#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vhm n LYS 2 N 0.00 3.08 -2.67 0.00 4.01 -1.26 -5.01 118.16 116.31 2vhm n LYS 2 Ca 0.00 0.00 -0.33 0.00 -0.51 0.00 0.00 58.31 57.47 2vhm n LYS 2 Cb 0.00 0.00 -0.06 0.00 -0.51 0.00 0.00 35.03 34.46 2vhm n LYS 2 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 2vhm s LYS 3 N 0.00 4.09 -0.72 1.97 2.20 -1.26 -5.00 119.74 121.02 2vhm s LYS 3 Ca 0.00 1.11 -0.27 0.00 -0.36 0.00 0.00 55.97 56.45 2vhm s LYS 3 Cb 0.00 -2.16 0.03 0.00 -1.51 0.00 0.00 37.83 34.19 2vhm s LYS 3 CO 0.00 -0.15 1.28 0.54 -0.36 0.00 0.00 175.35 176.65 2vhm s VAL 4 N -2.28 3.75 -0.45 4.02 0.11 -1.26 -4.86 120.40 119.43 2vhm s VAL 4 Ca 0.62 0.46 0.07 0.00 -2.93 0.00 0.00 61.98 60.20 2vhm s VAL 4 Cb -0.10 -4.89 0.25 0.00 -1.53 0.00 0.00 36.38 30.11 2vhm s VAL 4 CO 0.19 -1.80 0.80 1.67 -3.33 0.00 0.00 175.10 172.63 2vhm n GLN 5 N 9.28 0.79 -0.75 1.54 7.27 -1.26 -5.11 117.38 129.13 2vhm n GLN 5 Ca 0.04 -2.24 0.00 0.00 0.07 0.00 0.00 57.00 54.87 2vhm n GLN 5 Cb 0.49 -1.37 0.00 0.00 2.41 0.00 0.00 30.24 31.77 2vhm n GLN 5 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2vhm n ALA 6 N 1.42 -2.89 0.00 1.69 0.00 -1.26 -4.27 120.51 115.20 2vhm n ALA 6 Ca 0.13 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2vhm n ALA 6 Cb 0.61 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.51 2vhm n ALA 6 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2vhm n TYR 7 N 0.23 0.00 -3.50 0.00 0.18 -1.26 -1.24 117.16 111.56 2vhm n TYR 7 Ca 0.00 0.00 -0.19 0.00 1.88 0.00 0.00 57.90 59.59 2vhm n TYR 7 Cb 0.00 0.00 -0.13 0.00 -0.38 0.00 0.00 39.34 38.83 2vhm n TYR 7 CO 0.00 0.00 0.00 0.14 -2.08 0.00 0.00 176.86 174.92 2vhm s VAL 8 N -2.00 -0.31 -0.87 -3.48 -7.23 -1.22 -5.00 120.40 100.29 2vhm s VAL 8 Ca 0.00 -0.12 -0.21 0.00 -1.81 0.00 0.00 61.98 59.84 2vhm s VAL 8 Cb 0.00 -0.67 0.10 0.00 0.56 0.00 0.00 36.38 36.36 2vhm s VAL 8 CO 0.00 -0.21 1.15 -1.59 -0.31 0.00 0.00 175.10 174.14 2vhm s LYS 9 N 2.31 3.45 0.34 4.82 -2.85 -1.26 -4.31 119.74 122.24 2vhm s LYS 9 Ca 0.07 -1.34 0.00 0.00 -1.00 0.00 0.00 55.97 53.70 2vhm s LYS 9 Cb -0.16 -4.79 -0.03 0.00 -2.06 0.00 0.00 37.83 30.79 2vhm s LYS 9 CO -0.12 -1.88 0.54 -0.48 0.10 0.00 0.00 175.35 173.51 2vhm s LEU 10 N 3.59 4.03 -0.36 2.77 0.05 -1.26 -5.03 118.68 122.47 2vhm s LEU 10 Ca 0.33 0.46 -0.05 0.00 0.05 0.00 0.00 54.13 54.91 2vhm s LEU 10 Cb -0.07 -3.32 0.06 0.00 -2.05 0.00 0.00 46.19 40.81 2vhm s LEU 10 CO -0.04 -0.27 0.13 0.00 -0.55 0.00 0.00 176.35 175.62 2vhm s GLN 11 N -4.22 2.47 -0.13 1.48 -2.07 -1.26 -3.85 119.66 112.09 2vhm s GLN 11 Ca 0.40 -1.36 -0.07 0.00 -1.82 0.00 0.00 55.36 52.51 2vhm s GLN 11 Cb -0.10 -3.49 -0.04 0.00 -1.09 0.00 0.00 33.01 28.29 2vhm s GLN 11 CO 0.35 -0.78 0.12 0.14 -1.32 0.00 0.00 175.29 173.80 2vhm s VAL 12 N 1.33 5.35 0.84 3.63 -7.23 -0.80 -4.89 120.40 118.64 2vhm s VAL 12 Ca 0.00 0.15 -0.11 0.00 -1.81 0.00 0.00 61.98 60.21 2vhm s VAL 12 Cb -0.21 -3.34 0.10 0.00 0.56 0.00 0.00 36.38 33.49 2vhm s VAL 12 CO 0.01 0.59 1.15 0.00 -0.31 0.00 0.00 175.10 176.53 2vhm s ALA 13 N -0.78 1.79 -0.27 1.32 0.00 -1.26 -1.48 121.76 121.07 2vhm s ALA 13 Ca 0.13 0.58 0.21 0.00 0.00 0.00 0.00 51.96 52.89 2vhm s ALA 13 Cb -0.12 -3.42 0.08 0.00 0.00 0.00 0.00 23.12 19.67 2vhm s ALA 13 CO 0.03 -2.35 1.21 0.00 0.00 0.00 0.00 175.76 174.65 2vhm h ALA 14 N -1.36 0.68 -1.12 0.00 0.00 -1.83 -3.39 119.26 112.23 2vhm h ALA 14 Ca -0.44 -0.17 -0.55 0.00 0.00 0.00 0.00 54.91 53.75 2vhm h ALA 14 Cb 1.27 0.03 -0.42 0.00 0.00 0.00 0.00 17.79 18.67 2vhm h ALA 14 CO 0.45 0.20 -0.80 0.41 0.00 0.00 0.00 179.25 179.51 2vhm n GLY 15 N 1.19 5.82 0.00 0.00 0.00 -1.26 -4.19 105.19 106.76 2vhm n GLY 15 Ca -0.00 -2.59 0.00 0.00 0.00 0.00 0.00 46.02 43.42 2vhm n GLY 15 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2vhm n MET 16 N -0.57 0.00 -3.31 1.61 0.00 -1.26 -4.98 117.12 108.61 2vhm n MET 16 Ca 0.39 0.00 -0.41 0.00 -0.00 0.00 0.00 57.70 57.68 2vhm n MET 16 Cb 0.81 0.00 -0.08 0.00 0.00 0.00 0.00 33.22 33.94 2vhm n MET 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2vhm s ALA 17 N 0.00 3.49 0.00 -5.12 0.00 -1.26 -4.55 121.76 114.32 2vhm s ALA 17 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.87 2vhm s ALA 17 Cb 0.00 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.20 2vhm s ALA 17 CO 0.00 -1.14 0.00 -1.71 0.00 0.00 0.00 175.76 172.91 2vhm n ASN 18 N 5.57 0.00 -3.89 0.00 5.15 -1.26 -4.80 115.26 116.04 2vhm n ASN 18 Ca -0.07 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.91 2vhm n ASN 18 Cb 0.49 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.74 2vhm n ASN 18 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2vhm n PRO 19 N 0.00 1.95 0.00 1.20 -0.04 -1.26 -4.76 135.00 132.09 2vhm n PRO 19 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2vhm n PRO 19 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2vhm n PRO 19 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2vhm n SER 20 N 0.00 2.17 0.02 3.54 2.88 -1.26 -3.76 113.62 117.20 2vhm n SER 20 Ca 0.00 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.53 2vhm n SER 20 Cb 0.00 0.32 -0.00 0.00 -0.75 0.00 0.00 64.21 63.77 2vhm n SER 20 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2vhm h PRO 21 N 0.00 -0.06 0.62 -1.46 0.11 -1.96 -3.33 132.00 125.91 2vhm h PRO 21 Ca 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.09 2vhm h PRO 21 Cb 0.24 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.36 2vhm h PRO 21 CO 0.00 -0.04 -0.36 -1.35 -0.21 0.00 0.00 178.00 176.04 2vhm h PRO 22 N -0.27 -0.87 0.00 1.05 0.11 -1.97 -3.46 132.00 126.58 2vhm h PRO 22 Ca -0.01 0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.16 2vhm h PRO 22 Cb 0.05 0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.36 2vhm h PRO 22 CO 0.01 -0.58 0.00 0.28 -0.21 0.00 0.00 178.00 177.50 2vhm n VAL 23 N -4.64 0.00 0.00 3.15 0.31 -1.26 -4.87 118.33 111.01 2vhm n VAL 23 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 2vhm n VAL 23 Cb 0.37 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.30 2vhm n VAL 23 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2vhm n GLY 24 N 5.00 0.94 2.56 2.92 0.00 -1.25 -3.77 105.19 111.60 2vhm n GLY 24 Ca 0.00 0.42 -0.33 0.00 0.00 0.00 0.00 46.02 46.11 2vhm n GLY 24 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2vhm n PRO 25 N 0.00 2.72 0.18 1.61 -0.02 -1.25 -1.69 135.00 136.55 2vhm n PRO 25 Ca 0.00 -1.91 0.00 0.00 -2.02 0.00 0.00 63.50 59.57 2vhm n PRO 25 Cb 0.00 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 30.75 2vhm n PRO 25 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vhm n ALA 26 N 4.55 2.20 -0.01 3.55 0.00 -1.25 -4.89 120.51 124.66 2vhm n ALA 26 Ca 0.59 0.00 0.10 0.00 0.00 0.00 0.00 53.44 54.13 2vhm n ALA 26 Cb 0.23 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.51 2vhm n ALA 26 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2vhm n LEU 27 N -3.50 0.00 -0.89 0.00 -0.00 -1.25 -4.34 117.00 107.01 2vhm n LEU 27 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2vhm n LEU 27 Cb 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 43.42 43.43 2vhm n LEU 27 CO 0.00 0.01 0.39 0.61 -0.00 0.00 0.00 177.39 178.40 2vhm n GLY 28 N 1.30 1.64 0.00 1.47 0.00 -0.68 -2.26 105.19 106.66 2vhm n GLY 28 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2vhm n GLY 28 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2vhm n GLN 29 N 0.46 1.68 -0.05 1.61 1.13 -1.26 -4.76 117.38 116.19 2vhm n GLN 29 Ca 0.00 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.05 2vhm n GLN 29 Cb 0.39 -0.77 0.01 0.00 0.11 0.00 0.00 30.24 29.98 2vhm n GLN 29 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2vhm n GLN 30 N -1.46 1.08 -2.69 -1.09 1.13 -0.96 -4.77 117.38 108.63 2vhm n GLN 30 Ca 0.00 -0.13 -0.05 0.00 -1.94 0.00 0.00 57.00 54.88 2vhm n GLN 30 Cb 0.27 -1.17 0.02 0.00 0.11 0.00 0.00 30.24 29.46 2vhm n GLN 30 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2vhm n GLY 31 N 0.33 0.63 3.11 1.08 0.00 -1.25 -4.98 105.19 104.10 2vhm n GLY 31 Ca 0.02 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.22 2vhm n GLY 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vhm s VAL 32 N -3.06 2.85 -0.63 1.61 1.01 -1.18 -3.94 120.40 117.06 2vhm s VAL 32 Ca 0.11 -1.86 -0.28 0.00 0.00 0.00 0.00 61.98 59.94 2vhm s VAL 32 Cb -0.05 -2.85 -0.12 0.00 0.00 0.00 0.00 36.38 33.36 2vhm s VAL 32 CO 0.14 -0.41 2.48 0.59 0.00 0.00 0.00 175.10 177.90 2vhm n ASN 33 N 4.51 1.70 -0.06 3.32 3.02 -1.26 -4.31 115.26 122.17 2vhm n ASN 33 Ca -0.06 -0.20 -0.15 0.00 -0.03 0.00 0.00 54.58 54.15 2vhm n ASN 33 Cb 0.42 -1.35 -0.04 0.00 -0.61 0.00 0.00 39.78 38.21 2vhm n ASN 33 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2vhm h ILE 34 N 7.73 1.28 0.00 2.41 1.08 -1.94 -0.52 117.51 127.54 2vhm h ILE 34 Ca -0.19 -1.78 0.00 0.00 -0.39 0.00 0.00 64.86 62.50 2vhm h ILE 34 Cb 1.29 1.70 0.00 0.00 -3.07 0.00 0.00 36.82 36.74 2vhm h ILE 34 CO 1.21 0.58 0.00 0.80 -0.69 0.00 0.00 178.15 180.05 2vhm n MET 35 N -3.99 0.11 -0.04 2.37 1.56 -1.26 -2.08 117.12 113.79 2vhm n MET 35 Ca -0.05 0.18 -0.04 0.00 -0.27 0.00 0.00 57.70 57.53 2vhm n MET 35 Cb 0.65 -1.50 -0.06 0.00 2.15 0.00 0.00 33.22 34.45 2vhm n MET 35 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 2vhm n GLU 36 N -1.23 2.58 -0.05 2.12 2.13 -0.89 -4.66 120.64 120.65 2vhm n GLU 36 Ca 0.03 -0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.81 2vhm n GLU 36 Cb 0.04 -1.21 -0.04 0.00 0.27 0.00 0.00 31.44 30.51 2vhm n GLU 36 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 2vhm h PHE 37 N 0.00 -0.01 0.00 4.31 3.57 -0.54 -3.34 116.94 120.92 2vhm h PHE 37 Ca -0.22 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.28 2vhm h PHE 37 Cb 1.50 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.24 2vhm h PHE 37 CO 0.00 0.27 0.00 0.00 -2.23 0.00 0.00 178.31 176.35 2vhm n LYS 39 N -1.19 0.67 -0.39 0.00 4.81 -1.26 -3.22 118.16 117.59 2vhm n LYS 39 Ca 0.09 0.17 0.07 0.00 -0.87 0.00 0.00 58.31 57.77 2vhm n LYS 39 Cb 0.10 -1.66 0.25 0.00 0.02 0.00 0.00 35.03 33.74 2vhm n LYS 39 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2vhm n ALA 40 N -2.73 2.76 -0.02 3.14 0.00 -0.70 -3.27 120.51 119.69 2vhm n ALA 40 Ca -0.27 -1.06 -0.05 0.00 0.00 0.00 0.00 53.44 52.06 2vhm n ALA 40 Cb 1.09 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.52 2vhm n ALA 40 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2vhm n PHE 41 N 0.85 0.00 0.01 0.00 7.35 -0.75 -4.00 117.46 120.93 2vhm n PHE 41 Ca 0.18 0.00 0.08 0.00 -0.76 0.00 0.00 57.45 56.95 2vhm n PHE 41 Cb 0.60 -0.27 0.49 0.00 0.35 0.00 0.00 39.48 40.65 2vhm n PHE 41 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 2vhm h ASN 42 N -0.49 0.36 1.81 -2.13 2.35 -1.71 0.75 115.58 116.52 2vhm h ASN 42 Ca -0.03 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2vhm h ASN 42 Cb 0.56 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.85 2vhm h ASN 42 CO -0.02 0.24 -0.18 0.00 -1.65 0.00 0.00 177.43 175.83 2vhm h ALA 43 N 1.76 0.91 -0.25 -0.83 0.00 -1.82 -3.10 119.26 115.94 2vhm h ALA 43 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2vhm h ALA 43 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2vhm h ALA 43 CO -0.04 0.00 0.00 1.17 0.00 0.00 0.00 179.25 180.38 2vhm n LYS 44 N -3.01 2.12 -0.34 0.00 0.00 -0.36 -3.85 118.16 112.72 2vhm n LYS 44 Ca 0.03 -1.97 0.08 0.00 0.00 0.00 0.00 58.31 56.45 2vhm n LYS 44 Cb 0.53 -1.41 0.22 0.00 0.00 0.00 0.00 35.03 34.37 2vhm n LYS 44 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2vhm n THR 45 N 1.17 1.92 0.65 3.15 -2.24 0.25 -3.95 114.28 115.22 2vhm n THR 45 Ca 0.15 -1.69 0.12 0.00 -2.27 0.00 0.00 64.05 60.36 2vhm n THR 45 Cb 0.52 -0.06 0.21 0.00 -2.10 0.00 0.00 70.33 68.90 2vhm n THR 45 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2vhm n ASP 46 N -0.36 3.10 -0.09 3.42 8.00 -1.18 -1.99 116.55 127.44 2vhm n ASP 46 Ca 0.18 -1.95 -0.14 0.00 0.71 0.00 0.00 54.79 53.59 2vhm n ASP 46 Cb 0.74 -0.15 -0.05 0.00 -0.02 0.00 0.00 41.12 41.64 2vhm n ASP 46 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2vhm n SER 47 N 1.30 1.80 0.00 -2.24 2.88 -1.25 -4.84 113.62 111.27 2vhm n SER 47 Ca 0.18 0.30 0.00 0.00 -1.33 0.00 0.00 58.87 58.02 2vhm n SER 47 Cb 0.57 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 2vhm n SER 47 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2vhm n ILE 48 N -4.26 0.00 -3.61 2.46 5.41 -1.26 -5.02 119.36 113.08 2vhm n ILE 48 Ca -0.24 0.80 -0.10 0.00 1.00 0.00 0.00 62.75 64.21 2vhm n ILE 48 Cb 0.59 -1.71 -0.06 0.00 -0.71 0.00 0.00 39.64 37.74 2vhm n ILE 48 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 2vhm s GLU 49 N -1.55 0.55 -0.06 0.38 -1.05 -1.22 -5.10 118.70 110.64 2vhm s GLU 49 Ca 0.00 0.44 0.04 0.00 -0.15 0.00 0.00 54.97 55.30 2vhm s GLU 49 Cb 0.00 0.27 0.00 0.00 -0.44 0.00 0.00 34.13 33.96 2vhm s GLU 49 CO 0.00 -0.11 -0.18 0.21 0.95 0.00 0.00 175.26 176.13 2vhm s LYS 50 N -0.26 2.09 0.00 -4.83 2.20 -0.84 -4.62 119.74 113.48 2vhm s LYS 50 Ca 0.01 -0.63 0.00 0.00 -0.36 0.00 0.00 55.97 54.99 2vhm s LYS 50 Cb -0.03 -1.71 0.00 0.00 -1.51 0.00 0.00 37.83 34.57 2vhm s LYS 50 CO -0.03 0.18 0.00 0.41 -0.36 0.00 0.00 175.35 175.55 2vhm n GLY 51 N 3.40 3.03 3.71 5.54 0.00 -1.26 -4.92 105.19 114.69 2vhm n GLY 51 Ca -0.20 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.60 2vhm n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vhm s LEU 52 N 0.00 4.36 -0.11 0.99 1.02 -1.26 -4.65 118.68 119.03 2vhm s LEU 52 Ca 0.00 1.91 -0.37 0.00 0.02 0.00 0.00 54.13 55.69 2vhm s LEU 52 Cb 0.00 -3.57 -0.15 0.00 0.02 0.00 0.00 46.19 42.49 2vhm s LEU 52 CO 0.00 -0.43 1.67 -2.65 0.02 0.00 0.00 176.35 174.96 2vhm n PRO 53 N 4.04 1.51 -4.75 1.29 -0.02 -1.26 -4.31 135.00 131.49 2vhm n PRO 53 Ca 0.08 0.55 -0.33 0.00 -2.02 0.00 0.00 63.50 61.78 2vhm n PRO 53 Cb 0.47 -2.27 -0.14 0.00 -0.02 0.00 0.00 33.50 31.54 2vhm n PRO 53 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2vhm s ILE 54 N 2.72 3.04 -0.45 4.25 1.01 -0.55 -4.76 121.20 126.46 2vhm s ILE 54 Ca 0.92 -0.66 -0.21 0.00 0.00 0.00 0.00 60.65 60.69 2vhm s ILE 54 Cb -0.91 -2.28 0.03 0.00 0.01 0.00 0.00 42.46 39.31 2vhm s ILE 54 CO 0.55 0.52 0.67 -2.16 0.00 0.00 0.00 174.94 174.52 2vhm s PRO 55 N 0.39 3.29 0.23 2.79 0.04 -1.26 -1.90 135.00 138.57 2vhm s PRO 55 Ca -0.10 -0.37 0.10 0.00 0.04 0.00 0.00 61.00 60.67 2vhm s PRO 55 Cb -0.16 -3.96 -0.05 0.00 0.04 0.00 0.00 34.50 30.37 2vhm s PRO 55 CO 0.05 -1.05 -0.18 0.54 0.04 0.00 0.00 177.00 176.40 2vhm s VAL 56 N 2.91 2.12 -0.11 -0.36 0.11 -1.25 -1.39 120.40 122.43 2vhm s VAL 56 Ca 0.23 -2.23 0.00 0.00 -2.93 0.00 0.00 61.98 57.06 2vhm s VAL 56 Cb -0.14 -2.13 0.02 0.00 -1.53 0.00 0.00 36.38 32.61 2vhm s VAL 56 CO 0.19 -0.42 -0.09 -0.69 -3.33 0.00 0.00 175.10 170.76 2vhm s VAL 57 N -2.49 1.10 -0.43 2.04 1.01 -1.19 -4.08 120.40 116.36 2vhm s VAL 57 Ca 0.24 -0.35 -0.12 0.00 0.00 0.00 0.00 61.98 61.75 2vhm s VAL 57 Cb -0.04 -1.08 0.07 0.00 0.00 0.00 0.00 36.38 35.32 2vhm s VAL 57 CO 0.10 0.37 0.29 -0.63 0.00 0.00 0.00 175.10 175.24 2vhm s ILE 58 N 1.50 4.62 -0.55 2.22 1.09 -1.25 -3.74 121.20 125.09 2vhm s ILE 58 Ca 0.01 -1.18 -0.18 0.00 -1.10 0.00 0.00 60.65 58.20 2vhm s ILE 58 Cb -0.13 -3.75 0.10 0.00 -1.06 0.00 0.00 42.46 37.61 2vhm s ILE 58 CO -0.06 -0.47 0.61 -0.89 -0.10 0.00 0.00 174.94 174.03 2vhm s THR 59 N 1.52 4.95 0.83 2.92 2.01 0.10 -3.40 115.64 124.57 2vhm s THR 59 Ca 0.03 -0.99 -0.06 0.00 0.31 0.00 0.00 61.69 60.98 2vhm s THR 59 Cb -0.23 -4.38 0.18 0.00 0.01 0.00 0.00 72.50 68.08 2vhm s THR 59 CO 0.04 -0.95 1.14 0.52 -0.69 0.00 0.00 174.62 174.68 2vhm n VAL 60 N 5.47 0.00 0.01 3.82 0.31 -0.38 -2.70 118.33 124.85 2vhm n VAL 60 Ca -0.10 -1.36 0.00 0.00 -0.01 0.00 0.00 64.34 62.87 2vhm n VAL 60 Cb 0.43 -1.12 0.00 0.00 -0.91 0.00 0.00 33.84 32.23 2vhm n VAL 60 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2vhm n TYR 61 N -3.25 -0.02 -0.11 3.52 4.01 -1.20 -4.22 117.16 115.89 2vhm n TYR 61 Ca 0.17 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 2vhm n TYR 61 Cb 0.59 0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.66 2vhm n TYR 61 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2vhm n ALA 62 N -2.59 0.00 -1.30 -0.72 0.00 -1.26 -4.73 120.51 109.90 2vhm n ALA 62 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 2vhm n ALA 62 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.56 2vhm n ALA 62 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2vhm n ASP 63 N 0.00 6.56 -2.00 0.00 8.00 -1.26 -4.86 116.55 122.99 2vhm n ASP 63 Ca 0.00 -3.74 0.00 0.00 0.71 0.00 0.00 54.79 51.76 2vhm n ASP 63 Cb 0.01 -0.94 0.00 0.00 -0.02 0.00 0.00 41.12 40.17 2vhm n ASP 63 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 2vhm n ARG 64 N -0.99 -2.38 -4.58 -1.24 1.85 -1.25 -4.89 116.66 103.18 2vhm n ARG 64 Ca 0.62 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 57.13 2vhm n ARG 64 Cb 0.96 -3.99 -0.12 0.00 -1.05 0.00 0.00 32.46 28.26 2vhm n ARG 64 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2vhm s SER 65 N -1.61 4.64 0.04 2.89 0.15 -1.26 -4.37 113.70 114.17 2vhm s SER 65 Ca 0.00 -0.07 -0.03 0.00 0.70 0.00 0.00 55.95 56.54 2vhm s SER 65 Cb 0.00 -1.36 -0.02 0.00 -1.71 0.00 0.00 66.02 62.93 2vhm s SER 65 CO 0.00 0.30 0.04 0.72 1.20 0.00 0.00 173.24 175.50 2vhm s PHE 66 N -0.42 0.30 -0.03 3.44 -0.12 -1.26 -3.22 117.98 116.67 2vhm s PHE 66 Ca 0.06 -0.67 0.07 0.00 -0.05 0.00 0.00 56.93 56.35 2vhm s PHE 66 Cb -0.12 -0.22 -0.02 0.00 -0.63 0.00 0.00 43.02 42.03 2vhm s PHE 66 CO 0.02 -0.35 -0.26 -0.08 -0.05 0.00 0.00 175.22 174.51 2vhm s THR 67 N -2.83 2.05 -0.02 -4.49 -1.32 -1.10 -4.94 115.64 102.99 2vhm s THR 67 Ca -0.03 -1.10 -0.02 0.00 -1.21 0.00 0.00 61.69 59.33 2vhm s THR 67 Cb 0.00 -1.71 0.00 0.00 -1.51 0.00 0.00 72.50 69.29 2vhm s THR 67 CO -0.06 0.58 0.05 0.72 -2.21 0.00 0.00 174.62 173.70 2vhm s PHE 68 N -0.49 -0.04 0.35 9.09 -0.71 -1.26 -0.73 117.98 124.20 2vhm s PHE 68 Ca 0.06 0.10 -0.00 0.00 -1.04 0.00 0.00 56.93 56.05 2vhm s PHE 68 Cb -0.11 0.01 0.00 0.00 -1.21 0.00 0.00 43.02 41.71 2vhm s PHE 68 CO 0.00 -0.04 0.46 0.28 -1.34 0.00 0.00 175.22 174.58 2vhm n VAL 69 N 2.93 0.00 -4.43 -2.49 0.31 -1.24 -5.01 118.33 108.40 2vhm n VAL 69 Ca -0.13 -1.91 -0.23 0.00 -0.01 0.00 0.00 64.34 62.06 2vhm n VAL 69 Cb 0.59 1.13 -0.10 0.00 -0.91 0.00 0.00 33.84 34.55 2vhm n VAL 69 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2vhm s THR 70 N -2.91 2.24 0.00 2.52 2.01 -1.26 -3.15 115.64 115.09 2vhm s THR 70 Ca 0.31 -2.31 0.00 0.00 0.31 0.00 0.00 61.69 60.01 2vhm s THR 70 Cb -0.00 -2.20 0.00 0.00 0.01 0.00 0.00 72.50 70.31 2vhm s THR 70 CO 0.22 -0.43 0.00 0.29 -0.69 0.00 0.00 174.62 174.02 2vhm n LYS 71 N -0.45 0.00 -2.22 4.92 5.02 -0.48 -4.98 118.16 119.98 2vhm n LYS 71 Ca -0.07 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.98 2vhm n LYS 71 Cb 0.60 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.76 2vhm n LYS 71 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2vhm n THR 72 N 0.00 0.00 -1.30 -0.18 -2.24 -1.26 -4.15 114.28 105.15 2vhm n THR 72 Ca 0.00 -1.28 -0.29 0.00 -2.27 0.00 0.00 64.05 60.21 2vhm n THR 72 Cb 0.00 -1.17 0.18 0.00 -2.10 0.00 0.00 70.33 67.24 2vhm n THR 72 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2vhm s PRO 73 N -5.34 0.18 0.00 -0.78 0.02 -1.26 -4.38 135.00 123.43 2vhm s PRO 73 Ca 0.68 0.23 0.00 0.00 0.02 0.00 0.00 61.00 61.93 2vhm s PRO 73 Cb -0.03 -1.73 0.00 0.00 0.02 0.00 0.00 34.50 32.76 2vhm s PRO 73 CO 0.46 -2.84 0.00 -2.30 -0.33 0.00 0.00 177.00 171.99 2vhm n PRO 74 N -4.20 2.39 -1.10 5.54 -0.02 -1.26 -5.05 135.00 131.30 2vhm n PRO 74 Ca 0.08 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.51 2vhm n PRO 74 Cb 0.59 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 34.01 2vhm n PRO 74 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vhm n ALA 75 N -3.00 3.57 -1.34 3.55 0.00 -1.26 -4.92 120.51 117.11 2vhm n ALA 75 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.53 2vhm n ALA 75 Cb 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.06 2vhm n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vhm n ALA 76 N 0.04 0.41 0.00 0.00 0.00 -1.26 -4.85 120.51 114.85 2vhm n ALA 76 Ca -0.23 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2vhm n ALA 76 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.21 2vhm n ALA 76 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2vhm n VAL 77 N 0.00 0.00 0.65 0.00 0.24 -1.26 -4.71 118.33 113.25 2vhm n VAL 77 Ca 0.00 -0.18 0.13 0.00 -2.04 0.00 0.00 64.34 62.25 2vhm n VAL 77 Cb 0.35 0.91 0.30 0.00 -1.47 0.00 0.00 33.84 33.93 2vhm n VAL 77 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2vhm n LEU 78 N -0.42 0.68 0.06 1.34 4.77 -1.26 -3.52 117.00 118.65 2vhm n LEU 78 Ca 0.00 0.36 0.11 0.00 -0.03 0.00 0.00 56.01 56.46 2vhm n LEU 78 Cb 0.00 -0.26 -0.01 0.00 -2.33 0.00 0.00 43.42 40.82 2vhm n LEU 78 CO 0.00 -0.09 -0.11 0.18 -1.33 0.00 0.00 177.39 176.05 2vhm n LEU 79 N -2.08 0.61 0.03 2.23 4.77 -1.26 -3.86 117.00 117.44 2vhm n LEU 79 Ca 0.05 0.16 -0.05 0.00 -0.03 0.00 0.00 56.01 56.14 2vhm n LEU 79 Cb 0.42 -0.07 -0.10 0.00 -2.33 0.00 0.00 43.42 41.34 2vhm n LEU 79 CO 0.33 -0.08 -0.19 0.11 -1.33 0.00 0.00 177.39 176.23 2vhm h LYS 80 N 0.00 0.00 -0.01 3.23 1.57 -1.84 2.61 116.57 122.12 2vhm h LYS 80 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2vhm h LYS 80 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 2vhm h LYS 80 CO 0.00 0.58 -0.01 0.36 -0.57 0.00 0.00 179.45 179.81 2vhm n LYS 81 N -3.11 1.41 -0.08 3.15 2.85 -1.26 -1.97 118.16 119.14 2vhm n LYS 81 Ca -0.09 -0.64 -0.15 0.00 -1.05 0.00 0.00 58.31 56.39 2vhm n LYS 81 Cb 0.94 -1.49 -0.07 0.00 -0.65 0.00 0.00 35.03 33.77 2vhm n LYS 81 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2vhm n ALA 82 N -0.24 1.80 0.23 0.58 0.00 -1.06 -4.74 120.51 117.07 2vhm n ALA 82 Ca 0.20 -0.67 -0.12 0.00 0.00 0.00 0.00 53.44 52.85 2vhm n ALA 82 Cb 0.28 0.21 -0.07 0.00 0.00 0.00 0.00 19.45 19.88 2vhm n ALA 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vhm h ALA 83 N -0.31 -0.62 0.00 0.00 0.00 0.44 -3.48 119.26 115.29 2vhm h ALA 83 Ca -0.39 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2vhm h ALA 83 Cb 1.45 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.48 2vhm h ALA 83 CO -0.16 -0.64 0.00 0.41 0.00 0.00 0.00 179.25 178.86 2vhm n GLY 84 N -0.18 0.83 3.14 0.00 0.00 -0.92 -4.48 105.19 103.57 2vhm n GLY 84 Ca -0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 2vhm n GLY 84 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2vhm s ILE 85 N -1.37 0.12 -0.05 -0.61 -4.36 -0.83 -5.03 121.20 109.07 2vhm s ILE 85 Ca 0.00 -0.98 -0.06 0.00 -0.26 0.00 0.00 60.65 59.34 2vhm s ILE 85 Cb 0.00 -0.88 -0.02 0.00 1.25 0.00 0.00 42.46 42.81 2vhm s ILE 85 CO 0.00 -0.54 -0.12 0.29 0.24 0.00 0.00 174.94 174.80 2vhm n LYS 86 N 0.76 0.19 -2.83 0.37 5.02 -1.26 -4.57 118.16 115.84 2vhm n LYS 86 Ca -0.19 0.07 -0.41 0.00 -2.02 0.00 0.00 58.31 55.77 2vhm n LYS 86 Cb 0.58 -0.75 -0.04 0.00 -0.02 0.00 0.00 35.03 34.80 2vhm n LYS 86 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2vhm s SER 87 N -5.17 7.34 0.00 4.39 0.01 -1.26 -5.06 113.70 113.95 2vhm s SER 87 Ca -0.10 1.61 0.00 0.00 1.31 0.00 0.00 55.95 58.77 2vhm s SER 87 Cb 0.01 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2vhm s SER 87 CO 0.15 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.32 2vhm n GLY 88 N 2.51 -2.02 1.82 3.44 0.00 -1.26 -5.02 105.19 104.66 2vhm n GLY 88 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2vhm n GLY 88 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2vhm n SER 89 N 0.00 0.03 0.00 1.61 2.88 -1.22 -4.90 113.62 112.02 2vhm n SER 89 Ca 0.00 0.27 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 2vhm n SER 89 Cb 0.00 0.18 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 2vhm n SER 89 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2vhm n GLY 90 N 1.87 2.34 2.22 0.46 0.00 -1.26 -4.79 105.19 106.03 2vhm n GLY 90 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2vhm n GLY 90 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2vhm n LYS 91 N -2.00 0.97 -1.44 1.61 2.85 -1.26 -5.15 118.16 113.75 2vhm n LYS 91 Ca 0.00 -2.51 -0.37 0.00 -1.05 0.00 0.00 58.31 54.38 2vhm n LYS 91 Cb 0.00 -0.65 0.06 0.00 -0.65 0.00 0.00 35.03 33.79 2vhm n LYS 91 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 2vhm n PRO 92 N -0.31 0.56 -1.14 -1.58 -0.02 -1.26 -3.07 135.00 128.18 2vhm n PRO 92 Ca 0.00 0.23 -0.05 0.00 -2.02 0.00 0.00 63.50 61.67 2vhm n PRO 92 Cb 0.91 -1.98 -0.02 0.00 -0.02 0.00 0.00 33.50 32.39 2vhm n PRO 92 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2vhm n ASN 93 N -0.55 -4.32 -0.07 2.55 5.03 -1.26 -4.80 115.26 111.85 2vhm n ASN 93 Ca 0.12 0.12 -0.14 0.00 0.87 0.00 0.00 54.58 55.55 2vhm n ASN 93 Cb 0.49 -2.24 -0.05 0.00 -1.02 0.00 0.00 39.78 36.96 2vhm n ASN 93 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2vhm n LYS 94 N -1.86 0.31 -4.87 3.52 5.02 -1.17 -4.98 118.16 114.12 2vhm n LYS 94 Ca -0.05 0.14 -0.33 0.00 -2.02 0.00 0.00 58.31 56.05 2vhm n LYS 94 Cb 0.28 -1.03 -0.14 0.00 -0.02 0.00 0.00 35.03 34.12 2vhm n LYS 94 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2vhm s ASP 95 N -6.28 3.90 -0.64 4.39 1.01 -1.26 -5.09 116.67 112.70 2vhm s ASP 95 Ca -0.20 -0.32 -0.27 0.00 0.71 0.00 0.00 52.55 52.48 2vhm s ASP 95 Cb 0.07 -1.33 0.04 0.00 1.01 0.00 0.00 42.92 42.71 2vhm s ASP 95 CO 0.26 0.22 1.16 -0.54 0.21 0.00 0.00 175.17 176.48 2vhm s LYS 96 N 0.00 3.33 0.00 8.23 3.01 -1.26 -4.77 119.74 128.28 2vhm s LYS 96 Ca -0.05 -0.11 0.00 0.00 -1.01 0.00 0.00 55.97 54.80 2vhm s LYS 96 Cb -0.14 -4.10 0.00 0.00 -1.01 0.00 0.00 37.83 32.58 2vhm s LYS 96 CO 0.04 -1.82 0.24 0.28 0.51 0.00 0.00 175.35 174.61 2vhm n VAL 97 N 6.42 0.00 0.00 3.17 0.31 0.56 -4.80 118.33 123.98 2vhm n VAL 97 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 2vhm n VAL 97 Cb 0.48 -0.22 0.00 0.00 -0.91 0.00 0.00 33.84 33.19 2vhm n VAL 97 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2vhm n GLY 98 N 0.22 -0.54 3.45 2.92 0.00 -1.23 -4.73 105.19 105.28 2vhm n GLY 98 Ca 0.00 -0.57 -0.15 0.00 0.00 0.00 0.00 46.02 45.30 2vhm n GLY 98 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vhm s LYS 99 N -1.76 1.11 -0.12 1.61 -2.85 -1.26 -4.21 119.74 112.25 2vhm s LYS 99 Ca 0.00 -0.09 -0.05 0.00 -1.00 0.00 0.00 55.97 54.83 2vhm s LYS 99 Cb 0.00 0.51 0.06 0.00 -2.06 0.00 0.00 37.83 36.35 2vhm s LYS 99 CO 0.00 -0.40 0.26 0.42 0.10 0.00 0.00 175.35 175.72 2vhm s ILE 100 N -2.26 -0.38 1.06 3.79 -1.09 -1.25 -4.39 121.20 116.67 2vhm s ILE 100 Ca -0.06 0.28 -0.12 0.00 -2.23 0.00 0.00 60.65 58.51 2vhm s ILE 100 Cb -0.01 -0.43 0.22 0.00 -1.58 0.00 0.00 42.46 40.67 2vhm s ILE 100 CO 0.00 0.12 1.07 -0.44 -1.23 0.00 0.00 174.94 174.46 2vhm s SER 101 N 2.34 2.02 0.36 3.58 0.01 -1.26 -2.69 113.70 118.06 2vhm s SER 101 Ca 0.01 1.35 0.15 0.00 1.31 0.00 0.00 55.95 58.77 2vhm s SER 101 Cb -0.12 -2.05 0.68 0.00 0.21 0.00 0.00 66.02 64.73 2vhm s SER 101 CO -0.08 -3.53 1.76 -0.09 0.41 0.00 0.00 173.24 171.71 2vhm h ARG 102 N -2.16 0.00 0.00 12.44 2.43 -1.81 -2.74 114.38 122.53 2vhm h ARG 102 Ca -0.57 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 58.50 2vhm h ARG 102 Cb 1.33 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.86 2vhm h ARG 102 CO 0.54 0.41 -0.50 0.00 -1.51 0.00 0.00 179.97 178.92 2vhm h ALA 103 N 1.59 0.81 0.00 2.80 0.00 -1.94 -0.59 119.26 121.92 2vhm h ALA 103 Ca -0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2vhm h ALA 103 Cb 0.82 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2vhm h ALA 103 CO 0.05 0.63 0.00 1.04 0.00 0.00 0.00 179.25 180.97 2vhm n GLN 104 N -3.42 0.39 0.00 0.00 6.02 -1.04 0.13 117.38 119.47 2vhm n GLN 104 Ca 0.01 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 2vhm n GLN 104 Cb 0.64 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.40 2vhm n GLN 104 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2vhm n LEU 105 N -1.27 1.28 -0.10 1.08 4.77 -1.05 -4.28 117.00 117.43 2vhm n LEU 105 Ca 0.13 -1.28 0.02 0.00 -0.03 0.00 0.00 56.01 54.85 2vhm n LEU 105 Cb 0.20 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2vhm n LEU 105 CO 0.19 0.32 0.18 1.67 -1.33 0.00 0.00 177.39 178.43 2vhm n GLN 106 N -0.15 2.11 -0.08 3.23 7.27 -0.25 -4.27 117.38 125.23 2vhm n GLN 106 Ca 0.00 -0.45 -0.12 0.00 0.07 0.00 0.00 57.00 56.50 2vhm n GLN 106 Cb 0.09 -0.92 -0.08 0.00 2.41 0.00 0.00 30.24 31.74 2vhm n GLN 106 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 2vhm h GLU 107 N 0.50 0.00 -0.04 3.69 5.08 0.89 -3.13 114.58 121.57 2vhm h GLU 107 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2vhm h GLU 107 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2vhm h GLU 107 CO 0.00 0.59 0.00 -0.89 -1.00 0.00 0.00 179.01 177.71 2vhm n ILE 108 N -4.57 0.00 -0.06 3.13 5.41 -1.26 -1.31 119.36 120.70 2vhm n ILE 108 Ca -0.16 0.00 -0.06 0.00 1.00 0.00 0.00 62.75 63.53 2vhm n ILE 108 Cb 0.43 -0.27 -0.11 0.00 -0.71 0.00 0.00 39.64 38.97 2vhm n ILE 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2vhm n ALA 109 N -0.43 1.72 -0.02 -1.39 0.00 -1.24 -4.14 120.51 115.01 2vhm n ALA 109 Ca 0.00 -0.89 -0.05 0.00 0.00 0.00 0.00 53.44 52.50 2vhm n ALA 109 Cb 0.01 -0.08 -0.13 0.00 0.00 0.00 0.00 19.45 19.25 2vhm n ALA 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2vhm n GLN 110 N -2.48 0.64 0.23 0.00 6.02 -0.72 -4.12 117.38 116.94 2vhm n GLN 110 Ca -0.21 0.21 0.09 0.00 -0.01 0.00 0.00 57.00 57.08 2vhm n GLN 110 Cb 0.92 -1.75 0.55 0.00 1.02 0.00 0.00 30.24 30.97 2vhm n GLN 110 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2vhm h THR 111 N 0.00 0.77 -2.59 5.09 2.02 -1.43 -3.19 112.91 113.58 2vhm h THR 111 Ca -0.28 -0.91 -0.72 0.00 0.77 0.00 0.00 66.41 65.27 2vhm h THR 111 Cb 1.88 1.56 -0.34 0.00 -1.74 0.00 0.00 68.15 69.51 2vhm h THR 111 CO 0.06 0.22 0.20 0.29 0.37 0.00 0.00 175.52 176.66 2vhm n LYS 112 N -3.70 3.68 -0.08 6.66 5.02 -1.26 -4.85 118.16 123.63 2vhm n LYS 112 Ca -0.01 -4.62 -0.10 0.00 -2.02 0.00 0.00 58.31 51.55 2vhm n LYS 112 Cb 0.34 -2.40 -0.05 0.00 -0.02 0.00 0.00 35.03 32.90 2vhm n LYS 112 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2vhm h ALA 113 N 4.84 0.09 -0.77 7.82 0.00 -1.77 -3.30 119.26 126.17 2vhm h ALA 113 Ca 0.21 -0.70 -0.38 0.00 0.00 0.00 0.00 54.91 54.04 2vhm h ALA 113 Cb 0.62 0.51 -0.23 0.00 0.00 0.00 0.00 17.79 18.70 2vhm h ALA 113 CO 1.12 0.50 0.48 0.00 0.00 0.00 0.00 179.25 181.35 2vhm n ALA 114 N -3.43 4.86 0.00 0.00 0.00 -1.26 -3.93 120.51 116.75 2vhm n ALA 114 Ca -0.15 -2.24 0.00 0.00 0.00 0.00 0.00 53.44 51.05 2vhm n ALA 114 Cb 0.39 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.50 2vhm n ALA 114 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2vhm n ASP 115 N -0.70 2.71 -4.91 0.00 9.92 -1.26 -5.08 116.55 117.23 2vhm n ASP 115 Ca 0.46 0.00 -0.29 0.00 -0.53 0.00 0.00 54.79 54.42 2vhm n ASP 115 Cb 1.40 0.43 -0.04 0.00 -0.64 0.00 0.00 41.12 42.28 2vhm n ASP 115 CO 0.00 0.00 0.00 -0.04 0.13 0.00 0.00 177.20 177.29 2vhm s MET 116 N -1.27 3.57 -0.27 -1.24 -1.94 -1.24 -5.01 119.30 111.90 2vhm s MET 116 Ca 0.00 -0.19 0.12 0.00 -1.71 0.00 0.00 55.69 53.91 2vhm s MET 116 Cb 0.00 -2.82 0.73 0.00 2.01 0.00 0.00 34.83 34.75 2vhm s MET 116 CO 0.00 0.41 1.71 0.25 -0.01 0.00 0.00 175.02 177.39 2vhm n THR 117 N -0.34 2.77 -2.80 2.05 -2.24 -1.26 -4.92 114.28 107.53 2vhm n THR 117 Ca -0.03 -1.66 -0.42 0.00 -2.27 0.00 0.00 64.05 59.67 2vhm n THR 117 Cb 0.53 -0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 68.41 2vhm n THR 117 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2vhm s GLY 118 N -1.18 2.04 0.05 3.38 0.00 -1.26 -4.96 107.32 105.40 2vhm s GLY 118 Ca 0.53 0.12 -0.29 0.00 0.00 0.00 0.00 44.72 45.07 2vhm s GLY 118 CO 0.13 1.84 1.49 0.00 0.00 0.00 0.00 173.10 176.56 2vhm h ALA 119 N 7.34 -0.65 -3.46 3.20 0.00 -1.94 -3.42 119.26 120.33 2vhm h ALA 119 Ca -0.27 -0.17 -0.24 0.00 0.00 0.00 0.00 54.91 54.23 2vhm h ALA 119 Cb 1.12 0.25 0.10 0.00 0.00 0.00 0.00 17.79 19.26 2vhm h ALA 119 CO 0.87 -0.81 0.22 -0.25 0.00 0.00 0.00 179.25 179.28 2vhm n ASP 120 N -5.33 -0.13 0.04 0.00 8.00 -1.26 -4.96 116.55 112.91 2vhm n ASP 120 Ca -0.11 -1.23 -0.04 0.00 0.71 0.00 0.00 54.79 54.11 2vhm n ASP 120 Cb 0.30 -0.58 -0.09 0.00 -0.02 0.00 0.00 41.12 40.72 2vhm n ASP 120 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2vhm h ILE 121 N -1.53 1.02 -0.37 0.53 2.04 -1.94 -3.33 117.51 113.93 2vhm h ILE 121 Ca -0.24 -2.67 0.05 0.00 1.00 0.00 0.00 64.86 62.99 2vhm h ILE 121 Cb 0.68 2.46 -0.05 0.00 -0.74 0.00 0.00 36.82 39.17 2vhm h ILE 121 CO 0.17 0.58 0.10 -0.33 0.00 0.00 0.00 178.15 178.67 2vhm h GLU 122 N 0.00 0.23 0.00 2.37 3.07 -1.96 -1.39 114.58 116.90 2vhm h GLU 122 Ca -0.13 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.72 2vhm h GLU 122 Cb 1.74 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.60 2vhm h GLU 122 CO 0.08 0.15 0.00 0.00 -1.40 0.00 0.00 179.01 177.85 2vhm n ALA 123 N -2.38 -0.19 0.27 3.43 0.00 -1.25 -2.56 120.51 117.82 2vhm n ALA 123 Ca 0.02 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.55 2vhm n ALA 123 Cb 0.15 0.16 0.70 0.00 0.00 0.00 0.00 19.45 20.46 2vhm n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vhm h MET 124 N 0.00 0.00 0.00 0.00 -0.00 -1.67 -1.38 114.93 111.88 2vhm h MET 124 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.65 2vhm h MET 124 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.59 2vhm h MET 124 CO 0.00 0.02 -0.25 1.15 -0.00 0.00 0.00 176.91 177.83 2vhm h THR 125 N 0.00 1.03 0.00 -0.10 2.02 -1.22 -1.70 112.91 112.93 2vhm h THR 125 Ca -0.00 -0.89 0.00 0.00 0.77 0.00 0.00 66.41 66.29 2vhm h THR 125 Cb 0.03 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 2vhm h THR 125 CO 0.00 0.24 -0.19 0.54 0.37 0.00 0.00 175.52 176.49 2vhm n ARG 126 N -4.03 0.23 -0.01 6.66 1.74 -0.53 -0.39 116.66 120.33 2vhm n ARG 126 Ca -0.02 0.15 0.12 0.00 -0.77 0.00 0.00 57.85 57.34 2vhm n ARG 126 Cb 0.32 -1.73 0.65 0.00 -1.02 0.00 0.00 32.46 30.68 2vhm n ARG 126 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2vhm n SER 127 N -2.12 0.52 0.00 0.55 7.64 -0.66 -3.66 113.62 115.90 2vhm n SER 127 Ca 0.05 -1.34 0.00 0.00 1.01 0.00 0.00 58.87 58.59 2vhm n SER 127 Cb 0.42 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 2vhm n SER 127 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2vhm n ILE 128 N -0.52 0.00 -0.05 0.44 2.08 -0.63 -4.18 119.36 116.49 2vhm n ILE 128 Ca 0.18 0.00 0.21 0.00 0.56 0.00 0.00 62.75 63.70 2vhm n ILE 128 Cb 0.17 -0.04 0.67 0.00 -0.75 0.00 0.00 39.64 39.69 2vhm n ILE 128 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 2vhm h GLU 129 N 0.00 0.05 0.08 0.38 5.08 -0.79 -2.02 114.58 117.37 2vhm h GLU 129 Ca 0.00 -0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.11 2vhm h GLU 129 Cb 0.33 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2vhm h GLU 129 CO 0.00 0.04 -1.30 0.78 -1.00 0.00 0.00 179.01 177.53 2vhm h GLY 130 N 0.06 0.20 1.26 -3.84 0.00 -1.79 -3.25 103.07 95.70 2vhm h GLY 130 Ca 0.30 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2vhm h GLY 130 CO -0.02 0.45 0.00 -1.30 0.00 0.00 0.00 176.54 175.67 2vhm n THR 131 N -4.06 0.48 -0.01 4.70 -2.24 -1.06 0.54 114.28 112.64 2vhm n THR 131 Ca -0.26 0.12 -0.21 0.00 -2.27 0.00 0.00 64.05 61.44 2vhm n THR 131 Cb 0.83 -1.08 -0.14 0.00 -2.10 0.00 0.00 70.33 67.84 2vhm n THR 131 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2vhm h ALA 132 N 2.13 0.14 -0.31 6.98 0.00 -1.42 -3.38 119.26 123.40 2vhm h ALA 132 Ca 0.00 -1.00 -0.26 0.00 0.00 0.00 0.00 54.91 53.65 2vhm h ALA 132 Cb 0.01 0.41 -0.10 0.00 0.00 0.00 0.00 17.79 18.11 2vhm h ALA 132 CO 0.00 0.68 0.21 0.54 0.00 0.00 0.00 179.25 180.68 2vhm n ARG 133 N -4.06 1.74 -0.10 0.00 1.74 0.19 -3.22 116.66 112.95 2vhm n ARG 133 Ca -0.23 -1.25 -0.13 0.00 -0.77 0.00 0.00 57.85 55.47 2vhm n ARG 133 Cb 0.83 -1.61 -0.04 0.00 -1.02 0.00 0.00 32.46 30.62 2vhm n ARG 133 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2vhm n SER 134 N 1.00 1.94 -1.78 0.55 7.64 -1.19 -4.70 113.62 117.08 2vhm n SER 134 Ca 0.28 0.34 -0.02 0.00 1.01 0.00 0.00 58.87 60.48 2vhm n SER 134 Cb 0.60 -0.76 0.31 0.00 -1.01 0.00 0.00 64.21 63.35 2vhm n SER 134 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 2vhm n MET 135 N -4.42 3.69 -1.63 1.43 -0.00 -1.26 -4.72 117.12 110.21 2vhm n MET 135 Ca -0.22 -3.08 -0.00 0.00 -0.00 0.00 0.00 57.70 54.40 2vhm n MET 135 Cb 0.59 -2.15 0.00 0.00 -0.00 0.00 0.00 33.22 31.65 2vhm n MET 135 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2vhm n GLY 136 N -0.15 -0.56 3.01 3.17 0.00 -1.26 -3.39 105.19 106.00 2vhm n GLY 136 Ca 0.36 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 46.16 2vhm n GLY 136 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vhm s LEU 137 N -1.68 2.08 -0.01 0.99 1.43 -1.20 -0.32 118.68 119.97 2vhm s LEU 137 Ca 0.01 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 2vhm s LEU 137 Cb -0.00 -0.30 0.01 0.00 0.03 0.00 0.00 46.19 45.92 2vhm s LEU 137 CO 0.07 0.01 0.00 -0.69 0.23 0.00 0.00 176.35 175.97 2vhm s VAL 138 N -0.48 0.04 0.19 -1.59 1.01 -1.26 -4.23 120.40 114.09 2vhm s VAL 138 Ca -0.00 0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.73 2vhm s VAL 138 Cb -0.05 -0.09 -0.08 0.00 0.00 0.00 0.00 36.38 36.16 2vhm s VAL 138 CO 0.00 0.05 1.06 0.68 0.00 0.00 0.00 175.10 176.90 2vhm s VAL 139 N 0.41 3.93 -0.69 2.92 -7.23 -1.26 -3.91 120.40 114.56 2vhm s VAL 139 Ca -0.04 1.72 0.05 0.00 -1.81 0.00 0.00 61.98 61.90 2vhm s VAL 139 Cb -0.05 -4.10 0.27 0.00 0.56 0.00 0.00 36.38 33.06 2vhm s VAL 139 CO -0.01 0.32 0.88 1.21 -0.31 0.00 0.00 175.10 177.19 2vhm n GLU 140 N 2.16 2.89 0.00 4.82 4.07 -1.10 -4.92 120.64 128.57 2vhm n GLU 140 Ca 0.02 -4.68 0.00 0.00 -0.06 0.00 0.00 57.16 52.43 2vhm n GLU 140 Cb 0.46 -2.29 0.00 0.00 -0.06 0.00 0.00 31.44 29.55 2vhm n GLU 140 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82