#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4b s ASN 32 N 0.00 -0.18 -0.19 4.37 0.01 -1.26 -5.17 114.94 112.53 2k4b s ASN 32 Ca 0.00 0.76 -0.10 0.00 -0.71 0.00 0.00 52.86 52.81 2k4b s ASN 32 Cb 0.00 0.81 0.07 0.00 0.41 0.00 0.00 41.25 42.53 2k4b s ASN 32 CO 0.00 -0.21 0.46 0.68 -1.51 0.00 0.00 177.10 176.52 2k4b s VAL 33 N 1.91 -0.12 -0.18 1.60 -7.23 -1.26 -5.17 120.40 109.95 2k4b s VAL 33 Ca -0.05 0.09 -0.22 0.00 -1.81 0.00 0.00 61.98 59.99 2k4b s VAL 33 Cb -0.11 -0.68 0.06 0.00 0.56 0.00 0.00 36.38 36.21 2k4b s VAL 33 CO -0.11 0.04 0.59 -0.44 -0.31 0.00 0.00 175.10 174.87 2k4b s SER 34 N 1.63 -0.59 0.13 4.85 0.01 -1.26 -5.20 113.70 113.26 2k4b s SER 34 Ca -0.08 1.04 -0.25 0.00 1.31 0.00 0.00 55.95 57.96 2k4b s SER 34 Cb -0.08 1.04 0.07 0.00 0.21 0.00 0.00 66.02 67.25 2k4b s SER 34 CO -0.14 -0.29 0.89 0.20 0.41 0.00 0.00 173.24 174.31 2k4b s ASN 35 N -0.06 -0.26 0.11 2.44 0.01 -1.26 -5.08 114.94 110.84 2k4b s ASN 35 Ca -0.03 -0.29 -0.13 0.00 -0.71 0.00 0.00 52.86 51.70 2k4b s ASN 35 Cb -0.04 0.50 -0.10 0.00 0.41 0.00 0.00 41.25 42.02 2k4b s ASN 35 CO 0.03 -0.88 1.39 0.00 -1.51 0.00 0.00 177.10 176.13 2k4b h ALA 36 N 2.00 0.43 0.00 0.60 0.00 -2.05 -3.35 119.26 116.89 2k4b h ALA 36 Ca -0.24 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.18 2k4b h ALA 36 Cb 1.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2k4b h ALA 36 CO 0.27 0.60 0.00 1.05 0.00 0.00 0.00 179.25 181.18 2k4b h GLU 37 N 0.58 0.00 0.31 0.00 9.09 -1.99 -3.38 114.58 119.19 2k4b h GLU 37 Ca 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.42 2k4b h GLU 37 Cb 1.09 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.17 2k4b h GLU 37 CO 0.11 0.00 -0.41 1.25 0.05 0.00 0.00 179.01 180.01 2k4b h LEU 38 N 0.00 -1.15 -0.16 3.06 5.85 -2.00 -0.87 115.31 120.04 2k4b h LEU 38 Ca 0.00 0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.75 2k4b h LEU 38 Cb 0.27 0.39 -0.00 0.00 0.37 0.00 0.00 40.66 41.69 2k4b h LEU 38 CO 0.00 -0.50 -0.19 0.40 -0.34 0.00 0.00 178.44 177.81 2k4b h ILE 39 N -0.74 1.35 -0.68 4.05 2.04 -1.89 -1.66 117.51 119.97 2k4b h ILE 39 Ca -0.04 -1.38 0.03 0.00 1.00 0.00 0.00 64.86 64.48 2k4b h ILE 39 Cb 0.67 1.89 -0.04 0.00 -0.74 0.00 0.00 36.82 38.59 2k4b h ILE 39 CO -0.10 0.41 0.45 -0.37 0.00 0.00 0.00 178.15 178.54 2k4b h VAL 40 N 0.04 1.11 -0.11 1.67 -1.51 -1.77 -0.80 116.25 114.88 2k4b h VAL 40 Ca 0.02 -0.29 -0.22 0.00 -1.23 0.00 0.00 66.70 64.98 2k4b h VAL 40 Cb 0.74 0.20 0.01 0.00 -2.13 0.00 0.00 31.29 30.11 2k4b h VAL 40 CO 0.04 0.15 -0.80 -0.03 -1.23 0.00 0.00 177.57 175.70 2k4b h MET 41 N 0.83 0.73 -0.32 5.19 1.85 -1.12 -3.28 114.93 118.82 2k4b h MET 41 Ca 0.27 -0.65 -0.03 0.00 -0.61 0.00 0.00 59.70 58.68 2k4b h MET 41 Cb 0.04 0.15 -0.01 0.00 0.43 0.00 0.00 31.60 32.20 2k4b h MET 41 CO -0.07 1.25 0.08 -0.09 -0.40 0.00 0.00 176.91 177.68 2k4b h ARG 42 N 0.44 0.51 0.13 0.39 9.65 -0.64 -3.34 114.38 121.52 2k4b h ARG 42 Ca -0.07 -0.12 -0.19 0.00 -1.10 0.00 0.00 59.98 58.50 2k4b h ARG 42 Cb 1.44 -0.07 0.02 0.00 -1.39 0.00 0.00 29.97 29.98 2k4b h ARG 42 CO 0.16 0.57 -0.83 -0.39 2.80 0.00 0.00 179.97 182.28 2k4b h VAL 43 N 0.36 1.49 -0.28 0.20 -1.51 -1.30 -3.39 116.25 111.82 2k4b h VAL 43 Ca 0.10 -2.49 -0.19 0.00 -1.23 0.00 0.00 66.70 62.90 2k4b h VAL 43 Cb 0.28 3.11 0.00 0.00 -2.13 0.00 0.00 31.29 32.56 2k4b h VAL 43 CO 0.00 0.71 -0.55 0.40 -1.23 0.00 0.00 177.57 176.90 2k4b h ILE 44 N -0.30 1.28 -1.21 7.19 2.04 -1.71 -2.94 117.51 121.87 2k4b h ILE 44 Ca -0.14 -1.74 0.35 0.00 1.00 0.00 0.00 64.86 64.33 2k4b h ILE 44 Cb 1.63 1.64 -0.05 0.00 -0.74 0.00 0.00 36.82 39.30 2k4b h ILE 44 CO 0.16 0.57 0.86 -0.25 0.00 0.00 0.00 178.15 179.48 2k4b h TRP 45 N 0.65 0.07 -0.12 1.37 2.91 -1.75 -2.80 115.95 116.29 2k4b h TRP 45 Ca 0.01 0.00 -0.23 0.00 1.13 0.00 0.00 58.89 59.81 2k4b h TRP 45 Cb 1.16 -0.02 0.01 0.00 -0.51 0.00 0.00 29.16 29.80 2k4b h TRP 45 CO 0.07 0.00 -0.83 1.03 -1.03 0.00 0.00 178.44 177.68 2k4b h SER 46 N 0.04 0.91 -0.09 2.65 0.87 -1.71 -3.36 113.55 112.87 2k4b h SER 46 Ca 0.59 -0.63 -0.14 0.00 -1.23 0.00 0.00 61.79 60.38 2k4b h SER 46 Cb 2.26 -0.27 0.01 0.00 -0.44 0.00 0.00 62.40 63.95 2k4b h SER 46 CO -0.04 1.42 -0.50 0.25 -0.53 0.00 0.00 176.83 177.43 2k4b h LEU 47 N 0.50 0.60 0.00 2.23 6.46 -1.66 -3.49 115.31 119.95 2k4b h LEU 47 Ca -0.07 -0.65 0.00 0.00 -0.12 0.00 0.00 57.88 57.04 2k4b h LEU 47 Cb 1.46 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 41.22 2k4b h LEU 47 CO 0.17 1.15 0.00 0.61 -0.62 0.00 0.00 178.44 179.75 2k4b n GLY 48 N 0.73 2.26 2.91 3.75 0.00 -1.25 -5.00 105.19 108.58 2k4b n GLY 48 Ca -0.08 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 2k4b n GLY 48 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k4b s GLU 49 N 0.00 0.07 0.02 1.61 1.03 -1.26 -4.45 118.70 115.71 2k4b s GLU 49 Ca 0.00 -0.07 0.03 0.00 0.03 0.00 0.00 54.97 54.96 2k4b s GLU 49 Cb 0.00 0.03 -0.01 0.00 -0.80 0.00 0.00 34.13 33.34 2k4b s GLU 49 CO 0.00 -0.01 -0.09 0.00 -1.33 0.00 0.00 175.26 173.83 2k4b s ALA 50 N -0.22 0.70 0.71 -0.84 0.00 -0.32 -5.00 121.76 116.79 2k4b s ALA 50 Ca -0.02 -0.56 -0.11 0.00 0.00 0.00 0.00 51.96 51.27 2k4b s ALA 50 Cb -0.02 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.03 2k4b s ALA 50 CO -0.00 0.10 1.07 1.03 0.00 0.00 0.00 175.76 177.96 2k4b s ARG 51 N -0.83 2.83 0.27 0.00 3.00 -1.26 -0.43 118.95 122.52 2k4b s ARG 51 Ca -0.02 0.86 -0.03 0.00 0.00 0.00 0.00 55.73 56.54 2k4b s ARG 51 Cb -0.06 -1.98 0.40 0.00 0.00 0.00 0.00 34.95 33.30 2k4b s ARG 51 CO 0.00 -1.15 1.90 -0.24 0.00 0.00 0.00 175.30 175.81 2k4b h VAL 52 N -0.75 1.13 0.00 3.52 3.04 -1.92 -0.88 116.25 120.39 2k4b h VAL 52 Ca -0.44 -0.41 0.00 0.00 -1.01 0.00 0.00 66.70 64.84 2k4b h VAL 52 Cb 1.22 -0.17 0.00 0.00 -2.01 0.00 0.00 31.29 30.33 2k4b h VAL 52 CO 0.58 0.22 0.00 -0.78 -1.01 0.00 0.00 177.57 176.58 2k4b h ASP 53 N 1.19 0.00 0.04 3.17 1.82 -1.94 -2.41 116.42 118.30 2k4b h ASP 53 Ca 0.41 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 57.04 2k4b h ASP 53 Cb 0.09 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.10 2k4b h ASP 53 CO -0.14 0.00 -0.02 -0.08 -1.61 0.00 0.00 179.24 177.39 2k4b h GLU 54 N 0.00 -0.05 -0.92 0.28 4.22 -1.57 -2.85 114.58 113.69 2k4b h GLU 54 Ca 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.44 2k4b h GLU 54 Cb 0.61 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 2k4b h GLU 54 CO 0.00 0.60 0.57 -0.84 -2.18 0.00 0.00 179.01 177.16 2k4b h ILE 55 N -0.83 1.25 -0.68 2.32 3.07 -1.31 -0.23 117.51 121.10 2k4b h ILE 55 Ca -0.01 -0.52 0.02 0.00 1.55 0.00 0.00 64.86 65.90 2k4b h ILE 55 Cb 0.68 -0.07 -0.04 0.00 -0.27 0.00 0.00 36.82 37.12 2k4b h ILE 55 CO 0.01 0.26 0.45 0.22 -1.05 0.00 0.00 178.15 178.03 2k4b h TYR 56 N 1.27 0.82 0.00 0.16 3.20 -1.57 -2.65 116.97 118.20 2k4b h TYR 56 Ca 0.33 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.22 2k4b h TYR 56 Cb -0.08 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 37.91 2k4b h TYR 56 CO 0.00 0.50 0.00 0.00 -1.64 0.00 0.00 178.16 177.03 2k4b h ALA 57 N 1.59 1.00 -0.33 1.82 0.00 -0.77 -1.46 119.26 121.10 2k4b h ALA 57 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2k4b h ALA 57 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2k4b h ALA 57 CO -0.06 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.23 2k4b n GLN 58 N -2.35 1.92 -3.58 0.00 1.13 -1.00 -4.75 117.38 108.75 2k4b n GLN 58 Ca -0.01 -1.41 -0.40 0.00 -1.94 0.00 0.00 57.00 53.24 2k4b n GLN 58 Cb 0.07 -1.36 -0.07 0.00 0.11 0.00 0.00 30.24 28.99 2k4b n GLN 58 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2k4b s ILE 59 N -1.57 4.32 0.79 5.09 1.01 -0.55 -4.99 121.20 125.30 2k4b s ILE 59 Ca 0.30 -2.55 -0.11 0.00 0.00 0.00 0.00 60.65 58.30 2k4b s ILE 59 Cb 0.16 -3.78 0.07 0.00 0.01 0.00 0.00 42.46 38.92 2k4b s ILE 59 CO 0.22 -0.89 1.09 -2.16 0.00 0.00 0.00 174.94 173.20 2k4b s PRO 60 N 0.34 2.09 0.45 2.79 0.04 -1.26 -4.91 135.00 134.54 2k4b s PRO 60 Ca 0.14 1.02 0.18 0.00 0.04 0.00 0.00 61.00 62.39 2k4b s PRO 60 Cb -0.19 -1.89 0.99 0.00 0.04 0.00 0.00 34.50 33.45 2k4b s PRO 60 CO -0.04 -1.72 1.49 -0.56 0.04 0.00 0.00 177.00 176.21 2k4b h GLN 61 N -1.18 0.00 -0.42 4.56 -0.00 -1.98 -1.92 115.11 114.18 2k4b h GLN 61 Ca -0.45 0.00 0.12 0.00 -0.00 0.00 0.00 58.65 58.32 2k4b h GLN 61 Cb 1.24 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.71 2k4b h GLN 61 CO 0.53 0.00 0.32 1.49 -0.00 0.00 0.00 178.83 181.17 2k4b h GLU 62 N 0.00 0.00 0.00 0.06 4.81 -2.02 -2.75 114.58 114.67 2k4b h GLU 62 Ca 0.00 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.06 2k4b h GLU 62 Cb 0.68 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.03 2k4b h GLU 62 CO 0.00 0.00 -1.72 1.28 -0.73 0.00 0.00 179.01 177.84 2k4b n LEU 63 N -4.27 0.52 -3.03 1.64 4.77 -0.72 -5.02 117.00 110.88 2k4b n LEU 63 Ca 0.07 0.23 -0.18 0.00 -0.03 0.00 0.00 56.01 56.09 2k4b n LEU 63 Cb 0.51 0.15 0.07 0.00 -2.33 0.00 0.00 43.42 41.82 2k4b n LEU 63 CO 0.35 0.18 0.18 -0.62 -1.33 0.00 0.00 177.39 176.15 2k4b n GLU 64 N -2.73 -6.31 -3.82 3.23 1.02 -1.04 -5.02 120.64 105.97 2k4b n GLU 64 Ca -0.13 0.68 -0.35 0.00 -0.02 0.00 0.00 57.16 57.34 2k4b n GLU 64 Cb 0.85 -5.28 -0.09 0.00 -0.02 0.00 0.00 31.44 26.91 2k4b n GLU 64 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2k4b s TRP 65 N -3.27 3.36 0.61 -0.32 0.52 -1.26 -5.10 118.94 113.48 2k4b s TRP 65 Ca 0.37 0.24 -0.18 0.00 0.02 0.00 0.00 56.10 56.56 2k4b s TRP 65 Cb -0.16 -2.14 -0.03 0.00 -1.15 0.00 0.00 33.47 29.99 2k4b s TRP 65 CO 0.60 0.24 1.20 -1.12 0.02 0.00 0.00 176.95 177.89 2k4b s SER 66 N 0.38 5.09 0.60 2.95 0.01 -1.26 -4.94 113.70 116.53 2k4b s SER 66 Ca 0.06 2.37 0.29 0.00 1.31 0.00 0.00 55.95 59.98 2k4b s SER 66 Cb -0.11 -2.60 1.51 0.00 0.21 0.00 0.00 66.02 65.03 2k4b s SER 66 CO -0.01 -1.66 1.92 0.25 0.41 0.00 0.00 173.24 174.15 2k4b h LEU 67 N 0.73 0.00 -0.29 2.44 6.46 -1.99 -1.43 115.31 121.23 2k4b h LEU 67 Ca -0.50 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.25 2k4b h LEU 67 Cb 1.30 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.21 2k4b h LEU 67 CO 0.55 0.00 0.16 0.00 -0.62 0.00 0.00 178.44 178.52 2k4b h ALA 68 N 1.47 0.37 -0.65 1.25 0.00 -2.02 -3.35 119.26 116.32 2k4b h ALA 68 Ca 0.17 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2k4b h ALA 68 Cb 1.04 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 2k4b h ALA 68 CO -0.00 -0.11 0.31 1.15 0.00 0.00 0.00 179.25 180.60 2k4b h THR 69 N 0.35 1.21 -0.74 0.00 2.02 -1.63 -1.92 112.91 112.20 2k4b h THR 69 Ca 0.10 -0.60 -0.01 0.00 0.77 0.00 0.00 66.41 66.67 2k4b h THR 69 Cb 0.06 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 66.81 2k4b h THR 69 CO -0.02 0.25 0.43 1.62 0.37 0.00 0.00 175.52 178.18 2k4b h VAL 70 N 0.92 1.22 -0.36 3.16 3.04 -1.72 -2.77 116.25 119.73 2k4b h VAL 70 Ca 0.23 -0.50 -0.11 0.00 -1.01 0.00 0.00 66.70 65.31 2k4b h VAL 70 Cb 0.10 0.20 -0.01 0.00 -2.01 0.00 0.00 31.29 29.57 2k4b h VAL 70 CO -0.03 0.23 -0.22 0.11 -1.01 0.00 0.00 177.57 176.65 2k4b h LYS 71 N 1.02 0.70 -0.11 4.17 1.57 -1.49 0.12 116.57 122.54 2k4b h LYS 71 Ca 0.26 -0.27 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2k4b h LYS 71 Cb -0.01 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 2k4b h LYS 71 CO -0.05 0.86 0.04 1.79 -0.57 0.00 0.00 179.45 181.53 2k4b h THR 72 N 0.62 0.98 -0.15 -0.16 1.35 -1.55 -1.61 112.91 112.38 2k4b h THR 72 Ca 0.09 -0.03 -0.10 0.00 -0.55 0.00 0.00 66.41 65.82 2k4b h THR 72 Cb 0.70 0.87 0.00 0.00 -1.73 0.00 0.00 68.15 67.99 2k4b h THR 72 CO 0.05 0.02 -0.29 0.25 -0.25 0.00 0.00 175.52 175.31 2k4b h LEU 73 N 0.10 0.52 -0.36 3.87 6.46 -1.07 -2.30 115.31 122.53 2k4b h LEU 73 Ca 0.05 -0.55 0.08 0.00 -0.12 0.00 0.00 57.88 57.34 2k4b h LEU 73 Cb 0.02 -0.15 -0.08 0.00 -0.73 0.00 0.00 40.66 39.72 2k4b h LEU 73 CO -0.04 0.97 -0.21 -0.07 -0.62 0.00 0.00 178.44 178.46 2k4b h LEU 74 N 0.09 -0.70 -1.99 2.25 3.38 -0.86 0.19 115.31 117.66 2k4b h LEU 74 Ca 0.01 0.15 0.19 0.00 0.09 0.00 0.00 57.88 58.32 2k4b h LEU 74 Cb 0.87 0.36 -0.03 0.00 0.09 0.00 0.00 40.66 41.96 2k4b h LEU 74 CO 0.06 -0.24 0.50 1.23 0.09 0.00 0.00 178.44 180.09 2k4b h GLY 75 N -0.15 0.00 1.46 0.83 0.00 -0.84 0.14 103.07 104.51 2k4b h GLY 75 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.21 2k4b h GLY 75 CO -0.46 0.00 -1.34 3.21 0.00 0.00 0.00 176.54 177.96 2k4b h ARG 76 N 0.00 0.41 -0.27 4.80 3.08 -0.45 -3.09 114.38 118.86 2k4b h ARG 76 Ca 0.31 -0.68 -0.00 0.00 0.07 0.00 0.00 59.98 59.68 2k4b h ARG 76 Cb 1.32 0.25 -0.01 0.00 0.08 0.00 0.00 29.97 31.60 2k4b h ARG 76 CO -0.00 1.32 0.16 -0.07 -1.07 0.00 0.00 179.97 180.31 2k4b h LEU 77 N 0.12 0.32 -1.81 3.04 3.38 -0.03 -2.68 115.31 117.64 2k4b h LEU 77 Ca -0.19 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 2k4b h LEU 77 Cb 2.05 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 42.71 2k4b h LEU 77 CO 0.24 0.27 -0.13 -0.37 0.09 0.00 0.00 178.44 178.54 2k4b h VAL 78 N 0.34 0.97 0.00 1.22 -1.51 -0.93 -1.88 116.25 114.46 2k4b h VAL 78 Ca 0.10 -0.46 -0.00 0.00 -1.23 0.00 0.00 66.70 65.11 2k4b h VAL 78 Cb 0.01 1.25 -0.00 0.00 -2.13 0.00 0.00 31.29 30.42 2k4b h VAL 78 CO -0.02 0.13 -0.12 0.11 -1.23 0.00 0.00 177.57 176.44 2k4b h LYS 79 N 0.00 0.00 0.00 5.19 6.56 -1.46 -3.40 116.57 123.46 2k4b h LYS 79 Ca -0.00 0.00 -0.16 0.00 -1.06 0.00 0.00 60.65 59.43 2k4b h LYS 79 Cb 0.24 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.88 2k4b h LYS 79 CO 0.02 0.01 -1.05 1.17 -2.06 0.00 0.00 179.45 177.53 2k4b n LYS 80 N -3.06 0.53 0.00 3.15 4.81 -0.75 -5.05 118.16 117.79 2k4b n LYS 80 Ca 0.04 0.55 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 2k4b n LYS 80 Cb 0.54 -1.72 0.00 0.00 0.02 0.00 0.00 35.03 33.86 2k4b n LYS 80 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2k4b n GLU 81 N -4.49 0.00 -0.07 1.64 2.13 -0.96 -5.10 120.64 113.79 2k4b n GLU 81 Ca -0.25 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.55 2k4b n GLU 81 Cb 0.55 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.24 2k4b n GLU 81 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 2k4b n MET 82 N 0.00 -0.08 -4.05 5.31 2.81 -1.20 -4.74 117.12 115.18 2k4b n MET 82 Ca 0.00 0.41 -0.14 0.00 -1.81 0.00 0.00 57.70 56.16 2k4b n MET 82 Cb 0.00 -0.61 -0.03 0.00 -0.71 0.00 0.00 33.22 31.87 2k4b n MET 82 CO 0.00 0.00 0.00 -0.48 1.51 0.00 0.00 175.97 177.00 2k4b s LEU 83 N -6.90 0.89 0.31 4.03 2.34 -1.26 -4.86 118.68 113.22 2k4b s LEU 83 Ca -0.02 -1.45 0.04 0.00 0.06 0.00 0.00 54.13 52.76 2k4b s LEU 83 Cb 0.02 1.65 -0.03 0.00 -0.56 0.00 0.00 46.19 47.27 2k4b s LEU 83 CO 0.11 -1.36 0.19 -0.44 -1.06 0.00 0.00 176.35 173.80 2k4b s SER 84 N -3.22 1.50 -0.07 1.48 0.01 -0.54 -4.25 113.70 108.62 2k4b s SER 84 Ca 0.29 -1.62 -0.09 0.00 1.31 0.00 0.00 55.95 55.84 2k4b s SER 84 Cb -0.01 0.46 0.02 0.00 0.21 0.00 0.00 66.02 66.70 2k4b s SER 84 CO 0.19 -0.95 0.23 0.28 0.41 0.00 0.00 173.24 173.40 2k4b s THR 85 N -3.59 0.02 0.11 1.44 -1.32 -1.26 -1.24 115.64 109.80 2k4b s THR 85 Ca 0.37 -0.17 0.07 0.00 -1.21 0.00 0.00 61.69 60.75 2k4b s THR 85 Cb 0.04 -0.38 -0.04 0.00 -1.51 0.00 0.00 72.50 70.61 2k4b s THR 85 CO 0.20 -0.09 -0.17 -1.61 -2.21 0.00 0.00 174.62 170.73 2k4b s GLU 86 N -0.29 1.06 0.13 7.08 2.02 -0.45 -4.96 118.70 123.30 2k4b s GLU 86 Ca -0.04 -1.18 -0.30 0.00 0.02 0.00 0.00 54.97 53.47 2k4b s GLU 86 Cb -0.03 -1.15 -0.07 0.00 0.10 0.00 0.00 34.13 32.98 2k4b s GLU 86 CO 0.01 0.25 1.15 0.21 0.02 0.00 0.00 175.26 176.90 2k4b s LYS 87 N -2.20 4.51 -0.57 1.61 2.20 -1.26 -0.65 119.74 123.38 2k4b s LYS 87 Ca 0.07 1.76 0.04 0.00 -0.36 0.00 0.00 55.97 57.48 2k4b s LYS 87 Cb -0.08 -3.30 0.14 0.00 -1.51 0.00 0.00 37.83 33.08 2k4b s LYS 87 CO 0.04 -0.10 0.33 -1.21 -0.36 0.00 0.00 175.35 174.05 2k4b s GLU 88 N 0.28 2.05 0.00 4.03 0.41 -0.60 -4.94 118.70 119.93 2k4b s GLU 88 Ca 0.54 -2.78 0.00 0.00 -0.41 0.00 0.00 54.97 52.32 2k4b s GLU 88 Cb -0.30 -3.24 0.00 0.00 -1.78 0.00 0.00 34.13 28.81 2k4b s GLU 88 CO 0.33 -1.17 0.00 0.41 -0.49 0.00 0.00 175.26 174.34 2k4b n GLY 89 N 2.80 1.12 0.36 -1.39 0.00 -1.26 -3.59 105.19 103.23 2k4b n GLY 89 Ca 0.10 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2k4b n GLY 89 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2k4b n ARG 90 N 0.00 0.00 -2.58 1.61 1.85 -1.26 -5.10 116.66 111.18 2k4b n ARG 90 Ca 0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 56.62 2k4b n ARG 90 Cb 0.00 -0.68 0.09 0.00 -1.05 0.00 0.00 32.46 30.82 2k4b n ARG 90 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 2k4b s LYS 91 N -1.71 1.93 0.15 2.89 2.20 -1.24 -5.11 119.74 118.85 2k4b s LYS 91 Ca 0.00 -0.99 0.07 0.00 -0.36 0.00 0.00 55.97 54.69 2k4b s LYS 91 Cb 0.00 -2.37 -0.04 0.00 -1.51 0.00 0.00 37.83 33.91 2k4b s LYS 91 CO 0.00 -1.25 -0.03 -0.06 -0.36 0.00 0.00 175.35 173.65 2k4b s PHE 92 N -3.05 2.82 -0.26 4.03 0.40 -1.26 -1.56 117.98 119.10 2k4b s PHE 92 Ca 0.64 -0.13 0.02 0.00 -0.60 0.00 0.00 56.93 56.85 2k4b s PHE 92 Cb -0.07 -1.40 0.07 0.00 0.51 0.00 0.00 43.02 42.13 2k4b s PHE 92 CO 0.43 0.50 -0.05 0.08 0.70 0.00 0.00 175.22 176.88 2k4b s VAL 93 N -1.58 1.81 -0.21 -0.44 1.01 0.17 -2.71 120.40 118.47 2k4b s VAL 93 Ca 0.26 -1.54 -0.25 0.00 0.00 0.00 0.00 61.98 60.45 2k4b s VAL 93 Cb -0.10 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 2k4b s VAL 93 CO 0.17 -0.19 0.84 -0.31 0.00 0.00 0.00 175.10 175.61 2k4b s TYR 94 N 1.24 3.36 0.15 5.22 1.51 0.43 -1.34 117.35 127.91 2k4b s TYR 94 Ca -0.03 1.20 -0.15 0.00 -1.01 0.00 0.00 57.07 57.08 2k4b s TYR 94 Cb -0.19 -3.04 0.02 0.00 -0.11 0.00 0.00 41.96 38.64 2k4b s TYR 94 CO -0.07 -0.33 0.40 -0.98 -1.11 0.00 0.00 175.55 173.46 2k4b s ARG 95 N 2.55 1.15 0.97 -0.62 1.70 -0.37 -1.17 118.95 123.15 2k4b s ARG 95 Ca 0.37 -0.84 -0.12 0.00 -0.47 0.00 0.00 55.73 54.67 2k4b s ARG 95 Cb -0.16 0.46 0.17 0.00 -0.57 0.00 0.00 34.95 34.85 2k4b s ARG 95 CO 0.09 -0.45 1.08 -1.25 -1.08 0.00 0.00 175.30 173.70 2k4b s PRO 96 N -3.85 0.65 0.59 3.89 0.04 -1.26 -1.47 135.00 133.59 2k4b s PRO 96 Ca 0.07 0.81 -0.18 0.00 0.04 0.00 0.00 61.00 61.74 2k4b s PRO 96 Cb 0.02 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 32.78 2k4b s PRO 96 CO -0.08 -2.65 1.15 -0.51 0.04 0.00 0.00 177.00 174.95 2k4b s LEU 97 N -6.48 3.63 0.00 -3.56 2.01 -1.26 -4.76 118.68 108.26 2k4b s LEU 97 Ca 0.65 2.21 0.00 0.00 0.01 0.00 0.00 54.13 57.00 2k4b s LEU 97 Cb -0.20 -4.58 0.00 0.00 0.01 0.00 0.00 46.19 41.42 2k4b s LEU 97 CO 0.58 -1.46 0.00 0.80 1.01 0.00 0.00 176.35 177.28 2k4b n MET 98 N -1.68 0.00 0.00 1.70 0.00 -1.26 -5.12 117.12 110.76 2k4b n MET 98 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.82 2k4b n MET 98 Cb 0.51 -0.31 0.00 0.00 0.00 0.00 0.00 33.22 33.42 2k4b n MET 98 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12