#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rhh s LEU 5 N 0.00 3.83 -0.03 2.23 2.96 -1.26 -2.73 118.68 123.68 1rhh s LEU 5 Ca 0.00 -0.87 -0.00 0.00 -0.22 0.00 0.00 54.13 53.04 1rhh s LEU 5 Cb 0.00 -2.49 -0.04 0.00 0.50 0.00 0.00 46.19 44.16 1rhh s LEU 5 CO 0.00 -1.59 0.04 -1.83 -1.32 0.00 0.00 176.35 171.64 1rhh s GLU 6 N 4.77 2.96 0.35 1.98 4.04 -0.98 -4.26 118.70 127.56 1rhh s GLU 6 Ca 0.30 -0.50 0.09 0.00 0.04 0.00 0.00 54.97 54.90 1rhh s GLU 6 Cb -0.11 -2.79 -0.05 0.00 0.02 0.00 0.00 34.13 31.20 1rhh s GLU 6 CO 0.09 0.66 0.06 -0.65 -1.84 0.00 0.00 175.26 173.58 1rhh s GLN 7 N -1.44 2.14 0.84 -4.83 -0.21 -1.26 -0.76 119.66 114.13 1rhh s GLN 7 Ca 0.19 -1.74 -0.11 0.00 0.02 0.00 0.00 55.36 53.72 1rhh s GLN 7 Cb -0.12 -1.96 0.09 0.00 1.00 0.00 0.00 33.01 32.02 1rhh s GLN 7 CO 0.09 0.09 1.09 -1.54 -2.12 0.00 0.00 175.29 172.91 1rhh s SER 8 N -3.76 3.96 0.67 5.90 1.04 -1.13 -5.00 113.70 115.38 1rhh s SER 8 Ca 0.36 1.69 -0.12 0.00 0.48 0.00 0.00 55.95 58.36 1rhh s SER 8 Cb 0.01 -2.37 -0.00 0.00 0.10 0.00 0.00 66.02 63.75 1rhh s SER 8 CO 0.20 -2.36 1.06 -0.83 0.98 0.00 0.00 173.24 172.29 1rhh s GLY 9 N -3.37 1.78 0.80 7.32 0.00 -1.26 -4.67 107.32 107.92 1rhh s GLY 9 Ca 0.62 0.16 -0.14 0.00 0.00 0.00 0.00 44.72 45.36 1rhh s GLY 9 CO 0.57 0.47 0.90 0.00 0.00 0.00 0.00 173.10 175.03 1rhh n ALA 10 N -2.85 -0.77 -3.56 3.20 0.00 -1.26 -4.84 120.51 110.43 1rhh n ALA 10 Ca 0.08 -0.33 -0.14 0.00 0.00 0.00 0.00 53.44 53.04 1rhh n ALA 10 Cb 0.53 -2.07 -0.06 0.00 0.00 0.00 0.00 19.45 17.85 1rhh n ALA 10 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1rhh s GLU 11 N -3.63 0.83 -0.09 0.00 2.12 -0.80 -4.13 118.70 113.01 1rhh s GLU 11 Ca 0.69 0.29 -0.11 0.00 0.36 0.00 0.00 54.97 56.20 1rhh s GLU 11 Cb -0.30 0.39 -0.05 0.00 0.26 0.00 0.00 34.13 34.44 1rhh s GLU 11 CO 0.55 -0.24 0.27 0.54 -0.54 0.00 0.00 175.26 175.84 1rhh s VAL 12 N -0.95 5.28 -0.02 3.70 0.11 -1.26 -1.18 120.40 126.09 1rhh s VAL 12 Ca -0.06 0.52 0.04 0.00 -2.93 0.00 0.00 61.98 59.55 1rhh s VAL 12 Cb -0.01 -3.57 -0.01 0.00 -1.53 0.00 0.00 36.38 31.26 1rhh s VAL 12 CO 0.05 0.55 -0.13 -0.54 -3.33 0.00 0.00 175.10 171.70 1rhh s LYS 13 N -0.68 1.16 0.51 1.54 -0.14 0.85 -4.93 119.74 118.05 1rhh s LYS 13 Ca 0.18 -0.48 -0.20 0.00 -1.36 0.00 0.00 55.97 54.12 1rhh s LYS 13 Cb -0.14 -1.10 -0.08 0.00 -1.68 0.00 0.00 37.83 34.84 1rhh s LYS 13 CO 0.07 0.26 1.05 0.15 -0.76 0.00 0.00 175.35 176.13 1rhh s LYS 14 N -0.21 3.69 0.29 1.68 1.02 -1.23 -0.31 119.74 124.67 1rhh s LYS 14 Ca 0.03 1.37 -0.30 0.00 0.02 0.00 0.00 55.97 57.09 1rhh s LYS 14 Cb -0.06 -2.08 -0.12 0.00 -0.52 0.00 0.00 37.83 35.05 1rhh s LYS 14 CO -0.00 -0.52 1.53 -2.30 -0.92 0.00 0.00 175.35 173.13 1rhh n PRO 15 N -1.14 2.51 0.00 -1.68 -0.02 -1.26 -1.77 135.00 131.64 1rhh n PRO 15 Ca 0.09 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 1rhh n PRO 15 Cb 0.52 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1rhh n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rhh n GLY 16 N 1.96 1.88 2.25 -1.23 0.00 0.23 -4.93 105.19 105.35 1rhh n GLY 16 Ca 0.08 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.93 1rhh n GLY 16 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1rhh n SER 17 N 0.00 0.08 -4.22 1.61 3.41 -0.73 -4.04 113.62 109.73 1rhh n SER 17 Ca 0.00 -1.29 -0.22 0.00 -0.26 0.00 0.00 58.87 57.10 1rhh n SER 17 Cb 0.00 -0.59 -0.13 0.00 -0.26 0.00 0.00 64.21 63.23 1rhh n SER 17 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1rhh s SER 18 N -3.82 2.11 0.04 4.04 0.01 -1.26 -1.17 113.70 113.64 1rhh s SER 18 Ca 0.44 -0.59 0.06 0.00 1.31 0.00 0.00 55.95 57.17 1rhh s SER 18 Cb -0.01 -0.12 -0.02 0.00 0.21 0.00 0.00 66.02 66.07 1rhh s SER 18 CO 0.31 0.04 -0.17 0.54 0.41 0.00 0.00 173.24 174.37 1rhh s VAL 19 N -1.05 1.33 -0.19 3.43 0.11 -0.48 -4.99 120.40 118.56 1rhh s VAL 19 Ca 0.03 -1.04 -0.00 0.00 -2.93 0.00 0.00 61.98 58.04 1rhh s VAL 19 Cb -0.09 -1.17 0.01 0.00 -1.53 0.00 0.00 36.38 33.60 1rhh s VAL 19 CO 0.03 0.11 -0.16 -1.10 -3.33 0.00 0.00 175.10 170.64 1rhh s GLN 20 N -1.08 3.08 -0.18 1.54 -0.21 -1.26 -1.16 119.66 120.38 1rhh s GLN 20 Ca 0.04 -0.78 -0.06 0.00 0.02 0.00 0.00 55.36 54.58 1rhh s GLN 20 Cb -0.08 -2.67 -0.03 0.00 1.00 0.00 0.00 33.01 31.23 1rhh s GLN 20 CO 0.01 -0.21 0.03 0.08 -2.12 0.00 0.00 175.29 173.08 1rhh s VAL 21 N 1.33 4.37 0.22 1.09 1.01 -0.14 -4.95 120.40 123.33 1rhh s VAL 21 Ca 0.05 -0.18 0.06 0.00 0.00 0.00 0.00 61.98 61.92 1rhh s VAL 21 Cb -0.13 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 1rhh s VAL 21 CO -0.11 0.45 0.19 -0.94 0.00 0.00 0.00 175.10 174.69 1rhh s SER 22 N 0.59 5.57 -0.22 3.32 1.04 -1.26 -1.68 113.70 121.06 1rhh s SER 22 Ca 0.01 -0.19 -0.03 0.00 0.48 0.00 0.00 55.95 56.22 1rhh s SER 22 Cb -0.14 -1.45 0.10 0.00 0.10 0.00 0.00 66.02 64.64 1rhh s SER 22 CO 0.02 -0.00 0.23 0.00 0.98 0.00 0.00 173.24 174.47 1rhh s LYS 24 N 2.32 4.21 -0.06 0.00 2.20 0.06 -0.38 119.74 128.09 1rhh s LYS 24 Ca 0.08 0.34 -0.25 0.00 -0.36 0.00 0.00 55.97 55.77 1rhh s LYS 24 Cb -0.15 -3.53 -0.03 0.00 -1.51 0.00 0.00 37.83 32.60 1rhh s LYS 24 CO -0.17 -0.05 0.79 0.00 -0.36 0.00 0.00 175.35 175.56 1rhh s ALA 25 N 1.33 3.31 1.16 3.13 0.00 0.86 -2.31 121.76 129.24 1rhh s ALA 25 Ca 0.22 0.23 -0.19 0.00 0.00 0.00 0.00 51.96 52.22 1rhh s ALA 25 Cb -0.15 -3.08 0.27 0.00 0.00 0.00 0.00 23.12 20.16 1rhh s ALA 25 CO 0.09 -0.19 1.17 0.45 0.00 0.00 0.00 175.76 177.28 1rhh n SER 26 N 3.96 -1.30 0.00 0.00 2.88 -1.10 -3.73 113.62 114.33 1rhh n SER 26 Ca 0.01 -1.28 0.00 0.00 -1.33 0.00 0.00 58.87 56.27 1rhh n SER 26 Cb 0.51 -1.00 0.00 0.00 -0.75 0.00 0.00 64.21 62.97 1rhh n SER 26 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1rhh n GLY 27 N -4.34 0.45 3.77 0.46 0.00 -1.26 -3.81 105.19 100.46 1rhh n GLY 27 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 1rhh n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rhh n GLY 28 N -1.75 -0.49 3.62 -0.02 0.00 -1.24 -4.98 105.19 100.32 1rhh n GLY 28 Ca 0.00 0.21 -0.04 0.00 0.00 0.00 0.00 46.02 46.18 1rhh n GLY 28 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1rhh s THR 29 N -3.34 0.00 -0.07 2.61 -1.32 -1.25 -4.90 115.64 107.37 1rhh s THR 29 Ca 0.55 0.00 0.13 0.00 -1.21 0.00 0.00 61.69 61.16 1rhh s THR 29 Cb -0.26 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.63 1rhh s THR 29 CO 0.79 0.00 1.12 -0.26 -2.21 0.00 0.00 174.62 174.06 1rhh h PHE 30 N 2.18 0.00 0.00 9.09 0.04 -1.90 -3.45 116.94 122.89 1rhh h PHE 30 Ca -0.11 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1rhh h PHE 30 Cb 1.18 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.33 1rhh h PHE 30 CO 0.23 0.71 0.00 0.45 -0.60 0.00 0.00 178.31 179.10 1rhh n SER 31 N -3.13 0.00 -1.17 2.17 2.88 -1.26 -1.57 113.62 111.54 1rhh n SER 31 Ca -0.04 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.61 1rhh n SER 31 Cb 0.86 0.00 0.23 0.00 -0.75 0.00 0.00 64.21 64.55 1rhh n SER 31 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1rhh n MET 32 N 14.00 2.52 -2.48 -1.46 2.81 -1.26 -4.44 117.12 126.81 1rhh n MET 32 Ca 0.00 -2.31 -0.35 0.00 -1.81 0.00 0.00 57.70 53.24 1rhh n MET 32 Cb 0.00 -1.52 -0.03 0.00 -0.71 0.00 0.00 33.22 30.96 1rhh n MET 32 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 1rhh s TYR 33 N -1.46 2.99 0.04 2.03 2.02 -0.61 -4.59 117.35 117.78 1rhh s TYR 33 Ca 0.40 1.58 0.02 0.00 -0.37 0.00 0.00 57.07 58.70 1rhh s TYR 33 Cb 0.23 -3.14 -0.04 0.00 -0.40 0.00 0.00 41.96 38.61 1rhh s TYR 33 CO 0.32 -0.96 0.07 0.20 -1.57 0.00 0.00 175.55 173.60 1rhh s GLY 34 N -1.82 2.00 -0.21 0.71 0.00 0.12 -4.22 107.32 103.91 1rhh s GLY 34 Ca 0.66 -0.96 0.01 0.00 0.00 0.00 0.00 44.72 44.42 1rhh s GLY 34 CO 0.24 -0.89 -0.15 -1.36 0.00 0.00 0.00 173.10 170.93 1rhh s PHE 35 N -1.28 2.91 0.22 1.90 0.08 -0.02 -0.81 117.98 120.98 1rhh s PHE 35 Ca 0.26 -1.69 0.08 0.00 0.12 0.00 0.00 56.93 55.70 1rhh s PHE 35 Cb -0.12 -1.95 -0.04 0.00 -0.57 0.00 0.00 43.02 40.33 1rhh s PHE 35 CO 0.18 -0.79 0.03 -0.80 -0.10 0.00 0.00 175.22 173.74 1rhh s ASN 35 N 1.28 4.80 -0.15 1.36 0.01 0.76 -1.28 114.94 121.72 1rhh s ASN 35 Ca 0.02 -0.47 0.02 0.00 -0.71 0.00 0.00 52.86 51.71 1rhh s ASN 35 Cb -0.15 -1.01 0.01 0.00 0.41 0.00 0.00 41.25 40.52 1rhh s ASN 35 CO -0.10 0.03 -0.20 0.26 -1.51 0.00 0.00 177.10 175.58 1rhh s TRP 36 N -2.04 2.60 -0.09 2.20 0.51 -0.19 -0.35 118.94 121.58 1rhh s TRP 36 Ca 0.30 -1.39 0.02 0.00 -2.12 0.00 0.00 56.10 52.92 1rhh s TRP 36 Cb -0.08 -1.79 0.01 0.00 -0.81 0.00 0.00 33.47 30.80 1rhh s TRP 36 CO 0.20 -0.66 -0.15 0.08 -0.51 0.00 0.00 176.95 175.91 1rhh s VAL 37 N 1.02 1.44 0.30 4.03 1.01 -0.50 -0.71 120.40 127.00 1rhh s VAL 37 Ca -0.03 -0.64 0.09 0.00 0.00 0.00 0.00 61.98 61.40 1rhh s VAL 37 Cb -0.15 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 1rhh s VAL 37 CO -0.06 0.43 0.06 0.00 0.00 0.00 0.00 175.10 175.53 1rhh s ARG 38 N 0.75 2.34 -0.21 2.72 1.70 -0.65 0.35 118.95 125.95 1rhh s ARG 38 Ca -0.12 -1.48 -0.05 0.00 -0.47 0.00 0.00 55.73 53.62 1rhh s ARG 38 Cb -0.16 -2.17 0.11 0.00 -0.57 0.00 0.00 34.95 32.16 1rhh s ARG 38 CO 0.02 0.25 0.37 -1.14 -1.08 0.00 0.00 175.30 173.73 1rhh s GLN 39 N -3.75 0.30 0.38 3.89 0.74 -0.37 -1.58 119.66 119.28 1rhh s GLN 39 Ca 0.34 0.75 -0.27 0.00 0.05 0.00 0.00 55.36 56.23 1rhh s GLN 39 Cb -0.04 -0.13 -0.09 0.00 1.10 0.00 0.00 33.01 33.85 1rhh s GLN 39 CO 0.21 -0.44 1.25 0.00 -0.55 0.00 0.00 175.29 175.77 1rhh s ALA 40 N 2.55 3.29 -0.06 1.58 0.00 -1.26 -1.20 121.76 126.65 1rhh s ALA 40 Ca 0.05 1.14 -0.37 0.00 0.00 0.00 0.00 51.96 52.79 1rhh s ALA 40 Cb -0.14 -3.45 -0.15 0.00 0.00 0.00 0.00 23.12 19.39 1rhh s ALA 40 CO -0.13 -0.67 1.66 -2.30 0.00 0.00 0.00 175.76 174.32 1rhh n PRO 41 N 0.31 1.60 -0.88 0.00 -0.02 -1.26 -0.83 135.00 133.92 1rhh n PRO 41 Ca 0.03 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1rhh n PRO 41 Cb 0.44 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 1rhh n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rhh n GLY 42 N 3.71 0.67 0.00 -1.23 0.00 -1.26 -5.02 105.19 102.06 1rhh n GLY 42 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1rhh n GLY 42 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1rhh n HIS 43 N -2.64 0.00 -2.04 1.61 8.25 -0.01 -5.17 115.22 115.22 1rhh n HIS 43 Ca 0.00 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.27 1rhh n HIS 43 Cb 0.00 0.00 0.12 0.00 1.12 0.00 0.00 29.99 31.23 1rhh n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rhh n GLY 44 N 3.15 -0.46 3.88 -1.41 0.00 -1.26 -4.70 105.19 104.38 1rhh n GLY 44 Ca 0.00 -1.84 -0.35 0.00 0.00 0.00 0.00 46.02 43.83 1rhh n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rhh s LEU 45 N 0.00 4.37 -0.09 0.99 1.43 -1.26 -4.05 118.68 120.07 1rhh s LEU 45 Ca 0.51 0.64 -0.04 0.00 -1.03 0.00 0.00 54.13 54.21 1rhh s LEU 45 Cb -0.02 -2.76 0.05 0.00 0.03 0.00 0.00 46.19 43.49 1rhh s LEU 45 CO 0.35 0.23 0.20 -1.83 0.23 0.00 0.00 176.35 175.53 1rhh s GLU 46 N -1.77 0.13 0.15 1.70 -1.05 -0.61 -4.99 118.70 112.26 1rhh s GLU 46 Ca 0.29 0.49 -0.30 0.00 -0.15 0.00 0.00 54.97 55.30 1rhh s GLU 46 Cb -0.14 -0.16 -0.07 0.00 -0.44 0.00 0.00 34.13 33.33 1rhh s GLU 46 CO 0.16 -0.19 1.17 -0.46 0.95 0.00 0.00 175.26 176.89 1rhh s TRP 47 N 1.46 3.48 -0.20 4.83 -0.00 -1.26 -1.64 118.94 125.62 1rhh s TRP 47 Ca -0.07 1.45 0.05 0.00 -0.00 0.00 0.00 56.10 57.53 1rhh s TRP 47 Cb -0.11 -3.38 -0.16 0.00 -0.00 0.00 0.00 33.47 29.83 1rhh s TRP 47 CO -0.07 -1.03 -0.12 -1.33 -0.00 0.00 0.00 176.95 174.40 1rhh n MET 48 N 2.85 0.74 -3.26 5.86 2.81 0.12 -4.64 117.12 121.60 1rhh n MET 48 Ca 0.05 0.09 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 1rhh n MET 48 Cb 0.46 -1.42 0.00 0.00 -0.71 0.00 0.00 33.22 31.54 1rhh n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rhh n GLY 49 N 2.35 -1.11 3.92 3.03 0.00 -1.23 -1.28 105.19 110.87 1rhh n GLY 49 Ca -0.35 -1.37 0.01 0.00 0.00 0.00 0.00 46.02 44.31 1rhh n GLY 49 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rhh s GLY 50 N 0.00 -0.08 -0.07 -0.02 0.00 -0.59 -1.02 107.32 105.54 1rhh s GLY 50 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 44.72 44.64 1rhh s GLY 50 CO 0.00 4.06 0.19 -1.50 0.00 0.00 0.00 173.10 175.85 1rhh s ILE 51 N -2.12 -0.01 -0.52 0.90 2.07 -0.41 -2.17 121.20 118.95 1rhh s ILE 51 Ca 0.25 0.02 -0.07 0.00 -1.41 0.00 0.00 60.65 59.44 1rhh s ILE 51 Cb -0.01 -0.27 0.13 0.00 0.13 0.00 0.00 42.46 42.44 1rhh s ILE 51 CO 0.01 0.01 0.38 -0.63 -1.91 0.00 0.00 174.94 172.79 1rhh s ILE 52 N 0.24 4.10 0.22 2.00 1.01 0.86 -0.84 121.20 128.78 1rhh s ILE 52 Ca -0.01 -2.09 -0.16 0.00 0.00 0.00 0.00 60.65 58.40 1rhh s ILE 52 Cb -0.02 -3.69 0.24 0.00 0.01 0.00 0.00 42.46 38.99 1rhh s ILE 52 CO -0.01 -0.80 1.59 -0.65 0.00 0.00 0.00 174.94 175.07 1rhh h PRO 52 N 8.09 -0.06 -0.85 2.79 0.11 -1.84 0.15 132.00 140.39 1rhh h PRO 52 Ca -0.14 0.00 0.12 0.00 0.11 0.00 0.00 66.00 66.10 1rhh h PRO 52 Cb 1.05 0.01 -0.08 0.00 0.11 0.00 0.00 31.00 32.08 1rhh h PRO 52 CO 0.80 -0.04 0.47 0.97 -0.21 0.00 0.00 178.00 179.99 1rhh h ILE 53 N -0.06 0.82 0.00 4.15 6.09 -1.85 -1.98 117.51 124.69 1rhh h ILE 53 Ca 0.32 -0.25 0.00 0.00 -1.37 0.00 0.00 64.86 63.56 1rhh h ILE 53 Cb 0.57 0.04 0.00 0.00 0.47 0.00 0.00 36.82 37.89 1rhh h ILE 53 CO -0.78 0.13 -0.76 0.49 -3.07 0.00 0.00 178.15 174.16 1rhh n PHE 54 N -4.80 0.13 -2.27 2.19 3.72 -0.91 -4.96 117.46 110.56 1rhh n PHE 54 Ca 0.16 0.04 -0.14 0.00 -0.05 0.00 0.00 57.45 57.46 1rhh n PHE 54 Cb 0.36 -0.31 -0.01 0.00 -0.94 0.00 0.00 39.48 38.59 1rhh n PHE 54 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1rhh n GLY 55 N 1.44 -0.20 3.65 1.37 0.00 0.47 -5.00 105.19 106.92 1rhh n GLY 55 Ca 0.04 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 1rhh n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rhh s THR 56 N -2.69 4.48 -0.02 2.61 2.01 -1.12 -4.94 115.64 115.96 1rhh s THR 56 Ca 0.00 -0.16 -0.12 0.00 0.31 0.00 0.00 61.69 61.72 1rhh s THR 56 Cb -0.00 -2.95 0.02 0.00 0.01 0.00 0.00 72.50 69.58 1rhh s THR 56 CO 0.01 0.54 0.25 -0.94 -0.69 0.00 0.00 174.62 173.78 1rhh s SER 57 N -0.25 -0.13 0.35 3.53 1.04 -1.26 -0.10 113.70 116.88 1rhh s SER 57 Ca 0.07 0.03 -0.16 0.00 0.48 0.00 0.00 55.95 56.37 1rhh s SER 57 Cb -0.12 0.30 0.04 0.00 0.10 0.00 0.00 66.02 66.34 1rhh s SER 57 CO 0.02 -0.39 0.74 0.54 0.98 0.00 0.00 173.24 175.13 1rhh s ASN 58 N -1.21 -0.01 0.33 7.02 2.20 -0.92 -5.01 114.94 117.34 1rhh s ASN 58 Ca -0.13 -1.01 -0.13 0.00 -0.94 0.00 0.00 52.86 50.66 1rhh s ASN 58 Cb -0.06 0.80 0.02 0.00 -2.00 0.00 0.00 41.25 40.01 1rhh s ASN 58 CO 0.03 -1.55 0.63 -0.72 -2.94 0.00 0.00 177.10 172.55 1rhh s TYR 59 N -2.88 0.37 0.18 1.54 -0.85 -1.26 -1.54 117.35 112.91 1rhh s TYR 59 Ca 0.15 -0.83 -0.28 0.00 -0.52 0.00 0.00 57.07 55.60 1rhh s TYR 59 Cb -0.05 0.44 -0.08 0.00 0.38 0.00 0.00 41.96 42.65 1rhh s TYR 59 CO 0.11 -1.28 0.88 0.00 -1.52 0.00 0.00 175.55 173.73 1rhh s ALA 60 N -3.13 3.36 0.63 9.51 0.00 -0.41 -4.93 121.76 126.79 1rhh s ALA 60 Ca 0.20 0.51 0.30 0.00 0.00 0.00 0.00 51.96 52.97 1rhh s ALA 60 Cb -0.03 -3.13 1.66 0.00 0.00 0.00 0.00 23.12 21.62 1rhh s ALA 60 CO 0.12 0.18 1.99 1.96 0.00 0.00 0.00 175.76 180.02 1rhh h GLN 61 N 4.56 0.00 -0.16 0.00 1.08 -1.96 -0.79 115.11 117.83 1rhh h GLN 61 Ca -0.45 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 56.80 1rhh h GLN 61 Cb 1.20 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.63 1rhh h GLN 61 CO 0.68 0.00 0.13 -0.22 -0.95 0.00 0.00 178.83 178.47 1rhh h LYS 62 N 0.00 0.00 -0.39 1.46 3.64 -1.96 -1.88 116.57 117.45 1rhh h LYS 62 Ca 0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1rhh h LYS 62 Cb 0.71 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1rhh h LYS 62 CO -0.00 0.00 0.00 1.19 -2.27 0.00 0.00 179.45 178.37 1rhh n PHE 63 N -4.28 1.16 -1.74 1.91 3.72 -0.30 -5.01 117.46 112.92 1rhh n PHE 63 Ca 0.01 -0.76 -0.42 0.00 -0.05 0.00 0.00 57.45 56.23 1rhh n PHE 63 Cb 0.26 -0.30 -0.01 0.00 -0.94 0.00 0.00 39.48 38.48 1rhh n PHE 63 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 1rhh n ARG 64 N 0.09 2.59 -0.94 -1.08 1.85 -0.71 -1.21 116.66 117.25 1rhh n ARG 64 Ca 0.22 0.92 0.00 0.00 -1.00 0.00 0.00 57.85 57.99 1rhh n ARG 64 Cb 0.88 -2.67 0.00 0.00 -1.05 0.00 0.00 32.46 29.62 1rhh n ARG 64 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1rhh n GLY 65 N 1.88 0.59 0.00 2.89 0.00 -1.26 -4.80 105.19 104.49 1rhh n GLY 65 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1rhh n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rhh n ARG 66 N -2.05 2.58 -4.40 1.61 1.74 -0.35 -4.95 116.66 110.84 1rhh n ARG 66 Ca 0.00 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.78 1rhh n ARG 66 Cb 0.05 -0.96 -0.11 0.00 -1.02 0.00 0.00 32.46 30.42 1rhh n ARG 66 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1rhh s VAL 67 N -1.90 3.22 -0.01 1.55 -7.23 -1.07 -1.65 120.40 113.31 1rhh s VAL 67 Ca 0.00 -1.16 0.00 0.00 -1.81 0.00 0.00 61.98 59.01 1rhh s VAL 67 Cb 0.00 -2.44 0.01 0.00 0.56 0.00 0.00 36.38 34.51 1rhh s VAL 67 CO 0.00 0.23 0.01 -0.89 -0.31 0.00 0.00 175.10 174.14 1rhh s THR 68 N -1.08 0.00 -0.12 5.32 2.01 -0.79 -4.98 115.64 116.00 1rhh s THR 68 Ca 0.18 0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.28 1rhh s THR 68 Cb -0.11 -0.06 0.00 0.00 0.01 0.00 0.00 72.50 72.35 1rhh s THR 68 CO 0.10 0.04 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.49 1rhh s PHE 69 N 0.39 2.64 0.19 4.92 0.08 -1.26 -1.04 117.98 123.90 1rhh s PHE 69 Ca -0.03 -1.09 0.03 0.00 0.12 0.00 0.00 56.93 55.96 1rhh s PHE 69 Cb -0.05 -1.77 -0.05 0.00 -0.57 0.00 0.00 43.02 40.58 1rhh s PHE 69 CO -0.01 -0.46 -0.03 0.99 -0.10 0.00 0.00 175.22 175.61 1rhh s THR 70 N 0.52 0.98 -0.14 0.64 2.01 -0.47 -5.00 115.64 114.19 1rhh s THR 70 Ca -0.13 -2.03 -0.13 0.00 0.31 0.00 0.00 61.69 59.71 1rhh s THR 70 Cb -0.17 -2.14 0.04 0.00 0.01 0.00 0.00 72.50 70.25 1rhh s THR 70 CO 0.05 -0.49 0.38 0.00 -0.69 0.00 0.00 174.62 173.87 1rhh s ALA 71 N -3.45 -0.94 -0.25 7.40 0.00 -1.26 0.10 121.76 123.36 1rhh s ALA 71 Ca 0.24 1.12 -0.01 0.00 0.00 0.00 0.00 51.96 53.31 1rhh s ALA 71 Cb 0.05 -0.66 0.03 0.00 0.00 0.00 0.00 23.12 22.54 1rhh s ALA 71 CO 0.05 -0.19 -0.08 0.34 0.00 0.00 0.00 175.76 175.89 1rhh s ASP 72 N 0.35 4.25 0.31 0.00 2.15 0.23 -4.99 116.67 118.97 1rhh s ASP 72 Ca -0.01 -0.92 0.04 0.00 0.43 0.00 0.00 52.55 52.08 1rhh s ASP 72 Cb -0.03 -1.64 0.52 0.00 -0.30 0.00 0.00 42.92 41.47 1rhh s ASP 72 CO -0.01 -0.13 1.81 -0.61 -0.17 0.00 0.00 175.17 176.06 1rhh h GLN 73 N 7.98 0.50 -0.29 4.34 4.15 -1.96 0.10 115.11 129.93 1rhh h GLN 73 Ca -0.32 -0.14 -0.02 0.00 0.77 0.00 0.00 58.65 58.94 1rhh h GLN 73 Cb 1.10 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.72 1rhh h GLN 73 CO 0.57 0.61 0.09 0.00 -1.93 0.00 0.00 178.83 178.16 1rhh h ALA 74 N 1.42 1.60 -0.09 3.38 0.00 -1.97 -3.05 119.26 120.56 1rhh h ALA 74 Ca 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1rhh h ALA 74 Cb 0.47 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1rhh h ALA 74 CO 0.03 0.31 0.00 0.25 0.00 0.00 0.00 179.25 179.83 1rhh n THR 75 N -4.39 0.35 -3.09 0.00 -2.24 -1.10 -4.98 114.28 98.84 1rhh n THR 75 Ca 0.01 -0.67 -0.21 0.00 -2.27 0.00 0.00 64.05 60.91 1rhh n THR 75 Cb 0.16 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 1rhh n THR 75 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1rhh n SER 76 N 0.34 -4.34 -4.29 3.42 7.64 0.32 -4.73 113.62 111.99 1rhh n SER 76 Ca 0.06 -0.24 -0.33 0.00 1.01 0.00 0.00 58.87 59.36 1rhh n SER 76 Cb 0.25 -3.58 -0.15 0.00 -1.01 0.00 0.00 64.21 59.72 1rhh n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1rhh s THR 77 N -2.93 2.73 0.03 0.44 2.01 -0.99 -0.10 115.64 116.84 1rhh s THR 77 Ca 0.29 -0.76 -0.01 0.00 0.31 0.00 0.00 61.69 61.53 1rhh s THR 77 Cb -0.15 -2.14 -0.04 0.00 0.01 0.00 0.00 72.50 70.18 1rhh s THR 77 CO 0.36 0.52 0.18 0.00 -0.69 0.00 0.00 174.62 174.99 1rhh s ALA 78 N 0.63 3.91 0.08 7.40 0.00 0.48 -0.60 121.76 133.66 1rhh s ALA 78 Ca -0.08 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.07 1rhh s ALA 78 Cb -0.16 -1.79 -0.03 0.00 0.00 0.00 0.00 23.12 21.14 1rhh s ALA 78 CO 0.03 0.78 -0.09 0.71 0.00 0.00 0.00 175.76 177.19 1rhh s TYR 79 N -1.40 0.92 -0.04 0.00 1.51 0.12 -0.28 117.35 118.17 1rhh s TYR 79 Ca 0.31 -0.64 0.01 0.00 -1.01 0.00 0.00 57.07 55.73 1rhh s TYR 79 Cb -0.13 -0.52 0.03 0.00 -0.11 0.00 0.00 41.96 41.23 1rhh s TYR 79 CO 0.23 -0.05 -0.01 1.41 -1.11 0.00 0.00 175.55 176.02 1rhh s MET 80 N -2.51 0.48 -0.14 -0.62 1.75 -0.67 -1.37 119.30 116.21 1rhh s MET 80 Ca 0.01 0.02 -0.01 0.00 -1.25 0.00 0.00 55.69 54.46 1rhh s MET 80 Cb -0.04 -0.62 -0.02 0.00 2.84 0.00 0.00 34.83 36.99 1rhh s MET 80 CO -0.01 -0.13 -0.11 -2.00 -0.65 0.00 0.00 175.02 172.13 1rhh s GLU 81 N 1.04 3.44 -0.17 4.11 2.12 -0.20 -0.97 118.70 128.06 1rhh s GLU 81 Ca -0.09 -0.65 0.01 0.00 0.36 0.00 0.00 54.97 54.59 1rhh s GLU 81 Cb -0.14 -2.71 0.01 0.00 0.26 0.00 0.00 34.13 31.55 1rhh s GLU 81 CO -0.01 0.19 -0.18 -1.17 -0.54 0.00 0.00 175.26 173.54 1rhh s LEU 82 N 0.44 2.25 0.40 2.70 2.96 -0.31 -1.88 118.68 125.24 1rhh s LEU 82 Ca -0.08 -0.59 0.08 0.00 -0.22 0.00 0.00 54.13 53.32 1rhh s LEU 82 Cb -0.15 -1.51 -0.02 0.00 0.50 0.00 0.00 46.19 45.01 1rhh s LEU 82 CO 0.04 0.03 0.40 0.42 -1.32 0.00 0.00 176.35 175.93 1rhh s THR 82 N 1.13 2.94 -1.32 3.68 -4.23 -0.66 -1.38 115.64 115.80 1rhh s THR 82 Ca 0.01 -1.27 -0.00 0.00 -1.18 0.00 0.00 61.69 59.25 1rhh s THR 82 Cb -0.14 -3.05 0.00 0.00 1.34 0.00 0.00 72.50 70.65 1rhh s THR 82 CO -0.08 -0.04 0.70 0.59 -0.54 0.00 0.00 174.62 175.26 1rhh n ASN 82 N -1.58 -1.25 -4.75 3.99 3.02 -0.98 -4.89 115.26 108.82 1rhh n ASN 82 Ca 0.03 -0.82 -0.41 0.00 -0.03 0.00 0.00 54.58 53.35 1rhh n ASN 82 Cb 0.61 -4.03 0.01 0.00 -0.61 0.00 0.00 39.78 35.76 1rhh n ASN 82 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1rhh n LEU 82 N -4.29 4.69 -4.33 3.41 4.77 -0.32 -4.61 117.00 116.32 1rhh n LEU 82 Ca -0.29 1.15 -0.17 0.00 -0.03 0.00 0.00 56.01 56.67 1rhh n LEU 82 Cb 0.67 -1.58 -0.10 0.00 -2.33 0.00 0.00 43.42 40.08 1rhh n LEU 82 CO 0.69 -0.20 -0.30 -0.13 -1.33 0.00 0.00 177.39 176.11 1rhh s ARG 83 N -2.27 1.38 0.32 3.23 1.81 -1.26 0.77 118.95 122.93 1rhh s ARG 83 Ca 0.59 -1.72 0.09 0.00 -1.72 0.00 0.00 55.73 52.96 1rhh s ARG 83 Cb -0.48 -0.52 0.85 0.00 -0.45 0.00 0.00 34.95 34.35 1rhh s ARG 83 CO 0.60 -0.17 1.75 0.66 -0.68 0.00 0.00 175.30 177.46 1rhh h SER 84 N 2.42 0.71 0.00 0.23 4.64 -1.96 0.10 113.55 119.69 1rhh h SER 84 Ca -0.38 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1rhh h SER 84 Cb 1.23 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1rhh h SER 84 CO 0.64 0.16 0.00 -0.90 -0.87 0.00 0.00 176.83 175.86 1rhh n ASP 85 N -4.84 0.00 -0.60 4.97 5.75 -1.26 -2.03 116.55 118.54 1rhh n ASP 85 Ca 0.26 -1.66 0.12 0.00 -0.01 0.00 0.00 54.79 53.49 1rhh n ASP 85 Cb 0.69 0.00 0.08 0.00 -1.03 0.00 0.00 41.12 40.86 1rhh n ASP 85 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1rhh n ASP 86 N -0.52 2.18 -4.67 -1.12 8.00 0.36 -4.89 116.55 115.89 1rhh n ASP 86 Ca 0.01 -1.59 -0.42 0.00 0.71 0.00 0.00 54.79 53.50 1rhh n ASP 86 Cb 0.00 0.30 -0.03 0.00 -0.02 0.00 0.00 41.12 41.38 1rhh n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1rhh s THR 87 N -2.34 3.33 -0.03 -3.53 2.01 -0.86 -4.86 115.64 109.36 1rhh s THR 87 Ca 0.22 0.55 -0.30 0.00 0.31 0.00 0.00 61.69 62.48 1rhh s THR 87 Cb 0.19 -3.36 0.12 0.00 0.01 0.00 0.00 72.50 69.46 1rhh s THR 87 CO 0.49 -0.03 1.31 0.00 -0.69 0.00 0.00 174.62 175.69 1rhh s ALA 88 N 3.55 -2.35 -0.25 7.40 0.00 -0.86 -4.58 121.76 124.67 1rhh s ALA 88 Ca 0.75 0.50 -0.15 0.00 0.00 0.00 0.00 51.96 53.07 1rhh s ALA 88 Cb -0.37 0.52 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 1rhh s ALA 88 CO 0.32 -1.09 0.36 0.08 0.00 0.00 0.00 175.76 175.43 1rhh s VAL 89 N -2.24 5.20 -0.30 0.00 1.01 -0.34 -1.19 120.40 122.53 1rhh s VAL 89 Ca 0.19 0.57 -0.12 0.00 0.00 0.00 0.00 61.98 62.62 1rhh s VAL 89 Cb 0.03 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 1rhh s VAL 89 CO -0.03 0.20 0.23 -0.31 0.00 0.00 0.00 175.10 175.18 1rhh s TYR 90 N 1.81 3.22 -0.07 5.22 1.51 0.36 -1.24 117.35 128.17 1rhh s TYR 90 Ca 0.15 0.04 -0.04 0.00 -1.01 0.00 0.00 57.07 56.22 1rhh s TYR 90 Cb -0.15 -2.44 -0.04 0.00 -0.11 0.00 0.00 41.96 39.22 1rhh s TYR 90 CO 0.09 -0.24 0.12 0.71 -1.11 0.00 0.00 175.55 175.12 1rhh s TYR 91 N 1.79 3.46 -0.16 2.71 2.02 0.15 -0.94 117.35 126.38 1rhh s TYR 91 Ca 0.08 0.38 -0.14 0.00 -0.37 0.00 0.00 57.07 57.01 1rhh s TYR 91 Cb -0.16 -1.85 -0.05 0.00 -0.40 0.00 0.00 41.96 39.50 1rhh s TYR 91 CO 0.11 0.64 0.32 0.00 -1.57 0.00 0.00 175.55 175.05 1rhh s ALA 93 N 0.60 1.13 -0.01 0.00 0.00 0.52 0.06 121.76 124.07 1rhh s ALA 93 Ca 0.17 -0.39 -0.13 0.00 0.00 0.00 0.00 51.96 51.61 1rhh s ALA 93 Cb -0.13 -0.76 -0.05 0.00 0.00 0.00 0.00 23.12 22.18 1rhh s ALA 93 CO 0.05 -0.27 0.37 0.50 0.00 0.00 0.00 175.76 176.41 1rhh s ARG 94 N 1.45 3.84 0.32 0.00 3.52 0.01 -0.17 118.95 127.92 1rhh s ARG 94 Ca -0.01 0.32 0.03 0.00 -0.13 0.00 0.00 55.73 55.94 1rhh s ARG 94 Cb -0.13 -3.20 -0.04 0.00 -1.56 0.00 0.00 34.95 30.01 1rhh s ARG 94 CO -0.04 0.69 0.11 0.16 -0.81 0.00 0.00 175.30 175.41 1rhh s ASP 95 N -1.13 2.00 0.02 -2.12 1.47 0.01 -1.94 116.67 114.97 1rhh s ASP 95 Ca 0.23 -1.49 -0.28 0.00 1.18 0.00 0.00 52.55 52.19 1rhh s ASP 95 Cb -0.16 0.23 0.10 0.00 -0.34 0.00 0.00 42.92 42.75 1rhh s ASP 95 CO 0.13 -0.78 0.91 0.72 0.68 0.00 0.00 175.17 176.83 1rhh s PHE 96 N -3.46 -0.30 -0.08 2.11 -0.71 -1.26 0.11 117.98 114.39 1rhh s PHE 96 Ca 0.33 0.14 -0.02 0.00 -1.04 0.00 0.00 56.93 56.35 1rhh s PHE 96 Cb 0.06 0.56 0.03 0.00 -1.21 0.00 0.00 43.02 42.46 1rhh s PHE 96 CO 0.15 -0.58 0.01 0.20 -1.34 0.00 0.00 175.22 173.66 1rhh s GLY 97 N -2.56 0.46 -0.74 1.99 0.00 -1.26 -4.23 107.32 100.98 1rhh s GLY 97 Ca 0.06 -0.14 -0.27 0.00 0.00 0.00 0.00 44.72 44.37 1rhh s GLY 97 CO -0.07 1.20 1.30 -4.14 0.00 0.00 0.00 173.10 171.39 1rhh s PRO 98 N 1.99 3.18 -0.06 2.90 0.02 -1.26 -4.75 135.00 137.01 1rhh s PRO 98 Ca 0.05 -0.22 0.17 0.00 0.02 0.00 0.00 61.00 61.01 1rhh s PRO 98 Cb -0.13 -4.20 0.33 0.00 0.02 0.00 0.00 34.50 30.52 1rhh s PRO 98 CO -0.05 -2.17 1.15 -0.25 -0.33 0.00 0.00 177.00 175.34 1rhh n ASP 99 N 9.49 1.12 -2.60 2.53 8.00 -1.26 -4.76 116.55 129.06 1rhh n ASP 99 Ca 0.04 -2.58 -0.08 0.00 0.71 0.00 0.00 54.79 52.88 1rhh n ASP 99 Cb 0.49 -0.35 0.04 0.00 -0.02 0.00 0.00 41.12 41.28 1rhh n ASP 99 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1rhh n TRP 100 N -0.20 -1.64 -1.59 1.24 7.02 -1.26 -4.13 117.44 116.88 1rhh n TRP 100 Ca 0.09 0.58 -0.02 0.00 -1.02 0.00 0.00 57.50 57.13 1rhh n TRP 100 Cb 0.90 -3.48 -0.00 0.00 -2.42 0.00 0.00 31.31 26.30 1rhh n TRP 100 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 1rhh n GLU 100 N -2.42 -0.14 -0.84 -0.99 4.71 -1.26 -5.02 120.64 114.68 1rhh n GLU 100 Ca -0.04 0.30 0.00 0.00 -0.01 0.00 0.00 57.16 57.41 1rhh n GLU 100 Cb 0.56 -3.89 0.00 0.00 -1.01 0.00 0.00 31.44 27.10 1rhh n GLU 100 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 1rhh n ASP 100 N 1.68 0.00 0.00 1.62 5.68 -1.26 -5.13 116.55 119.13 1rhh n ASP 100 Ca -0.02 -0.73 0.00 0.00 -0.50 0.00 0.00 54.79 53.54 1rhh n ASP 100 Cb 0.31 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 1rhh n ASP 100 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rhh n GLY 100 N 0.00 0.00 3.47 6.12 0.00 -1.26 -4.26 105.19 109.26 1rhh n GLY 100 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1rhh n GLY 100 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rhh s ASP 100 N -2.48 -1.23 0.00 1.61 2.15 -1.26 -4.66 116.67 110.80 1rhh s ASP 100 Ca 0.00 1.32 0.00 0.00 0.43 0.00 0.00 52.55 54.30 1rhh s ASP 100 Cb 0.00 2.25 0.00 0.00 -0.30 0.00 0.00 42.92 44.87 1rhh s ASP 100 CO 0.00 -0.23 0.36 -1.54 -0.17 0.00 0.00 175.17 173.59 1rhh n SER 100 N 5.44 0.00 0.00 -0.34 3.41 -1.26 -5.08 113.62 115.79 1rhh n SER 100 Ca -0.08 -1.05 0.00 0.00 -0.26 0.00 0.00 58.87 57.48 1rhh n SER 100 Cb 0.50 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1rhh n SER 100 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rhh n TYR 100 N 0.00 0.00 0.00 7.33 9.36 -1.26 -5.02 117.16 127.57 1rhh n TYR 100 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1rhh n TYR 100 Cb 0.51 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.22 1rhh n TYR 100 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1rhh n ASP 100 N 0.00 0.00 0.00 2.98 -0.08 -1.26 -4.34 116.55 113.85 1rhh n ASP 100 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1rhh n ASP 100 Cb 0.00 -0.02 0.00 0.00 2.34 0.00 0.00 41.12 43.44 1rhh n ASP 100 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1rhh n GLY 100 N -0.03 -0.94 3.92 0.27 0.00 -1.26 -5.13 105.19 102.02 1rhh n GLY 100 Ca 0.00 0.35 -0.29 0.00 0.00 0.00 0.00 46.02 46.08 1rhh n GLY 100 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rhh s SER 100 N -4.00 6.27 0.00 1.61 0.01 -1.26 -5.10 113.70 111.22 1rhh s SER 100 Ca 0.00 0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.46 1rhh s SER 100 Cb 0.00 -1.89 0.00 0.00 0.21 0.00 0.00 66.02 64.34 1rhh s SER 100 CO 0.00 0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.38 1rhh n GLY 100 N -0.06 0.95 2.22 3.44 0.00 -1.26 -4.94 105.19 105.54 1rhh n GLY 100 Ca -0.06 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 45.09 1rhh n GLY 100 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1rhh n ARG 100 N 0.00 3.10 -2.46 1.61 1.85 -1.26 -4.87 116.66 114.63 1rhh n ARG 100 Ca 0.00 -3.69 -0.41 0.00 -1.00 0.00 0.00 57.85 52.74 1rhh n ARG 100 Cb 0.00 -2.28 0.01 0.00 -1.05 0.00 0.00 32.46 29.13 1rhh n ARG 100 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1rhh n GLY 100 N -0.81 5.50 3.06 2.89 0.00 -1.26 -4.37 105.19 110.20 1rhh n GLY 100 Ca 0.54 -2.37 -0.03 0.00 0.00 0.00 0.00 46.02 44.16 1rhh n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rhh s PHE 100 N -2.43 -1.16 -0.71 1.61 0.08 -1.26 -5.07 117.98 109.04 1rhh s PHE 100 Ca 0.42 1.29 0.25 0.00 0.12 0.00 0.00 56.93 59.02 1rhh s PHE 100 Cb 0.15 0.29 0.65 0.00 -0.57 0.00 0.00 43.02 43.54 1rhh s PHE 100 CO -0.06 -0.77 1.61 -0.40 -0.10 0.00 0.00 175.22 175.51 1rhh n ASP 101 N 5.40 0.76 -3.75 1.36 5.75 -0.82 -4.80 116.55 120.44 1rhh n ASP 101 Ca -0.03 0.40 -0.13 0.00 -0.01 0.00 0.00 54.79 55.02 1rhh n ASP 101 Cb 0.50 -0.44 -0.14 0.00 -1.03 0.00 0.00 41.12 40.01 1rhh n ASP 101 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1rhh s PHE 102 N -3.12 -0.19 -0.03 2.11 5.36 -1.25 -5.03 117.98 115.84 1rhh s PHE 102 Ca 0.09 0.52 0.06 0.00 -0.96 0.00 0.00 56.93 56.64 1rhh s PHE 102 Cb 0.13 -0.06 -0.02 0.00 -0.34 0.00 0.00 43.02 42.72 1rhh s PHE 102 CO 0.64 -0.17 -0.20 -1.58 -1.46 0.00 0.00 175.22 172.45 1rhh s TRP 103 N 1.17 2.53 0.94 10.12 0.52 -1.26 -0.81 118.94 132.15 1rhh s TRP 103 Ca -0.09 -0.29 -0.12 0.00 0.02 0.00 0.00 56.10 55.62 1rhh s TRP 103 Cb -0.11 -1.56 0.16 0.00 -1.15 0.00 0.00 33.47 30.81 1rhh s TRP 103 CO -0.06 0.10 1.13 0.20 0.02 0.00 0.00 176.95 178.33 1rhh s GLY 104 N -0.75 1.57 0.02 0.98 0.00 0.11 -4.91 107.32 104.34 1rhh s GLY 104 Ca 0.11 -0.49 0.22 0.00 0.00 0.00 0.00 44.72 44.56 1rhh s GLY 104 CO 0.00 0.09 1.71 0.61 0.00 0.00 0.00 173.10 175.51 1rhh n GLN 105 N -3.90 0.02 0.00 2.90 10.64 -1.26 -4.65 117.38 121.12 1rhh n GLN 105 Ca 0.06 0.13 0.00 0.00 -1.83 0.00 0.00 57.00 55.36 1rhh n GLN 105 Cb 0.59 -1.53 0.00 0.00 -0.86 0.00 0.00 30.24 28.44 1rhh n GLN 105 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1rhh n GLY 106 N 0.78 1.01 2.86 2.61 0.00 -1.26 -5.02 105.19 106.17 1rhh n GLY 106 Ca 0.05 -1.69 -0.28 0.00 0.00 0.00 0.00 46.02 44.10 1rhh n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rhh s THR 107 N -2.67 1.04 -0.37 2.61 2.01 -0.12 -4.91 115.64 113.23 1rhh s THR 107 Ca 0.00 -0.69 -0.26 0.00 0.31 0.00 0.00 61.69 61.04 1rhh s THR 107 Cb 0.00 -1.30 0.02 0.00 0.01 0.00 0.00 72.50 71.23 1rhh s THR 107 CO 0.00 0.02 0.95 -0.22 -0.69 0.00 0.00 174.62 174.69 1rhh s LEU 108 N 1.65 3.97 -0.29 4.42 2.96 -1.26 -0.49 118.68 129.64 1rhh s LEU 108 Ca -0.01 0.60 -0.09 0.00 -0.22 0.00 0.00 54.13 54.42 1rhh s LEU 108 Cb -0.16 -3.31 -0.02 0.00 0.50 0.00 0.00 46.19 43.20 1rhh s LEU 108 CO -0.07 -0.89 0.13 -0.69 -1.32 0.00 0.00 176.35 173.51 1rhh s VAL 109 N 3.56 4.62 -0.28 1.68 1.01 -0.34 -1.90 120.40 128.76 1rhh s VAL 109 Ca 0.39 -0.25 -0.09 0.00 0.00 0.00 0.00 61.98 62.04 1rhh s VAL 109 Cb -0.12 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 1rhh s VAL 109 CO 0.19 0.18 0.12 -0.89 0.00 0.00 0.00 175.10 174.70 1rhh s THR 110 N 1.64 4.57 -0.43 3.92 2.01 -0.32 -2.02 115.64 125.00 1rhh s THR 110 Ca 0.06 -0.22 -0.20 0.00 0.31 0.00 0.00 61.69 61.64 1rhh s THR 110 Cb -0.16 -3.22 0.02 0.00 0.01 0.00 0.00 72.50 69.15 1rhh s THR 110 CO 0.06 0.22 0.62 -0.69 -0.69 0.00 0.00 174.62 174.14 1rhh s VAL 111 N 1.64 4.86 0.13 3.82 1.01 -1.26 -0.10 120.40 130.50 1rhh s VAL 111 Ca 0.06 0.08 -0.24 0.00 0.00 0.00 0.00 61.98 61.88 1rhh s VAL 111 Cb -0.16 -4.18 0.07 0.00 0.00 0.00 0.00 36.38 32.12 1rhh s VAL 111 CO 0.06 -0.56 0.62 -0.55 0.00 0.00 0.00 175.10 174.67 1rhh s SER 112 N 1.96 -0.57 0.00 3.32 0.15 0.58 -4.64 113.70 114.50 1rhh s SER 112 Ca 0.21 0.07 0.26 0.00 0.70 0.00 0.00 55.95 57.20 1rhh s SER 112 Cb -0.14 0.59 0.65 0.00 -1.71 0.00 0.00 66.02 65.40 1rhh s SER 112 CO 0.18 -0.92 1.51 -1.54 1.20 0.00 0.00 173.24 173.67 1rhh n SER 113 N -0.25 2.00 -4.78 5.45 3.41 -1.26 -3.47 113.62 114.73 1rhh n SER 113 Ca -0.17 -1.61 -0.36 0.00 -0.26 0.00 0.00 58.87 56.47 1rhh n SER 113 Cb 0.64 0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 64.60 1rhh n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rhh s ALA 114 N -2.09 3.06 0.47 7.33 0.00 -1.26 -5.03 121.76 124.24 1rhh s ALA 114 Ca 0.32 0.70 -0.14 0.00 0.00 0.00 0.00 51.96 52.84 1rhh s ALA 114 Cb 0.20 -3.27 -0.07 0.00 0.00 0.00 0.00 23.12 19.98 1rhh s ALA 114 CO 0.36 -0.23 0.89 -1.54 0.00 0.00 0.00 175.76 175.24 1rhh s SER 115 N -1.60 6.56 0.27 0.00 1.04 -1.26 -4.98 113.70 113.74 1rhh s SER 115 Ca 0.59 1.36 -0.29 0.00 0.48 0.00 0.00 55.95 58.09 1rhh s SER 115 Cb -0.22 -2.42 -0.09 0.00 0.10 0.00 0.00 66.02 63.39 1rhh s SER 115 CO 0.27 -0.51 1.02 -0.89 0.98 0.00 0.00 173.24 174.11 1rhh s THR 116 N -2.53 3.77 -0.06 2.02 2.01 -1.26 -4.74 115.64 114.85 1rhh s THR 116 Ca 0.55 1.74 -0.02 0.00 0.31 0.00 0.00 61.69 64.27 1rhh s THR 116 Cb -0.10 -4.09 0.04 0.00 0.01 0.00 0.00 72.50 68.35 1rhh s THR 116 CO 0.32 0.38 0.13 -0.75 -0.69 0.00 0.00 174.62 174.01 1rhh s LYS 117 N -1.43 0.07 0.64 4.92 2.47 0.63 -4.94 119.74 122.09 1rhh s LYS 117 Ca 0.44 0.36 -0.14 0.00 -1.56 0.00 0.00 55.97 55.08 1rhh s LYS 117 Cb -0.28 -0.20 -0.02 0.00 -1.46 0.00 0.00 37.83 35.87 1rhh s LYS 117 CO 0.36 -0.18 1.06 0.20 0.16 0.00 0.00 175.35 176.95 1rhh s GLY 118 N 1.28 1.95 0.47 5.54 0.00 -1.26 -1.13 107.32 114.17 1rhh s GLY 118 Ca -0.08 0.29 -0.00 0.00 0.00 0.00 0.00 44.72 44.93 1rhh s GLY 118 CO -0.06 0.61 0.70 2.56 0.00 0.00 0.00 173.10 176.92 1rhh s PRO 119 N -4.44 3.02 -0.11 2.90 0.04 -1.26 -4.50 135.00 130.66 1rhh s PRO 119 Ca 0.62 -0.44 -0.01 0.00 0.04 0.00 0.00 61.00 61.21 1rhh s PRO 119 Cb -0.16 -2.52 -0.03 0.00 0.04 0.00 0.00 34.50 31.84 1rhh s PRO 119 CO 0.44 -0.35 -0.08 -1.54 0.04 0.00 0.00 177.00 175.52 1rhh s SER 120 N -4.24 4.51 -0.22 6.66 1.04 -1.01 -4.97 113.70 115.47 1rhh s SER 120 Ca 0.49 -0.14 -0.06 0.00 0.48 0.00 0.00 55.95 56.72 1rhh s SER 120 Cb -0.10 -1.46 -0.03 0.00 0.10 0.00 0.00 66.02 64.54 1rhh s SER 120 CO 0.39 0.25 0.03 -0.69 0.98 0.00 0.00 173.24 174.20 1rhh s VAL 121 N -0.14 4.09 0.00 5.02 1.01 -1.26 -2.28 120.40 126.85 1rhh s VAL 121 Ca 0.01 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 61.78 1rhh s VAL 121 Cb -0.13 -2.88 -0.03 0.00 0.00 0.00 0.00 36.38 33.34 1rhh s VAL 121 CO 0.03 0.39 -0.14 -0.36 0.00 0.00 0.00 175.10 175.02 1rhh s PHE 122 N 1.25 2.69 0.43 5.22 0.08 0.81 -4.94 117.98 123.51 1rhh s PHE 122 Ca 0.04 -0.17 -0.18 0.00 0.12 0.00 0.00 56.93 56.74 1rhh s PHE 122 Cb -0.15 -1.55 -0.10 0.00 -0.57 0.00 0.00 43.02 40.66 1rhh s PHE 122 CO 0.02 0.26 0.91 -1.25 -0.10 0.00 0.00 175.22 175.06 1rhh s PRO 123 N -1.22 4.09 -0.82 0.24 0.04 -1.26 0.99 135.00 137.05 1rhh s PRO 123 Ca 0.14 0.95 0.01 0.00 0.04 0.00 0.00 61.00 62.14 1rhh s PRO 123 Cb -0.11 -2.23 0.20 0.00 0.04 0.00 0.00 34.50 32.40 1rhh s PRO 123 CO 0.04 -0.05 0.67 -0.51 0.04 0.00 0.00 177.00 177.20 1rhh s LEU 124 N -3.41 5.29 0.24 -3.56 1.43 0.58 -4.74 118.68 114.50 1rhh s LEU 124 Ca 0.59 -3.76 -0.31 0.00 -1.03 0.00 0.00 54.13 49.61 1rhh s LEU 124 Cb -0.10 -1.81 -0.11 0.00 0.03 0.00 0.00 46.19 44.20 1rhh s LEU 124 CO 0.19 -0.15 1.65 0.00 0.23 0.00 0.00 176.35 178.27 1rhh s ALA 125 N -1.38 3.84 0.45 4.21 0.00 -1.26 -1.87 121.76 125.74 1rhh s ALA 125 Ca 0.26 1.55 -0.23 0.00 0.00 0.00 0.00 51.96 53.54 1rhh s ALA 125 Cb -0.06 -3.67 -0.08 0.00 0.00 0.00 0.00 23.12 19.31 1rhh s ALA 125 CO -0.14 -0.92 1.15 -1.25 0.00 0.00 0.00 175.76 174.60 1rhh s PRO 126 N 0.51 3.84 0.19 0.00 0.04 -1.26 -4.76 135.00 133.56 1rhh s PRO 126 Ca 0.69 1.73 -0.07 0.00 0.04 0.00 0.00 61.00 63.40 1rhh s PRO 126 Cb -0.48 -2.44 0.03 0.00 0.04 0.00 0.00 34.50 31.65 1rhh s PRO 126 CO 0.38 -0.47 0.38 -1.13 0.04 0.00 0.00 177.00 176.20 1rhh n SER 127 N -0.39 -1.11 0.14 6.66 3.41 -1.26 -2.41 113.62 118.65 1rhh n SER 127 Ca 0.07 -1.79 0.10 0.00 -0.26 0.00 0.00 58.87 56.98 1rhh n SER 127 Cb 0.48 1.86 0.50 0.00 -0.26 0.00 0.00 64.21 66.79 1rhh n SER 127 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1rhh n SER 128 N -1.29 0.51 -0.75 4.04 3.41 -1.26 -1.06 113.62 117.22 1rhh n SER 128 Ca -0.04 0.71 0.11 0.00 -0.26 0.00 0.00 58.87 59.39 1rhh n SER 128 Cb 0.29 -0.79 0.05 0.00 -0.26 0.00 0.00 64.21 63.51 1rhh n SER 128 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1rhh n LYS 129 N -2.16 1.83 -2.10 4.33 4.76 -1.26 -4.28 118.16 119.28 1rhh n LYS 129 Ca -0.00 -1.51 -0.12 0.00 -2.87 0.00 0.00 58.31 53.81 1rhh n LYS 129 Cb 0.07 -1.46 0.05 0.00 -1.84 0.00 0.00 35.03 31.85 1rhh n LYS 129 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1rhh n SER 130 N 0.74 3.30 -4.45 4.39 3.41 -0.23 -5.05 113.62 115.74 1rhh n SER 130 Ca 0.12 -3.12 -0.25 0.00 -0.26 0.00 0.00 58.87 55.36 1rhh n SER 130 Cb 0.54 -0.40 -0.11 0.00 -0.26 0.00 0.00 64.21 63.98 1rhh n SER 130 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1rhh s THR 131 N -3.93 2.40 -0.30 6.66 -4.23 -1.20 -0.52 115.64 114.52 1rhh s THR 131 Ca 0.41 -2.28 0.03 0.00 -1.18 0.00 0.00 61.69 58.68 1rhh s THR 131 Cb 0.38 -2.23 0.17 0.00 1.34 0.00 0.00 72.50 72.16 1rhh s THR 131 CO -0.01 -0.32 0.46 -0.55 -0.54 0.00 0.00 174.62 173.67 1rhh s SER 132 N -3.23 -0.15 1.35 3.99 0.15 0.41 -4.99 113.70 111.24 1rhh s SER 132 Ca 0.27 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1rhh s SER 132 Cb -0.06 1.34 0.00 0.00 -1.71 0.00 0.00 66.02 65.59 1rhh s SER 132 CO 0.13 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.85 1rhh n GLY 133 N 5.24 2.61 0.14 9.45 0.00 -1.26 -1.82 105.19 119.56 1rhh n GLY 133 Ca 0.03 -0.35 0.02 0.00 0.00 0.00 0.00 46.02 45.72 1rhh n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rhh n GLY 134 N 0.00 -0.65 3.44 -0.02 0.00 -1.26 -4.85 105.19 101.86 1rhh n GLY 134 Ca 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 1rhh n GLY 134 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rhh s THR 135 N -1.90 2.60 0.07 2.61 -4.23 -0.75 -1.04 115.64 113.00 1rhh s THR 135 Ca 0.08 -1.51 0.08 0.00 -1.18 0.00 0.00 61.69 59.16 1rhh s THR 135 Cb 0.04 -2.15 -0.03 0.00 1.34 0.00 0.00 72.50 71.70 1rhh s THR 135 CO 0.06 0.16 -0.22 0.00 -0.54 0.00 0.00 174.62 174.08 1rhh s ALA 136 N -1.05 1.90 -0.06 3.99 0.00 0.13 -0.44 121.76 126.22 1rhh s ALA 136 Ca 0.16 -1.19 0.01 0.00 0.00 0.00 0.00 51.96 50.94 1rhh s ALA 136 Cb -0.10 -0.33 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 1rhh s ALA 136 CO 0.07 0.42 -0.08 0.00 0.00 0.00 0.00 175.76 176.17 1rhh s ALA 137 N -0.95 2.94 0.20 0.00 0.00 0.32 -0.73 121.76 123.54 1rhh s ALA 137 Ca 0.08 -0.91 -0.16 0.00 0.00 0.00 0.00 51.96 50.98 1rhh s ALA 137 Cb -0.09 -1.19 0.02 0.00 0.00 0.00 0.00 23.12 21.85 1rhh s ALA 137 CO 0.03 0.57 0.49 -0.48 0.00 0.00 0.00 175.76 176.37 1rhh s LEU 138 N -0.83 0.22 0.00 0.00 2.34 -0.85 -4.11 118.68 115.45 1rhh s LEU 138 Ca 0.13 -0.58 0.00 0.00 0.06 0.00 0.00 54.13 53.73 1rhh s LEU 138 Cb -0.11 1.99 0.00 0.00 -0.56 0.00 0.00 46.19 47.51 1rhh s LEU 138 CO 0.02 -1.05 0.00 0.61 -1.06 0.00 0.00 176.35 174.87 1rhh n GLY 139 N -0.33 0.74 3.02 -3.48 0.00 -0.78 -0.53 105.19 103.82 1rhh n GLY 139 Ca -0.09 -0.69 -0.19 0.00 0.00 0.00 0.00 46.02 45.06 1rhh n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rhh s LEU 141 N -0.14 4.23 -0.39 0.00 2.96 0.28 -1.64 118.68 123.97 1rhh s LEU 141 Ca 0.02 -0.43 -0.06 0.00 -0.22 0.00 0.00 54.13 53.44 1rhh s LEU 141 Cb -0.04 -2.06 0.08 0.00 0.50 0.00 0.00 46.19 44.67 1rhh s LEU 141 CO -0.00 -0.19 0.19 -0.69 -1.32 0.00 0.00 176.35 174.33 1rhh s VAL 142 N 1.67 3.73 0.24 1.68 1.01 0.47 -0.14 120.40 129.07 1rhh s VAL 142 Ca 0.05 -1.53 0.04 0.00 0.00 0.00 0.00 61.98 60.54 1rhh s VAL 142 Cb -0.17 -3.31 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 1rhh s VAL 142 CO 0.08 -0.45 -0.01 -1.59 0.00 0.00 0.00 175.10 173.12 1rhh s LYS 143 N 1.32 1.39 -1.04 2.72 -2.85 -0.96 -0.11 119.74 120.20 1rhh s LYS 143 Ca 0.02 -1.70 -0.04 0.00 -1.00 0.00 0.00 55.97 53.25 1rhh s LYS 143 Cb -0.22 -0.74 -0.05 0.00 -2.06 0.00 0.00 37.83 34.76 1rhh s LYS 143 CO 0.00 -0.07 0.90 -0.25 0.10 0.00 0.00 175.35 176.03 1rhh n ASP 144 N -0.46 -5.37 -4.30 0.03 8.00 0.05 -2.39 116.55 112.10 1rhh n ASP 144 Ca -0.05 -0.66 -0.17 0.00 0.71 0.00 0.00 54.79 54.63 1rhh n ASP 144 Cb 0.64 -4.99 -0.10 0.00 -0.02 0.00 0.00 41.12 36.65 1rhh n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1rhh s TYR 145 N -3.37 1.51 -0.28 1.24 -0.85 -0.89 -4.32 117.35 110.40 1rhh s TYR 145 Ca 0.33 -0.67 -0.24 0.00 -0.52 0.00 0.00 57.07 55.98 1rhh s TYR 145 Cb -0.04 -0.74 0.12 0.00 0.38 0.00 0.00 41.96 41.67 1rhh s TYR 145 CO 0.70 0.22 0.97 0.12 -1.52 0.00 0.00 175.55 176.05 1rhh s PHE 146 N -3.15 -0.55 0.00 -3.49 2.19 -0.29 -0.82 117.98 111.87 1rhh s PHE 146 Ca 0.20 1.30 0.00 0.00 0.33 0.00 0.00 56.93 58.76 1rhh s PHE 146 Cb 0.01 0.36 0.00 0.00 -1.31 0.00 0.00 43.02 42.08 1rhh s PHE 146 CO 0.04 -0.27 0.00 -0.35 1.83 0.00 0.00 175.22 176.48 1rhh n PRO 147 N 2.55 0.97 -1.50 10.12 -0.04 -1.26 -0.27 135.00 145.57 1rhh n PRO 147 Ca -0.14 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.02 1rhh n PRO 147 Cb 0.56 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.12 1rhh n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1rhh s GLU 148 N -1.47 1.94 0.45 0.54 2.02 -1.26 -4.79 118.70 116.12 1rhh s GLU 148 Ca 0.00 0.66 0.07 0.00 0.02 0.00 0.00 54.97 55.72 1rhh s GLU 148 Cb 0.00 -1.90 -0.02 0.00 0.10 0.00 0.00 34.13 32.31 1rhh s GLU 148 CO 0.00 -1.73 0.29 -1.25 0.02 0.00 0.00 175.26 172.59 1rhh s PRO 149 N -5.12 2.33 -0.05 0.39 0.04 -1.26 -4.74 135.00 126.58 1rhh s PRO 149 Ca 0.61 -1.80 0.05 0.00 0.04 0.00 0.00 61.00 59.90 1rhh s PRO 149 Cb -0.15 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 32.26 1rhh s PRO 149 CO 0.55 -0.27 -0.21 0.08 0.04 0.00 0.00 177.00 177.19 1rhh s VAL 150 N -2.61 1.72 -0.11 -0.36 1.01 -1.26 -4.46 120.40 114.33 1rhh s VAL 150 Ca 0.41 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 61.50 1rhh s VAL 150 Cb 0.00 -1.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.89 1rhh s VAL 150 CO 0.23 0.49 -0.10 0.42 0.00 0.00 0.00 175.10 176.14 1rhh s THR 151 N -0.07 3.41 -0.07 3.92 -4.23 -0.37 -4.97 115.64 113.26 1rhh s THR 151 Ca -0.03 -0.56 0.04 0.00 -1.18 0.00 0.00 61.69 59.96 1rhh s THR 151 Cb -0.12 -2.42 -0.00 0.00 1.34 0.00 0.00 72.50 71.29 1rhh s THR 151 CO 0.03 0.55 -0.20 0.68 -0.54 0.00 0.00 174.62 175.14 1rhh s VAL 152 N -0.14 1.69 0.18 2.29 -7.23 -1.26 -1.20 120.40 114.73 1rhh s VAL 152 Ca 0.00 -0.83 0.07 0.00 -1.81 0.00 0.00 61.98 59.41 1rhh s VAL 152 Cb -0.13 -1.46 -0.04 0.00 0.56 0.00 0.00 36.38 35.30 1rhh s VAL 152 CO 0.03 0.48 -0.14 -0.94 -0.31 0.00 0.00 175.10 174.22 1rhh s SER 153 N 0.20 2.41 -0.13 4.85 1.04 -0.54 -4.94 113.70 116.60 1rhh s SER 153 Ca -0.10 -0.98 0.01 0.00 0.48 0.00 0.00 55.95 55.36 1rhh s SER 153 Cb -0.15 -0.11 -0.00 0.00 0.10 0.00 0.00 66.02 65.86 1rhh s SER 153 CO 0.05 -0.18 -0.18 0.26 0.98 0.00 0.00 173.24 174.18 1rhh s TRP 154 N -2.83 2.71 -1.19 5.02 0.52 -1.26 0.54 118.94 122.45 1rhh s TRP 154 Ca 0.19 -0.93 -0.16 0.00 0.02 0.00 0.00 56.10 55.22 1rhh s TRP 154 Cb -0.01 -1.81 -0.01 0.00 -1.15 0.00 0.00 33.47 30.49 1rhh s TRP 154 CO 0.05 -0.37 0.73 0.09 0.02 0.00 0.00 176.95 177.47 1rhh n ASN 155 N 3.70 -4.29 -0.39 2.95 3.02 0.07 -0.83 115.26 119.49 1rhh n ASN 155 Ca -0.19 -1.00 -0.03 0.00 -0.03 0.00 0.00 54.58 53.33 1rhh n ASN 155 Cb 0.52 -3.38 -0.01 0.00 -0.61 0.00 0.00 39.78 36.30 1rhh n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1rhh n SER 156 N -2.75 -3.15 0.00 6.41 7.64 -1.26 -0.30 113.62 120.22 1rhh n SER 156 Ca -0.14 0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.82 1rhh n SER 156 Cb 0.61 -2.33 0.00 0.00 -1.01 0.00 0.00 64.21 61.48 1rhh n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rhh n GLY 157 N 0.32 0.79 0.15 0.23 0.00 -0.01 -4.98 105.19 101.69 1rhh n GLY 157 Ca -0.03 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.82 1rhh n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rhh h ALA 158 N 0.00 0.19 -2.29 4.61 0.00 -0.48 -3.41 119.26 117.87 1rhh h ALA 158 Ca 0.00 -0.76 -0.69 0.00 0.00 0.00 0.00 54.91 53.46 1rhh h ALA 158 Cb 0.00 0.03 -0.18 0.00 0.00 0.00 0.00 17.79 17.64 1rhh h ALA 158 CO 0.00 0.80 -0.12 -1.17 0.00 0.00 0.00 179.25 178.76 1rhh s LEU 159 N -7.68 4.87 0.00 0.00 1.98 -1.04 -4.82 118.68 111.99 1rhh s LEU 159 Ca -0.07 -0.70 0.00 0.00 -2.89 0.00 0.00 54.13 50.47 1rhh s LEU 159 Cb 0.07 -2.44 0.00 0.00 0.66 0.00 0.00 46.19 44.49 1rhh s LEU 159 CO 0.89 -0.67 0.00 0.35 -1.89 0.00 0.00 176.35 175.04 1rhh n THR 160 N 5.52 0.00 -2.15 3.68 -2.24 -1.26 -4.08 114.28 113.74 1rhh n THR 160 Ca -0.07 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.30 1rhh n THR 160 Cb 0.47 -0.45 -0.03 0.00 -2.10 0.00 0.00 70.33 68.22 1rhh n THR 160 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1rhh s SER 161 N -2.05 6.82 0.00 3.42 0.01 -1.26 -2.65 113.70 117.99 1rhh s SER 161 Ca 0.00 2.57 0.00 0.00 1.31 0.00 0.00 55.95 59.83 1rhh s SER 161 Cb 0.00 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.60 1rhh s SER 161 CO 0.00 -0.54 0.00 0.61 0.41 0.00 0.00 173.24 173.72 1rhh n GLY 162 N 1.58 0.45 3.73 3.44 0.00 -1.26 -4.71 105.19 108.42 1rhh n GLY 162 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1rhh n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rhh s VAL 163 N -2.22 4.62 -0.15 1.61 1.01 -1.09 -3.04 120.40 121.15 1rhh s VAL 163 Ca 0.00 2.00 -0.01 0.00 0.00 0.00 0.00 61.98 63.96 1rhh s VAL 163 Cb 0.00 -4.29 0.04 0.00 0.00 0.00 0.00 36.38 32.13 1rhh s VAL 163 CO 0.00 0.29 -0.01 -1.00 0.00 0.00 0.00 175.10 174.38 1rhh s HIS 164 N 0.21 1.24 -0.28 5.22 3.76 0.85 -4.98 115.29 121.31 1rhh s HIS 164 Ca 0.47 -0.78 -0.06 0.00 -0.15 0.00 0.00 55.06 54.54 1rhh s HIS 164 Cb -0.22 -1.10 0.01 0.00 1.11 0.00 0.00 32.58 32.38 1rhh s HIS 164 CO 0.28 -0.54 0.05 0.99 -0.85 0.00 0.00 174.74 174.68 1rhh s THR 165 N 1.79 3.78 0.38 1.30 2.01 -1.26 -0.47 115.64 123.17 1rhh s THR 165 Ca 0.01 -0.72 -0.24 0.00 0.31 0.00 0.00 61.69 61.06 1rhh s THR 165 Cb -0.15 -2.93 -0.10 0.00 0.01 0.00 0.00 72.50 69.33 1rhh s THR 165 CO -0.07 0.12 0.98 -0.36 -0.69 0.00 0.00 174.62 174.60 1rhh s PHE 166 N 1.47 3.44 0.51 4.92 0.08 -0.59 -5.01 117.98 122.80 1rhh s PHE 166 Ca 0.02 1.69 -0.23 0.00 0.12 0.00 0.00 56.93 58.54 1rhh s PHE 166 Cb -0.17 -2.97 -0.07 0.00 -0.57 0.00 0.00 43.02 39.25 1rhh s PHE 166 CO 0.01 -0.16 1.29 -2.30 -0.10 0.00 0.00 175.22 173.96 1rhh n PRO 167 N -0.00 1.72 -1.89 0.24 -0.02 -1.26 -4.49 135.00 129.30 1rhh n PRO 167 Ca 0.04 0.63 -0.33 0.00 -2.02 0.00 0.00 63.50 61.82 1rhh n PRO 167 Cb 0.51 -2.48 0.03 0.00 -0.02 0.00 0.00 33.50 31.55 1rhh n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rhh s ALA 168 N -1.28 2.55 0.03 3.55 0.00 -1.26 -4.84 121.76 120.50 1rhh s ALA 168 Ca 0.68 0.58 0.09 0.00 0.00 0.00 0.00 51.96 53.30 1rhh s ALA 168 Cb -0.45 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.33 1rhh s ALA 168 CO 0.52 -1.12 -0.26 0.14 0.00 0.00 0.00 175.76 175.05 1rhh s VAL 169 N -2.25 2.05 -0.25 0.00 -7.23 -0.64 -4.94 120.40 107.14 1rhh s VAL 169 Ca 0.68 -1.30 -0.21 0.00 -1.81 0.00 0.00 61.98 59.34 1rhh s VAL 169 Cb -0.20 -1.75 -0.02 0.00 0.56 0.00 0.00 36.38 34.97 1rhh s VAL 169 CO 0.38 0.40 0.66 -0.22 -0.31 0.00 0.00 175.10 176.01 1rhh s LEU 170 N -1.08 4.07 0.61 1.32 2.96 -1.26 -2.22 118.68 123.08 1rhh s LEU 170 Ca 0.11 0.74 -0.09 0.00 -0.22 0.00 0.00 54.13 54.67 1rhh s LEU 170 Cb -0.10 -2.90 -0.02 0.00 0.50 0.00 0.00 46.19 43.67 1rhh s LEU 170 CO 0.01 -0.40 0.97 -1.10 -1.32 0.00 0.00 176.35 174.52 1rhh s GLN 171 N 2.56 3.28 0.64 1.98 -0.21 -0.04 -4.93 119.66 122.94 1rhh s GLN 171 Ca 0.27 0.43 0.33 0.00 0.02 0.00 0.00 55.36 56.42 1rhh s GLN 171 Cb -0.15 -2.16 1.84 0.00 1.00 0.00 0.00 33.01 33.53 1rhh s GLN 171 CO 0.08 -0.64 2.08 0.66 -2.12 0.00 0.00 175.29 175.35 1rhh h SER 172 N -0.27 0.00 1.15 5.90 4.64 -1.97 0.24 113.55 123.24 1rhh h SER 172 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1rhh h SER 172 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1rhh h SER 172 CO 0.62 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 177.35 1rhh h SER 173 N 0.00 0.00 0.00 4.97 4.64 -2.02 -3.46 113.55 117.68 1rhh h SER 173 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1rhh h SER 173 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1rhh h SER 173 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1rhh n GLY 174 N 0.44 0.75 3.66 -0.77 0.00 0.84 -5.06 105.19 105.05 1rhh n GLY 174 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1rhh n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rhh s LEU 175 N 0.00 3.34 0.38 0.99 1.43 -1.25 -4.87 118.68 118.70 1rhh s LEU 175 Ca 0.00 -0.28 -0.04 0.00 -1.03 0.00 0.00 54.13 52.78 1rhh s LEU 175 Cb 0.00 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1rhh s LEU 175 CO 0.00 0.15 0.65 -0.31 0.23 0.00 0.00 176.35 177.07 1rhh s TYR 176 N -1.41 3.51 -0.12 0.29 2.02 -0.00 -0.86 117.35 120.78 1rhh s TYR 176 Ca 0.25 0.66 -0.13 0.00 -0.37 0.00 0.00 57.07 57.48 1rhh s TYR 176 Cb -0.11 -2.15 0.03 0.00 -0.40 0.00 0.00 41.96 39.34 1rhh s TYR 176 CO 0.17 -0.02 0.36 -1.54 -1.57 0.00 0.00 175.55 172.96 1rhh s SER 177 N -3.72 -0.36 0.11 2.29 1.04 -0.94 -0.77 113.70 111.35 1rhh s SER 177 Ca 0.45 0.63 -0.11 0.00 0.48 0.00 0.00 55.95 57.40 1rhh s SER 177 Cb -0.10 0.68 0.01 0.00 0.10 0.00 0.00 66.02 66.70 1rhh s SER 177 CO 0.37 -0.19 0.27 -1.48 0.98 0.00 0.00 173.24 173.18 1rhh s LEU 178 N -0.09 1.06 0.05 2.42 0.05 0.84 -1.62 118.68 121.39 1rhh s LEU 178 Ca -0.03 -0.58 0.07 0.00 0.05 0.00 0.00 54.13 53.64 1rhh s LEU 178 Cb -0.03 1.30 -0.03 0.00 -2.05 0.00 0.00 46.19 45.39 1rhh s LEU 178 CO 0.01 -0.79 -0.19 -0.44 -0.55 0.00 0.00 176.35 174.40 1rhh s SER 179 N -2.86 2.23 -0.14 1.48 0.01 -1.26 -0.39 113.70 112.77 1rhh s SER 179 Ca 0.06 -0.53 0.00 0.00 1.31 0.00 0.00 55.95 56.79 1rhh s SER 179 Cb 0.04 -0.16 0.02 0.00 0.21 0.00 0.00 66.02 66.13 1rhh s SER 179 CO -0.10 0.10 -0.13 -0.55 0.41 0.00 0.00 173.24 172.97 1rhh s SER 180 N -1.29 2.57 0.38 2.44 0.15 -0.65 -1.55 113.70 115.74 1rhh s SER 180 Ca 0.05 -0.45 0.07 0.00 0.70 0.00 0.00 55.95 56.33 1rhh s SER 180 Cb -0.09 -1.12 -0.07 0.00 -1.71 0.00 0.00 66.02 63.03 1rhh s SER 180 CO 0.02 -0.05 -0.02 0.68 1.20 0.00 0.00 173.24 175.07 1rhh s VAL 181 N 1.43 1.99 -0.26 4.45 -7.23 0.38 -0.41 120.40 120.75 1rhh s VAL 181 Ca 0.03 -2.07 -0.25 0.00 -1.81 0.00 0.00 61.98 57.88 1rhh s VAL 181 Cb -0.13 -2.84 0.08 0.00 0.56 0.00 0.00 36.38 34.05 1rhh s VAL 181 CO -0.09 -0.08 0.79 0.54 -0.31 0.00 0.00 175.10 175.95 1rhh s VAL 182 N -2.75 0.00 -0.20 1.32 0.11 0.31 -0.10 120.40 119.09 1rhh s VAL 182 Ca 0.34 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 59.31 1rhh s VAL 182 Cb 0.07 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.88 1rhh s VAL 182 CO 0.17 0.00 0.09 0.42 -3.33 0.00 0.00 175.10 172.45 1rhh s THR 183 N 0.28 4.92 0.10 5.04 -4.23 -1.17 -2.00 115.64 118.58 1rhh s THR 183 Ca 0.00 0.02 0.03 0.00 -1.18 0.00 0.00 61.69 60.56 1rhh s THR 183 Cb -0.05 -3.24 -0.04 0.00 1.34 0.00 0.00 72.50 70.51 1rhh s THR 183 CO -0.00 0.43 -0.08 0.68 -0.54 0.00 0.00 174.62 175.10 1rhh s VAL 184 N 0.57 0.81 0.15 2.29 -7.23 0.09 -4.76 120.40 112.32 1rhh s VAL 184 Ca 0.05 -1.73 -0.33 0.00 -1.81 0.00 0.00 61.98 58.16 1rhh s VAL 184 Cb -0.13 -1.44 -0.13 0.00 0.56 0.00 0.00 36.38 35.25 1rhh s VAL 184 CO 0.01 -0.68 1.66 -2.65 -0.31 0.00 0.00 175.10 173.13 1rhh n PRO 185 N 0.36 2.38 -0.15 4.82 -0.02 -1.26 0.21 135.00 141.33 1rhh n PRO 185 Ca -0.15 0.86 0.17 0.00 -2.02 0.00 0.00 63.50 62.36 1rhh n PRO 185 Cb 0.59 -2.67 0.53 0.00 -0.02 0.00 0.00 33.50 31.94 1rhh n PRO 185 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1rhh h SER 186 N 6.64 0.34 -0.75 2.55 0.02 -1.36 -1.54 113.55 119.44 1rhh h SER 186 Ca -0.45 0.02 0.01 0.00 -0.84 0.00 0.00 61.79 60.53 1rhh h SER 186 Cb 1.24 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.70 1rhh h SER 186 CO 0.92 0.17 0.49 0.77 -1.14 0.00 0.00 176.83 178.04 1rhh h SER 187 N 0.35 0.87 0.85 3.07 4.64 -1.89 -2.54 113.55 118.90 1rhh h SER 187 Ca 0.36 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 1rhh h SER 187 Cb 0.91 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1rhh h SER 187 CO -0.11 0.63 0.00 0.77 -0.87 0.00 0.00 176.83 177.26 1rhh h SER 188 N 1.02 0.00 -0.07 4.97 4.64 -1.65 -3.26 113.55 119.20 1rhh h SER 188 Ca 0.27 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.61 1rhh h SER 188 Cb -0.11 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 61.98 1rhh h SER 188 CO -0.06 0.00 0.45 -0.07 -0.87 0.00 0.00 176.83 176.29 1rhh h LEU 189 N 0.00 0.00 0.00 5.97 3.38 -1.52 0.44 115.31 123.58 1rhh h LEU 189 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rhh h LEU 189 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1rhh h LEU 189 CO 0.00 0.00 -1.92 0.61 0.09 0.00 0.00 178.44 177.22 1rhh n GLY 190 N -1.30 -0.93 0.02 0.83 0.00 -1.23 -4.60 105.19 97.99 1rhh n GLY 190 Ca -0.00 -0.48 0.01 0.00 0.00 0.00 0.00 46.02 45.55 1rhh n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rhh n THR 191 N -2.20 0.25 -3.98 2.61 -2.24 -0.36 -4.98 114.28 103.38 1rhh n THR 191 Ca -0.04 -0.30 -0.35 0.00 -2.27 0.00 0.00 64.05 61.10 1rhh n THR 191 Cb 0.53 -0.13 -0.10 0.00 -2.10 0.00 0.00 70.33 68.53 1rhh n THR 191 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1rhh s GLN 192 N -2.52 3.95 0.14 -0.78 2.00 0.14 -5.09 119.66 117.50 1rhh s GLN 192 Ca -0.04 -0.35 -0.24 0.00 -2.00 0.00 0.00 55.36 52.73 1rhh s GLN 192 Cb 0.05 -3.23 -0.08 0.00 0.80 0.00 0.00 33.01 30.55 1rhh s GLN 192 CO 0.41 0.22 0.73 0.99 -0.50 0.00 0.00 175.29 177.14 1rhh s THR 193 N 0.50 4.46 -0.18 -0.34 2.01 -1.26 -4.67 115.64 116.16 1rhh s THR 193 Ca 0.03 1.59 0.01 0.00 0.31 0.00 0.00 61.69 63.63 1rhh s THR 193 Cb -0.13 -4.08 0.04 0.00 0.01 0.00 0.00 72.50 68.34 1rhh s THR 193 CO 0.01 0.53 -0.11 -0.31 -0.69 0.00 0.00 174.62 174.04 1rhh s TYR 194 N -1.11 2.28 -0.05 4.92 2.02 -1.26 -4.96 117.35 119.19 1rhh s TYR 194 Ca 0.34 -1.43 0.02 0.00 -0.37 0.00 0.00 57.07 55.63 1rhh s TYR 194 Cb -0.22 -1.60 0.01 0.00 -0.40 0.00 0.00 41.96 39.75 1rhh s TYR 194 CO 0.24 -0.71 -0.11 0.42 -1.57 0.00 0.00 175.55 173.83 1rhh s ILE 195 N 1.44 0.97 -0.17 2.71 1.01 -1.26 -0.36 121.20 125.55 1rhh s ILE 195 Ca 0.01 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.15 1rhh s ILE 195 Cb -0.15 -0.89 -0.05 0.00 0.01 0.00 0.00 42.46 41.38 1rhh s ILE 195 CO -0.09 0.31 0.16 0.00 0.00 0.00 0.00 174.94 175.32 1rhh s ASN 197 N -0.03 5.98 -0.21 0.00 -0.87 0.19 0.01 114.94 120.01 1rhh s ASN 197 Ca 0.11 -1.21 -0.10 0.00 -1.57 0.00 0.00 52.86 50.09 1rhh s ASN 197 Cb -0.12 -2.12 -0.05 0.00 -0.02 0.00 0.00 41.25 38.95 1rhh s ASN 197 CO 0.01 -0.54 0.14 -0.69 -2.57 0.00 0.00 177.10 173.45 1rhh s VAL 198 N 1.60 5.39 -0.06 1.60 1.01 0.32 -1.46 120.40 128.79 1rhh s VAL 198 Ca 0.04 0.19 0.02 0.00 0.00 0.00 0.00 61.98 62.22 1rhh s VAL 198 Cb -0.22 -3.48 0.02 0.00 0.00 0.00 0.00 36.38 32.70 1rhh s VAL 198 CO 0.07 0.41 -0.10 0.21 0.00 0.00 0.00 175.10 175.69 1rhh s ASN 199 N 0.57 1.52 -0.59 3.32 3.04 -0.35 -0.87 114.94 121.59 1rhh s ASN 199 Ca 0.08 -0.24 0.04 0.00 0.04 0.00 0.00 52.86 52.78 1rhh s ASN 199 Cb -0.12 -0.71 0.16 0.00 -1.54 0.00 0.00 41.25 39.05 1rhh s ASN 199 CO -0.00 0.00 0.40 -2.28 -3.04 0.00 0.00 177.10 172.19 1rhh s HIS 200 N 0.76 2.81 0.31 0.43 5.65 0.70 -1.24 115.29 124.71 1rhh s HIS 200 Ca -0.13 -2.99 0.05 0.00 0.25 0.00 0.00 55.06 52.23 1rhh s HIS 200 Cb -0.15 -2.24 0.83 0.00 -1.18 0.00 0.00 32.58 29.83 1rhh s HIS 200 CO 0.02 -0.66 1.59 0.87 -0.65 0.00 0.00 174.74 175.92 1rhh h LYS 201 N 5.74 0.06 -0.93 2.88 1.57 -1.78 -1.80 116.57 122.31 1rhh h LYS 201 Ca 0.13 -0.00 0.19 0.00 -1.87 0.00 0.00 60.65 59.09 1rhh h LYS 201 Cb 0.82 -0.01 -0.11 0.00 0.08 0.00 0.00 32.23 33.01 1rhh h LYS 201 CO 0.61 0.04 0.51 -1.35 -0.57 0.00 0.00 179.45 178.70 1rhh h PRO 202 N 0.06 0.62 -0.50 3.15 0.11 -1.87 -1.79 132.00 131.78 1rhh h PRO 202 Ca 0.62 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.69 1rhh h PRO 202 Cb 1.35 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1rhh h PRO 202 CO -0.82 0.41 0.00 -1.13 -0.21 0.00 0.00 178.00 176.25 1rhh n SER 203 N -4.86 3.64 -3.06 -2.05 3.41 -0.72 -4.94 113.62 105.04 1rhh n SER 203 Ca 0.21 -2.18 -0.22 0.00 -0.26 0.00 0.00 58.87 56.43 1rhh n SER 203 Cb 0.56 -0.40 0.02 0.00 -0.26 0.00 0.00 64.21 64.13 1rhh n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1rhh n ASN 204 N 0.85 -5.22 -4.73 4.04 4.13 -0.67 -4.91 115.26 108.75 1rhh n ASN 204 Ca 0.19 -0.27 -0.37 0.00 1.68 0.00 0.00 54.58 55.81 1rhh n ASN 204 Cb 0.61 -4.26 -0.07 0.00 -1.54 0.00 0.00 39.78 34.52 1rhh n ASN 204 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1rhh s THR 205 N -3.06 5.28 -0.28 3.41 2.01 -1.03 -4.98 115.64 116.99 1rhh s THR 205 Ca 0.30 0.64 -0.01 0.00 0.31 0.00 0.00 61.69 62.93 1rhh s THR 205 Cb -0.14 -3.67 0.14 0.00 0.01 0.00 0.00 72.50 68.83 1rhh s THR 205 CO 0.37 0.38 0.31 -0.75 -0.69 0.00 0.00 174.62 174.23 1rhh s LYS 206 N 0.48 0.33 -0.08 4.92 2.36 -1.26 -0.22 119.74 126.27 1rhh s LYS 206 Ca 0.19 -0.04 0.03 0.00 -2.55 0.00 0.00 55.97 53.59 1rhh s LYS 206 Cb -0.13 -0.65 0.01 0.00 -1.05 0.00 0.00 37.83 36.01 1rhh s LYS 206 CO 0.05 -0.98 -0.17 0.54 1.55 0.00 0.00 175.35 176.35 1rhh s VAL 207 N 2.39 1.49 -0.34 4.02 0.11 -0.04 -4.98 120.40 123.05 1rhh s VAL 207 Ca 0.09 -0.68 -0.11 0.00 -2.93 0.00 0.00 61.98 58.36 1rhh s VAL 207 Cb -0.14 -1.33 0.01 0.00 -1.53 0.00 0.00 36.38 33.38 1rhh s VAL 207 CO -0.30 0.44 0.19 1.51 -3.33 0.00 0.00 175.10 173.60 1rhh s ASP 208 N 0.61 5.69 -0.14 3.54 -4.77 -1.26 -0.53 116.67 119.81 1rhh s ASP 208 Ca -0.15 -0.69 -0.11 0.00 -3.30 0.00 0.00 52.55 48.30 1rhh s ASP 208 Cb -0.16 -2.03 -0.05 0.00 -1.09 0.00 0.00 42.92 39.59 1rhh s ASP 208 CO 0.05 -0.28 0.23 -0.54 0.70 0.00 0.00 175.17 175.33 1rhh s LYS 209 N 1.61 4.02 -0.18 2.11 -0.14 0.10 -4.88 119.74 122.37 1rhh s LYS 209 Ca 0.04 -0.00 -0.21 0.00 -1.36 0.00 0.00 55.97 54.44 1rhh s LYS 209 Cb -0.18 -3.35 -0.03 0.00 -1.68 0.00 0.00 37.83 32.60 1rhh s LYS 209 CO 0.07 0.43 0.62 0.15 -0.76 0.00 0.00 175.35 175.86 1rhh s LYS 210 N -0.07 4.24 -0.35 1.68 1.02 -1.26 -0.42 119.74 124.57 1rhh s LYS 210 Ca 0.15 0.62 -0.05 0.00 0.02 0.00 0.00 55.97 56.72 1rhh s LYS 210 Cb -0.13 -3.56 0.06 0.00 -0.52 0.00 0.00 37.83 33.69 1rhh s LYS 210 CO 0.03 -0.19 0.11 0.08 -0.92 0.00 0.00 175.35 174.47 1rhh s VAL 211 N 1.73 3.48 0.19 3.17 1.01 0.51 -4.92 120.40 125.58 1rhh s VAL 211 Ca 0.29 -1.42 0.11 0.00 0.00 0.00 0.00 61.98 60.96 1rhh s VAL 211 Cb -0.16 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1rhh s VAL 211 CO 0.11 -0.29 -0.22 -1.83 0.00 0.00 0.00 175.10 172.86 1rhh s GLU 212 N 1.31 1.58 0.27 2.72 -1.05 -1.26 -4.33 118.70 117.94 1rhh s GLU 212 Ca -0.00 -1.49 -0.28 0.00 -0.15 0.00 0.00 54.97 53.05 1rhh s GLU 212 Cb -0.21 -1.89 -0.15 0.00 -0.44 0.00 0.00 34.13 31.45 1rhh s GLU 212 CO 0.00 0.40 0.90 -0.35 0.95 0.00 0.00 175.26 177.17 1rhh n PRO 213 N 0.25 1.06 -1.65 -4.83 -0.04 -1.26 -4.47 135.00 124.06 1rhh n PRO 213 Ca -0.12 0.37 -0.47 0.00 -0.04 0.00 0.00 63.50 63.23 1rhh n PRO 213 Cb 0.56 -1.66 -0.05 0.00 -0.04 0.00 0.00 33.50 32.31 1rhh n PRO 213 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1rhh n LYS 214 N 0.77 1.87 0.00 0.54 2.85 -1.01 -4.88 118.16 118.30 1rhh n LYS 214 Ca 0.11 0.67 0.10 0.00 -1.05 0.00 0.00 58.31 58.15 1rhh n LYS 214 Cb 0.31 -2.40 0.58 0.00 -0.65 0.00 0.00 35.03 32.87 1rhh n LYS 214 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 1rhh n SER 215 N 3.09 0.00 0.00 -5.58 3.41 -1.26 -5.05 113.62 108.23 1rhh n SER 215 Ca 0.17 -0.97 0.14 0.00 -0.26 0.00 0.00 58.87 57.94 1rhh n SER 215 Cb 0.26 0.00 0.81 0.00 -0.26 0.00 0.00 64.21 65.02 1rhh n SER 215 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88