#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ror s SER 2 N 0.00 1.74 0.20 1.61 0.15 -1.26 -5.15 113.70 111.00 2ror s SER 2 Ca 0.00 -0.90 -0.16 0.00 0.70 0.00 0.00 55.95 55.59 2ror s SER 2 Cb 0.00 -0.02 -0.08 0.00 -1.71 0.00 0.00 66.02 64.21 2ror s SER 2 CO 0.00 -0.26 0.63 -0.55 1.20 0.00 0.00 173.24 174.26 2ror s SER 3 N -2.78 6.89 0.00 5.45 0.15 -1.26 -4.98 113.70 117.17 2ror s SER 3 Ca 0.11 1.21 0.00 0.00 0.70 0.00 0.00 55.95 57.98 2ror s SER 3 Cb -0.01 -2.34 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 2ror s SER 3 CO 0.01 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.09 2ror n GLY 4 N 0.56 2.11 3.51 9.45 0.00 -1.26 -5.18 105.19 114.38 2ror n GLY 4 Ca -0.03 -0.14 0.01 0.00 0.00 0.00 0.00 46.02 45.86 2ror n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ror s SER 5 N 0.00 -0.38 0.24 1.61 0.15 -1.26 -5.18 113.70 108.88 2ror s SER 5 Ca 0.00 0.56 -0.22 0.00 0.70 0.00 0.00 55.95 56.99 2ror s SER 5 Cb 0.00 1.29 0.04 0.00 -1.71 0.00 0.00 66.02 65.64 2ror s SER 5 CO 0.00 -0.08 0.82 -0.94 1.20 0.00 0.00 173.24 174.24 2ror s SER 6 N 1.72 -0.20 -0.37 5.45 1.04 -1.26 -5.06 113.70 115.02 2ror s SER 6 Ca -0.06 -0.59 -0.25 0.00 0.48 0.00 0.00 55.95 55.53 2ror s SER 6 Cb -0.04 0.65 0.04 0.00 0.10 0.00 0.00 66.02 66.77 2ror s SER 6 CO -0.15 -1.21 0.51 0.61 0.98 0.00 0.00 173.24 173.98 2ror n GLY 7 N -0.48 -0.53 3.67 7.32 0.00 -1.26 -5.01 105.19 108.91 2ror n GLY 7 Ca -0.05 0.98 0.00 0.00 0.00 0.00 0.00 46.02 46.96 2ror n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ror s LYS 8 N -2.23 0.62 0.30 1.61 -2.85 -1.26 -5.15 119.74 110.78 2ror s LYS 8 Ca 0.27 -0.35 -0.16 0.00 -1.00 0.00 0.00 55.97 54.73 2ror s LYS 8 Cb -0.04 0.21 -0.12 0.00 -2.06 0.00 0.00 37.83 35.82 2ror s LYS 8 CO 0.72 -0.28 0.08 0.00 0.10 0.00 0.00 175.35 175.97 2ror n ALA 9 N -0.51 -2.60 -1.66 0.59 0.00 -1.26 -4.85 120.51 110.22 2ror n ALA 9 Ca -0.07 0.10 -0.31 0.00 0.00 0.00 0.00 53.44 53.16 2ror n ALA 9 Cb 0.62 -1.13 0.05 0.00 0.00 0.00 0.00 19.45 18.99 2ror n ALA 9 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2ror n GLU 10 N 1.01 3.06 -3.04 0.00 0.28 -1.26 -5.01 120.64 115.68 2ror n GLU 10 Ca 0.09 -3.67 -0.22 0.00 -0.16 0.00 0.00 57.16 53.19 2ror n GLU 10 Cb 0.30 -2.28 0.01 0.00 1.43 0.00 0.00 31.44 30.90 2ror n GLU 10 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2ror s ALA 11 N -3.75 3.82 -0.00 -1.84 0.00 -1.26 -5.09 121.76 113.63 2ror s ALA 11 Ca 0.58 -1.11 -0.15 0.00 0.00 0.00 0.00 51.96 51.28 2ror s ALA 11 Cb 0.47 -2.08 -0.06 0.00 0.00 0.00 0.00 23.12 21.45 2ror s ALA 11 CO -0.02 -0.34 0.43 -2.00 0.00 0.00 0.00 175.76 173.83 2ror s GLU 12 N -4.51 3.97 0.08 0.00 2.12 -1.26 -5.08 118.70 114.03 2ror s GLU 12 Ca 0.48 0.44 -0.11 0.00 0.36 0.00 0.00 54.97 56.14 2ror s GLU 12 Cb -0.10 -3.24 -0.06 0.00 0.26 0.00 0.00 34.13 30.99 2ror s GLU 12 CO 0.37 0.65 0.43 1.14 -0.54 0.00 0.00 175.26 177.31 2ror s GLN 13 N -0.96 3.83 0.00 4.30 -2.07 -1.26 -4.98 119.66 118.52 2ror s GLN 13 Ca 0.24 0.28 0.00 0.00 -1.82 0.00 0.00 55.36 54.06 2ror s GLN 13 Cb -0.17 -3.01 0.00 0.00 -1.09 0.00 0.00 33.01 28.74 2ror s GLN 13 CO 0.14 0.56 0.68 0.27 -1.32 0.00 0.00 175.29 175.62 2ror n ASN 14 N 1.01 1.27 -2.00 12.60 0.23 -1.26 -4.80 115.26 122.30 2ror n ASN 14 Ca -0.08 -1.45 -0.13 0.00 -0.53 0.00 0.00 54.58 52.40 2ror n ASN 14 Cb 0.52 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 38.09 2ror n ASN 14 CO 0.00 0.00 0.00 0.79 -0.93 0.00 0.00 177.26 177.12 2ror n TRP 15 N -0.22 0.26 -3.91 -2.53 7.02 -1.26 -4.88 117.44 111.91 2ror n TRP 15 Ca 0.00 -1.51 -0.21 0.00 -1.02 0.00 0.00 57.50 54.76 2ror n TRP 15 Cb 0.18 -1.41 -0.03 0.00 -2.42 0.00 0.00 31.31 27.62 2ror n TRP 15 CO 0.00 0.00 0.00 1.67 -2.02 0.00 0.00 177.69 177.34 2ror s TRP 16 N 0.43 3.09 -0.45 -5.99 -2.14 -1.26 -5.09 118.94 107.52 2ror s TRP 16 Ca 0.56 -0.18 0.02 0.00 2.66 0.00 0.00 56.10 59.17 2ror s TRP 16 Cb 0.29 -1.64 0.15 0.00 -3.10 0.00 0.00 33.47 29.17 2ror s TRP 16 CO -0.03 0.33 0.28 -1.21 -2.66 0.00 0.00 176.95 173.66 2ror s GLU 17 N -3.96 1.23 0.00 3.25 2.02 -1.26 -5.00 118.70 114.98 2ror s GLU 17 Ca 0.37 -2.07 0.00 0.00 0.02 0.00 0.00 54.97 53.29 2ror s GLU 17 Cb -0.08 -2.11 0.00 0.00 0.10 0.00 0.00 34.13 32.04 2ror s GLU 17 CO 0.27 -1.23 0.00 0.41 0.02 0.00 0.00 175.26 174.73 2ror n GLY 18 N 3.31 -0.63 3.71 -1.39 0.00 -1.26 -5.17 105.19 103.75 2ror n GLY 18 Ca 0.15 0.73 -0.29 0.00 0.00 0.00 0.00 46.02 46.60 2ror n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ror s PRO 19 N 0.00 1.03 -0.09 1.61 0.04 -1.26 -4.96 135.00 131.37 2ror s PRO 19 Ca 0.00 0.75 -0.30 0.00 0.04 0.00 0.00 61.00 61.49 2ror s PRO 19 Cb 0.00 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.71 2ror s PRO 19 CO 0.00 -2.38 1.52 -1.25 0.04 0.00 0.00 177.00 174.93 2ror s PRO 20 N -4.94 4.20 0.56 0.56 0.04 -1.26 -5.00 135.00 129.16 2ror s PRO 20 Ca 0.64 2.01 -0.17 0.00 0.04 0.00 0.00 61.00 63.52 2ror s PRO 20 Cb -0.18 -3.90 -0.05 0.00 0.04 0.00 0.00 34.50 30.41 2ror s PRO 20 CO 0.57 -0.79 1.05 -1.14 0.04 0.00 0.00 177.00 176.73 2ror s GLN 21 N 3.80 3.47 -0.57 4.56 0.74 -1.26 -4.96 119.66 125.43 2ror s GLN 21 Ca 0.67 1.26 -0.28 0.00 0.05 0.00 0.00 55.36 57.07 2ror s GLN 21 Cb -0.30 -2.05 0.01 0.00 1.10 0.00 0.00 33.01 31.78 2ror s GLN 21 CO 0.25 -0.70 1.43 -0.51 -0.55 0.00 0.00 175.29 175.21 2ror s ASP 22 N -2.51 6.09 0.41 6.67 1.11 -1.26 -4.86 116.67 122.32 2ror s ASP 22 Ca 0.65 0.24 0.31 0.00 0.18 0.00 0.00 52.55 53.93 2ror s ASP 22 Cb -0.16 -2.55 1.37 0.00 1.07 0.00 0.00 42.92 42.65 2ror s ASP 22 CO 0.31 -1.75 1.41 0.18 1.18 0.00 0.00 175.17 176.51 2ror n LEU 23 N 9.70 0.17 -0.33 1.23 4.77 -1.26 -0.20 117.00 131.08 2ror n LEU 23 Ca 0.12 1.21 0.08 0.00 -0.03 0.00 0.00 56.01 57.39 2ror n LEU 23 Cb 0.49 -0.59 0.17 0.00 -2.33 0.00 0.00 43.42 41.16 2ror n LEU 23 CO 0.71 -1.30 0.65 -0.24 -1.33 0.00 0.00 177.39 175.88 2ror n SER 24 N -4.41 -0.27 -0.30 -1.43 2.88 -1.26 0.58 113.62 109.40 2ror n SER 24 Ca 0.37 1.60 0.19 0.00 -1.33 0.00 0.00 58.87 59.69 2ror n SER 24 Cb 1.47 -0.51 0.35 0.00 -0.75 0.00 0.00 64.21 64.77 2ror n SER 24 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2ror n VAL 25 N -5.48 -0.38 -2.00 2.46 0.24 0.72 -4.38 118.33 109.52 2ror n VAL 25 Ca 0.17 1.91 -0.38 0.00 -2.04 0.00 0.00 64.34 64.01 2ror n VAL 25 Cb 0.54 -2.90 0.02 0.00 -1.47 0.00 0.00 33.84 30.03 2ror n VAL 25 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 2ror s HIS 26 N -5.69 2.53 -1.03 6.34 4.02 0.20 -4.85 115.29 116.80 2ror s HIS 26 Ca -0.10 1.46 0.00 0.00 1.02 0.00 0.00 55.06 57.43 2ror s HIS 26 Cb 0.28 -3.59 0.00 0.00 -1.02 0.00 0.00 32.58 28.25 2ror s HIS 26 CO 0.70 -2.26 0.96 -0.11 1.02 0.00 0.00 174.74 175.05 2ror n LEU 27 N -0.89 0.00 -3.93 0.89 7.94 -1.26 -4.38 117.00 115.37 2ror n LEU 27 Ca 0.10 0.46 -0.22 0.00 -1.11 0.00 0.00 56.01 55.24 2ror n LEU 27 Cb 0.47 -0.46 -0.17 0.00 0.53 0.00 0.00 43.42 43.79 2ror n LEU 27 CO 0.50 -0.46 -0.43 -1.66 -1.11 0.00 0.00 177.39 174.22 2ror s TRP 28 N -2.93 1.04 0.01 1.96 1.48 -1.26 -2.44 118.94 116.80 2ror s TRP 28 Ca 0.00 -0.36 -0.12 0.00 -1.06 0.00 0.00 56.10 54.56 2ror s TRP 28 Cb 0.00 -0.85 0.01 0.00 -1.16 0.00 0.00 33.47 31.47 2ror s TRP 28 CO 0.00 -0.25 0.25 -0.47 -4.06 0.00 0.00 176.95 172.42 2ror s TYR 29 N 0.95 -0.07 -0.25 1.66 5.04 -1.26 -4.68 117.35 118.74 2ror s TYR 29 Ca -0.10 0.02 -0.03 0.00 -2.44 0.00 0.00 57.07 54.52 2ror s TYR 29 Cb -0.15 0.04 0.14 0.00 0.35 0.00 0.00 41.96 42.35 2ror s TYR 29 CO 0.00 -0.40 0.43 0.00 -1.34 0.00 0.00 175.55 174.25 2ror s ALA 30 N -1.80 -1.36 0.85 3.97 0.00 0.64 -4.54 121.76 119.52 2ror s ALA 30 Ca -0.11 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.04 2ror s ALA 30 Cb -0.04 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.33 2ror s ALA 30 CO 0.01 -1.23 0.00 0.41 0.00 0.00 0.00 175.76 174.95 2ror n GLY 31 N 5.38 -2.48 0.00 0.00 0.00 -1.26 -3.65 105.19 103.18 2ror n GLY 31 Ca -0.04 -1.06 0.01 0.00 0.00 0.00 0.00 46.02 44.94 2ror n GLY 31 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ror n PRO 32 N 0.00 0.49 -0.59 1.61 -0.04 -1.26 -3.58 135.00 131.62 2ror n PRO 32 Ca 0.00 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.26 2ror n PRO 32 Cb 0.00 -1.07 -0.01 0.00 -0.04 0.00 0.00 33.50 32.38 2ror n PRO 32 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 2ror n MET 33 N -0.57 0.00 -2.93 0.54 1.56 -1.26 -4.93 117.12 109.53 2ror n MET 33 Ca 0.02 0.00 -0.19 0.00 -0.27 0.00 0.00 57.70 57.26 2ror n MET 33 Cb 0.01 -0.43 0.03 0.00 2.15 0.00 0.00 33.22 34.98 2ror n MET 33 CO 0.00 0.00 0.00 -1.83 -0.73 0.00 0.00 175.97 173.41 2ror s GLU 34 N -0.43 2.60 0.01 2.12 -1.05 -1.26 -4.82 118.70 115.87 2ror s GLU 34 Ca 0.27 -1.25 -0.02 0.00 -0.15 0.00 0.00 54.97 53.83 2ror s GLU 34 Cb -0.38 -2.67 -0.00 0.00 -0.44 0.00 0.00 34.13 30.64 2ror s GLU 34 CO 0.24 -0.54 1.00 -2.13 0.95 0.00 0.00 175.26 174.78 2ror n ARG 35 N -2.07 -0.02 0.14 -4.83 0.00 -1.26 0.54 116.66 109.15 2ror n ARG 35 Ca 0.10 1.00 0.14 0.00 -0.00 0.00 0.00 57.85 59.09 2ror n ARG 35 Cb 0.60 -1.50 0.67 0.00 0.00 0.00 0.00 32.46 32.23 2ror n ARG 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ror h ALA 36 N -0.90 2.22 -0.17 5.13 0.00 -2.00 -0.80 119.26 122.75 2ror h ALA 36 Ca 0.01 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2ror h ALA 36 Cb 0.02 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2ror h ALA 36 CO -0.05 -0.31 -0.27 0.78 0.00 0.00 0.00 179.25 179.40 2ror h GLY 37 N 0.00 0.34 0.00 0.00 0.00 -0.27 -2.75 103.07 100.40 2ror h GLY 37 Ca 0.12 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2ror h GLY 37 CO -0.00 0.25 -0.01 0.00 0.00 0.00 0.00 176.54 176.78 2ror h ALA 38 N 1.44 0.00 -1.00 3.60 0.00 0.11 -3.32 119.26 120.09 2ror h ALA 38 Ca 0.04 -0.01 0.36 0.00 0.00 0.00 0.00 54.91 55.30 2ror h ALA 38 Cb 0.63 0.01 -0.18 0.00 0.00 0.00 0.00 17.79 18.25 2ror h ALA 38 CO 0.05 0.01 0.32 0.93 0.00 0.00 0.00 179.25 180.55 2ror h GLU 39 N -0.57 0.00 -0.67 0.00 5.08 -1.53 0.87 114.58 117.77 2ror h GLU 39 Ca 0.00 -0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.47 2ror h GLU 39 Cb 0.01 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.17 2ror h GLU 39 CO 0.00 0.00 0.25 0.77 -1.00 0.00 0.00 179.01 179.03 2ror h SER 40 N 0.00 0.23 0.00 1.42 0.02 -1.63 0.29 113.55 113.89 2ror h SER 40 Ca 0.75 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.79 2ror h SER 40 Cb 1.82 0.08 0.00 0.00 0.14 0.00 0.00 62.40 64.44 2ror h SER 40 CO -0.84 0.12 0.00 -0.38 -1.14 0.00 0.00 176.83 174.59 2ror n ILE 41 N -5.01 0.00 -0.08 3.27 5.41 0.30 -0.54 119.36 122.71 2ror n ILE 41 Ca 0.11 1.40 0.26 0.00 1.00 0.00 0.00 62.75 65.52 2ror n ILE 41 Cb 0.33 -2.38 0.70 0.00 -0.71 0.00 0.00 39.64 37.59 2ror n ILE 41 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2ror h LEU 42 N 0.00 0.00 0.37 1.39 -0.00 -1.46 0.40 115.31 116.01 2ror h LEU 42 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.86 2ror h LEU 42 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 2ror h LEU 42 CO 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 178.44 178.26 2ror h ALA 43 N 1.37 -0.49 -0.46 1.53 0.00 -0.16 -3.32 119.26 117.73 2ror h ALA 43 Ca 0.35 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2ror h ALA 43 Cb 1.66 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.62 2ror h ALA 43 CO -0.00 -0.52 0.27 -0.91 0.00 0.00 0.00 179.25 178.08 2ror h ASN 44 N -1.00 0.56 -2.62 0.00 2.35 0.42 -3.44 115.58 111.85 2ror h ASN 44 Ca -0.05 -0.06 -0.28 0.00 -0.55 0.00 0.00 56.30 55.35 2ror h ASN 44 Cb 0.51 -0.14 0.16 0.00 0.05 0.00 0.00 38.32 38.90 2ror h ASN 44 CO 0.08 0.46 -0.06 0.54 -1.65 0.00 0.00 177.43 176.80 2ror n ARG 45 N -4.72 -3.66 -0.97 0.81 3.00 0.01 -4.99 116.66 106.14 2ror n ARG 45 Ca 0.01 -1.18 -0.28 0.00 -0.01 0.00 0.00 57.85 56.39 2ror n ARG 45 Cb 0.06 -1.37 0.20 0.00 0.00 0.00 0.00 32.46 31.35 2ror n ARG 45 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2ror s SER 46 N -3.15 2.06 -0.17 0.55 0.01 -1.26 -4.94 113.70 106.80 2ror s SER 46 Ca 0.52 1.29 -0.29 0.00 1.31 0.00 0.00 55.95 58.78 2ror s SER 46 Cb -0.08 -1.99 -0.01 0.00 0.21 0.00 0.00 66.02 64.15 2ror s SER 46 CO 0.42 -3.50 1.21 -1.81 0.41 0.00 0.00 173.24 169.97 2ror s ASP 47 N -3.16 6.99 0.00 2.44 1.11 -1.26 -3.19 116.67 119.60 2ror s ASP 47 Ca 0.66 1.64 0.00 0.00 0.18 0.00 0.00 52.55 55.03 2ror s ASP 47 Cb -0.21 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.24 2ror s ASP 47 CO 0.60 -0.72 0.00 0.61 1.18 0.00 0.00 175.17 176.84 2ror n GLY 48 N 3.52 1.10 3.75 0.21 0.00 -0.82 -4.91 105.19 108.03 2ror n GLY 48 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 2ror n GLY 48 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ror s THR 49 N -2.00 2.93 0.26 2.61 2.01 -1.19 -1.81 115.64 118.45 2ror s THR 49 Ca 0.00 0.39 -0.10 0.00 0.31 0.00 0.00 61.69 62.30 2ror s THR 49 Cb 0.00 -2.86 -0.01 0.00 0.01 0.00 0.00 72.50 69.64 2ror s THR 49 CO 0.00 -0.31 0.44 0.72 -0.69 0.00 0.00 174.62 174.78 2ror s PHE 50 N -2.42 0.57 0.19 4.92 -0.71 0.18 -1.70 117.98 119.02 2ror s PHE 50 Ca 0.67 -0.90 -0.22 0.00 -1.04 0.00 0.00 56.93 55.44 2ror s PHE 50 Cb -0.22 0.07 0.07 0.00 -1.21 0.00 0.00 43.02 41.73 2ror s PHE 50 CO 0.47 -0.98 1.00 -0.48 -1.34 0.00 0.00 175.22 173.89 2ror s LEU 51 N -3.07 -0.04 -0.18 -1.99 0.05 -0.96 -1.07 118.68 111.42 2ror s LEU 51 Ca 0.26 -0.64 0.00 0.00 0.05 0.00 0.00 54.13 53.79 2ror s LEU 51 Cb 0.00 2.16 0.04 0.00 -2.05 0.00 0.00 46.19 46.34 2ror s LEU 51 CO 0.11 -1.02 -0.07 -0.69 -0.55 0.00 0.00 176.35 174.13 2ror s VAL 52 N -2.45 1.34 0.16 1.48 1.01 -1.26 -3.05 120.40 117.63 2ror s VAL 52 Ca 0.19 -0.81 0.10 0.00 0.00 0.00 0.00 61.98 61.46 2ror s VAL 52 Cb -0.02 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 2ror s VAL 52 CO 0.05 0.14 -0.17 0.00 0.00 0.00 0.00 175.10 175.11 2ror s ARG 53 N 1.53 1.78 0.31 2.72 1.70 -0.87 -0.26 118.95 125.87 2ror s ARG 53 Ca -0.00 -1.30 0.03 0.00 -0.47 0.00 0.00 55.73 53.98 2ror s ARG 53 Cb -0.16 -2.05 -0.03 0.00 -0.57 0.00 0.00 34.95 32.14 2ror s ARG 53 CO -0.08 0.44 0.48 -1.14 -1.08 0.00 0.00 175.30 173.93 2ror s GLN 54 N -2.48 3.43 0.31 3.89 0.74 -1.23 -0.90 119.66 123.41 2ror s GLN 54 Ca 0.21 -0.54 -0.02 0.00 0.05 0.00 0.00 55.36 55.06 2ror s GLN 54 Cb -0.09 -2.75 -0.04 0.00 1.10 0.00 0.00 33.01 31.22 2ror s GLN 54 CO 0.11 0.23 0.53 1.03 -0.55 0.00 0.00 175.29 176.65 2ror s ARG 55 N -4.20 3.55 -0.21 1.67 1.81 -1.24 -4.80 118.95 115.54 2ror s ARG 55 Ca 0.38 -0.18 -0.06 0.00 -1.72 0.00 0.00 55.73 54.15 2ror s ARG 55 Cb -0.09 -2.67 -0.20 0.00 -0.45 0.00 0.00 34.95 31.54 2ror s ARG 55 CO 0.33 0.20 0.02 0.28 -0.68 0.00 0.00 175.30 175.45 2ror n VAL 56 N -1.30 1.61 -0.19 3.52 0.31 -1.26 -4.34 118.33 116.68 2ror n VAL 56 Ca -0.03 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.79 2ror n VAL 56 Cb 0.55 -1.68 0.10 0.00 -0.91 0.00 0.00 33.84 31.90 2ror n VAL 56 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2ror h LYS 57 N -0.25 0.26 -3.95 5.55 1.79 -2.03 -3.38 116.57 114.56 2ror h LYS 57 Ca -0.51 -0.02 -0.52 0.00 -2.18 0.00 0.00 60.65 57.42 2ror h LYS 57 Cb 1.83 -0.06 -0.38 0.00 -1.58 0.00 0.00 32.23 32.04 2ror h LYS 57 CO -0.09 0.17 -0.78 0.34 -1.08 0.00 0.00 179.45 178.00 2ror s ASP 58 N -5.30 2.57 0.15 0.86 -1.08 -1.26 -5.04 116.67 107.57 2ror s ASP 58 Ca -0.13 -0.56 -0.29 0.00 -0.52 0.00 0.00 52.55 51.05 2ror s ASP 58 Cb 0.17 -0.75 -0.03 0.00 -1.46 0.00 0.00 42.92 40.85 2ror s ASP 58 CO 0.74 -0.21 1.56 0.00 0.52 0.00 0.00 175.17 177.78 2ror h ALA 59 N 8.19 -0.52 -0.40 3.66 0.00 -1.76 -3.18 119.26 125.26 2ror h ALA 59 Ca -0.22 0.07 -0.34 0.00 0.00 0.00 0.00 54.91 54.43 2ror h ALA 59 Cb 1.12 1.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.96 2ror h ALA 59 CO 0.36 -0.93 1.10 0.00 0.00 0.00 0.00 179.25 179.78 2ror n ALA 60 N -3.15 1.81 -3.54 0.00 0.00 -1.26 -4.60 120.51 109.77 2ror n ALA 60 Ca -0.00 -2.98 -0.08 0.00 0.00 0.00 0.00 53.44 50.37 2ror n ALA 60 Cb 0.34 -3.48 -0.02 0.00 0.00 0.00 0.00 19.45 16.28 2ror n ALA 60 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2ror s GLU 61 N 6.50 1.01 0.27 0.00 2.02 -1.20 -4.61 118.70 122.69 2ror s GLU 61 Ca 0.68 -0.42 -0.21 0.00 0.02 0.00 0.00 54.97 55.04 2ror s GLU 61 Cb 0.00 0.43 0.03 0.00 0.10 0.00 0.00 34.13 34.69 2ror s GLU 61 CO 0.14 -0.45 0.72 -0.06 0.02 0.00 0.00 175.26 175.63 2ror s PHE 62 N -3.30 -0.22 0.03 1.61 0.08 -1.25 -3.60 117.98 111.34 2ror s PHE 62 Ca 0.06 -0.22 -0.22 0.00 0.12 0.00 0.00 56.93 56.67 2ror s PHE 62 Cb -0.01 0.70 0.05 0.00 -0.57 0.00 0.00 43.02 43.18 2ror s PHE 62 CO -0.07 -1.20 0.50 0.00 -0.10 0.00 0.00 175.22 174.35 2ror s ALA 63 N -3.89 -1.28 -0.32 5.36 0.00 -0.07 -0.48 121.76 121.08 2ror s ALA 63 Ca 0.10 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.66 2ror s ALA 63 Cb -0.05 0.33 0.08 0.00 0.00 0.00 0.00 23.12 23.47 2ror s ALA 63 CO 0.05 -0.47 0.03 0.42 0.00 0.00 0.00 175.76 175.79 2ror s ILE 64 N -2.28 2.70 -0.23 0.00 1.01 -0.11 -2.04 121.20 120.25 2ror s ILE 64 Ca -0.06 -1.82 -0.12 0.00 0.00 0.00 0.00 60.65 58.65 2ror s ILE 64 Cb -0.01 -2.73 -0.05 0.00 0.01 0.00 0.00 42.46 39.68 2ror s ILE 64 CO -0.01 -0.34 0.21 -0.55 0.00 0.00 0.00 174.94 174.25 2ror s SER 65 N 1.26 6.19 0.00 3.58 0.15 -1.17 -1.68 113.70 122.03 2ror s SER 65 Ca 0.01 0.20 0.02 0.00 0.70 0.00 0.00 55.95 56.88 2ror s SER 65 Cb -0.20 -2.13 -0.01 0.00 -1.71 0.00 0.00 66.02 61.97 2ror s SER 65 CO -0.04 0.04 -0.06 -0.51 1.20 0.00 0.00 173.24 173.86 2ror s ILE 66 N 1.07 0.50 -0.03 6.45 -1.16 -0.12 -2.28 121.20 125.64 2ror s ILE 66 Ca 0.10 -0.38 -0.22 0.00 -0.51 0.00 0.00 60.65 59.64 2ror s ILE 66 Cb -0.14 -0.45 -0.05 0.00 0.61 0.00 0.00 42.46 42.44 2ror s ILE 66 CO 0.05 0.07 0.63 -0.75 -2.81 0.00 0.00 174.94 172.13 2ror s LYS 67 N -0.35 4.37 -0.29 3.50 2.47 -0.69 -0.24 119.74 128.53 2ror s LYS 67 Ca 0.01 0.79 -0.25 0.00 -1.56 0.00 0.00 55.97 54.95 2ror s LYS 67 Cb -0.03 -3.38 0.16 0.00 -1.46 0.00 0.00 37.83 33.11 2ror s LYS 67 CO -0.00 0.25 1.27 -0.47 0.16 0.00 0.00 175.35 176.56 2ror s TYR 68 N 0.18 -0.23 -0.83 4.03 5.04 -0.16 -1.95 117.35 123.42 2ror s TYR 68 Ca 0.33 0.55 -0.00 0.00 -2.44 0.00 0.00 57.07 55.51 2ror s TYR 68 Cb -0.18 0.43 0.00 0.00 0.35 0.00 0.00 41.96 42.56 2ror s TYR 68 CO 0.17 -0.11 0.70 -1.71 -1.34 0.00 0.00 175.55 173.26 2ror n ASN 69 N 1.79 -2.19 -1.90 4.32 4.05 -1.26 -2.50 115.26 117.58 2ror n ASN 69 Ca -0.11 -0.42 -0.08 0.00 0.45 0.00 0.00 54.58 54.41 2ror n ASN 69 Cb 0.57 -3.69 -0.02 0.00 1.23 0.00 0.00 39.78 37.86 2ror n ASN 69 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 2ror n VAL 70 N -3.22 -0.21 -3.70 3.44 0.24 -1.26 -4.87 118.33 108.74 2ror n VAL 70 Ca -0.19 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 61.97 2ror n VAL 70 Cb 0.61 -1.00 -0.09 0.00 -1.47 0.00 0.00 33.84 31.90 2ror n VAL 70 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2ror s GLU 71 N -3.95 0.60 -0.26 7.34 0.41 -1.04 -5.14 118.70 116.66 2ror s GLU 71 Ca 0.00 0.58 -0.20 0.00 -0.41 0.00 0.00 54.97 54.94 2ror s GLU 71 Cb 0.00 0.29 -0.02 0.00 -1.78 0.00 0.00 34.13 32.62 2ror s GLU 71 CO 0.00 -0.09 0.61 0.08 -0.49 0.00 0.00 175.26 175.37 2ror s VAL 72 N 0.04 5.00 0.23 2.63 1.01 -1.26 -0.99 120.40 127.06 2ror s VAL 72 Ca -0.02 1.09 -0.02 0.00 0.00 0.00 0.00 61.98 63.03 2ror s VAL 72 Cb -0.03 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 2ror s VAL 72 CO 0.01 0.04 0.44 -0.54 0.00 0.00 0.00 175.10 175.06 2ror s LYS 73 N 2.47 3.55 -0.01 2.72 -0.14 0.67 -4.93 119.74 124.06 2ror s LYS 73 Ca 0.25 -0.25 0.01 0.00 -1.36 0.00 0.00 55.97 54.62 2ror s LYS 73 Cb -0.16 -2.78 0.01 0.00 -1.68 0.00 0.00 37.83 33.22 2ror s LYS 73 CO 0.09 0.34 -0.03 -1.01 -0.76 0.00 0.00 175.35 173.98 2ror s HIS 74 N -1.95 0.37 -0.17 3.18 3.76 -1.26 -0.94 115.29 118.29 2ror s HIS 74 Ca 0.40 -0.06 0.01 0.00 -0.15 0.00 0.00 55.06 55.26 2ror s HIS 74 Cb -0.11 -0.31 0.02 0.00 1.11 0.00 0.00 32.58 33.29 2ror s HIS 74 CO 0.29 -0.05 -0.20 0.42 -0.85 0.00 0.00 174.74 174.35 2ror s ILE 75 N 0.29 2.09 0.39 0.60 1.09 -0.67 -4.95 121.20 120.04 2ror s ILE 75 Ca -0.03 -0.95 -0.24 0.00 -1.10 0.00 0.00 60.65 58.34 2ror s ILE 75 Cb -0.06 -1.86 -0.10 0.00 -1.06 0.00 0.00 42.46 39.38 2ror s ILE 75 CO -0.01 0.54 0.99 -0.75 -0.10 0.00 0.00 174.94 175.62 2ror s LYS 76 N 1.11 4.30 -0.11 2.79 2.20 -1.26 -0.94 119.74 127.82 2ror s LYS 76 Ca 0.00 1.34 0.03 0.00 -0.36 0.00 0.00 55.97 56.99 2ror s LYS 76 Cb -0.14 -2.51 0.01 0.00 -1.51 0.00 0.00 37.83 33.68 2ror s LYS 76 CO -0.09 0.01 -0.21 0.42 -0.36 0.00 0.00 175.35 175.12 2ror s ILE 77 N -1.79 1.90 0.27 5.43 1.01 0.37 -4.74 121.20 123.64 2ror s ILE 77 Ca 0.57 -0.90 -0.05 0.00 0.00 0.00 0.00 60.65 60.27 2ror s ILE 77 Cb -0.17 -1.68 -0.05 0.00 0.01 0.00 0.00 42.46 40.57 2ror s ILE 77 CO 0.22 0.52 0.52 -0.04 0.00 0.00 0.00 174.94 176.17 2ror s MET 78 N 0.66 3.63 -0.11 2.79 -1.94 -1.24 -3.83 119.30 119.26 2ror s MET 78 Ca -0.12 -0.02 -0.13 0.00 -1.71 0.00 0.00 55.69 53.71 2ror s MET 78 Cb -0.16 -2.68 0.03 0.00 2.01 0.00 0.00 34.83 34.03 2ror s MET 78 CO 0.03 0.26 0.35 0.95 -0.01 0.00 0.00 175.02 176.59 2ror s THR 79 N -2.01 0.01 0.00 2.05 -4.23 -1.26 -3.83 115.64 106.37 2ror s THR 79 Ca 0.43 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.85 2ror s THR 79 Cb -0.11 -0.52 0.00 0.00 1.34 0.00 0.00 72.50 73.21 2ror s THR 79 CO 0.29 -0.05 0.00 0.00 -0.54 0.00 0.00 174.62 174.32 2ror n ALA 80 N 2.55 2.87 -0.32 3.99 0.00 -1.26 -4.89 120.51 123.44 2ror n ALA 80 Ca -0.15 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.35 2ror n ALA 80 Cb 0.57 0.00 0.17 0.00 0.00 0.00 0.00 19.45 20.19 2ror n ALA 80 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ror n GLU 81 N -2.31 2.89 0.00 0.00 1.02 -1.26 -4.89 120.64 116.09 2ror n GLU 81 Ca 0.00 -2.18 0.00 0.00 -0.02 0.00 0.00 57.16 54.96 2ror n GLU 81 Cb 0.00 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 2ror n GLU 81 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ror n GLY 82 N 0.29 1.98 3.94 0.62 0.00 -1.26 -5.15 105.19 105.61 2ror n GLY 82 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 2ror n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ror s LEU 83 N 0.00 3.01 -0.17 0.99 2.01 -1.26 -4.71 118.68 118.55 2ror s LEU 83 Ca 0.00 -0.99 -0.07 0.00 0.01 0.00 0.00 54.13 53.08 2ror s LEU 83 Cb 0.00 -1.57 0.07 0.00 0.01 0.00 0.00 46.19 44.70 2ror s LEU 83 CO 0.00 -1.07 0.38 -0.31 1.01 0.00 0.00 176.35 176.36 2ror s TYR 84 N -2.66 -0.64 -0.25 0.29 1.51 -1.24 -4.32 117.35 110.04 2ror s TYR 84 Ca 0.46 1.31 -0.26 0.00 -1.01 0.00 0.00 57.07 57.58 2ror s TYR 84 Cb -0.04 0.23 0.08 0.00 -0.11 0.00 0.00 41.96 42.12 2ror s TYR 84 CO 0.28 -0.40 0.80 -0.98 -1.11 0.00 0.00 175.55 174.15 2ror s ARG 85 N 2.05 0.78 0.04 -0.62 1.70 -1.25 -1.62 118.95 120.03 2ror s ARG 85 Ca -0.05 0.80 0.22 0.00 -0.47 0.00 0.00 55.73 56.24 2ror s ARG 85 Cb -0.11 0.38 -0.14 0.00 -0.57 0.00 0.00 34.95 34.51 2ror s ARG 85 CO -0.12 -0.12 0.80 0.44 -1.08 0.00 0.00 175.30 175.23 2ror n ILE 86 N 2.33 0.16 -3.93 4.99 -5.35 -1.26 -3.62 119.36 112.67 2ror n ILE 86 Ca -0.14 -0.37 -0.09 0.00 -0.27 0.00 0.00 62.75 61.89 2ror n ILE 86 Cb 0.55 0.13 -0.09 0.00 -1.74 0.00 0.00 39.64 38.50 2ror n ILE 86 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2ror s THR 87 N -3.33 0.16 0.25 7.28 -4.23 -1.26 -5.04 115.64 109.48 2ror s THR 87 Ca -0.01 -1.28 0.01 0.00 -1.18 0.00 0.00 61.69 59.23 2ror s THR 87 Cb 0.14 -1.21 0.04 0.00 1.34 0.00 0.00 72.50 72.81 2ror s THR 87 CO 0.85 -0.71 1.67 1.05 -0.54 0.00 0.00 174.62 176.94 2ror h GLU 88 N 3.18 0.52 0.86 3.99 4.11 -2.04 -3.25 114.58 121.96 2ror h GLU 88 Ca -0.33 -0.22 -0.04 0.00 0.07 0.00 0.00 59.36 58.83 2ror h GLU 88 Cb 1.18 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.42 2ror h GLU 88 CO 0.56 0.77 -0.41 0.87 0.07 0.00 0.00 179.01 180.87 2ror h LYS 89 N 0.45 -1.12 -5.81 1.06 1.57 -2.02 -3.42 116.57 107.28 2ror h LYS 89 Ca 0.06 0.08 -0.64 0.00 -1.87 0.00 0.00 60.65 58.27 2ror h LYS 89 Cb 0.76 0.25 -0.06 0.00 0.08 0.00 0.00 32.23 33.26 2ror h LYS 89 CO 0.06 -0.74 -0.38 0.21 -0.57 0.00 0.00 179.45 178.03 2ror s LYS 90 N -5.88 3.60 -0.00 3.15 2.47 -1.23 -5.10 119.74 116.76 2ror s LYS 90 Ca -0.19 0.03 -0.11 0.00 -1.56 0.00 0.00 55.97 54.14 2ror s LYS 90 Cb 0.02 -3.17 0.01 0.00 -1.46 0.00 0.00 37.83 33.24 2ror s LYS 90 CO 0.59 0.72 0.23 0.00 0.16 0.00 0.00 175.35 177.06 2ror s ALA 91 N -1.11 -0.58 0.41 3.13 0.00 -1.26 -3.98 121.76 118.38 2ror s ALA 91 Ca 0.20 0.10 0.04 0.00 0.00 0.00 0.00 51.96 52.31 2ror s ALA 91 Cb -0.14 0.11 -0.05 0.00 0.00 0.00 0.00 23.12 23.04 2ror s ALA 91 CO 0.09 -0.25 0.04 -0.06 0.00 0.00 0.00 175.76 175.59 2ror s PHE 92 N -1.44 2.11 -0.23 0.00 0.40 -0.64 -5.03 117.98 113.15 2ror s PHE 92 Ca -0.14 -0.90 0.06 0.00 -0.60 0.00 0.00 56.93 55.35 2ror s PHE 92 Cb -0.06 -1.51 -0.20 0.00 0.51 0.00 0.00 43.02 41.76 2ror s PHE 92 CO 0.03 0.17 -0.09 2.89 0.70 0.00 0.00 175.22 178.92 2ror n ARG 93 N -0.95 0.67 -4.07 0.44 -4.01 -1.26 -3.64 116.66 103.83 2ror n ARG 93 Ca -0.08 0.11 -0.11 0.00 -1.04 0.00 0.00 57.85 56.74 2ror n ARG 93 Cb 0.67 -1.54 -0.11 0.00 -3.04 0.00 0.00 32.46 28.44 2ror n ARG 93 CO 0.00 0.00 0.00 0.20 -3.04 0.00 0.00 177.63 174.79 2ror s GLY 94 N -6.14 0.51 0.25 2.89 0.00 -1.26 -4.46 107.32 99.12 2ror s GLY 94 Ca -0.26 -0.91 -0.03 0.00 0.00 0.00 0.00 44.72 43.52 2ror s GLY 94 CO 0.68 -0.99 1.79 -2.00 0.00 0.00 0.00 173.10 172.58 2ror h LEU 95 N 4.03 0.61 0.02 0.66 5.85 -1.91 -2.31 115.31 122.27 2ror h LEU 95 Ca -0.35 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.44 2ror h LEU 95 Cb 1.19 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 2ror h LEU 95 CO 0.49 0.32 -0.09 0.74 -0.34 0.00 0.00 178.44 179.56 2ror h THR 96 N 0.72 0.00 -0.83 1.05 2.02 -1.99 -1.98 112.91 111.89 2ror h THR 96 Ca 0.43 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.81 2ror h THR 96 Cb 0.49 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.76 2ror h THR 96 CO -0.30 0.00 0.18 -0.33 0.37 0.00 0.00 175.52 175.45 2ror h GLU 97 N -0.12 0.20 -0.91 6.66 4.39 -1.92 0.66 114.58 123.54 2ror h GLU 97 Ca -0.00 -0.01 0.22 0.00 0.34 0.00 0.00 59.36 59.91 2ror h GLU 97 Cb 0.13 -0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 28.67 2ror h GLU 97 CO -0.05 0.13 0.61 1.25 -1.16 0.00 0.00 179.01 179.79 2ror h LEU 98 N 0.21 0.33 0.06 1.33 6.46 -0.87 0.33 115.31 123.16 2ror h LEU 98 Ca 0.50 0.04 -0.26 0.00 -0.12 0.00 0.00 57.88 58.03 2ror h LEU 98 Cb 0.95 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.84 2ror h LEU 98 CO -0.63 0.12 -1.42 0.58 -0.62 0.00 0.00 178.44 176.48 2ror h VAL 99 N 0.33 0.92 0.00 1.05 2.07 0.85 -3.21 116.25 118.25 2ror h VAL 99 Ca 0.47 -2.28 0.00 0.00 0.82 0.00 0.00 66.70 65.71 2ror h VAL 99 Cb 1.30 2.47 0.00 0.00 -1.52 0.00 0.00 31.29 33.54 2ror h VAL 99 CO -0.15 0.57 0.00 -0.62 0.02 0.00 0.00 177.57 177.38 2ror n GLU 100 N -4.08 0.17 -0.11 1.57 -0.58 0.73 -2.54 120.64 115.78 2ror n GLU 100 Ca -0.29 0.17 -0.24 0.00 -0.42 0.00 0.00 57.16 56.37 2ror n GLU 100 Cb 0.82 -1.50 -0.11 0.00 -0.57 0.00 0.00 31.44 30.07 2ror n GLU 100 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2ror n PHE 101 N -1.25 0.36 -0.29 -0.32 7.35 0.11 -4.39 117.46 119.04 2ror n PHE 101 Ca 0.05 0.12 0.09 0.00 -0.76 0.00 0.00 57.45 56.95 2ror n PHE 101 Cb 0.07 -1.04 0.32 0.00 0.35 0.00 0.00 39.48 39.19 2ror n PHE 101 CO 0.00 0.00 0.00 1.88 -0.76 0.00 0.00 176.76 177.88 2ror h TYR 102 N -0.61 0.93 -0.13 -5.13 0.05 -1.49 0.77 116.97 111.35 2ror h TYR 102 Ca -0.57 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.27 2ror h TYR 102 Cb 1.68 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 39.12 2ror h TYR 102 CO -0.00 0.38 0.51 1.96 -1.05 0.00 0.00 178.16 179.97 2ror h GLN 103 N 0.82 0.00 0.00 4.88 4.20 -1.74 0.39 115.11 123.65 2ror h GLN 103 Ca 0.44 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.95 2ror h GLN 103 Cb 0.55 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.29 2ror h GLN 103 CO -0.20 0.00 -1.75 1.04 -0.67 0.00 0.00 178.83 177.25 2ror n GLN 104 N -2.99 2.20 -3.67 1.46 6.02 0.15 -4.83 117.38 115.72 2ror n GLN 104 Ca 0.01 -0.01 -0.39 0.00 -0.01 0.00 0.00 57.00 56.61 2ror n GLN 104 Cb 0.59 -1.28 -0.12 0.00 1.02 0.00 0.00 30.24 30.45 2ror n GLN 104 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2ror s ASN 105 N -4.35 5.53 0.23 1.08 0.01 0.13 -5.07 114.94 112.50 2ror s ASN 105 Ca -0.05 -1.11 -0.32 0.00 -0.71 0.00 0.00 52.86 50.67 2ror s ASN 105 Cb 0.03 -1.95 -0.13 0.00 0.41 0.00 0.00 41.25 39.62 2ror s ASN 105 CO 0.45 -0.37 1.51 -1.20 -1.51 0.00 0.00 177.10 175.98 2ror n SER 106 N 4.90 3.14 0.00 -1.22 7.64 -1.25 -4.48 113.62 122.35 2ror n SER 106 Ca -0.12 1.12 0.02 0.00 1.01 0.00 0.00 58.87 60.90 2ror n SER 106 Cb 0.45 -1.47 0.08 0.00 -1.01 0.00 0.00 64.21 62.26 2ror n SER 106 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2ror n LEU 107 N 2.61 0.00 0.30 -3.43 4.32 -1.20 -1.67 117.00 117.94 2ror n LEU 107 Ca 0.13 0.44 0.19 0.00 -0.02 0.00 0.00 56.01 56.75 2ror n LEU 107 Cb 0.32 -0.44 0.88 0.00 -1.62 0.00 0.00 43.42 42.56 2ror n LEU 107 CO 0.63 -0.39 1.06 0.07 -1.22 0.00 0.00 177.39 177.54 2ror h LYS 108 N 0.00 0.00 -0.33 3.23 2.10 -1.43 0.61 116.57 120.76 2ror h LYS 108 Ca 0.00 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.58 2ror h LYS 108 Cb 0.05 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.36 2ror h LYS 108 CO 0.00 0.00 -0.10 0.22 -2.00 0.00 0.00 179.45 177.57 2ror h ASP 109 N 0.00 0.54 0.00 7.07 3.58 -1.62 -3.35 116.42 122.65 2ror h ASP 109 Ca 0.00 -0.14 -0.33 0.00 0.42 0.00 0.00 57.03 56.98 2ror h ASP 109 Cb 0.32 -0.14 -0.05 0.00 1.72 0.00 0.00 39.33 41.18 2ror h ASP 109 CO 0.00 0.68 -2.09 0.00 -2.88 0.00 0.00 179.24 174.95 2ror s PHE 111 N -2.58 3.48 -0.30 0.00 0.08 0.16 -5.02 117.98 113.80 2ror s PHE 111 Ca -0.35 0.18 0.17 0.00 0.12 0.00 0.00 56.93 57.06 2ror s PHE 111 Cb 0.12 -1.74 -0.23 0.00 -0.57 0.00 0.00 43.02 40.59 2ror s PHE 111 CO 0.45 0.35 0.50 0.36 -0.10 0.00 0.00 175.22 176.78 2ror n LYS 112 N -1.22 0.90 0.02 0.44 0.00 -1.26 -3.93 118.16 113.11 2ror n LYS 112 Ca -0.07 -0.10 -0.18 0.00 -0.00 0.00 0.00 58.31 57.96 2ror n LYS 112 Cb 0.56 -1.36 -0.14 0.00 -0.00 0.00 0.00 35.03 34.09 2ror n LYS 112 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2ror h SER 113 N 0.00 0.40 -2.78 -5.58 0.87 -1.94 -3.41 113.55 101.11 2ror h SER 113 Ca 0.00 -0.92 -0.66 0.00 -1.23 0.00 0.00 61.79 58.99 2ror h SER 113 Cb 0.64 -0.13 -0.17 0.00 -0.44 0.00 0.00 62.40 62.30 2ror h SER 113 CO 0.00 1.28 0.36 -0.76 -0.53 0.00 0.00 176.83 177.18 2ror s LEU 114 N -8.05 4.80 -0.37 2.23 1.43 -1.26 -4.88 118.68 112.58 2ror s LEU 114 Ca -0.14 -1.15 0.04 0.00 -1.03 0.00 0.00 54.13 51.84 2ror s LEU 114 Cb 0.01 -2.38 0.57 0.00 0.03 0.00 0.00 46.19 44.41 2ror s LEU 114 CO 0.81 -1.29 1.76 -0.67 0.23 0.00 0.00 176.35 177.19 2ror n ASP 115 N 7.11 3.68 -3.98 2.29 2.03 -1.26 -1.63 116.55 124.78 2ror n ASP 115 Ca -0.06 -3.32 -0.10 0.00 0.52 0.00 0.00 54.79 51.83 2ror n ASP 115 Cb 0.44 -0.78 -0.07 0.00 -0.72 0.00 0.00 41.12 39.99 2ror n ASP 115 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2ror s THR 116 N -2.75 0.05 0.33 5.18 -1.32 -1.26 -4.84 115.64 111.04 2ror s THR 116 Ca 0.48 -1.43 0.10 0.00 -1.21 0.00 0.00 61.69 59.62 2ror s THR 116 Cb 0.40 -1.93 -0.06 0.00 -1.51 0.00 0.00 72.50 69.40 2ror s THR 116 CO 0.09 -0.24 -0.11 0.28 -2.21 0.00 0.00 174.62 172.43 2ror s THR 117 N -3.99 2.33 -0.52 5.08 -1.32 -1.26 -3.22 115.64 112.75 2ror s THR 117 Ca 0.19 -2.24 -0.41 0.00 -1.21 0.00 0.00 61.69 58.02 2ror s THR 117 Cb 0.03 -2.57 -0.18 0.00 -1.51 0.00 0.00 72.50 68.27 2ror s THR 117 CO 0.02 -0.25 2.20 0.18 -2.21 0.00 0.00 174.62 174.56 2ror n LEU 118 N -0.76 0.92 -0.09 9.08 4.77 -1.26 -4.81 117.00 124.85 2ror n LEU 118 Ca -0.05 0.58 -0.18 0.00 -0.03 0.00 0.00 56.01 56.34 2ror n LEU 118 Cb 0.63 -0.96 -0.11 0.00 -2.33 0.00 0.00 43.42 40.64 2ror n LEU 118 CO 0.42 -0.77 -0.18 1.56 -1.33 0.00 0.00 177.39 177.09 2ror h GLN 119 N 9.86 0.00 -3.35 3.23 1.08 -1.69 -3.43 115.11 120.82 2ror h GLN 119 Ca -0.12 0.00 -0.23 0.00 -1.45 0.00 0.00 58.65 56.85 2ror h GLN 119 Cb 1.39 0.00 -0.30 0.00 -0.05 0.00 0.00 27.48 28.53 2ror h GLN 119 CO 1.11 0.92 -0.60 -0.06 -0.95 0.00 0.00 178.83 179.25 2ror s PHE 120 N -2.28 -0.14 1.07 2.96 0.08 -1.06 -4.87 117.98 113.73 2ror s PHE 120 Ca -0.24 0.40 -0.18 0.00 0.12 0.00 0.00 56.93 57.03 2ror s PHE 120 Cb 0.02 -0.04 0.26 0.00 -0.57 0.00 0.00 43.02 42.70 2ror s PHE 120 CO 0.59 -0.12 0.94 -0.35 -0.10 0.00 0.00 175.22 176.18 2ror n PRO 121 N 3.73 -2.87 0.07 0.24 -0.04 -1.26 0.51 135.00 135.38 2ror n PRO 121 Ca -0.21 -1.51 -0.13 0.00 -0.04 0.00 0.00 63.50 61.61 2ror n PRO 121 Cb 0.55 -1.42 -0.08 0.00 -0.04 0.00 0.00 33.50 32.51 2ror n PRO 121 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2ror h PHE 122 N -2.57 -0.09 0.00 0.54 3.57 -1.25 -3.35 116.94 113.78 2ror h PHE 122 Ca -0.36 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.14 2ror h PHE 122 Cb 1.09 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.86 2ror h PHE 122 CO 0.00 -0.01 -0.00 0.87 -2.23 0.00 0.00 178.31 176.94 2ror h LYS 123 N -0.16 -0.00 -1.27 1.11 1.57 -1.80 -3.50 116.57 112.53 2ror h LYS 123 Ca -0.01 0.00 0.22 0.00 -1.87 0.00 0.00 60.65 58.99 2ror h LYS 123 Cb 0.13 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.20 2ror h LYS 123 CO 0.02 -0.00 0.84 -1.83 -0.57 0.00 0.00 179.45 177.90 2ror s GLU 124 N -1.83 0.23 0.33 3.15 4.04 -1.26 -5.12 118.70 118.24 2ror s GLU 124 Ca -0.00 0.00 -0.28 0.00 0.04 0.00 0.00 54.97 54.73 2ror s GLU 124 Cb 0.00 0.11 -0.10 0.00 0.02 0.00 0.00 34.13 34.16 2ror s GLU 124 CO 0.00 -0.08 1.22 -1.25 -1.84 0.00 0.00 175.26 173.31 2ror s PRO 125 N -1.47 4.38 0.12 -4.83 0.04 -1.26 -4.51 135.00 127.47 2ror s PRO 125 Ca 0.07 2.02 -0.03 0.00 0.04 0.00 0.00 61.00 63.10 2ror s PRO 125 Cb -0.01 -3.03 -0.05 0.00 0.04 0.00 0.00 34.50 31.45 2ror s PRO 125 CO -0.05 -0.10 0.33 -2.00 0.04 0.00 0.00 177.00 175.22 2ror s GLU 126 N -1.79 3.56 -0.34 4.56 2.56 -1.26 -5.00 118.70 120.98 2ror s GLU 126 Ca 0.49 -0.21 0.08 0.00 0.00 0.00 0.00 54.97 55.33 2ror s GLU 126 Cb -0.36 -2.91 0.63 0.00 2.00 0.00 0.00 34.13 33.50 2ror s GLU 126 CO 0.47 0.51 1.71 0.36 -0.56 0.00 0.00 175.26 177.74 2ror n LYS 127 N 0.10 2.62 -3.30 4.30 0.00 -1.26 -4.83 118.16 115.79 2ror n LYS 127 Ca -0.03 -3.07 -0.45 0.00 -0.00 0.00 0.00 58.31 54.76 2ror n LYS 127 Cb 0.52 -2.05 -0.00 0.00 -0.00 0.00 0.00 35.03 33.49 2ror n LYS 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 2ror s ARG 128 N -3.15 4.13 -0.38 -1.58 6.06 -1.26 -4.86 118.95 117.90 2ror s ARG 128 Ca 0.51 -3.08 -0.01 0.00 -2.50 0.00 0.00 55.73 50.66 2ror s ARG 128 Cb 0.43 -4.59 0.29 0.00 0.06 0.00 0.00 34.95 31.15 2ror s ARG 128 CO 0.08 -1.30 1.95 0.25 -2.50 0.00 0.00 175.30 173.78 2ror n THR 129 N 3.02 2.87 -0.34 4.11 -2.24 -1.26 -4.58 114.28 115.86 2ror n THR 129 Ca 0.24 -1.82 0.09 0.00 -2.27 0.00 0.00 64.05 60.28 2ror n THR 129 Cb 0.40 -1.20 0.26 0.00 -2.10 0.00 0.00 70.33 67.69 2ror n THR 129 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2ror h ILE 130 N 0.93 0.82 -5.81 2.28 6.09 -2.02 -3.46 117.51 116.34 2ror h ILE 130 Ca 0.37 -0.29 -0.35 0.00 -1.37 0.00 0.00 64.86 63.22 2ror h ILE 130 Cb 1.09 -0.09 0.13 0.00 0.47 0.00 0.00 36.82 38.42 2ror h ILE 130 CO 0.91 0.15 -0.84 -1.20 -3.07 0.00 0.00 178.15 174.10 2ror n SER 131 N -4.72 -3.68 -2.37 2.19 7.64 -1.26 -4.90 113.62 106.51 2ror n SER 131 Ca 0.20 -0.77 -0.35 0.00 1.01 0.00 0.00 58.87 58.96 2ror n SER 131 Cb 0.43 -4.57 0.07 0.00 -1.01 0.00 0.00 64.21 59.13 2ror n SER 131 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2ror n ARG 132 N -3.91 2.78 -1.15 1.43 0.63 -1.26 -5.01 116.66 110.18 2ror n ARG 132 Ca -0.20 -3.40 -0.29 0.00 -0.92 0.00 0.00 57.85 53.04 2ror n ARG 132 Cb 0.65 -2.29 0.19 0.00 0.45 0.00 0.00 32.46 31.46 2ror n ARG 132 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 2ror s SER 133 N -1.92 2.20 -0.44 6.15 0.01 -1.26 -5.05 113.70 113.39 2ror s SER 133 Ca 0.62 1.05 0.03 0.00 1.31 0.00 0.00 55.95 58.97 2ror s SER 133 Cb 0.49 -1.64 0.25 0.00 0.21 0.00 0.00 66.02 65.33 2ror s SER 133 CO -0.05 -3.38 1.00 0.61 0.41 0.00 0.00 173.24 171.83 2ror n GLY 134 N -1.05 -0.54 2.04 3.44 0.00 -1.26 -5.16 105.19 102.66 2ror n GLY 134 Ca 0.06 0.42 -0.17 0.00 0.00 0.00 0.00 46.02 46.33 2ror n GLY 134 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ror n PRO 135 N 1.63 -2.26 -3.10 1.61 -0.04 -1.26 -4.49 135.00 127.08 2ror n PRO 135 Ca 0.07 -1.02 -0.13 0.00 -0.04 0.00 0.00 63.50 62.37 2ror n PRO 135 Cb 0.65 -0.96 0.05 0.00 -0.04 0.00 0.00 33.50 33.20 2ror n PRO 135 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2ror n SER 136 N -4.09 -4.32 -4.53 3.54 2.88 -1.26 -4.98 113.62 100.86 2ror n SER 136 Ca 0.09 -0.31 -0.43 0.00 -1.33 0.00 0.00 58.87 56.89 2ror n SER 136 Cb 0.34 -3.10 -0.07 0.00 -0.75 0.00 0.00 64.21 60.64 2ror n SER 136 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2ror s SER 137 N -3.23 6.35 0.00 -3.46 0.15 -1.26 -5.36 113.70 106.88 2ror s SER 137 Ca 0.31 -0.24 0.00 0.00 0.70 0.00 0.00 55.95 56.72 2ror s SER 137 Cb -0.14 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.85 2ror s SER 137 CO 0.42 -0.77 0.00 0.61 1.20 0.00 0.00 173.24 174.70