#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 -0.14 -0.01 -2.13 3.84 -1.26 -5.20 114.94 110.04 2k4b s ASN 32 Ca 0.00 -0.32 -0.29 0.00 0.21 0.00 0.00 52.86 52.46 2k4b s ASN 32 Cb 0.00 0.39 0.08 0.00 -0.55 0.00 0.00 41.25 41.16 2k4b s ASN 32 CO 0.00 -0.71 0.69 0.68 -2.79 0.00 0.00 177.10 174.97 2k4b s VAL 33 N -3.02 0.00 0.33 -5.21 -7.23 -1.26 -5.21 120.40 98.81 2k4b s VAL 33 Ca 0.13 0.00 -0.15 0.00 -1.81 0.00 0.00 61.98 60.15 2k4b s VAL 33 Cb 0.01 -1.00 0.03 0.00 0.56 0.00 0.00 36.38 35.98 2k4b s VAL 33 CO 0.00 0.00 0.69 -0.94 -0.31 0.00 0.00 175.10 174.54 2k4b s SER 34 N -1.58 0.04 0.93 4.85 1.04 -1.26 -5.18 113.70 112.54 2k4b s SER 34 Ca -0.07 -1.01 0.00 0.00 0.48 0.00 0.00 55.95 55.35 2k4b s SER 34 Cb -0.00 0.76 0.00 0.00 0.10 0.00 0.00 66.02 66.88 2k4b s SER 34 CO 0.04 -1.47 0.00 -3.20 0.98 0.00 0.00 173.24 169.58 2k4b n ASN 35 N -1.00 -5.39 0.24 7.02 2.85 -1.26 -4.49 115.26 113.22 2k4b n ASN 35 Ca -0.05 0.00 -0.15 0.00 -0.11 0.00 0.00 54.58 54.27 2k4b n ASN 35 Cb 0.60 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.54 2k4b n ASN 35 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k4b h ALA 36 N -0.93 -0.59 -2.02 5.20 0.00 -2.04 -3.50 119.26 115.38 2k4b h ALA 36 Ca 0.00 -0.17 0.30 0.00 0.00 0.00 0.00 54.91 55.04 2k4b h ALA 36 Cb 0.00 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 2k4b h ALA 36 CO 0.00 -0.74 0.79 -0.85 0.00 0.00 0.00 179.25 178.45 2k4b n GLU 37 N -5.27 0.16 0.00 0.00 -0.00 -1.26 -5.06 120.64 109.20 2k4b n GLU 37 Ca -0.11 -0.67 0.00 0.00 -0.00 0.00 0.00 57.16 56.38 2k4b n GLU 37 Cb 0.29 1.11 0.00 0.00 -0.00 0.00 0.00 31.44 32.83 2k4b n GLU 37 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2k4b n LEU 38 N 0.00 1.06 -0.06 -1.84 7.99 -1.26 -4.86 117.00 118.03 2k4b n LEU 38 Ca 0.04 -1.06 -0.11 0.00 -0.01 0.00 0.00 56.01 54.87 2k4b n LEU 38 Cb 0.50 0.00 -0.05 0.00 -0.11 0.00 0.00 43.42 43.76 2k4b n LEU 38 CO 0.13 0.27 0.81 0.40 -1.51 0.00 0.00 177.39 177.49 2k4b h ILE 39 N 1.20 1.20 -0.76 -0.08 2.04 -2.00 -2.71 117.51 116.40 2k4b h ILE 39 Ca 0.00 -0.65 0.00 0.00 1.00 0.00 0.00 64.86 65.22 2k4b h ILE 39 Cb 0.66 1.27 -0.04 0.00 -0.74 0.00 0.00 36.82 37.98 2k4b h ILE 39 CO 0.00 0.20 0.49 -0.37 0.00 0.00 0.00 178.15 178.47 2k4b h VAL 40 N 0.12 1.20 0.00 1.67 -1.51 -1.99 -2.23 116.25 113.51 2k4b h VAL 40 Ca 0.06 -0.38 -0.03 0.00 -1.23 0.00 0.00 66.70 65.12 2k4b h VAL 40 Cb 0.26 0.09 -0.00 0.00 -2.13 0.00 0.00 31.29 29.51 2k4b h VAL 40 CO 0.00 0.20 -0.13 -0.03 -1.23 0.00 0.00 177.57 176.37 2k4b h MET 41 N 1.03 0.00 0.00 5.19 -1.53 -1.84 -3.25 114.93 114.53 2k4b h MET 41 Ca 0.28 0.00 -0.06 0.00 -3.44 0.00 0.00 59.70 56.47 2k4b h MET 41 Cb -0.10 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 30.94 2k4b h MET 41 CO -0.06 0.13 -0.76 0.54 0.14 0.00 0.00 176.91 176.91 2k4b n ARG 42 N -3.68 0.48 -0.35 0.39 1.74 -0.89 -4.14 116.66 110.22 2k4b n ARG 42 Ca -0.02 0.52 -0.02 0.00 -0.77 0.00 0.00 57.85 57.56 2k4b n ARG 42 Cb 0.25 -1.69 0.11 0.00 -1.02 0.00 0.00 32.46 30.11 2k4b n ARG 42 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 2k4b h VAL 43 N -1.00 1.21 -0.09 1.55 -1.51 -1.51 -2.22 116.25 112.68 2k4b h VAL 43 Ca -0.10 -0.43 -0.07 0.00 -1.23 0.00 0.00 66.70 64.87 2k4b h VAL 43 Cb 0.74 -0.15 0.00 0.00 -2.13 0.00 0.00 31.29 29.76 2k4b h VAL 43 CO -0.06 0.23 -0.22 0.40 -1.23 0.00 0.00 177.57 176.69 2k4b h ILE 44 N 1.25 1.40 -0.46 7.19 2.04 -1.83 -3.17 117.51 123.93 2k4b h ILE 44 Ca 0.36 -1.54 0.07 0.00 1.00 0.00 0.00 64.86 64.74 2k4b h ILE 44 Cb -0.09 2.17 -0.03 0.00 -0.74 0.00 0.00 36.82 38.14 2k4b h ILE 44 CO -0.09 0.44 0.31 -0.25 0.00 0.00 0.00 178.15 178.56 2k4b h TRP 45 N -0.15 0.33 0.02 1.37 2.91 -1.64 -2.98 115.95 115.82 2k4b h TRP 45 Ca -0.00 0.01 -0.26 0.00 1.13 0.00 0.00 58.89 59.76 2k4b h TRP 45 Cb 0.83 -0.11 0.02 0.00 -0.51 0.00 0.00 29.16 29.38 2k4b h TRP 45 CO 0.11 0.18 -1.06 1.03 -1.03 0.00 0.00 178.44 177.67 2k4b h SER 46 N 0.33 0.82 0.00 2.65 0.87 -1.39 -3.38 113.55 113.46 2k4b h SER 46 Ca 0.20 -0.67 -0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2k4b h SER 46 Cb 0.38 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 2k4b h SER 46 CO -0.05 1.48 -0.00 0.25 -0.53 0.00 0.00 176.83 177.98 2k4b h LEU 47 N 0.34 -0.00 0.00 2.23 6.46 -1.52 -3.50 115.31 119.31 2k4b h LEU 47 Ca -0.13 -0.81 0.00 0.00 -0.12 0.00 0.00 57.88 56.82 2k4b h LEU 47 Cb 1.71 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.64 2k4b h LEU 47 CO 0.20 0.82 0.00 0.61 -0.62 0.00 0.00 178.44 179.45 2k4b n GLY 48 N 1.14 2.31 3.02 3.75 0.00 -1.19 -4.97 105.19 109.24 2k4b n GLY 48 Ca -0.09 -0.75 -0.31 0.00 0.00 0.00 0.00 46.02 44.87 2k4b n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k4b s GLU 49 N 0.00 2.21 0.36 1.61 8.01 -1.26 -4.21 118.70 125.42 2k4b s GLU 49 Ca 0.00 -0.77 0.09 0.00 0.01 0.00 0.00 54.97 54.30 2k4b s GLU 49 Cb 0.00 -2.35 -0.07 0.00 -4.31 0.00 0.00 34.13 27.41 2k4b s GLU 49 CO 0.00 -0.35 -0.04 0.00 0.01 0.00 0.00 175.26 174.87 2k4b s ALA 50 N 1.40 3.07 0.44 5.21 0.00 -0.65 -4.96 121.76 126.27 2k4b s ALA 50 Ca 0.01 -2.12 0.07 0.00 0.00 0.00 0.00 51.96 49.92 2k4b s ALA 50 Cb -0.15 -0.07 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 2k4b s ALA 50 CO -0.09 0.03 0.28 -0.98 0.00 0.00 0.00 175.76 175.00 2k4b s ARG 51 N -3.66 2.34 0.27 0.00 3.03 -1.26 0.01 118.95 119.68 2k4b s ARG 51 Ca 0.34 -1.78 0.00 0.00 2.03 0.00 0.00 55.73 56.32 2k4b s ARG 51 Cb 0.04 -2.13 0.56 0.00 -1.03 0.00 0.00 34.95 32.39 2k4b s ARG 51 CO 0.18 -0.23 1.79 -0.24 -1.13 0.00 0.00 175.30 175.66 2k4b h VAL 52 N 1.17 0.79 0.00 4.99 3.04 -1.69 0.56 116.25 125.12 2k4b h VAL 52 Ca -0.41 -0.26 0.00 0.00 -1.01 0.00 0.00 66.70 65.02 2k4b h VAL 52 Cb 1.27 -0.03 0.00 0.00 -2.01 0.00 0.00 31.29 30.52 2k4b h VAL 52 CO 0.64 0.14 0.00 -2.24 -1.01 0.00 0.00 177.57 175.09 2k4b h ASP 53 N 0.75 0.00 0.04 3.17 2.03 -1.96 -3.17 116.42 117.28 2k4b h ASP 53 Ca 0.48 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.78 2k4b h ASP 53 Cb 0.63 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.13 2k4b h ASP 53 CO -0.33 0.00 -0.02 -0.08 -1.03 0.00 0.00 179.24 177.78 2k4b h GLU 54 N 0.00 -0.06 -0.85 4.15 4.22 -1.41 -3.29 114.58 117.35 2k4b h GLU 54 Ca 0.00 0.00 0.07 0.00 0.08 0.00 0.00 59.36 59.51 2k4b h GLU 54 Cb 0.55 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.75 2k4b h GLU 54 CO 0.00 0.38 0.52 -0.84 -2.18 0.00 0.00 179.01 176.88 2k4b h ILE 55 N -0.98 1.00 -0.42 2.32 3.07 -1.03 0.15 117.51 121.62 2k4b h ILE 55 Ca -0.01 -0.32 -0.03 0.00 1.55 0.00 0.00 64.86 66.06 2k4b h ILE 55 Cb 0.46 0.00 -0.02 0.00 -0.27 0.00 0.00 36.82 36.99 2k4b h ILE 55 CO 0.01 0.17 0.16 0.22 -1.05 0.00 0.00 178.15 177.65 2k4b h TYR 56 N 0.92 0.60 0.00 0.16 3.20 -1.76 -2.11 116.97 117.98 2k4b h TYR 56 Ca 0.38 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.21 2k4b h TYR 56 Cb 0.23 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.31 2k4b h TYR 56 CO -0.04 0.48 -0.06 0.00 -1.64 0.00 0.00 178.16 176.91 2k4b h ALA 57 N 1.58 1.36 -0.00 1.82 0.00 -0.77 -2.00 119.26 121.23 2k4b h ALA 57 Ca 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2k4b h ALA 57 Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2k4b h ALA 57 CO -0.01 0.07 -0.11 1.04 0.00 0.00 0.00 179.25 180.24 2k4b n GLN 58 N -3.67 0.76 -3.33 0.00 3.00 -0.80 -4.68 117.38 108.66 2k4b n GLN 58 Ca -0.02 -0.28 -0.46 0.00 -0.01 0.00 0.00 57.00 56.22 2k4b n GLN 58 Cb 0.16 -1.49 -0.04 0.00 0.00 0.00 0.00 30.24 28.87 2k4b n GLN 58 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2k4b s ILE 59 N -2.43 5.32 0.77 5.09 1.01 -0.75 -5.08 121.20 125.12 2k4b s ILE 59 Ca 0.30 -1.93 -0.11 0.00 0.00 0.00 0.00 60.65 58.91 2k4b s ILE 59 Cb 0.20 -4.36 0.05 0.00 0.01 0.00 0.00 42.46 38.36 2k4b s ILE 59 CO 0.47 -0.93 1.10 -2.16 0.00 0.00 0.00 174.94 173.41 2k4b s PRO 60 N 0.98 2.36 0.56 2.79 0.04 -1.26 -4.94 135.00 135.52 2k4b s PRO 60 Ca 0.09 0.59 0.33 0.00 0.04 0.00 0.00 61.00 62.05 2k4b s PRO 60 Cb -0.22 -1.95 1.48 0.00 0.04 0.00 0.00 34.50 33.85 2k4b s PRO 60 CO -0.02 -1.42 1.81 1.96 0.04 0.00 0.00 177.00 179.37 2k4b h GLN 61 N -0.94 0.00 -0.40 4.56 1.08 -1.98 -1.71 115.11 115.73 2k4b h GLN 61 Ca -0.46 0.00 0.12 0.00 -1.45 0.00 0.00 58.65 56.85 2k4b h GLN 61 Cb 1.26 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.68 2k4b h GLN 61 CO 0.61 0.00 0.40 1.49 -0.95 0.00 0.00 178.83 180.38 2k4b h GLU 62 N 0.00 0.00 0.00 1.46 4.81 -2.02 -1.57 114.58 117.26 2k4b h GLU 62 Ca 0.45 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.53 2k4b h GLU 62 Cb 1.93 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 31.28 2k4b h GLU 62 CO -0.00 0.00 -1.52 1.28 -0.73 0.00 0.00 179.01 178.03 2k4b n LEU 63 N -3.82 0.67 -0.36 1.64 4.77 -0.64 -5.02 117.00 114.24 2k4b n LEU 63 Ca 0.07 0.29 -0.05 0.00 -0.03 0.00 0.00 56.01 56.29 2k4b n LEU 63 Cb 0.58 0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.74 2k4b n LEU 63 CO 0.29 0.11 -0.04 -0.62 -1.33 0.00 0.00 177.39 175.80 2k4b n GLU 64 N -2.77 -0.69 -2.60 3.23 1.02 -0.59 -5.02 120.64 113.22 2k4b n GLU 64 Ca -0.10 0.53 -0.38 0.00 -0.02 0.00 0.00 57.16 57.19 2k4b n GLU 64 Cb 0.80 -4.27 -0.05 0.00 -0.02 0.00 0.00 31.44 27.89 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 -1.99 3.56 0.37 -0.32 0.52 -1.26 -5.08 118.94 114.73 2k4b s TRP 65 Ca 0.00 1.73 -0.13 0.00 0.02 0.00 0.00 56.10 57.72 2k4b s TRP 65 Cb 0.00 -3.11 -0.08 0.00 -1.15 0.00 0.00 33.47 29.13 2k4b s TRP 65 CO 0.00 -0.27 0.76 -1.12 0.02 0.00 0.00 176.95 176.34 2k4b s SER 66 N -1.32 6.65 0.35 2.95 0.01 -1.26 -5.01 113.70 116.07 2k4b s SER 66 Ca 0.50 1.22 0.03 0.00 1.31 0.00 0.00 55.95 59.00 2k4b s SER 66 Cb -0.25 -2.35 0.64 0.00 0.21 0.00 0.00 66.02 64.27 2k4b s SER 66 CO 0.31 -0.31 1.99 0.25 0.41 0.00 0.00 173.24 175.90 2k4b h LEU 67 N 1.75 0.74 -1.40 2.44 6.46 -2.00 -0.85 115.31 122.45 2k4b h LEU 67 Ca -0.47 -0.01 0.17 0.00 -0.12 0.00 0.00 57.88 57.44 2k4b h LEU 67 Cb 1.18 -0.18 -0.07 0.00 -0.73 0.00 0.00 40.66 40.86 2k4b h LEU 67 CO 0.65 0.52 0.58 0.00 -0.62 0.00 0.00 178.44 179.56 2k4b h ALA 68 N 1.59 2.02 0.75 1.25 0.00 -2.01 -3.19 119.26 119.67 2k4b h ALA 68 Ca 0.26 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 2k4b h ALA 68 Cb -0.02 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.71 2k4b h ALA 68 CO -0.07 -0.29 -0.36 1.15 0.00 0.00 0.00 179.25 179.69 2k4b h THR 69 N 0.54 0.22 -0.75 0.00 2.02 -1.54 -2.01 112.91 111.39 2k4b h THR 69 Ca 0.46 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.53 2k4b h THR 69 Cb 0.95 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.56 2k4b h THR 69 CO -0.20 0.01 0.42 1.62 0.37 0.00 0.00 175.52 177.74 2k4b h VAL 70 N -1.08 1.22 -0.35 3.16 3.04 -1.68 -1.19 116.25 119.37 2k4b h VAL 70 Ca -0.10 -0.53 -0.03 0.00 -1.01 0.00 0.00 66.70 65.03 2k4b h VAL 70 Cb 0.79 0.20 -0.02 0.00 -2.01 0.00 0.00 31.29 30.25 2k4b h VAL 70 CO 0.17 0.24 0.12 0.11 -1.01 0.00 0.00 177.57 177.20 2k4b h LYS 71 N 1.04 0.54 0.00 4.17 1.57 -1.60 0.19 116.57 122.49 2k4b h LYS 71 Ca 0.27 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 58.88 2k4b h LYS 71 Cb 0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2k4b h LYS 71 CO -0.04 0.56 -0.24 0.00 -0.57 0.00 0.00 179.45 179.15 2k4b h THR 72 N 0.42 0.91 0.00 -0.16 1.03 -0.81 -3.03 112.91 111.27 2k4b h THR 72 Ca 0.12 -0.92 -0.10 0.00 -0.01 0.00 0.00 66.41 65.50 2k4b h THR 72 Cb 0.23 1.54 0.01 0.00 -1.07 0.00 0.00 68.15 68.86 2k4b h THR 72 CO -0.01 0.24 -0.38 0.25 -0.01 0.00 0.00 175.52 175.61 2k4b h LEU 73 N 0.00 0.33 -0.32 0.00 6.46 -0.87 -3.29 115.31 117.62 2k4b h LEU 73 Ca -0.00 -0.78 0.07 0.00 -0.12 0.00 0.00 57.88 57.04 2k4b h LEU 73 Cb 0.52 -0.10 -0.08 0.00 -0.73 0.00 0.00 40.66 40.26 2k4b h LEU 73 CO 0.03 1.07 -0.31 -0.07 -0.62 0.00 0.00 178.44 178.54 2k4b h LEU 74 N -0.38 -1.02 -2.05 2.25 3.38 -0.91 0.08 115.31 116.67 2k4b h LEU 74 Ca -0.05 0.17 0.12 0.00 0.09 0.00 0.00 57.88 58.21 2k4b h LEU 74 Cb 1.13 0.47 -0.02 0.00 0.09 0.00 0.00 40.66 42.34 2k4b h LEU 74 CO 0.08 -0.32 0.36 1.23 0.09 0.00 0.00 178.44 179.88 2k4b h GLY 75 N -0.28 0.00 1.40 0.83 0.00 -1.64 0.20 103.07 103.58 2k4b h GLY 75 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.17 2k4b h GLY 75 CO -0.48 0.00 -1.40 3.21 0.00 0.00 0.00 176.54 177.87 2k4b h ARG 76 N 0.00 0.40 -0.05 4.80 3.08 -1.07 -2.68 114.38 118.86 2k4b h ARG 76 Ca 0.19 -0.68 -0.00 0.00 0.07 0.00 0.00 59.98 59.56 2k4b h ARG 76 Cb 0.91 0.25 -0.00 0.00 0.08 0.00 0.00 29.97 31.21 2k4b h ARG 76 CO -0.00 1.32 0.03 -0.07 -1.07 0.00 0.00 179.97 180.17 2k4b h LEU 77 N 0.11 0.06 -0.11 3.04 3.38 0.06 -3.16 115.31 118.69 2k4b h LEU 77 Ca -0.21 -0.08 -0.24 0.00 0.09 0.00 0.00 57.88 57.44 2k4b h LEU 77 Cb 2.07 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 42.82 2k4b h LEU 77 CO 0.23 0.13 -1.00 -0.37 0.09 0.00 0.00 178.44 177.52 2k4b h VAL 78 N -0.01 1.39 0.00 1.22 -1.51 -1.10 -1.23 116.25 115.01 2k4b h VAL 78 Ca 0.02 -2.47 -0.03 0.00 -1.23 0.00 0.00 66.70 62.99 2k4b h VAL 78 Cb 0.08 2.47 -0.00 0.00 -2.13 0.00 0.00 31.29 31.71 2k4b h VAL 78 CO -0.00 0.74 -0.13 0.50 -1.23 0.00 0.00 177.57 177.45 2k4b h LYS 79 N 0.24 0.00 -0.67 5.19 1.63 -1.60 -1.36 116.57 120.00 2k4b h LYS 79 Ca -0.10 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.70 2k4b h LYS 79 Cb 1.64 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.27 2k4b h LYS 79 CO 0.18 0.13 0.00 1.17 -3.45 0.00 0.00 179.45 177.48 2k4b n LYS 80 N -4.03 3.27 -3.02 1.90 4.81 -1.09 -4.96 118.16 115.04 2k4b n LYS 80 Ca -0.02 -2.02 -0.18 0.00 -0.87 0.00 0.00 58.31 55.21 2k4b n LYS 80 Cb 0.21 -1.87 -0.01 0.00 0.02 0.00 0.00 35.03 33.39 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 0.54 -2.96 0.06 1.64 2.13 -0.51 -4.85 120.64 116.68 2k4b n GLU 81 Ca 0.18 0.47 -0.21 0.00 0.66 0.00 0.00 57.16 58.26 2k4b n GLU 81 Cb 0.78 -5.12 -0.15 0.00 0.27 0.00 0.00 31.44 27.22 2k4b n GLU 81 CO 0.00 0.00 0.00 0.52 -0.41 0.00 0.00 177.13 177.24 2k4b h MET 82 N -0.59 0.34 -6.21 5.31 2.86 -1.47 -3.48 114.93 111.69 2k4b h MET 82 Ca -0.35 -0.58 -0.59 0.00 -2.06 0.00 0.00 59.70 56.13 2k4b h MET 82 Cb 1.24 0.22 -0.12 0.00 0.06 0.00 0.00 31.60 33.00 2k4b h MET 82 CO 0.43 1.24 -0.70 -0.51 1.06 0.00 0.00 176.91 178.42 2k4b s LEU 83 N -7.16 2.88 0.25 1.22 1.43 -1.25 -4.61 118.68 111.43 2k4b s LEU 83 Ca -0.14 -0.84 0.08 0.00 -1.03 0.00 0.00 54.13 52.20 2k4b s LEU 83 Cb 0.06 -1.40 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 2k4b s LEU 83 CO 0.85 0.02 0.09 -0.44 0.23 0.00 0.00 176.35 177.10 2k4b s SER 84 N -3.58 5.03 -0.02 2.29 0.01 -0.48 -4.46 113.70 112.49 2k4b s SER 84 Ca 0.31 -0.43 -0.29 0.00 1.31 0.00 0.00 55.95 56.84 2k4b s SER 84 Cb -0.06 -1.13 0.07 0.00 0.21 0.00 0.00 66.02 65.11 2k4b s SER 84 CO 0.17 -0.00 0.66 0.28 0.41 0.00 0.00 173.24 174.75 2k4b s THR 85 N -2.16 0.00 0.08 1.44 -1.32 -1.26 -1.07 115.64 111.34 2k4b s THR 85 Ca 0.32 -0.02 0.03 0.00 -1.21 0.00 0.00 61.69 60.80 2k4b s THR 85 Cb -0.07 -0.99 -0.03 0.00 -1.51 0.00 0.00 72.50 69.89 2k4b s THR 85 CO 0.22 -0.01 -0.09 -1.61 -2.21 0.00 0.00 174.62 170.92 2k4b s GLU 86 N -1.51 0.73 -0.02 7.08 2.02 -0.35 -4.99 118.70 121.66 2k4b s GLU 86 Ca -0.10 -1.03 -0.27 0.00 0.02 0.00 0.00 54.97 53.59 2k4b s GLU 86 Cb -0.00 -0.40 -0.03 0.00 0.10 0.00 0.00 34.13 33.80 2k4b s GLU 86 CO 0.07 0.06 0.86 0.21 0.02 0.00 0.00 175.26 176.48 2k4b s LYS 87 N -2.49 4.52 -0.83 1.61 2.20 -1.26 -0.37 119.74 123.11 2k4b s LYS 87 Ca 0.01 1.20 0.01 0.00 -0.36 0.00 0.00 55.97 56.83 2k4b s LYS 87 Cb -0.04 -3.45 0.26 0.00 -1.51 0.00 0.00 37.83 33.09 2k4b s LYS 87 CO -0.01 0.02 0.98 0.39 -0.36 0.00 0.00 175.35 176.38 2k4b n GLU 88 N 3.75 3.15 0.00 4.03 -0.58 -0.38 -4.92 120.64 125.69 2k4b n GLU 88 Ca 0.03 -4.60 0.00 0.00 -0.42 0.00 0.00 57.16 52.17 2k4b n GLU 88 Cb 0.51 -2.37 0.00 0.00 -0.57 0.00 0.00 31.44 29.01 2k4b n GLU 88 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k4b n GLY 89 N 1.28 0.12 0.01 0.62 0.00 -1.26 -1.59 105.19 104.36 2k4b n GLY 89 Ca 0.27 0.58 0.08 0.00 0.00 0.00 0.00 46.02 46.95 2k4b n GLY 89 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2k4b n ARG 90 N 0.00 0.69 -3.78 1.61 0.00 -1.26 -5.00 116.66 108.93 2k4b n ARG 90 Ca 0.00 -0.12 -0.24 0.00 -0.00 0.00 0.00 57.85 57.49 2k4b n ARG 90 Cb 0.00 -1.35 -0.02 0.00 0.00 0.00 0.00 32.46 31.10 2k4b n ARG 90 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 2k4b s LYS 91 N -2.98 2.33 -0.07 -0.14 2.47 -0.62 -5.15 119.74 115.58 2k4b s LYS 91 Ca -0.04 -1.84 0.00 0.00 -1.56 0.00 0.00 55.97 52.53 2k4b s LYS 91 Cb 0.10 -2.19 0.02 0.00 -1.46 0.00 0.00 37.83 34.30 2k4b s LYS 91 CO 0.64 -0.45 -0.04 -0.06 0.16 0.00 0.00 175.35 175.60 2k4b s PHE 92 N -2.66 0.93 -0.03 4.03 0.40 -1.26 -1.25 117.98 118.13 2k4b s PHE 92 Ca 0.40 -0.33 -0.03 0.00 -0.60 0.00 0.00 56.93 56.37 2k4b s PHE 92 Cb -0.02 -0.86 -0.04 0.00 0.51 0.00 0.00 43.02 42.61 2k4b s PHE 92 CO 0.24 -0.31 0.16 0.08 0.70 0.00 0.00 175.22 176.09 2k4b s VAL 93 N 1.41 5.34 -0.13 -0.44 1.01 0.50 -1.66 120.40 126.44 2k4b s VAL 93 Ca -0.03 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 61.85 2k4b s VAL 93 Cb -0.13 -3.45 0.02 0.00 0.00 0.00 0.00 36.38 32.81 2k4b s VAL 93 CO -0.03 0.40 -0.16 -0.31 0.00 0.00 0.00 175.10 174.99 2k4b s TYR 94 N -1.24 2.18 0.26 5.22 2.02 0.10 -1.21 117.35 124.68 2k4b s TYR 94 Ca 0.24 -1.09 0.12 0.00 -0.37 0.00 0.00 57.07 55.96 2k4b s TYR 94 Cb -0.12 -1.55 -0.05 0.00 -0.40 0.00 0.00 41.96 39.84 2k4b s TYR 94 CO 0.15 -0.55 -0.21 1.03 -1.57 0.00 0.00 175.55 174.39 2k4b s ARG 95 N 1.07 1.64 0.50 -0.62 0.52 -0.23 -1.64 118.95 120.19 2k4b s ARG 95 Ca -0.04 -1.71 -0.08 0.00 -0.52 0.00 0.00 55.73 53.38 2k4b s ARG 95 Cb -0.15 -1.79 0.12 0.00 0.52 0.00 0.00 34.95 33.66 2k4b s ARG 95 CO -0.04 0.35 0.45 -0.35 0.02 0.00 0.00 175.30 175.73 2k4b n PRO 96 N -0.40 -1.84 -3.75 3.54 -0.04 -1.26 -1.38 135.00 129.88 2k4b n PRO 96 Ca -0.07 -0.72 -0.21 0.00 -0.04 0.00 0.00 63.50 62.46 2k4b n PRO 96 Cb 0.59 -0.67 -0.04 0.00 -0.04 0.00 0.00 33.50 33.34 2k4b n PRO 96 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2k4b s LEU 97 N 0.00 3.44 -0.23 1.53 2.01 -1.26 -4.11 118.68 120.05 2k4b s LEU 97 Ca 0.29 -0.67 -0.28 0.00 0.01 0.00 0.00 54.13 53.48 2k4b s LEU 97 Cb -0.03 -2.05 0.01 0.00 0.01 0.00 0.00 46.19 44.13 2k4b s LEU 97 CO 0.22 -0.49 0.99 -0.32 1.01 0.00 0.00 176.35 177.76 2k4b s MET 98 N -4.04 4.24 0.00 1.70 0.00 -1.26 -5.11 119.30 114.84 2k4b s MET 98 Ca 0.44 1.25 0.00 0.00 0.00 0.00 0.00 55.69 57.38 2k4b s MET 98 Cb -0.04 -3.64 0.00 0.00 0.00 0.00 0.00 34.83 31.15 2k4b s MET 98 CO 0.26 -0.61 0.00 -1.91 0.00 0.00 0.00 175.02 172.77