#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cru n SER 2 N 0.00 1.68 -4.36 1.61 7.64 -1.26 -4.87 113.62 114.06 2cru n SER 2 Ca 0.00 0.58 -0.45 0.00 1.01 0.00 0.00 58.87 60.01 2cru n SER 2 Cb 0.00 -1.12 -0.04 0.00 -1.01 0.00 0.00 64.21 62.04 2cru n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2cru s SER 3 N 6.41 6.27 0.00 6.43 0.01 -1.26 -4.81 113.70 126.76 2cru s SER 3 Ca 1.12 -1.70 0.00 0.00 1.31 0.00 0.00 55.95 56.68 2cru s SER 3 Cb -1.11 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 62.85 2cru s SER 3 CO 0.57 -0.98 0.00 0.61 0.41 0.00 0.00 173.24 173.85 2cru n GLY 4 N 5.15 1.01 3.84 3.44 0.00 -1.26 -4.99 105.19 112.37 2cru n GLY 4 Ca -0.06 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 44.86 2cru n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cru s SER 5 N -4.00 6.80 -0.13 1.61 0.01 -1.26 -5.02 113.70 111.71 2cru s SER 5 Ca 0.00 1.47 -0.15 0.00 1.31 0.00 0.00 55.95 58.58 2cru s SER 5 Cb 0.00 -2.45 -0.05 0.00 0.21 0.00 0.00 66.02 63.73 2cru s SER 5 CO 0.00 -0.33 -0.29 -0.24 0.41 0.00 0.00 173.24 172.79 2cru n SER 6 N -0.71 1.80 0.00 2.44 2.88 -1.26 -4.88 113.62 113.89 2cru n SER 6 Ca 0.05 0.30 0.00 0.00 -1.33 0.00 0.00 58.87 57.89 2cru n SER 6 Cb 0.54 -0.67 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 2cru n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cru n GLY 7 N 1.81 1.18 3.86 0.46 0.00 -1.26 -5.09 105.19 106.15 2cru n GLY 7 Ca -0.12 0.48 -0.32 0.00 0.00 0.00 0.00 46.02 46.07 2cru n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cru s LEU 8 N 0.00 3.99 -0.62 0.99 1.43 -1.26 -4.99 118.68 118.21 2cru s LEU 8 Ca 0.00 1.20 -0.01 0.00 -1.03 0.00 0.00 54.13 54.29 2cru s LEU 8 Cb 0.00 -4.03 0.45 0.00 0.03 0.00 0.00 46.19 42.64 2cru s LEU 8 CO 0.00 -0.27 1.93 0.54 0.23 0.00 0.00 176.35 178.79 2cru n ARG 9 N -0.68 2.81 -1.20 1.70 5.12 -1.26 -5.03 116.66 118.11 2cru n ARG 9 Ca 0.03 -3.40 -0.43 0.00 -1.93 0.00 0.00 57.85 52.12 2cru n ARG 9 Cb 0.53 -2.29 -0.04 0.00 -1.16 0.00 0.00 32.46 29.51 2cru n ARG 9 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2cru n ARG 10 N -0.89 0.00 -3.50 5.56 1.74 -1.26 -4.88 116.66 113.42 2cru n ARG 10 Ca 0.61 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 57.35 2cru n ARG 10 Cb 0.70 -0.98 -0.06 0.00 -1.02 0.00 0.00 32.46 31.10 2cru n ARG 10 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2cru n GLN 11 N 0.98 2.83 -3.64 5.56 10.64 -1.26 -4.99 117.38 127.49 2cru n GLN 11 Ca 0.16 -4.55 -0.05 0.00 -1.83 0.00 0.00 57.00 50.73 2cru n GLN 11 Cb 0.16 -2.37 -0.07 0.00 -0.86 0.00 0.00 30.24 27.10 2cru n GLN 11 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.06 175.73 2cru s ARG 12 N -1.96 0.54 0.09 2.61 6.06 -1.26 -5.17 118.95 119.86 2cru s ARG 12 Ca 0.32 0.94 -0.04 0.00 -2.50 0.00 0.00 55.73 54.44 2cru s ARG 12 Cb 0.02 0.11 -0.05 0.00 0.06 0.00 0.00 34.95 35.09 2cru s ARG 12 CO -0.06 -0.11 0.31 -0.48 -2.50 0.00 0.00 175.30 172.46 2cru s LEU 13 N 1.47 4.32 -0.09 -0.88 2.34 -1.26 -5.10 118.68 119.48 2cru s LEU 13 Ca -0.09 0.52 -0.26 0.00 0.06 0.00 0.00 54.13 54.36 2cru s LEU 13 Cb -0.04 -3.06 0.06 0.00 -0.56 0.00 0.00 46.19 42.59 2cru s LEU 13 CO -0.17 0.13 0.60 0.00 -1.06 0.00 0.00 176.35 175.85 2cru s ALA 14 N -1.52 -1.53 0.77 1.48 0.00 -1.26 -5.15 121.76 114.55 2cru s ALA 14 Ca 0.36 1.25 -0.16 0.00 0.00 0.00 0.00 51.96 53.41 2cru s ALA 14 Cb -0.13 -0.25 -0.06 0.00 0.00 0.00 0.00 23.12 22.69 2cru s ALA 14 CO 0.23 -0.33 0.24 -1.91 0.00 0.00 0.00 175.76 173.99 2cru n GLU 15 N 1.45 0.12 -1.28 0.00 2.13 -1.26 -4.95 120.64 116.86 2cru n GLU 15 Ca -0.18 0.07 -0.29 0.00 0.66 0.00 0.00 57.16 57.42 2cru n GLU 15 Cb 0.56 -1.61 0.16 0.00 0.27 0.00 0.00 31.44 30.82 2cru n GLU 15 CO 0.00 0.00 0.00 -0.48 -0.41 0.00 0.00 177.13 176.24 2cru s LEU 16 N 1.45 1.78 -0.45 4.31 0.05 -1.26 -5.02 118.68 119.54 2cru s LEU 16 Ca 0.59 1.16 -0.00 0.00 0.05 0.00 0.00 54.13 55.93 2cru s LEU 16 Cb -0.32 -3.41 0.12 0.00 -2.05 0.00 0.00 46.19 40.53 2cru s LEU 16 CO 0.64 -2.91 0.22 -1.58 -0.55 0.00 0.00 176.35 172.17 2cru s GLN 17 N -5.05 1.98 -0.58 1.48 0.74 -1.26 -5.06 119.66 111.91 2cru s GLN 17 Ca 0.65 -2.06 -0.27 0.00 0.05 0.00 0.00 55.36 53.72 2cru s GLN 17 Cb -0.17 -3.49 0.00 0.00 1.10 0.00 0.00 33.01 30.45 2cru s GLN 17 CO 0.56 -1.07 1.55 0.00 -0.55 0.00 0.00 175.29 175.79 2cru s ALA 18 N 0.69 2.63 -0.12 1.58 0.00 -1.26 -4.59 121.76 120.68 2cru s ALA 18 Ca 0.12 -0.68 -0.22 0.00 0.00 0.00 0.00 51.96 51.18 2cru s ALA 18 Cb -0.22 -4.17 -0.03 0.00 0.00 0.00 0.00 23.12 18.70 2cru s ALA 18 CO -0.04 -3.23 0.63 0.21 0.00 0.00 0.00 175.76 173.33 2cru s LYS 19 N 5.98 4.34 0.51 0.00 2.20 -1.26 -5.03 119.74 126.48 2cru s LYS 19 Ca 0.56 0.71 -0.21 0.00 -0.36 0.00 0.00 55.97 56.67 2cru s LYS 19 Cb -0.12 -3.49 -0.07 0.00 -1.51 0.00 0.00 37.83 32.64 2cru s LYS 19 CO 0.23 -0.02 1.02 -2.39 -0.36 0.00 0.00 175.35 173.82 2cru n HIS 20 N 4.20 1.10 -4.95 4.03 1.44 -1.26 -4.63 115.22 115.16 2cru n HIS 20 Ca -0.02 0.48 0.00 0.00 -2.01 0.00 0.00 57.72 56.17 2cru n HIS 20 Cb 0.51 -2.20 0.00 0.00 0.12 0.00 0.00 29.99 28.42 2cru n HIS 20 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2cru n GLY 21 N 1.19 2.78 3.64 -1.39 0.00 -1.26 -4.88 105.19 105.27 2cru n GLY 21 Ca 0.11 -0.40 -0.05 0.00 0.00 0.00 0.00 46.02 45.68 2cru n GLY 21 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cru s ASP 22 N -4.00 -0.19 -0.01 1.61 -1.08 -1.26 -5.07 116.67 106.68 2cru s ASP 22 Ca 0.00 0.36 -0.25 0.00 -0.52 0.00 0.00 52.55 52.15 2cru s ASP 22 Cb 0.00 0.37 -0.19 0.00 -1.46 0.00 0.00 42.92 41.64 2cru s ASP 22 CO 0.00 -0.06 1.29 1.55 0.52 0.00 0.00 175.17 178.46 2cru h PRO 23 N 3.50 0.09 0.00 4.34 0.13 -1.97 -3.49 132.00 134.60 2cru h PRO 23 Ca -0.28 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2cru h PRO 23 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2cru h PRO 23 CO 0.16 0.55 0.00 0.41 -0.23 0.00 0.00 178.00 178.89 2cru n GLY 24 N 0.22 0.83 0.17 1.56 0.00 -1.26 -4.25 105.19 102.45 2cru n GLY 24 Ca -0.08 -1.18 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 2cru n GLY 24 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2cru h ASP 25 N 0.00 0.47 -0.89 1.61 5.19 -1.98 -1.14 116.42 119.69 2cru h ASP 25 Ca 0.00 -0.18 0.11 0.00 -0.62 0.00 0.00 57.03 56.34 2cru h ASP 25 Cb 0.00 -0.12 -0.13 0.00 0.18 0.00 0.00 39.33 39.26 2cru h ASP 25 CO 0.00 0.53 -0.42 0.00 -3.12 0.00 0.00 179.24 176.23 2cru n ALA 26 N -2.29 -0.30 -0.02 3.45 0.00 -1.26 -0.99 120.51 119.11 2cru n ALA 26 Ca -0.01 0.83 -0.16 0.00 0.00 0.00 0.00 53.44 54.10 2cru n ALA 26 Cb 0.15 -0.28 -0.11 0.00 0.00 0.00 0.00 19.45 19.21 2cru n ALA 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cru h ALA 27 N 0.90 0.06 -0.98 0.00 0.00 -1.82 -3.34 119.26 114.09 2cru h ALA 27 Ca 0.24 -0.50 0.12 0.00 0.00 0.00 0.00 54.91 54.77 2cru h ALA 27 Cb 0.46 0.02 -0.14 0.00 0.00 0.00 0.00 17.79 18.13 2cru h ALA 27 CO -0.86 0.19 -0.49 0.94 0.00 0.00 0.00 179.25 179.03 2cru n GLN 28 N -4.40 -0.34 -0.27 0.00 -0.06 -0.22 0.71 117.38 112.81 2cru n GLN 28 Ca -0.10 1.49 0.25 0.00 -2.00 0.00 0.00 57.00 56.64 2cru n GLN 28 Cb 0.56 -2.20 0.46 0.00 -4.06 0.00 0.00 30.24 25.00 2cru n GLN 28 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2cru n GLN 29 N -5.32 -0.05 0.03 3.69 1.13 -0.16 0.49 117.38 117.19 2cru n GLN 29 Ca 0.06 1.15 -0.11 0.00 -1.94 0.00 0.00 57.00 56.15 2cru n GLN 29 Cb 0.32 -2.04 -0.08 0.00 0.11 0.00 0.00 30.24 28.55 2cru n GLN 29 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 2cru h GLU 30 N 0.00 -0.16 -0.26 -1.09 4.39 0.10 -2.91 114.58 114.65 2cru h GLU 30 Ca 0.68 0.01 0.06 0.00 0.34 0.00 0.00 59.36 60.45 2cru h GLU 30 Cb 1.76 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 30.38 2cru h GLU 30 CO -0.65 0.32 -0.17 0.00 -1.16 0.00 0.00 179.01 177.34 2cru h ALA 31 N -0.18 0.01 -0.13 3.43 0.00 0.48 0.10 119.26 122.97 2cru h ALA 31 Ca -0.02 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.02 2cru h ALA 31 Cb 0.55 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2cru h ALA 31 CO 0.03 -0.58 0.13 1.57 0.00 0.00 0.00 179.25 180.40 2cru h LYS 32 N -0.15 0.00 -0.10 0.00 2.10 -0.67 -1.82 116.57 115.92 2cru h LYS 32 Ca 0.14 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.76 2cru h LYS 32 Cb 0.37 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.70 2cru h LYS 32 CO -0.35 0.00 -0.06 1.25 -2.00 0.00 0.00 179.45 178.29 2cru h HIS 33 N 0.00 0.26 -0.83 0.07 2.76 -0.60 -3.16 115.15 113.65 2cru h HIS 33 Ca 0.06 -0.07 -0.02 0.00 -2.20 0.00 0.00 60.37 58.14 2cru h HIS 33 Cb 0.32 -0.06 -0.04 0.00 1.55 0.00 0.00 27.41 29.19 2cru h HIS 33 CO 0.00 0.59 0.44 0.00 -1.30 0.00 0.00 177.93 177.67 2cru h ARG 34 N -0.15 1.16 0.00 5.26 2.47 -0.86 -1.24 114.38 121.01 2cru h ARG 34 Ca 0.02 -0.14 0.00 0.00 -1.26 0.00 0.00 59.98 58.60 2cru h ARG 34 Cb 0.53 -0.23 0.00 0.00 -1.65 0.00 0.00 29.97 28.63 2cru h ARG 34 CO 0.02 0.86 0.06 1.49 0.56 0.00 0.00 179.97 182.96 2cru h GLU 35 N 1.16 0.00 0.00 0.04 4.81 -1.42 0.13 114.58 119.30 2cru h GLU 35 Ca 0.29 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.44 2cru h GLU 35 Cb 0.04 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2cru h GLU 35 CO -0.04 0.00 -1.46 0.00 -0.73 0.00 0.00 179.01 176.77 2cru n ALA 36 N -1.99 2.34 0.06 2.92 0.00 -0.49 -3.56 120.51 119.78 2cru n ALA 36 Ca -0.03 -0.47 -0.21 0.00 0.00 0.00 0.00 53.44 52.73 2cru n ALA 36 Cb 0.12 -0.91 -0.15 0.00 0.00 0.00 0.00 19.45 18.52 2cru n ALA 36 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2cru h GLU 37 N 0.00 0.33 -0.17 0.00 4.39 -0.53 -3.12 114.58 115.48 2cru h GLU 37 Ca -0.09 -0.56 -0.02 0.00 0.34 0.00 0.00 59.36 59.03 2cru h GLU 37 Cb 1.26 0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 30.12 2cru h GLU 37 CO 0.02 1.27 0.04 0.00 -1.16 0.00 0.00 179.01 179.17 2cru h MET 38 N -0.29 0.27 -0.54 2.33 -0.00 -1.44 -2.97 114.93 112.30 2cru h MET 38 Ca -0.18 -0.07 0.07 0.00 -0.00 0.00 0.00 59.70 59.52 2cru h MET 38 Cb 1.74 -0.03 -0.06 0.00 -0.00 0.00 0.00 31.60 33.25 2cru h MET 38 CO 0.16 0.42 0.22 0.07 -0.00 0.00 0.00 176.91 177.78 2cru h ARG 39 N 0.08 0.41 0.02 -0.10 0.11 -1.70 -2.02 114.38 111.18 2cru h ARG 39 Ca 0.05 -0.02 0.03 0.00 0.10 0.00 0.00 59.98 60.13 2cru h ARG 39 Cb 0.28 -0.09 -0.05 0.00 1.11 0.00 0.00 29.97 31.21 2cru h ARG 39 CO 0.00 0.27 -0.45 -0.91 0.10 0.00 0.00 179.97 178.98 2cru h ASN 40 N 0.42 -1.36 -0.20 0.08 2.35 -1.47 0.24 115.58 115.65 2cru h ASN 40 Ca 0.26 0.16 0.06 0.00 -0.55 0.00 0.00 56.30 56.23 2cru h ASN 40 Cb 0.26 0.52 -0.01 0.00 0.05 0.00 0.00 38.32 39.15 2cru h ASN 40 CO -0.24 -0.48 0.21 -1.28 -1.65 0.00 0.00 177.43 173.99 2cru h SER 41 N -0.62 0.00 0.51 5.81 0.87 -1.33 0.34 113.55 119.13 2cru h SER 41 Ca 0.03 0.00 -0.27 0.00 -1.23 0.00 0.00 61.79 60.33 2cru h SER 41 Cb 0.68 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.65 2cru h SER 41 CO -0.31 0.00 -1.18 0.40 -0.53 0.00 0.00 176.83 175.21 2cru h ILE 42 N 0.00 1.45 0.06 2.23 2.04 -0.14 -2.62 117.51 120.53 2cru h ILE 42 Ca 0.09 -2.85 -0.25 0.00 1.00 0.00 0.00 64.86 62.86 2cru h ILE 42 Cb 0.52 2.80 -0.02 0.00 -0.74 0.00 0.00 36.82 39.38 2cru h ILE 42 CO -0.00 0.84 -1.17 -0.07 0.00 0.00 0.00 178.15 177.75 2cru h LEU 43 N 0.13 0.19 -0.61 1.44 3.38 0.12 -2.52 115.31 117.44 2cru h LEU 43 Ca -0.13 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 2cru h LEU 43 Cb 1.87 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.56 2cru h LEU 43 CO 0.20 1.17 -0.22 0.00 0.09 0.00 0.00 178.44 179.68 2cru h ALA 44 N 0.80 0.92 0.06 1.53 0.00 -0.50 0.63 119.26 122.70 2cru h ALA 44 Ca -0.09 -0.20 -0.31 0.00 0.00 0.00 0.00 54.91 54.31 2cru h ALA 44 Cb 1.88 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.60 2cru h ALA 44 CO 0.16 0.27 -1.71 -0.56 0.00 0.00 0.00 179.25 177.42 2cru h GLN 45 N 0.00 0.12 0.00 0.00 3.07 -1.50 -3.35 115.11 113.45 2cru h GLN 45 Ca -0.00 -0.21 0.00 0.00 0.09 0.00 0.00 58.65 58.53 2cru h GLN 45 Cb 0.95 0.08 0.00 0.00 0.08 0.00 0.00 27.48 28.58 2cru h GLN 45 CO 0.03 0.84 -0.77 -0.39 0.09 0.00 0.00 178.83 178.63 2cru h VAL 46 N 0.03 0.00 -3.54 1.86 -1.51 -1.45 -3.42 116.25 108.22 2cru h VAL 46 Ca -0.30 -0.89 -0.67 0.00 -1.23 0.00 0.00 66.70 63.61 2cru h VAL 46 Cb 2.01 1.49 -0.33 0.00 -2.13 0.00 0.00 31.29 32.33 2cru h VAL 46 CO 0.10 0.00 -0.76 -0.76 -1.23 0.00 0.00 177.57 174.93 2cru s LEU 47 N -5.25 3.20 0.74 4.19 1.43 0.21 -1.31 118.68 121.90 2cru s LEU 47 Ca 0.02 -0.94 -0.13 0.00 -1.03 0.00 0.00 54.13 52.04 2cru s LEU 47 Cb 0.10 -1.64 0.05 0.00 0.03 0.00 0.00 46.19 44.72 2cru s LEU 47 CO 0.76 -0.14 1.14 -0.62 0.23 0.00 0.00 176.35 177.72 2cru s ASP 48 N 1.29 4.37 0.53 2.29 2.15 -1.11 -4.56 116.67 121.62 2cru s ASP 48 Ca -0.01 2.10 0.42 0.00 0.43 0.00 0.00 52.55 55.50 2cru s ASP 48 Cb -0.17 -2.56 1.62 0.00 -0.30 0.00 0.00 42.92 41.51 2cru s ASP 48 CO -0.05 -2.14 1.65 -0.61 -0.17 0.00 0.00 175.17 173.86 2cru h GLN 49 N -0.60 0.02 0.47 4.34 4.15 -1.90 0.52 115.11 122.11 2cru h GLN 49 Ca -0.46 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 58.94 2cru h GLN 49 Cb 1.26 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.95 2cru h GLN 49 CO 0.50 0.02 -0.22 0.77 -1.93 0.00 0.00 178.83 177.96 2cru h SER 50 N 0.02 -0.53 -0.89 -0.69 0.02 -1.91 -2.98 113.55 106.60 2cru h SER 50 Ca 0.81 0.02 0.19 0.00 -0.84 0.00 0.00 61.79 61.96 2cru h SER 50 Cb 3.10 0.14 -0.07 0.00 0.14 0.00 0.00 62.40 65.71 2cru h SER 50 CO -0.09 -0.17 0.58 0.00 -1.14 0.00 0.00 176.83 176.02 2cru h ALA 51 N -1.29 2.10 0.52 3.77 0.00 -1.20 -2.03 119.26 121.13 2cru h ALA 51 Ca -0.06 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2cru h ALA 51 Cb 0.48 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2cru h ALA 51 CO 0.11 -0.38 -0.39 0.00 0.00 0.00 0.00 179.25 178.58 2cru h ARG 52 N 0.47 -0.86 -0.89 0.00 2.47 -1.16 -0.38 114.38 114.02 2cru h ARG 52 Ca 0.46 0.06 0.15 0.00 -1.26 0.00 0.00 59.98 59.39 2cru h ARG 52 Cb 1.05 0.20 -0.09 0.00 -1.65 0.00 0.00 29.97 29.47 2cru h ARG 52 CO -0.19 -0.57 0.49 0.00 0.56 0.00 0.00 179.97 180.26 2cru h ALA 53 N -0.57 1.36 0.40 0.04 0.00 -1.22 -1.28 119.26 118.00 2cru h ALA 53 Ca -0.06 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2cru h ALA 53 Cb 0.76 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2cru h ALA 53 CO 0.01 -0.03 -0.19 -0.09 0.00 0.00 0.00 179.25 178.95 2cru h ARG 54 N 0.70 -0.52 0.00 0.00 1.12 -1.10 -2.05 114.38 112.54 2cru h ARG 54 Ca 0.48 0.04 0.00 0.00 -1.11 0.00 0.00 59.98 59.39 2cru h ARG 54 Cb 0.65 0.12 0.00 0.00 -0.01 0.00 0.00 29.97 30.73 2cru h ARG 54 CO -0.35 -0.31 0.00 -0.11 -3.11 0.00 0.00 179.97 176.10 2cru n LEU 55 N -5.30 0.00 -0.33 3.80 7.94 -0.19 -2.49 117.00 120.44 2cru n LEU 55 Ca -0.11 0.94 0.01 0.00 -1.11 0.00 0.00 56.01 55.74 2cru n LEU 55 Cb 0.25 -0.44 0.06 0.00 0.53 0.00 0.00 43.42 43.82 2cru n LEU 55 CO 0.35 -0.44 0.53 -0.24 -1.11 0.00 0.00 177.39 176.48 2cru n SER 56 N -2.04 -0.48 -0.31 1.96 2.88 -0.54 0.16 113.62 115.25 2cru n SER 56 Ca 0.00 1.50 0.17 0.00 -1.33 0.00 0.00 58.87 59.21 2cru n SER 56 Cb 0.00 -0.38 0.36 0.00 -0.75 0.00 0.00 64.21 63.44 2cru n SER 56 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 2cru h ASN 57 N 0.00 0.27 -0.06 -3.46 -1.24 -1.22 0.08 115.58 109.95 2cru h ASN 57 Ca 0.34 0.18 -0.07 0.00 0.71 0.00 0.00 56.30 57.46 2cru h ASN 57 Cb 0.56 0.19 0.00 0.00 0.73 0.00 0.00 38.32 39.79 2cru h ASN 57 CO -0.87 -0.10 -0.23 0.25 -1.29 0.00 0.00 177.43 175.19 2cru h LEU 58 N 0.31 0.30 -0.98 0.34 5.85 0.19 -3.14 115.31 118.18 2cru h LEU 58 Ca 0.62 -0.64 0.22 0.00 0.84 0.00 0.00 57.88 58.92 2cru h LEU 58 Cb 1.28 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 2cru h LEU 58 CO -0.60 0.89 1.09 0.00 -0.34 0.00 0.00 178.44 179.48 2cru h ALA 59 N 0.42 2.68 0.29 1.25 0.00 0.42 0.28 119.26 124.60 2cru h ALA 59 Ca -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2cru h ALA 59 Cb 0.88 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2cru h ALA 59 CO 0.05 -1.48 -0.14 -0.07 0.00 0.00 0.00 179.25 177.61 2cru h LEU 60 N 0.00 -0.33 -0.49 0.00 3.38 -1.45 -1.83 115.31 114.59 2cru h LEU 60 Ca 0.36 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 58.22 2cru h LEU 60 Cb 2.53 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 43.35 2cru h LEU 60 CO -0.00 -0.12 -0.20 1.62 0.09 0.00 0.00 178.44 179.83 2cru h VAL 61 N -0.62 1.27 -2.90 1.22 3.04 -1.12 -3.37 116.25 113.78 2cru h VAL 61 Ca -0.04 -1.36 -0.61 0.00 -1.01 0.00 0.00 66.70 63.68 2cru h VAL 61 Cb 0.30 1.11 -0.41 0.00 -2.01 0.00 0.00 31.29 30.28 2cru h VAL 61 CO 0.07 0.47 -0.71 -0.54 -1.01 0.00 0.00 177.57 175.85 2cru s LYS 62 N -4.70 1.83 0.09 4.17 1.02 0.78 -4.95 119.74 117.99 2cru s LYS 62 Ca -0.11 -2.76 -0.16 0.00 0.02 0.00 0.00 55.97 52.96 2cru s LYS 62 Cb 0.12 -2.71 -0.09 0.00 -0.52 0.00 0.00 37.83 34.63 2cru s LYS 62 CO 0.87 -1.28 1.41 -1.00 -0.92 0.00 0.00 175.35 174.43 2cru h PRO 63 N 5.75 0.65 0.05 -1.68 0.13 -1.50 -2.54 132.00 132.86 2cru h PRO 63 Ca 0.14 -0.34 -0.00 0.00 -0.87 0.00 0.00 66.00 64.92 2cru h PRO 63 Cb 0.83 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2cru h PRO 63 CO 0.59 0.95 -0.03 0.93 -0.23 0.00 0.00 178.00 180.21 2cru h GLU 64 N 0.38 -0.07 0.21 0.86 5.08 -1.92 -1.17 114.58 117.93 2cru h GLU 64 Ca 0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2cru h GLU 64 Cb 0.83 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 2cru h GLU 64 CO 0.07 0.16 -0.19 -0.22 -1.00 0.00 0.00 179.01 177.82 2cru h LYS 65 N -0.29 -0.38 -0.90 2.33 3.11 -1.97 -2.70 116.57 115.78 2cru h LYS 65 Ca -0.01 0.03 0.22 0.00 -2.81 0.00 0.00 60.65 58.07 2cru h LYS 65 Cb 0.26 0.09 -0.12 0.00 -1.00 0.00 0.00 32.23 31.45 2cru h LYS 65 CO 0.01 -0.25 0.41 1.15 -2.81 0.00 0.00 179.45 177.96 2cru h THR 66 N -0.39 0.50 -0.41 1.00 2.02 -1.54 -1.56 112.91 112.53 2cru h THR 66 Ca -0.03 -0.15 0.06 0.00 0.77 0.00 0.00 66.41 67.07 2cru h THR 66 Cb 0.33 0.03 -0.09 0.00 -1.74 0.00 0.00 68.15 66.69 2cru h THR 66 CO -0.01 0.08 -0.49 0.50 0.37 0.00 0.00 175.52 175.96 2cru h LYS 67 N 0.42 -0.35 -1.00 6.66 3.11 -0.90 0.14 116.57 124.65 2cru h LYS 67 Ca 0.56 0.02 0.20 0.00 -2.81 0.00 0.00 60.65 58.62 2cru h LYS 67 Cb 1.04 0.08 -0.11 0.00 -1.00 0.00 0.00 32.23 32.25 2cru h LYS 67 CO -0.51 -0.23 0.61 0.00 -2.81 0.00 0.00 179.45 176.51 2cru h ALA 68 N 0.21 1.72 -0.79 5.00 0.00 -0.98 0.36 119.26 124.80 2cru h ALA 68 Ca 0.11 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2cru h ALA 68 Cb 0.60 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2cru h ALA 68 CO -0.59 -0.10 0.44 0.28 0.00 0.00 0.00 179.25 179.29 2cru h VAL 69 N 0.73 1.23 -0.49 0.00 2.07 -0.64 -2.48 116.25 116.67 2cru h VAL 69 Ca 0.58 -0.56 0.09 0.00 0.82 0.00 0.00 66.70 67.63 2cru h VAL 69 Cb 0.95 0.17 -0.07 0.00 -1.52 0.00 0.00 31.29 30.82 2cru h VAL 69 CO -0.38 0.25 0.06 -0.33 0.02 0.00 0.00 177.57 177.20 2cru h GLU 70 N 1.09 0.18 -0.68 1.57 4.39 0.28 -0.99 114.58 120.42 2cru h GLU 70 Ca 0.28 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.92 2cru h GLU 70 Cb 0.01 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.59 2cru h GLU 70 CO -0.05 0.12 0.24 -0.97 -1.16 0.00 0.00 179.01 177.19 2cru h ASN 71 N 0.19 0.94 -0.06 1.42 -1.24 -1.36 -2.69 115.58 112.77 2cru h ASN 71 Ca 0.25 -0.15 0.03 0.00 0.71 0.00 0.00 56.30 57.13 2cru h ASN 71 Cb 0.35 -0.24 -0.03 0.00 0.73 0.00 0.00 38.32 39.12 2cru h ASN 71 CO -0.35 0.86 -0.12 0.22 -1.29 0.00 0.00 177.43 176.75 2cru h TYR 72 N 0.99 -0.31 -0.78 0.67 3.20 -0.76 -0.81 116.97 119.18 2cru h TYR 72 Ca 0.22 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.16 2cru h TYR 72 Cb 0.24 0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.60 2cru h TYR 72 CO 0.02 -0.18 0.48 -0.07 -1.64 0.00 0.00 178.16 176.76 2cru h LEU 73 N -0.18 0.76 0.69 2.82 3.38 -1.22 -0.08 115.31 121.48 2cru h LEU 73 Ca 0.07 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2cru h LEU 73 Cb 0.27 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2cru h LEU 73 CO -0.17 0.51 -0.37 0.40 0.09 0.00 0.00 178.44 178.90 2cru h ILE 74 N 0.90 0.24 -0.81 1.22 2.04 -1.09 -1.70 117.51 118.31 2cru h ILE 74 Ca 0.33 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.26 2cru h ILE 74 Cb 0.10 0.24 -0.05 0.00 -0.74 0.00 0.00 36.82 36.37 2cru h ILE 74 CO -0.15 0.00 0.53 0.06 0.00 0.00 0.00 178.15 178.59 2cru h GLN 75 N -0.98 0.81 -0.75 2.37 3.07 -0.97 -1.15 115.11 117.51 2cru h GLN 75 Ca -0.09 -0.05 -0.01 0.00 0.09 0.00 0.00 58.65 58.59 2cru h GLN 75 Cb 0.78 -0.18 -0.04 0.00 0.08 0.00 0.00 27.48 28.12 2cru h GLN 75 CO 0.12 0.54 0.43 0.52 0.09 0.00 0.00 178.83 180.53 2cru h MET 76 N 0.84 1.02 0.76 0.06 2.86 -0.70 -2.59 114.93 117.18 2cru h MET 76 Ca 0.36 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 57.86 2cru h MET 76 Cb 0.30 -0.21 0.01 0.00 0.06 0.00 0.00 31.60 31.76 2cru h MET 76 CO -0.13 0.74 -0.38 0.00 1.06 0.00 0.00 176.91 178.19 2cru h ALA 77 N 1.44 -1.27 -0.48 6.32 0.00 -0.27 -0.81 119.26 124.19 2cru h ALA 77 Ca 0.27 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 55.03 2cru h ALA 77 Cb -0.01 0.43 -0.10 0.00 0.00 0.00 0.00 17.79 18.12 2cru h ALA 77 CO -0.05 -1.20 -0.38 0.00 0.00 0.00 0.00 179.25 177.62 2cru h ARG 78 N -1.04 -0.24 0.09 0.00 3.08 -1.47 -2.58 114.38 112.21 2cru h ARG 78 Ca -0.10 0.02 0.01 0.00 0.07 0.00 0.00 59.98 59.97 2cru h ARG 78 Cb 0.81 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.88 2cru h ARG 78 CO 0.16 -0.16 -0.30 1.88 -1.07 0.00 0.00 179.97 180.48 2cru h TYR 79 N -0.25 -0.86 0.00 3.04 -1.99 -1.44 -3.47 116.97 111.99 2cru h TYR 79 Ca 0.18 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.93 2cru h TYR 79 Cb 0.56 0.37 0.00 0.00 2.00 0.00 0.00 36.73 39.66 2cru h TYR 79 CO -0.62 -0.34 0.00 0.41 -0.00 0.00 0.00 178.16 177.61 2cru n GLY 80 N -1.28 0.63 0.14 3.88 0.00 -0.39 -5.06 105.19 103.11 2cru n GLY 80 Ca -0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.76 2cru n GLY 80 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2cru n GLN 81 N 0.00 0.74 -2.33 1.61 6.02 -0.73 -4.81 117.38 117.88 2cru n GLN 81 Ca 0.00 0.25 -0.42 0.00 -0.01 0.00 0.00 57.00 56.81 2cru n GLN 81 Cb 0.00 -1.68 -0.02 0.00 1.02 0.00 0.00 30.24 29.55 2cru n GLN 81 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2cru s LEU 82 N -6.98 3.52 -0.01 1.08 1.43 -1.25 -4.91 118.68 111.55 2cru s LEU 82 Ca -0.24 0.68 -0.03 0.00 -1.03 0.00 0.00 54.13 53.51 2cru s LEU 82 Cb 0.07 -3.37 -0.02 0.00 0.03 0.00 0.00 46.19 42.90 2cru s LEU 82 CO 0.74 -1.56 0.43 -1.28 0.23 0.00 0.00 176.35 174.91 2cru h SER 83 N 11.10 -0.10 -2.73 2.29 0.87 -1.97 -3.48 113.55 119.53 2cru h SER 83 Ca -0.28 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 59.76 2cru h SER 83 Cb 1.11 0.03 -0.14 0.00 -0.44 0.00 0.00 62.40 62.96 2cru h SER 83 CO 1.11 -0.00 -0.59 -1.83 -0.53 0.00 0.00 176.83 175.00 2cru s GLU 84 N -2.09 1.79 -0.29 2.24 -1.05 -1.26 -5.08 118.70 112.96 2cru s GLU 84 Ca -0.02 -2.03 -0.42 0.00 -0.15 0.00 0.00 54.97 52.36 2cru s GLU 84 Cb 0.00 -1.02 -0.17 0.00 -0.44 0.00 0.00 34.13 32.50 2cru s GLU 84 CO 0.05 -0.22 1.64 1.63 0.95 0.00 0.00 175.26 179.32 2cru n LYS 85 N -0.81 0.80 -2.27 -4.83 5.02 -1.26 -4.89 118.16 109.91 2cru n LYS 85 Ca -0.05 0.29 -0.35 0.00 -2.02 0.00 0.00 58.31 56.19 2cru n LYS 85 Cb 0.66 -1.92 -0.00 0.00 -0.02 0.00 0.00 35.03 33.76 2cru n LYS 85 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2cru s VAL 86 N 2.99 3.24 0.31 -0.18 1.01 -0.42 -4.81 120.40 122.53 2cru s VAL 86 Ca 0.99 0.76 0.09 0.00 0.00 0.00 0.00 61.98 63.82 2cru s VAL 86 Cb -1.18 -3.30 -0.05 0.00 0.00 0.00 0.00 36.38 31.85 2cru s VAL 86 CO 0.68 -0.17 0.02 -0.44 0.00 0.00 0.00 175.10 175.18 2cru s SER 87 N -1.82 4.36 0.05 3.32 0.01 -1.26 -2.75 113.70 115.61 2cru s SER 87 Ca 0.72 -0.83 -0.10 0.00 1.31 0.00 0.00 55.95 57.04 2cru s SER 87 Cb -0.23 -0.66 -0.02 0.00 0.21 0.00 0.00 66.02 65.32 2cru s SER 87 CO 0.27 -0.15 0.95 1.21 0.41 0.00 0.00 173.24 175.93 2cru n GLU 88 N -0.95 -0.15 -0.41 12.44 2.13 -1.26 -0.40 120.64 132.04 2cru n GLU 88 Ca -0.05 0.94 -0.09 0.00 0.66 0.00 0.00 57.16 58.62 2cru n GLU 88 Cb 0.61 -1.39 -0.07 0.00 0.27 0.00 0.00 31.44 30.85 2cru n GLU 88 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 2cru n GLN 89 N -3.72 -0.40 0.14 5.31 6.02 -1.26 -0.91 117.38 122.56 2cru n GLN 89 Ca 0.01 1.51 -0.14 0.00 -0.01 0.00 0.00 57.00 58.37 2cru n GLN 89 Cb 0.09 -2.22 -0.08 0.00 1.02 0.00 0.00 30.24 29.04 2cru n GLN 89 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2cru h GLY 90 N 0.00 -1.18 -0.47 1.08 0.00 -1.12 -2.67 103.07 98.71 2cru h GLY 90 Ca 0.20 0.60 0.05 0.00 0.00 0.00 0.00 47.33 48.18 2cru h GLY 90 CO -0.95 -0.32 -0.47 -2.00 0.00 0.00 0.00 176.54 172.81 2cru h LEU 91 N -0.68 -1.61 -0.93 3.11 5.85 -0.10 0.13 115.31 121.08 2cru h LEU 91 Ca -0.02 0.22 0.29 0.00 0.84 0.00 0.00 57.88 59.21 2cru h LEU 91 Cb 0.65 0.67 -0.17 0.00 0.37 0.00 0.00 40.66 42.18 2cru h LEU 91 CO -0.18 -0.29 0.16 -0.38 -0.34 0.00 0.00 178.44 177.40 2cru n ILE 92 N -4.89 -0.39 -0.07 4.05 5.41 -0.09 0.24 119.36 123.63 2cru n ILE 92 Ca -0.02 2.00 -0.04 0.00 1.00 0.00 0.00 62.75 65.69 2cru n ILE 92 Cb 0.26 -3.00 0.17 0.00 -0.71 0.00 0.00 39.64 36.36 2cru n ILE 92 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2cru h GLU 93 N 0.00 0.70 -0.52 0.38 5.08 -0.44 -2.99 114.58 116.79 2cru h GLU 93 Ca 0.63 -0.21 0.05 0.00 -1.00 0.00 0.00 59.36 58.83 2cru h GLU 93 Cb 1.42 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.55 2cru h GLU 93 CO -0.83 0.78 0.25 0.82 -1.00 0.00 0.00 179.01 179.02 2cru h ILE 94 N 0.64 0.92 -0.99 3.13 1.08 0.40 -1.83 117.51 120.85 2cru h ILE 94 Ca 0.11 -0.16 0.28 0.00 -0.39 0.00 0.00 64.86 64.70 2cru h ILE 94 Cb 0.53 0.40 -0.14 0.00 -3.07 0.00 0.00 36.82 34.55 2cru h ILE 94 CO 0.03 0.09 0.55 -0.07 -0.69 0.00 0.00 178.15 178.06 2cru h LEU 95 N 0.47 0.54 -3.20 1.44 3.38 -1.28 1.05 115.31 117.71 2cru h LEU 95 Ca 0.24 0.17 -0.31 0.00 0.09 0.00 0.00 57.88 58.07 2cru h LEU 95 Cb 0.18 0.10 -0.18 0.00 0.09 0.00 0.00 40.66 40.85 2cru h LEU 95 CO -0.19 -0.04 0.39 0.29 0.09 0.00 0.00 178.44 178.99 2cru n LYS 96 N -5.00 1.82 0.00 1.13 5.02 -0.69 -4.07 118.16 116.36 2cru n LYS 96 Ca 0.29 -1.84 0.00 0.00 -2.02 0.00 0.00 58.31 54.73 2cru n LYS 96 Cb 0.86 -1.73 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 2cru n LYS 96 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2cru n LYS 97 N -0.48 0.00 0.07 1.97 4.76 0.36 -4.60 118.16 120.23 2cru n LYS 97 Ca 0.36 0.00 0.01 0.00 -2.87 0.00 0.00 58.31 55.81 2cru n LYS 97 Cb 1.21 -0.58 0.35 0.00 -1.84 0.00 0.00 35.03 34.17 2cru n LYS 97 CO 0.00 0.00 0.00 -0.24 -1.37 0.00 0.00 177.40 175.79 2cru h VAL 98 N 0.00 1.18 0.06 -0.18 3.04 -1.61 -2.69 116.25 116.05 2cru h VAL 98 Ca 0.00 -0.78 -0.00 0.00 -1.01 0.00 0.00 66.70 64.91 2cru h VAL 98 Cb 0.81 1.09 0.00 0.00 -2.01 0.00 0.00 31.29 31.18 2cru h VAL 98 CO 0.00 0.25 -0.03 -1.28 -1.01 0.00 0.00 177.57 175.50 2cru h SER 99 N 0.35 -0.07 -0.92 3.17 0.87 -1.84 -3.12 113.55 111.99 2cru h SER 99 Ca 0.07 -0.31 0.11 0.00 -1.23 0.00 0.00 61.79 60.44 2cru h SER 99 Cb 0.35 0.02 -0.08 0.00 -0.44 0.00 0.00 62.40 62.25 2cru h SER 99 CO 0.02 0.28 0.55 1.56 -0.53 0.00 0.00 176.83 178.71 2cru h GLN 100 N -0.42 0.85 -5.60 2.24 1.08 -1.78 -3.38 115.11 108.09 2cru h GLN 100 Ca -0.01 -0.05 -0.61 0.00 -1.45 0.00 0.00 58.65 56.53 2cru h GLN 100 Cb 0.37 -0.19 -0.11 0.00 -0.05 0.00 0.00 27.48 27.50 2cru h GLN 100 CO 0.01 0.56 0.25 -1.14 -0.95 0.00 0.00 178.83 177.57 2cru s GLN 101 N -5.99 4.04 0.64 1.46 2.00 -1.03 -5.02 119.66 115.76 2cru s GLN 101 Ca -0.12 0.55 -0.17 0.00 -2.00 0.00 0.00 55.36 53.61 2cru s GLN 101 Cb 0.21 -3.69 -0.12 0.00 0.80 0.00 0.00 33.01 30.22 2cru s GLN 101 CO 0.80 -0.52 -0.03 -2.37 -0.50 0.00 0.00 175.29 172.66 2cru n THR 102 N 5.33 0.63 -3.61 -0.34 5.66 -1.26 -4.82 114.28 115.87 2cru n THR 102 Ca 0.01 -0.48 -0.09 0.00 -3.05 0.00 0.00 64.05 60.44 2cru n THR 102 Cb 0.49 -0.23 -0.06 0.00 -1.55 0.00 0.00 70.33 68.98 2cru n THR 102 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 2cru s GLU 103 N -1.66 0.48 0.33 1.09 2.12 -1.26 -5.04 118.70 114.75 2cru s GLU 103 Ca 0.57 0.25 -0.10 0.00 0.36 0.00 0.00 54.97 56.05 2cru s GLU 103 Cb -0.41 0.23 0.02 0.00 0.26 0.00 0.00 34.13 34.23 2cru s GLU 103 CO 0.66 -0.12 0.59 -1.59 -0.54 0.00 0.00 175.26 174.26 2cru s LYS 104 N -0.66 1.93 -0.87 4.30 0.00 -1.26 -5.07 119.74 118.11 2cru s LYS 104 Ca 0.01 -1.50 -0.26 0.00 0.00 0.00 0.00 55.97 54.23 2cru s LYS 104 Cb -0.02 0.52 -0.15 0.00 0.00 0.00 0.00 37.83 38.18 2cru s LYS 104 CO -0.03 -0.84 2.30 0.95 0.00 0.00 0.00 175.35 177.73 2cru s THR 105 N -3.09 3.06 -0.25 3.79 -4.23 -1.26 -4.90 115.64 108.76 2cru s THR 105 Ca 0.23 -0.06 -0.14 0.00 -1.18 0.00 0.00 61.69 60.54 2cru s THR 105 Cb -0.02 -3.34 -0.04 0.00 1.34 0.00 0.00 72.50 70.44 2cru s THR 105 CO 0.14 -0.12 0.30 0.42 -0.54 0.00 0.00 174.62 174.82 2cru s THR 106 N 14.85 5.24 0.09 3.99 -4.23 -1.26 -5.08 115.64 129.24 2cru s THR 106 Ca 0.88 0.45 0.06 0.00 -1.18 0.00 0.00 61.69 61.90 2cru s THR 106 Cb -0.10 -3.64 -0.04 0.00 1.34 0.00 0.00 72.50 70.06 2cru s THR 106 CO 0.09 0.23 -0.09 0.28 -0.54 0.00 0.00 174.62 174.60 2cru s THR 107 N 1.65 3.44 -0.13 3.99 -1.32 -1.26 -5.12 115.64 116.89 2cru s THR 107 Ca 0.13 -1.19 -0.01 0.00 -1.21 0.00 0.00 61.69 59.40 2cru s THR 107 Cb -0.15 -2.60 -0.02 0.00 -1.51 0.00 0.00 72.50 68.22 2cru s THR 107 CO 0.09 0.14 -0.09 0.68 -2.21 0.00 0.00 174.62 173.23 2cru s VAL 108 N -1.20 3.44 -0.31 5.08 -7.23 -1.26 -5.09 120.40 113.82 2cru s VAL 108 Ca 0.21 -0.53 -0.06 0.00 -1.81 0.00 0.00 61.98 59.79 2cru s VAL 108 Cb -0.11 -2.47 0.03 0.00 0.56 0.00 0.00 36.38 34.39 2cru s VAL 108 CO 0.13 0.52 0.08 -0.54 -0.31 0.00 0.00 175.10 174.98 2cru s LYS 109 N 0.26 2.82 0.17 4.82 3.01 -1.26 -5.06 119.74 124.51 2cru s LYS 109 Ca -0.06 -1.03 -0.23 0.00 -1.01 0.00 0.00 55.97 53.63 2cru s LYS 109 Cb -0.15 -3.38 0.07 0.00 -1.01 0.00 0.00 37.83 33.36 2cru s LYS 109 CO 0.04 -0.55 1.02 0.12 0.51 0.00 0.00 175.35 176.48 2cru s PHE 110 N 1.43 0.01 -0.28 3.18 5.36 -1.26 -5.14 117.98 121.27 2cru s PHE 110 Ca 0.00 -0.37 -0.11 0.00 -0.96 0.00 0.00 56.93 55.49 2cru s PHE 110 Cb -0.18 0.68 -0.04 0.00 -0.34 0.00 0.00 43.02 43.14 2cru s PHE 110 CO 0.02 -0.89 0.18 1.21 -1.46 0.00 0.00 175.22 174.28 2cru s ASN 111 N -3.23 5.88 -0.06 6.13 3.84 -1.26 -4.96 114.94 121.28 2cru s ASN 111 Ca 0.18 -0.11 -0.09 0.00 0.21 0.00 0.00 52.86 53.06 2cru s ASN 111 Cb -0.02 -2.09 -0.03 0.00 -0.55 0.00 0.00 41.25 38.56 2cru s ASN 111 CO 0.04 -0.08 -0.17 -1.14 -2.79 0.00 0.00 177.10 172.96 2cru n ARG 112 N 5.04 0.26 -3.89 0.43 0.00 -1.26 -5.05 116.66 112.20 2cru n ARG 112 Ca -0.14 0.10 -0.16 0.00 -0.00 0.00 0.00 57.85 57.66 2cru n ARG 112 Cb 0.52 -0.91 -0.16 0.00 0.00 0.00 0.00 32.46 31.91 2cru n ARG 112 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2cru s SER 113 N -5.53 0.26 0.18 6.15 1.04 -1.26 -5.15 113.70 109.39 2cru s SER 113 Ca -0.14 -0.01 -0.13 0.00 0.48 0.00 0.00 55.95 56.15 2cru s SER 113 Cb 0.02 -0.14 -0.07 0.00 0.10 0.00 0.00 66.02 65.93 2cru s SER 113 CO 0.21 -0.09 0.56 -0.83 0.98 0.00 0.00 173.24 174.08 2cru s GLY 114 N 0.84 2.42 1.10 7.32 0.00 -1.26 -5.08 107.32 112.66 2cru s GLY 114 Ca -0.08 -0.15 -0.16 0.00 0.00 0.00 0.00 44.72 44.34 2cru s GLY 114 CO -0.02 0.10 1.10 2.56 0.00 0.00 0.00 173.10 176.84 2cru s PRO 115 N -2.21 -0.42 0.01 2.90 0.04 -1.26 -4.92 135.00 129.14 2cru s PRO 115 Ca 0.41 0.22 -0.27 0.00 0.04 0.00 0.00 61.00 61.41 2cru s PRO 115 Cb -0.14 -1.66 0.06 0.00 0.04 0.00 0.00 34.50 32.80 2cru s PRO 115 CO 0.20 -3.24 0.61 -1.54 0.04 0.00 0.00 177.00 173.06 2cru s SER 116 N -3.66 -0.57 0.09 6.66 1.04 -1.26 -4.73 113.70 111.28 2cru s SER 116 Ca 0.68 0.43 -0.31 0.00 0.48 0.00 0.00 55.95 57.23 2cru s SER 116 Cb -0.14 0.53 -0.09 0.00 0.10 0.00 0.00 66.02 66.41 2cru s SER 116 CO 0.57 -0.69 1.78 -0.94 0.98 0.00 0.00 173.24 174.93 2cru s SER 117 N -1.66 6.50 0.00 7.02 1.04 -1.26 -5.23 113.70 120.11 2cru s SER 117 Ca -0.08 2.63 0.00 0.00 0.48 0.00 0.00 55.95 58.99 2cru s SER 117 Cb -0.01 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.55 2cru s SER 117 CO 0.03 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 173.89