 -2.84 -0.09 0.00 0.00 0.00 0.00 36.38 33.37 3h6s s VAL 114 CO 0.01 0.60 0.91 -0.69 0.00 0.00 0.00 175.10 175.93 3h6s s VAL 115 N -0.90 4.21 -0.39 2.92 1.01 -0.50 -4.95 120.40 121.80 3h6s s VAL 115 Ca 0.14 1.84 -0.40 0.00 0.00 0.00 0.00 61.98 63.55 3h6s s VAL 115 Cb -0.11 -4.09 -0.16 0.00 0.00 0.00 0.00 36.38 32.01 3h6s s VAL 115 CO 0.03 0.27 1.99 0.00 0.00 0.00 0.00 175.10 177.39 3h6s n ALA 116 N 0.91 0.21 -1.65 5.51 0.00 -1.26 -4.68 120.51 119.54 3h6s n ALA 116 Ca -0.00 0.20 -0.55 0.00 0.00 0.00 0.00 53.44 53.09 3h6s n ALA 116 Cb 0.49 -2.25 -0.07 0.00 0.00 0.00 0.00 19.45 17.62 3h6s n ALA 116 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3h6s n PRO 117 N 6.75 1.11 -0.94 0.00 -0.04 -1.26 -1.34 135.00 139.28 3h6s n PRO 117 Ca 0.40 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 64.26 3h6s n PRO 117 Cb 0.09 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.49 3h6s n PRO 117 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h6s n GLY 118 N 3.40 0.38 3.40 0.55 0.00 0.56 -4.95 105.19 108.52 3h6s n GLY 118 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 3h6s n GLY 118 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h6s s LYS 119 N -0.71 2.92 0.47 1.61 -0.14 -0.45 -4.86 119.74 118.59 3h6s s LYS 119 Ca 0.00 -1.24 0.15 0.00 -1.36 0.00 0.00 55.97 53.52 3h6s s LYS 119 Cb 0.00 -4.01 1.10 0.00 -1.68 0.00 0.00 37.83 33.24 3h6s s LYS 119 CO 0.00 -0.90 2.06 0.93 -0.76 0.00 0.00 175.35 176.67 3h6s h GLU 120 N 8.65 0.02 -0.31 1.68 5.08 -1.89 0.86 114.58 128.67 3h6s h GLU 120 Ca -0.27 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.05 3h6s h GLU 120 Cb 1.11 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 3h6s h GLU 120 CO 0.80 0.12 0.06 -0.22 -1.00 0.00 0.00 179.01 178.77 3h6s h LYS 121 N 0.02 0.51 -0.10 2.33 1.63 -1.97 0.49 116.57 119.48 3h6s h LYS 121 Ca 0.00 -0.13 -0.16 0.00 -0.85 0.00 0.00 60.65 59.51 3h6s h LYS 121 Cb 0.18 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.74 3h6s h LYS 121 CO 0.01 0.60 -0.63 0.00 -3.45 0.00 0.00 179.45 175.98 3h6s h ALA 122 N 0.89 0.73 -0.48 5.00 0.00 -1.64 -1.43 119.26 122.34 3h6s h ALA 122 Ca 0.10 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 3h6s h ALA 122 Cb 0.33 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3h6s h ALA 122 CO 0.00 0.73 0.19 1.25 0.00 0.00 0.00 179.25 181.43 3h6s h LEU 123 N 0.26 0.66 -1.19 0.00 5.85 -0.45 -0.09 115.31 120.36 3h6s h LEU 123 Ca -0.01 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.54 3h6s h LEU 123 Cb 1.17 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.99 3h6s h LEU 123 CO 0.11 0.65 0.48 -0.03 -0.34 0.00 0.00 178.44 179.30 3h6s h MET 124 N 0.63 1.03 -0.33 1.25 4.05 0.35 -0.29 114.93 121.62 3h6s h MET 124 Ca 0.16 -0.08 -0.13 0.00 -0.28 0.00 0.00 59.70 59.37 3h6s h MET 124 Cb 0.19 -0.22 -0.01 0.00 -0.80 0.00 0.00 31.60 30.76 3h6s h MET 124 CO -0.01 0.71 -0.32 -0.22 0.23 0.00 0.00 176.91 177.30 3h6s h LYS 125 N 1.05 0.80 -0.36 0.39 3.64 -0.82 -0.95 116.57 120.33 3h6s h LYS 125 Ca 0.28 -0.42 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 3h6s h LYS 125 Cb -0.07 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 3h6s h LYS 125 CO -0.06 1.05 0.22 0.00 -2.27 0.00 0.00 179.45 178.40 3h6s h ALA 126 N 0.74 0.45 -0.09 5.00 0.00 -0.40 -1.11 119.26 123.86 3h6s h ALA 126 Ca 0.05 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 3h6s h ALA 126 Cb 0.90 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3h6s h ALA 126 CO 0.08 -0.06 -0.62 -0.39 0.00 0.00 0.00 179.25 178.26 3h6s h VAL 127 N 0.47 1.38 -0.55 0.00 -1.51 -0.91 -0.65 116.25 114.48 3h6s h VAL 127 Ca 0.13 -1.99 -0.08 0.00 -1.23 0.00 0.00 66.70 63.53 3h6s h VAL 127 Cb -0.02 1.99 -0.02 0.00 -2.13 0.00 0.00 31.29 31.11 3h6s h VAL 127 CO -0.03 0.59 0.03 0.00 -1.23 0.00 0.00 177.57 176.94 3h6s h ALA 128 N 1.12 0.74 -0.02 5.19 0.00 -0.97 -3.17 119.26 122.15 3h6s h ALA 128 Ca -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3h6s h ALA 128 Cb 1.14 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3h6s h ALA 128 CO 0.10 0.53 -0.16 0.25 0.00 0.00 0.00 179.25 179.97 3h6s n THR 129 N -4.29 0.00 0.00 0.00 -2.24 -0.44 -4.65 114.28 102.66 3h6s n THR 129 Ca 0.02 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 3h6s n THR 129 Cb 0.31 1.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.90 3h6s n THR 129 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3h6s n VAL 130 N 0.71 0.00 0.00 2.28 0.31 -0.25 -5.05 118.33 116.33 3h6s n VAL 130 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 3h6s n VAL 130 Cb 0.49 -0.76 0.00 0.00 -0.91 0.00 0.00 33.84 32.65 3h6s n VAL 130 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h6s n GLY 131 N 2.92 0.85 3.75 2.92 0.00 -1.20 -4.90 105.19 109.52 3h6s n GLY 131 Ca 0.00 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 3h6s n GLY 131 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h6s n PRO 132 N 0.00 2.65 -4.95 1.61 -0.02 -1.26 -4.32 135.00 128.71 3h6s n PRO 132 Ca 0.00 0.94 -0.32 0.00 -2.02 0.00 0.00 63.50 62.09 3h6s n PRO 132 Cb 0.00 -2.69 -0.14 0.00 -0.02 0.00 0.00 33.50 30.64 3h6s n PRO 132 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3h6s s ILE 133 N -0.33 2.82 -0.03 4.25 -1.09 -0.01 -4.66 121.20 122.16 3h6s s ILE 133 Ca 0.61 -0.79 -0.30 0.00 -2.23 0.00 0.00 60.65 57.94 3h6s s ILE 133 Cb -0.50 -2.11 -0.03 0.00 -1.58 0.00 0.00 42.46 38.23 3h6s s ILE 133 CO 0.53 0.57 1.13 -0.44 -1.23 0.00 0.00 174.94 175.50 3h6s s SER 134 N -0.30 7.14 0.06 3.58 0.01 -0.37 -1.25 113.70 122.57 3h6s s SER 134 Ca 0.02 1.79 0.02 0.00 1.31 0.00 0.00 55.95 59.09 3h6s s SER 134 Cb -0.13 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.51 3h6s s SER 134 CO 0.03 -0.48 -0.08 0.68 0.41 0.00 0.00 173.24 173.79 3h6s s VAL 135 N 1.72 0.63 0.03 3.43 -7.23 -0.79 -0.48 120.40 117.72 3h6s s VAL 135 Ca 0.55 -1.28 0.03 0.00 -1.81 0.00 0.00 61.98 59.46 3h6s s VAL 135 Cb -0.24 -0.88 -0.04 0.00 0.56 0.00 0.00 36.38 35.79 3h6s s VAL 135 CO 0.24 -0.47 -0.02 0.00 -0.31 0.00 0.00 175.10 174.54 3h6s s ALA 136 N -1.84 3.21 0.24 1.32 0.00 -1.25 -0.56 121.76 122.87 3h6s s ALA 136 Ca -0.05 -1.02 -0.07 0.00 0.00 0.00 0.00 51.96 50.83 3h6s s ALA 136 Cb -0.07 -1.24 -0.02 0.00 0.00 0.00 0.00 23.12 21.80 3h6s s ALA 136 CO -0.00 0.65 0.34 0.00 0.00 0.00 0.00 175.76 176.74 3h6s s MET 137 N -1.73 1.45 -0.53 0.00 0.23 0.59 -4.26 119.30 115.04 3h6s s MET 137 Ca 0.21 -1.46 -0.20 0.00 -1.03 0.00 0.00 55.69 53.20 3h6s s MET 137 Cb -0.11 0.39 0.06 0.00 -1.53 0.00 0.00 34.83 33.63 3h6s s MET 137 CO 0.12 -0.56 0.72 0.34 -2.03 0.00 0.00 175.02 173.61 3h6s s ASP 138 N -3.10 6.24 0.00 -1.18 2.15 0.05 -1.37 116.67 119.46 3h6s s ASP 138 Ca 0.30 -0.85 0.13 0.00 0.43 0.00 0.00 52.55 52.55 3h6s s ASP 138 Cb 0.02 -2.33 0.33 0.00 -0.30 0.00 0.00 42.92 40.65 3h6s s ASP 138 CO 0.12 -1.01 1.26 0.00 -0.17 0.00 0.00 175.17 175.36 3h6s n ALA 139 N 6.54 2.23 -1.05 3.66 0.00 -1.26 -4.79 120.51 125.84 3h6s n ALA 139 Ca -0.05 -1.11 -0.15 0.00 0.00 0.00 0.00 53.44 52.13 3h6s n ALA 139 Cb 0.45 -0.51 -0.15 0.00 0.00 0.00 0.00 19.45 19.25 3h6s n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h6s n GLY 140 N 0.70 3.18 3.09 0.00 0.00 -1.26 -4.43 105.19 106.47 3h6s n GLY 140 Ca 0.13 -1.27 -0.12 0.00 0.00 0.00 0.00 46.02 44.76 3h6s n GLY 140 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h6s s HIS 141 N 1.01 -0.20 0.31 1.61 3.76 -1.26 -5.04 115.29 115.47 3h6s s HIS 141 Ca 0.67 0.49 0.07 0.00 -0.15 0.00 0.00 55.06 56.13 3h6s s HIS 141 Cb 0.31 0.07 0.78 0.00 1.11 0.00 0.00 32.58 34.84 3h6s s HIS 141 CO -0.01 -0.12 1.76 0.77 -0.85 0.00 0.00 174.74 176.28 3h6s h SER 142 N 5.68 0.74 0.07 1.40 0.02 -1.98 0.77 113.55 120.24 3h6s h SER 142 Ca -0.26 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 60.79 3h6s h SER 142 Cb 1.20 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 3h6s h SER 142 CO 0.38 0.21 -0.07 0.77 -1.14 0.00 0.00 176.83 176.99 3h6s h SER 143 N 0.70 0.00 0.04 3.07 4.64 -1.96 -0.58 113.55 119.46 3h6s h SER 143 Ca 0.60 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.66 3h6s h SER 143 Cb 1.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.06 3h6s h SER 143 CO -0.42 0.07 -1.38 0.15 -0.87 0.00 0.00 176.83 174.38 3h6s h PHE 144 N 0.00 0.15 -0.88 4.77 3.57 -1.22 -3.06 116.94 120.27 3h6s h PHE 144 Ca -0.00 -0.11 0.16 0.00 3.53 0.00 0.00 57.97 61.54 3h6s h PHE 144 Cb 0.12 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 38.79 3h6s h PHE 144 CO 0.00 1.54 0.57 1.96 -2.23 0.00 0.00 178.31 180.15 3h6s h GLN 145 N -0.70 0.58 -0.32 1.11 1.08 -1.09 -1.94 115.11 113.84 3h6s h GLN 145 Ca -0.35 -0.03 -0.16 0.00 -1.45 0.00 0.00 58.65 56.66 3h6s h GLN 145 Cb 1.50 -0.13 -0.09 0.00 -0.05 0.00 0.00 27.48 28.70 3h6s h GLN 145 CO -0.11 0.38 -0.11 1.19 -0.95 0.00 0.00 178.83 179.23 3h6s n PHE 146 N -4.55 0.98 -2.00 2.96 3.72 -0.23 -4.95 117.46 113.39 3h6s n PHE 146 Ca 0.17 -1.55 -0.37 0.00 -0.05 0.00 0.00 57.45 55.65 3h6s n PHE 146 Cb 0.52 -0.46 0.02 0.00 -0.94 0.00 0.00 39.48 38.63 3h6s n PHE 146 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 3h6s s TYR 147 N -3.22 2.50 0.11 1.38 5.04 -0.73 -4.96 117.35 117.46 3h6s s TYR 147 Ca 0.44 1.46 0.00 0.00 -2.44 0.00 0.00 57.07 56.53 3h6s s TYR 147 Cb 0.40 -3.58 0.00 0.00 0.35 0.00 0.00 41.96 39.13 3h6s s TYR 147 CO -0.00 -2.27 0.00 1.17 -1.34 0.00 0.00 175.55 173.10 3h6s n LYS 148 N -1.00 0.00 -3.92 4.97 3.00 -1.26 -3.36 118.16 116.58 3h6s n LYS 148 Ca 0.10 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.31 3h6s n LYS 148 Cb 0.47 -0.45 -0.01 0.00 0.00 0.00 0.00 35.03 35.04 3h6s n LYS 148 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 3h6s s SER 149 N -5.78 0.25 0.00 3.14 1.04 -1.26 -2.99 113.70 108.10 3h6s s SER 149 Ca 0.00 -1.17 0.00 0.00 0.48 0.00 0.00 55.95 55.26 3h6s s SER 149 Cb 0.00 0.75 0.00 0.00 0.10 0.00 0.00 66.02 66.87 3h6s s SER 149 CO 0.00 -1.47 0.00 0.61 0.98 0.00 0.00 173.24 173.36 3h6s n GLY 150 N -0.52 -2.95 3.56 7.32 0.00 -1.26 -4.79 105.19 106.56 3h6s n GLY 150 Ca -0.04 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 3h6s n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h6s s ILE 151 N -0.88 4.73 0.03 -0.61 1.01 -1.26 -4.09 121.20 120.12 3h6s s ILE 151 Ca 0.00 0.62 -0.30 0.00 0.00 0.00 0.00 60.65 60.97 3h6s s ILE 151 Cb 0.00 -4.23 -0.07 0.00 0.01 0.00 0.00 42.46 38.16 3h6s s ILE 151 CO 0.00 -0.53 1.69 -0.47 0.00 0.00 0.00 174.94 175.63 3h6s s TYR 152 N 3.10 2.13 -0.04 3.97 5.04 0.15 -4.81 117.35 126.88 3h6s s TYR 152 Ca 0.29 0.18 -0.01 0.00 -2.44 0.00 0.00 57.07 55.08 3h6s s TYR 152 Cb -0.13 -3.99 0.03 0.00 0.35 0.00 0.00 41.96 38.23 3h6s s TYR 152 CO 0.19 -4.09 0.08 0.12 -1.34 0.00 0.00 175.55 170.51 3h6s s PHE 153 N 3.32 -0.04 -0.20 4.97 5.36 -1.26 -2.17 117.98 127.97 3h6s s PHE 153 Ca 0.76 0.30 -0.03 0.00 -0.96 0.00 0.00 56.93 57.00 3h6s s PHE 153 Cb -0.38 -0.24 0.06 0.00 -0.34 0.00 0.00 43.02 42.12 3h6s s PHE 153 CO 0.33 -0.15 0.03 -2.00 -1.46 0.00 0.00 175.22 171.97 3h6s s GLU 154 N 1.44 0.72 0.39 10.12 2.56 -1.26 -5.04 118.70 127.62 3h6s s GLU 154 Ca -0.05 -0.46 0.14 0.00 0.00 0.00 0.00 54.97 54.60 3h6s s GLU 154 Cb -0.12 -2.15 0.98 0.00 2.00 0.00 0.00 34.13 34.83 3h6s s GLU 154 CO -0.04 -0.64 1.85 -1.35 -0.56 0.00 0.00 175.26 174.52 3h6s h PRO 155 N 8.22 0.50 -0.00 4.30 0.11 -2.05 -0.94 132.00 142.14 3h6s h PRO 155 Ca -0.16 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.92 3h6s h PRO 155 Cb 1.12 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.11 3h6s h PRO 155 CO 0.34 0.33 0.00 -0.25 -0.21 0.00 0.00 178.00 178.22 3h6s n ASP 156 N -4.55 0.08 -4.74 -2.05 10.43 -1.26 -4.92 116.55 109.54 3h6s n ASP 156 Ca 0.19 -1.17 -0.42 0.00 2.57 0.00 0.00 54.79 55.97 3h6s n ASP 156 Cb 0.62 -0.00 -0.02 0.00 1.84 0.00 0.00 41.12 43.55 3h6s n ASP 156 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3h6s s SER 158 N 0.57 6.53 0.00 0.00 0.15 -1.26 -4.57 113.70 115.11 3h6s s SER 158 Ca 0.62 0.64 0.18 0.00 0.70 0.00 0.00 55.95 58.09 3h6s s SER 158 Cb -0.42 -2.11 0.21 0.00 -1.71 0.00 0.00 66.02 61.98 3h6s s SER 158 CO 0.40 0.08 1.14 -1.54 1.20 0.00 0.00 173.24 174.52 3h6s n SER 159 N 0.28 2.69 -0.07 5.45 3.41 -1.26 -2.58 113.62 121.54 3h6s n SER 159 Ca -0.04 -1.80 -0.14 0.00 -0.26 0.00 0.00 58.87 56.63 3h6s n SER 159 Cb 0.52 -0.07 -0.06 0.00 -0.26 0.00 0.00 64.21 64.34 3h6s n SER 159 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3h6s n LYS 160 N 1.03 0.33 -3.04 4.33 5.02 -1.26 -4.40 118.16 120.17 3h6s n LYS 160 Ca 0.12 0.12 -0.45 0.00 -2.02 0.00 0.00 58.31 56.09 3h6s n LYS 160 Cb 0.47 -1.11 -0.02 0.00 -0.02 0.00 0.00 35.03 34.34 3h6s n LYS 160 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3h6s s ASN 161 N -6.04 6.68 -0.14 4.39 0.02 -1.26 -5.01 114.94 113.58 3h6s s ASN 161 Ca -0.20 -2.26 -0.09 0.00 -1.02 0.00 0.00 52.86 49.29 3h6s s ASN 161 Cb 0.07 -2.35 -0.05 0.00 0.02 0.00 0.00 41.25 38.95 3h6s s ASN 161 CO 0.28 -0.92 0.18 -0.76 0.02 0.00 0.00 177.10 175.90 3h6s s LEU 162 N 1.94 4.33 0.00 0.60 1.43 -1.26 -4.42 118.68 121.29 3h6s s LEU 162 Ca 0.29 0.44 0.00 0.00 -1.03 0.00 0.00 54.13 53.83 3h6s s LEU 162 Cb -0.06 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 44.01 3h6s s LEU 162 CO -0.09 0.30 0.20 -0.90 0.23 0.00 0.00 176.35 176.08 3h6s n ASP 163 N 2.61 0.39 -3.95 2.29 3.85 -0.47 -4.90 116.55 116.37 3h6s n ASP 163 Ca -0.17 -0.78 -0.19 0.00 -0.71 0.00 0.00 54.79 52.93 3h6s n ASP 163 Cb 0.54 0.17 -0.16 0.00 -1.35 0.00 0.00 41.12 40.32 3h6s n ASP 163 CO 0.00 0.00 0.00 -2.28 -1.01 0.00 0.00 177.20 173.91 3h6s s HIS 164 N -0.17 0.77 -0.21 2.11 5.04 -0.64 -4.96 115.29 117.23 3h6s s HIS 164 Ca 0.00 -0.19 -0.08 0.00 -1.54 0.00 0.00 55.06 53.25 3h6s s HIS 164 Cb 0.00 -0.59 -0.04 0.00 0.04 0.00 0.00 32.58 31.98 3h6s s HIS 164 CO 0.00 -0.11 0.09 0.20 -2.34 0.00 0.00 174.74 172.58 3h6s s GLY 165 N 0.40 1.91 0.00 1.59 0.00 -1.26 -0.30 107.32 109.65 3h6s s GLY 165 Ca -0.06 -0.84 0.00 0.00 0.00 0.00 0.00 44.72 43.82 3h6s s GLY 165 CO 0.00 0.22 0.00 3.33 0.00 0.00 0.00 173.10 176.65 3h6s n VAL 166 N 3.95 0.00 -3.89 1.40 0.24 0.28 -4.41 118.33 115.89 3h6s n VAL 166 Ca -0.16 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.85 3h6s n VAL 166 Cb 0.52 0.00 -0.16 0.00 -1.47 0.00 0.00 33.84 32.73 3h6s n VAL 166 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3h6s s LEU 167 N 0.00 1.88 -0.27 1.34 2.96 -1.00 -1.88 118.68 121.71 3h6s s LEU 167 Ca 0.00 -0.84 -0.27 0.00 -0.22 0.00 0.00 54.13 52.80 3h6s s LEU 167 Cb 0.00 -0.97 0.01 0.00 0.50 0.00 0.00 46.19 45.72 3h6s s LEU 167 CO 0.00 -0.21 0.97 -0.69 -1.32 0.00 0.00 176.35 175.10 3h6s s VAL 168 N 1.58 4.69 -1.39 1.68 1.01 -0.38 -0.82 120.40 126.75 3h6s s VAL 168 Ca -0.01 1.75 0.12 0.00 0.00 0.00 0.00 61.98 63.83 3h6s s VAL 168 Cb -0.17 -4.27 0.14 0.00 0.00 0.00 0.00 36.38 32.08 3h6s s VAL 168 CO -0.07 -0.24 0.95 1.33 0.00 0.00 0.00 175.10 177.07 3h6s n VAL 169 N 5.47 0.19 -3.34 2.92 0.24 -0.26 -0.83 118.33 122.73 3h6s n VAL 169 Ca 0.10 -0.59 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 3h6s n VAL 169 Cb 0.47 1.11 0.00 0.00 -1.47 0.00 0.00 33.84 33.95 3h6s n VAL 169 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h6s n GLY 170 N 0.65 -1.34 3.68 7.63 0.00 -1.19 -0.69 105.19 113.93 3h6s n GLY 170 Ca 0.08 -1.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.00 3h6s n GLY 170 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3h6s s TYR 171 N -2.96 -0.31 0.00 1.61 -0.85 -0.70 -0.95 117.35 113.19 3h6s s TYR 171 Ca 0.00 -0.03 0.00 0.00 -0.52 0.00 0.00 57.07 56.52 3h6s s TYR 171 Cb 0.00 0.64 0.00 0.00 0.38 0.00 0.00 41.96 42.98 3h6s s TYR 171 CO 0.00 -1.03 0.00 0.41 -1.52 0.00 0.00 175.55 173.41 3h6s n GLY 172 N -0.42 1.17 3.36 5.49 0.00 -0.97 -0.96 105.19 112.86 3h6s n GLY 172 Ca -0.09 -0.70 -0.14 0.00 0.00 0.00 0.00 46.02 45.09 3h6s n GLY 172 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h6s s PHE 173 N -2.73 -0.44 0.18 1.61 -0.12 -1.26 -1.70 117.98 113.53 3h6s s PHE 173 Ca 0.00 0.93 0.05 0.00 -0.05 0.00 0.00 56.93 57.86 3h6s s PHE 173 Cb 0.00 0.19 -0.04 0.00 -0.63 0.00 0.00 43.02 42.55 3h6s s PHE 173 CO 0.00 -0.36 0.22 -1.21 -0.05 0.00 0.00 175.22 173.82 3h6s s GLU 174 N -0.49 3.12 0.00 1.99 2.02 0.40 -4.97 118.70 120.77 3h6s s GLU 174 Ca -0.06 -0.81 0.00 0.00 0.02 0.00 0.00 54.97 54.12 3h6s s GLU 174 Cb -0.03 -2.75 0.00 0.00 0.10 0.00 0.00 34.13 31.44 3h6s s GLU 174 CO 0.03 0.47 0.00 0.41 0.02 0.00 0.00 175.26 176.20 3h6s n GLY 175 N -0.68 -1.57 0.34 -1.39 0.00 -1.26 -4.19 105.19 96.45 3h6s n GLY 175 Ca -0.08 -1.55 0.17 0.00 0.00 0.00 0.00 46.02 44.56 3h6s n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6s h ALA 176 N 0.00 1.40 -3.14 4.61 0.00 -1.95 -3.41 119.26 116.78 3h6s h ALA 176 Ca 0.00 -0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.28 3h6s h ALA 176 Cb 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 17.79 17.60 3h6s h ALA 176 CO 0.00 -0.33 -0.60 1.21 0.00 0.00 0.00 179.25 179.53 3h6s s ASN 177 N -4.68 5.33 0.62 0.00 3.84 -1.26 -4.95 114.94 113.83 3h6s s ASN 177 Ca -0.04 -0.07 0.34 0.00 0.21 0.00 0.00 52.86 53.31 3h6s s ASN 177 Cb 0.10 -1.93 2.01 0.00 -0.55 0.00 0.00 41.25 40.89 3h6s s ASN 177 CO 0.33 0.08 2.29 0.77 -2.79 0.00 0.00 177.10 177.79 3h6s h SER 178 N 7.36 0.00 -0.05 -4.21 4.64 -1.91 0.12 113.55 119.50 3h6s h SER 178 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 3h6s h SER 178 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3h6s h SER 178 CO 0.64 0.00 0.00 -0.67 -0.87 0.00 0.00 176.83 175.93 3h6s n ASP 179 N -3.61 2.74 -4.74 4.97 4.64 -1.26 -4.78 116.55 114.51 3h6s n ASP 179 Ca -0.03 -1.85 -0.36 0.00 -1.38 0.00 0.00 54.79 51.17 3h6s n ASP 179 Cb 0.08 -0.02 -0.08 0.00 -1.04 0.00 0.00 41.12 40.06 3h6s n ASP 179 CO 0.00 0.00 0.00 0.20 -0.82 0.00 0.00 177.20 176.58 3h6s s ASN 180 N -1.66 5.66 -0.98 1.67 0.01 0.41 -4.66 114.94 115.38 3h6s s ASN 180 Ca 0.25 0.24 -0.11 0.00 -0.71 0.00 0.00 52.86 52.53 3h6s s ASN 180 Cb 0.17 -1.73 -0.01 0.00 0.41 0.00 0.00 41.25 40.09 3h6s s ASN 180 CO 0.25 0.36 0.76 -1.20 -1.51 0.00 0.00 177.10 175.77 3h6s n SER 181 N 2.27 -6.05 -4.88 -1.22 7.64 -1.26 -3.46 113.62 106.66 3h6s n SER 181 Ca -0.19 -0.74 -0.30 0.00 1.01 0.00 0.00 58.87 58.65 3h6s n SER 181 Cb 0.54 -3.85 -0.02 0.00 -1.01 0.00 0.00 64.21 59.86 3h6s n SER 181 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3h6s s LYS 182 N -4.89 3.73 0.08 1.43 3.01 -1.26 -0.45 119.74 121.39 3h6s s LYS 182 Ca 0.29 0.45 -0.11 0.00 -1.01 0.00 0.00 55.97 55.59 3h6s s LYS 182 Cb -0.09 -2.36 0.01 0.00 -1.01 0.00 0.00 37.83 34.38 3h6s s LYS 182 CO 0.82 -0.11 0.25 1.52 0.51 0.00 0.00 175.35 178.35 3h6s s TYR 183 N -2.50 0.02 0.13 3.18 -0.85 -0.69 -2.36 117.35 114.29 3h6s s TYR 183 Ca 0.51 -0.36 -0.05 0.00 -0.52 0.00 0.00 57.07 56.65 3h6s s TYR 183 Cb -0.10 0.04 -0.06 0.00 0.38 0.00 0.00 41.96 42.22 3h6s s TYR 183 CO 0.35 -0.56 0.38 -1.58 -1.52 0.00 0.00 175.55 172.62 3h6s s TRP 184 N -3.49 3.48 -0.27 -3.49 0.52 0.11 -2.29 118.94 113.51 3h6s s TRP 184 Ca 0.02 0.58 -0.08 0.00 0.02 0.00 0.00 56.10 56.64 3h6s s TRP 184 Cb 0.03 -2.02 -0.02 0.00 -1.15 0.00 0.00 33.47 30.31 3h6s s TRP 184 CO -0.09 0.44 0.09 -1.17 0.02 0.00 0.00 176.95 176.25 3h6s s LEU 185 N -2.57 3.66 -0.03 2.99 0.20 -0.13 -1.43 118.68 121.36 3h6s s LEU 185 Ca 0.40 -0.34 0.05 0.00 0.69 0.00 0.00 54.13 54.94 3h6s s LEU 185 Cb -0.12 -1.94 -0.01 0.00 -0.43 0.00 0.00 46.19 43.69 3h6s s LEU 185 CO 0.24 -0.09 -0.20 -0.69 -0.29 0.00 0.00 176.35 175.32 3h6s s VAL 186 N 1.60 1.61 -0.21 1.68 1.01 0.76 -1.10 120.40 125.75 3h6s s VAL 186 Ca 0.06 -0.84 -0.15 0.00 0.00 0.00 0.00 61.98 61.05 3h6s s VAL 186 Cb -0.16 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 3h6s s VAL 186 CO 0.04 0.46 0.36 -0.75 0.00 0.00 0.00 175.10 175.21 3h6s s LYS 187 N -0.22 4.15 0.52 2.72 2.20 -0.00 -0.69 119.74 128.43 3h6s s LYS 187 Ca 0.01 0.12 0.08 0.00 -0.36 0.00 0.00 55.97 55.82 3h6s s LYS 187 Cb -0.10 -3.54 0.08 0.00 -1.51 0.00 0.00 37.83 32.75 3h6s s LYS 187 CO 0.01 -0.03 0.63 -1.71 -0.36 0.00 0.00 175.35 173.88 3h6s n ASN 188 N 4.48 2.15 -2.52 1.43 2.85 -0.86 -2.39 115.26 120.40 3h6s n ASN 188 Ca -0.09 -2.51 -0.12 0.00 -0.11 0.00 0.00 54.58 51.74 3h6s n ASN 188 Cb 0.51 -0.28 0.03 0.00 1.24 0.00 0.00 39.78 41.28 3h6s n ASN 188 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 3h6s n SER 189 N -2.22 2.93 -0.47 1.20 3.41 -1.26 -4.49 113.62 112.71 3h6s n SER 189 Ca 0.10 -2.85 0.07 0.00 -0.26 0.00 0.00 58.87 55.92 3h6s n SER 189 Cb 0.56 -0.44 0.19 0.00 -0.26 0.00 0.00 64.21 64.25 3h6s n SER 189 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 3h6s n TRP 190 N -0.53 0.13 0.00 7.33 8.01 -1.19 -1.08 117.44 130.11 3h6s n TRP 190 Ca 0.22 -1.30 0.00 0.00 -1.31 0.00 0.00 57.50 55.11 3h6s n TRP 190 Cb 0.84 -0.24 0.00 0.00 -2.01 0.00 0.00 31.31 29.90 3h6s n TRP 190 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3h6s n GLY 191 N -1.21 -1.17 0.14 6.99 0.00 0.70 -4.30 105.19 106.34 3h6s n GLY 191 Ca 0.19 -1.58 0.12 0.00 0.00 0.00 0.00 46.02 44.76 3h6s n GLY 191 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6s h PRO 192 N 0.00 0.00 -0.00 1.61 0.13 -1.82 -3.04 132.00 128.88 3h6s h PRO 192 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3h6s h PRO 192 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3h6s h PRO 192 CO 0.00 0.00 -0.04 -0.85 -0.23 0.00 0.00 178.00 176.88 3h6s n GLU 193 N -2.31 0.07 -2.98 0.86 0.00 -1.26 -2.33 120.64 112.69 3h6s n GLU 193 Ca 0.03 -0.01 -0.35 0.00 0.00 0.00 0.00 57.16 56.83 3h6s n GLU 193 Cb 0.27 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.15 3h6s n GLU 193 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.13 176.67 3h6s s TRP 194 N -2.93 3.57 0.00 -1.84 -0.00 -1.15 -4.79 118.94 111.80 3h6s s TRP 194 Ca 0.16 1.50 0.00 0.00 -0.00 0.00 0.00 56.10 57.76 3h6s s TRP 194 Cb 0.19 -2.72 0.00 0.00 -0.00 0.00 0.00 33.47 30.94 3h6s s TRP 194 CO 0.53 0.21 0.00 0.41 -0.00 0.00 0.00 176.95 178.10 3h6s n GLY 195 N 0.33 3.28 3.21 5.86 0.00 -1.21 0.53 105.19 117.19 3h6s n GLY 195 Ca 0.01 0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3h6s n GLY 195 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h6s s SER 196 N -4.00 6.34 -1.46 1.61 0.15 0.10 -4.56 113.70 111.88 3h6s s SER 196 Ca 0.00 -3.30 -0.07 0.00 0.70 0.00 0.00 55.95 53.28 3h6s s SER 196 Cb 0.00 -2.04 0.03 0.00 -1.71 0.00 0.00 66.02 62.30 3h6s s SER 196 CO 0.00 -0.33 0.65 0.59 1.20 0.00 0.00 173.24 175.35 3h6s n ASN 197 N 3.00 -5.39 0.00 5.45 5.03 -1.21 -1.16 115.26 120.98 3h6s n ASN 197 Ca 0.18 -0.37 0.00 0.00 0.87 0.00 0.00 54.58 55.26 3h6s n ASN 197 Cb 0.40 -4.36 0.00 0.00 -1.02 0.00 0.00 39.78 34.80 3h6s n ASN 197 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h6s n GLY 198 N -1.48 0.69 3.53 7.41 0.00 0.19 -4.67 105.19 110.85 3h6s n GLY 198 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 3h6s n GLY 198 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h6s s TYR 199 N -2.42 2.46 0.01 1.61 2.02 -0.31 -2.03 117.35 118.69 3h6s s TYR 199 Ca 0.00 -0.29 -0.02 0.00 -0.37 0.00 0.00 57.07 56.40 3h6s s TYR 199 Cb 0.00 -1.11 -0.01 0.00 -0.40 0.00 0.00 41.96 40.44 3h6s s TYR 199 CO 0.00 0.63 0.02 0.54 -1.57 0.00 0.00 175.55 175.17 3h6s s VAL 200 N -2.23 0.08 -0.23 0.71 0.11 0.14 -0.72 120.40 118.25 3h6s s VAL 200 Ca 0.28 -0.63 -0.10 0.00 -2.93 0.00 0.00 61.98 58.60 3h6s s VAL 200 Cb -0.06 -0.24 -0.05 0.00 -1.53 0.00 0.00 36.38 34.50 3h6s s VAL 200 CO 0.16 -0.35 0.14 -0.54 -3.33 0.00 0.00 175.10 171.18 3h6s s LYS 201 N -1.07 4.02 -0.05 1.54 1.02 -1.26 -0.17 119.74 123.77 3h6s s LYS 201 Ca -0.12 -0.30 0.04 0.00 0.02 0.00 0.00 55.97 55.62 3h6s s LYS 201 Cb -0.07 -3.48 -0.02 0.00 -0.52 0.00 0.00 37.83 33.74 3h6s s LYS 201 CO -0.00 0.06 -0.17 0.42 -0.92 0.00 0.00 175.35 174.74 3h6s s ILE 202 N 1.03 2.86 0.06 2.17 1.01 -0.52 0.29 121.20 128.10 3h6s s ILE 202 Ca 0.07 -0.80 -0.35 0.00 0.00 0.00 0.00 60.65 59.57 3h6s s ILE 202 Cb -0.14 -2.10 -0.14 0.00 0.01 0.00 0.00 42.46 40.10 3h6s s ILE 202 CO 0.04 0.59 1.63 0.00 0.00 0.00 0.00 174.94 177.19 3h6s n ALA 203 N 2.37 0.76 -2.59 9.38 0.00 -0.92 0.07 120.51 129.58 3h6s n ALA 203 Ca -0.17 0.41 -0.31 0.00 0.00 0.00 0.00 53.44 53.38 3h6s n ALA 203 Cb 0.52 -2.34 -0.10 0.00 0.00 0.00 0.00 19.45 17.53 3h6s n ALA 203 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3h6s s LYS 204 N 1.81 2.35 -1.32 0.00 2.20 -0.99 -4.54 119.74 119.25 3h6s s LYS 204 Ca 0.84 -0.87 -0.07 0.00 -0.36 0.00 0.00 55.97 55.52 3h6s s LYS 204 Cb -0.75 -2.41 0.01 0.00 -1.51 0.00 0.00 37.83 33.17 3h6s s LYS 204 CO 0.45 0.55 1.11 -0.25 -0.36 0.00 0.00 175.35 176.85 3h6s n ASP 205 N 1.08 -4.98 -2.78 1.43 10.43 -1.26 -4.43 116.55 116.05 3h6s n ASP 205 Ca -0.14 -0.58 -0.21 0.00 2.57 0.00 0.00 54.79 56.43 3h6s n ASP 205 Cb 0.52 -4.98 -0.01 0.00 1.84 0.00 0.00 41.12 38.49 3h6s n ASP 205 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3h6s n LYS 206 N -4.74 2.29 -3.30 -1.24 4.76 -1.26 -4.91 118.16 109.77 3h6s n LYS 206 Ca -0.08 -4.04 -0.17 0.00 -2.87 0.00 0.00 58.31 51.15 3h6s n LYS 206 Cb 0.59 -1.88 0.07 0.00 -1.84 0.00 0.00 35.03 31.98 3h6s n LYS 206 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3h6s n ASN 207 N -0.16 -3.66 -3.71 4.39 4.13 -1.26 -3.61 115.26 111.37 3h6s n ASN 207 Ca 0.26 -0.49 -0.23 0.00 1.68 0.00 0.00 54.58 55.81 3h6s n ASN 207 Cb 0.64 -4.34 0.04 0.00 -1.54 0.00 0.00 39.78 34.58 3h6s n ASN 207 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 3h6s n ASN 208 N -2.56 -2.31 -4.65 6.41 5.15 -1.26 -4.84 115.26 111.19 3h6s n ASN 208 Ca -0.13 -0.78 -0.48 0.00 -0.60 0.00 0.00 54.58 52.59 3h6s n ASN 208 Cb 0.60 -4.18 -0.05 0.00 -0.53 0.00 0.00 39.78 35.62 3h6s n ASN 208 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 3h6s n HIS 209 N -4.39 2.09 -1.27 1.20 -0.00 -1.24 -0.83 115.22 110.79 3h6s n HIS 209 Ca -0.21 0.33 -0.09 0.00 -0.00 0.00 0.00 57.72 57.75 3h6s n HIS 209 Cb 0.64 -2.51 -0.04 0.00 -0.00 0.00 0.00 29.99 28.08 3h6s n HIS 209 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3h6s n GLY 211 N -0.37 0.66 0.44 0.00 0.00 -0.01 -0.77 105.19 105.13 3h6s n GLY 211 Ca -0.09 -0.26 0.28 0.00 0.00 0.00 0.00 46.02 45.95 3h6s n GLY 211 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3h6s h ILE 212 N 0.00 0.41 -0.72 -0.61 2.10 -1.56 -0.97 117.51 116.16 3h6s h ILE 212 Ca -0.34 -0.09 0.00 0.00 1.08 0.00 0.00 64.86 65.51 3h6s h ILE 212 Cb 1.14 0.12 0.00 0.00 -1.09 0.00 0.00 36.82 36.99 3h6s h ILE 212 CO 0.45 0.05 0.00 0.00 -1.08 0.00 0.00 178.15 177.57 3h6s n ALA 213 N -2.52 2.46 0.10 0.18 0.00 -1.26 -4.52 120.51 114.95 3h6s n ALA 213 Ca 0.28 -1.30 -0.15 0.00 0.00 0.00 0.00 53.44 52.27 3h6s n ALA 213 Cb 1.07 -0.95 -0.13 0.00 0.00 0.00 0.00 19.45 19.43 3h6s n ALA 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h6s h THR 214 N 4.21 1.51 -1.27 0.00 1.03 -1.46 0.16 112.91 117.09 3h6s h THR 214 Ca 0.00 -3.05 -0.39 0.00 -0.01 0.00 0.00 66.41 62.96 3h6s h THR 214 Cb 1.02 2.92 -0.34 0.00 -1.07 0.00 0.00 68.15 70.67 3h6s h THR 214 CO 0.02 0.89 -1.03 0.00 -0.01 0.00 0.00 175.52 175.40 3h6s n ALA 215 N -2.52 1.96 -2.10 0.00 0.00 -1.26 -4.05 120.51 112.54 3h6s n ALA 215 Ca -0.08 -2.88 -0.39 0.00 0.00 0.00 0.00 53.44 50.09 3h6s n ALA 215 Cb 1.01 -0.97 -0.06 0.00 0.00 0.00 0.00 19.45 19.43 3h6s n ALA 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h6s s ALA 216 N -2.04 3.50 0.28 0.00 0.00 -1.26 -3.96 121.76 118.28 3h6s s ALA 216 Ca 0.32 0.23 -0.17 0.00 0.00 0.00 0.00 51.96 52.34 3h6s s ALA 216 Cb 0.38 -2.83 0.02 0.00 0.00 0.00 0.00 23.12 20.68 3h6s s ALA 216 CO -0.04 0.33 0.64 -1.54 0.00 0.00 0.00 175.76 175.15 3h6s s SER 217 N -1.16 -0.13 -0.06 0.00 1.04 0.37 -1.42 113.70 112.36 3h6s s SER 217 Ca 0.33 -0.81 -0.22 0.00 0.48 0.00 0.00 55.95 55.73 3h6s s SER 217 Cb -0.22 0.70 0.05 0.00 0.10 0.00 0.00 66.02 66.65 3h6s s SER 217 CO 0.23 -1.32 0.50 -0.72 0.98 0.00 0.00 173.24 172.91 3h6s s TYR 218 N -3.73 -0.44 0.47 5.02 -0.85 -0.69 -1.23 117.35 115.89 3h6s s TYR 218 Ca 0.16 0.80 -0.20 0.00 -0.52 0.00 0.00 57.07 57.31 3h6s s TYR 218 Cb -0.04 0.25 -0.09 0.00 0.38 0.00 0.00 41.96 42.45 3h6s s TYR 218 CO 0.09 -0.47 1.01 -1.25 -1.52 0.00 0.00 175.55 173.41 3h6s s PRO 219 N -1.04 3.93 -0.39 -3.49 0.04 -1.26 -1.40 135.00 131.39 3h6s s PRO 219 Ca -0.11 1.26 -0.17 0.00 0.04 0.00 0.00 61.00 62.02 3h6s s PRO 219 Cb -0.03 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.40 3h6s s PRO 219 CO 0.06 -0.31 0.45 -0.80 0.04 0.00 0.00 177.00 176.44 3h6s s ASN 220 N -2.12 6.22 0.00 6.66 0.01 0.16 -4.86 114.94 121.01 3h6s s ASN 220 Ca 0.65 -0.44 0.18 0.00 -0.71 0.00 0.00 52.86 52.55 3h6s s ASN 220 Cb -0.14 -2.23 0.15 0.00 0.41 0.00 0.00 41.25 39.44 3h6s s ASN 220 CO 0.19 -0.52 1.08 1.33 -1.51 0.00 0.00 177.10 177.67