#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c3k s THR 8 N 0.00 4.53 0.77 3.15 -1.32 -1.26 -5.02 115.64 116.49 3c3k s THR 8 Ca 0.00 1.83 -0.06 0.00 -1.21 0.00 0.00 61.69 62.25 3c3k s THR 8 Cb 0.00 -4.18 0.16 0.00 -1.51 0.00 0.00 72.50 66.98 3c3k s THR 8 CO 0.00 -0.01 1.05 0.61 -2.21 0.00 0.00 174.62 174.06 3c3k n GLY 9 N 3.24 -0.19 3.16 6.08 0.00 -0.69 -4.93 105.19 111.86 3c3k n GLY 9 Ca 0.10 -1.90 -0.18 0.00 0.00 0.00 0.00 46.02 44.04 3c3k n GLY 9 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3c3k s MET 10 N -5.23 0.80 -0.03 1.61 -1.94 -1.26 -1.89 119.30 111.37 3c3k s MET 10 Ca 0.65 -0.92 0.05 0.00 -1.71 0.00 0.00 55.69 53.75 3c3k s MET 10 Cb -0.03 -0.79 -0.03 0.00 2.01 0.00 0.00 34.83 35.99 3c3k s MET 10 CO 0.44 0.18 -0.16 -0.51 -0.01 0.00 0.00 175.02 174.96 3c3k s LEU 11 N -1.67 2.68 -0.20 -0.03 1.43 -0.29 -0.48 118.68 120.10 3c3k s LEU 11 Ca -0.02 -0.26 -0.21 0.00 -1.03 0.00 0.00 54.13 52.61 3c3k s LEU 11 Cb -0.10 -1.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.55 3c3k s LEU 11 CO 0.02 0.32 0.64 -0.22 0.23 0.00 0.00 176.35 177.35 3c3k s LEU 12 N -0.90 4.14 -0.21 1.79 2.96 -0.71 -0.21 118.68 125.53 3c3k s LEU 12 Ca 0.12 0.84 -0.07 0.00 -0.22 0.00 0.00 54.13 54.81 3c3k s LEU 12 Cb -0.11 -2.91 -0.03 0.00 0.50 0.00 0.00 46.19 43.64 3c3k s LEU 12 CO 0.02 -0.29 0.05 -0.69 -1.32 0.00 0.00 176.35 174.12 3c3k s VAL 13 N 2.00 4.44 -0.48 1.68 1.01 0.83 -0.87 120.40 129.00 3c3k s VAL 13 Ca 0.29 -0.14 -0.17 0.00 0.00 0.00 0.00 61.98 61.96 3c3k s VAL 13 Cb -0.16 -3.03 0.07 0.00 0.00 0.00 0.00 36.38 33.26 3c3k s VAL 13 CO 0.10 0.40 0.47 -0.04 0.00 0.00 0.00 175.10 176.03 3c3k s MET 14 N 1.01 3.03 -0.04 2.72 -1.94 0.09 -0.66 119.30 123.51 3c3k s MET 14 Ca 0.04 -1.17 -0.16 0.00 -1.71 0.00 0.00 55.69 52.68 3c3k s MET 14 Cb -0.14 -4.11 -0.05 0.00 2.01 0.00 0.00 34.83 32.53 3c3k s MET 14 CO 0.03 -1.08 0.44 0.08 -0.01 0.00 0.00 175.02 174.48 3c3k s VAL 15 N 1.98 5.06 0.18 -6.03 1.01 0.33 -0.54 120.40 122.39 3c3k s VAL 15 Ca 0.08 0.90 -0.03 0.00 0.00 0.00 0.00 61.98 62.93 3c3k s VAL 15 Cb -0.22 -3.76 -0.08 0.00 0.00 0.00 0.00 36.38 32.32 3c3k s VAL 15 CO 0.09 0.49 1.47 0.77 0.00 0.00 0.00 175.10 177.91 3c3k h SER 16 N 5.42 0.59 -1.11 3.32 4.64 -1.87 -1.95 113.55 122.59 3c3k h SER 16 Ca -0.47 -0.34 0.12 0.00 -0.47 0.00 0.00 61.79 60.62 3c3k h SER 16 Cb 1.20 -0.17 -0.21 0.00 -0.31 0.00 0.00 62.40 62.91 3c3k h SER 16 CO 0.67 1.07 -0.14 0.21 -0.87 0.00 0.00 176.83 177.76 3c3k s ASN 17 N -6.95 -1.14 0.57 4.97 3.84 -1.26 -3.48 114.94 111.48 3c3k s ASN 17 Ca -0.07 0.93 0.35 0.00 0.21 0.00 0.00 52.86 54.28 3c3k s ASN 17 Cb 0.11 2.05 1.65 0.00 -0.55 0.00 0.00 41.25 44.50 3c3k s ASN 17 CO 0.84 -0.21 2.10 -0.29 -2.79 0.00 0.00 177.10 176.75 3c3k h ILE 18 N 5.86 0.16 -0.00 -5.21 2.10 -1.95 -0.65 117.51 117.82 3c3k h ILE 18 Ca -0.20 -0.42 0.00 0.00 1.08 0.00 0.00 64.86 65.32 3c3k h ILE 18 Cb 1.15 1.36 0.00 0.00 -1.09 0.00 0.00 36.82 38.23 3c3k h ILE 18 CO 0.16 0.04 -0.14 0.00 -1.08 0.00 0.00 178.15 177.14 3c3k n ALA 19 N -2.14 2.71 -2.60 0.18 0.00 -1.26 -4.75 120.51 112.65 3c3k n ALA 19 Ca -0.01 -0.20 -0.43 0.00 0.00 0.00 0.00 53.44 52.80 3c3k n ALA 19 Cb 0.24 -1.36 -0.02 0.00 0.00 0.00 0.00 19.45 18.30 3c3k n ALA 19 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3c3k s ASN 20 N -2.84 6.85 0.67 0.00 2.47 -0.25 -4.92 114.94 116.92 3c3k s ASN 20 Ca 0.18 0.98 0.42 0.00 0.42 0.00 0.00 52.86 54.86 3c3k s ASN 20 Cb 0.19 -2.54 2.29 0.00 -1.45 0.00 0.00 41.25 39.73 3c3k s ASN 20 CO 0.55 -0.97 2.29 1.55 -3.72 0.00 0.00 177.10 176.80 3c3k h PRO 21 N 8.43 0.00 -0.41 0.43 0.13 -1.86 -0.43 132.00 138.29 3c3k h PRO 21 Ca -0.22 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.85 3c3k h PRO 21 Cb 1.07 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.18 3c3k h PRO 21 CO 1.05 0.00 0.01 0.35 -0.23 0.00 0.00 178.00 179.18 3c3k h PHE 22 N 0.00 0.78 -0.58 1.56 3.57 -1.92 -2.37 116.94 117.98 3c3k h PHE 22 Ca 0.00 -0.13 0.05 0.00 3.53 0.00 0.00 57.97 61.42 3c3k h PHE 22 Cb 0.13 -0.21 -0.05 0.00 2.79 0.00 0.00 35.95 38.62 3c3k h PHE 22 CO 0.00 0.78 0.31 0.00 -2.23 0.00 0.00 178.31 177.17 3c3k h ALA 24 N 1.31 1.34 -0.39 0.00 0.00 -1.39 0.13 119.26 120.25 3c3k h ALA 24 Ca 0.26 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 3c3k h ALA 24 Cb 0.16 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3c3k h ALA 24 CO -0.17 0.56 -0.25 0.00 0.00 0.00 0.00 179.25 179.39 3c3k h ALA 25 N 1.43 0.56 -0.32 0.00 0.00 -0.94 -1.21 119.26 118.79 3c3k h ALA 25 Ca 0.27 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 3c3k h ALA 25 Cb -0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3c3k h ALA 25 CO -0.05 0.56 -0.01 0.28 0.00 0.00 0.00 179.25 180.03 3c3k h VAL 26 N 0.67 1.26 -0.82 0.00 2.07 -0.35 -2.98 116.25 116.11 3c3k h VAL 26 Ca 0.08 -0.98 0.13 0.00 0.82 0.00 0.00 66.70 66.74 3c3k h VAL 26 Cb 0.82 1.28 -0.09 0.00 -1.52 0.00 0.00 31.29 31.78 3c3k h VAL 26 CO 0.07 0.32 0.43 0.58 0.02 0.00 0.00 177.57 178.98 3c3k h VAL 27 N 0.36 0.79 -0.66 2.57 2.07 -0.73 -0.25 116.25 120.39 3c3k h VAL 27 Ca 0.09 -0.22 0.11 0.00 0.82 0.00 0.00 66.70 67.49 3c3k h VAL 27 Cb 0.46 0.08 -0.08 0.00 -1.52 0.00 0.00 31.29 30.23 3c3k h VAL 27 CO 0.02 0.12 0.27 0.50 0.02 0.00 0.00 177.57 178.50 3c3k h LYS 28 N 0.65 0.44 -0.25 1.57 3.64 -1.07 -0.23 116.57 121.33 3c3k h LYS 28 Ca 0.43 -0.03 -0.17 0.00 -1.27 0.00 0.00 60.65 59.61 3c3k h LYS 28 Cb 0.54 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 3c3k h LYS 28 CO -0.32 0.29 -0.54 0.78 -2.27 0.00 0.00 179.45 177.39 3c3k h GLY 29 N 0.45 0.81 0.36 5.01 0.00 -1.19 -1.97 103.07 106.53 3c3k h GLY 29 Ca 0.34 -0.93 0.05 0.00 0.00 0.00 0.00 47.33 46.78 3c3k h GLY 29 CO -0.32 0.84 -0.20 -2.22 0.00 0.00 0.00 176.54 174.63 3c3k h ILE 30 N 0.57 0.49 -0.79 2.60 2.04 -0.51 -2.38 117.51 119.52 3c3k h ILE 30 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 3c3k h ILE 30 Cb 1.12 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 3c3k h ILE 30 CO 0.11 0.00 0.43 -0.33 0.00 0.00 0.00 178.15 178.37 3c3k h GLU 31 N -0.26 1.09 -0.01 2.37 5.08 -0.89 0.48 114.58 122.45 3c3k h GLU 31 Ca 0.10 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3c3k h GLU 31 Cb 0.40 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 3c3k h GLU 31 CO -0.28 0.80 0.00 0.87 -1.00 0.00 0.00 179.01 179.40 3c3k h LYS 32 N 1.10 0.01 -0.28 2.33 1.57 -1.00 -1.20 116.57 119.10 3c3k h LYS 32 Ca 0.28 -0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.92 3c3k h LYS 32 Cb 0.02 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3c3k h LYS 32 CO -0.05 0.14 -0.35 1.15 -0.57 0.00 0.00 179.45 179.77 3c3k h THR 33 N -0.12 1.30 -0.76 -0.16 2.02 -1.13 -3.23 112.91 110.84 3c3k h THR 33 Ca 0.00 -1.54 -0.01 0.00 0.77 0.00 0.00 66.41 65.64 3c3k h THR 33 Cb 0.13 1.62 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 3c3k h THR 33 CO -0.00 0.49 0.44 0.00 0.37 0.00 0.00 175.52 176.83 3c3k h ALA 34 N 0.69 0.97 0.00 6.16 0.00 -0.83 -2.97 119.26 123.28 3c3k h ALA 34 Ca 0.04 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3c3k h ALA 34 Cb 0.94 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3c3k h ALA 34 CO 0.08 0.45 0.00 0.39 0.00 0.00 0.00 179.25 180.18 3c3k n GLU 35 N -4.48 0.09 0.04 0.00 1.02 -0.46 -1.31 120.64 115.54 3c3k n GLU 35 Ca 0.07 0.08 0.13 0.00 -0.02 0.00 0.00 57.16 57.42 3c3k n GLU 35 Cb 0.07 -1.61 0.44 0.00 -0.02 0.00 0.00 31.44 30.32 3c3k n GLU 35 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3c3k n LYS 36 N -1.77 0.13 -0.18 3.49 4.76 -1.13 -3.93 118.16 119.53 3c3k n LYS 36 Ca 0.06 0.08 0.06 0.00 -2.87 0.00 0.00 58.31 55.65 3c3k n LYS 36 Cb 0.37 -1.63 0.14 0.00 -1.84 0.00 0.00 35.03 32.07 3c3k n LYS 36 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3c3k n ASN 37 N -1.84 2.82 0.00 4.39 3.02 -0.43 -4.98 115.26 118.25 3c3k n ASN 37 Ca 0.06 -2.54 0.00 0.00 -0.03 0.00 0.00 54.58 52.07 3c3k n ASN 37 Cb 0.38 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.24 3c3k n ASN 37 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3c3k n GLY 38 N -0.49 0.68 3.27 7.41 0.00 -1.10 -4.99 105.19 109.98 3c3k n GLY 38 Ca 0.13 -0.72 -0.26 0.00 0.00 0.00 0.00 46.02 45.17 3c3k n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3c3k s TYR 39 N -2.00 1.86 0.40 1.61 2.02 -0.68 -1.70 117.35 118.86 3c3k s TYR 39 Ca 0.00 -0.39 0.08 0.00 -0.37 0.00 0.00 57.07 56.39 3c3k s TYR 39 Cb 0.00 -1.08 -0.04 0.00 -0.40 0.00 0.00 41.96 40.44 3c3k s TYR 39 CO 0.00 0.13 0.26 1.03 -1.57 0.00 0.00 175.55 175.40 3c3k s ARG 40 N -1.38 2.38 -0.10 -0.62 1.81 -0.79 -3.10 118.95 117.16 3c3k s ARG 40 Ca 0.08 -1.67 0.04 0.00 -1.72 0.00 0.00 55.73 52.46 3c3k s ARG 40 Cb -0.09 -2.18 -0.00 0.00 -0.45 0.00 0.00 34.95 32.22 3c3k s ARG 40 CO 0.02 -0.12 -0.24 0.42 -0.68 0.00 0.00 175.30 174.71 3c3k s ILE 41 N -2.52 2.09 -0.09 1.52 -1.09 -1.26 -1.14 121.20 118.70 3c3k s ILE 41 Ca 0.44 -1.01 -0.00 0.00 -2.23 0.00 0.00 60.65 57.84 3c3k s ILE 41 Cb -0.00 -1.79 -0.03 0.00 -1.58 0.00 0.00 42.46 39.06 3c3k s ILE 41 CO 0.25 0.56 -0.06 -0.76 -1.23 0.00 0.00 174.94 173.70 3c3k s LEU 42 N 0.30 3.20 0.12 2.97 1.43 0.71 -4.94 118.68 122.47 3c3k s LEU 42 Ca -0.17 -0.05 0.04 0.00 -1.03 0.00 0.00 54.13 52.92 3c3k s LEU 42 Cb -0.18 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.29 3c3k s LEU 42 CO 0.08 0.31 0.10 -0.76 0.23 0.00 0.00 176.35 176.32 3c3k s LEU 43 N -0.50 3.77 -0.04 1.79 1.43 -1.26 -0.12 118.68 123.75 3c3k s LEU 43 Ca 0.08 -0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.09 3c3k s LEU 43 Cb -0.12 -2.42 0.02 0.00 0.03 0.00 0.00 46.19 43.71 3c3k s LEU 43 CO 0.02 0.12 -0.02 0.00 0.23 0.00 0.00 176.35 176.70 3c3k s ASN 45 N 1.03 6.96 0.04 0.00 2.47 -1.26 -0.52 114.94 123.66 3c3k s ASN 45 Ca -0.10 -2.75 -0.05 0.00 0.42 0.00 0.00 52.86 50.38 3c3k s ASN 45 Cb -0.14 -2.42 -0.29 0.00 -1.45 0.00 0.00 41.25 36.95 3c3k s ASN 45 CO -0.01 -0.86 1.01 0.71 -3.72 0.00 0.00 177.10 174.23 3c3k h THR 46 N 4.99 1.33 -6.50 -5.21 1.35 -1.67 -3.48 112.91 103.73 3c3k h THR 46 Ca 0.30 -2.91 -0.51 0.00 -0.55 0.00 0.00 66.41 62.74 3c3k h THR 46 Cb 0.90 2.89 -0.12 0.00 -1.73 0.00 0.00 68.15 70.09 3c3k h THR 46 CO 1.24 0.85 -0.79 -0.62 -0.25 0.00 0.00 175.52 175.96 3c3k n GLU 47 N -3.53 -4.42 -3.48 4.72 1.02 -0.97 -1.32 120.64 112.67 3c3k n GLU 47 Ca -0.13 0.49 -0.25 0.00 -0.02 0.00 0.00 57.16 57.26 3c3k n GLU 47 Cb 1.04 -5.32 -0.01 0.00 -0.02 0.00 0.00 31.44 27.14 3c3k n GLU 47 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3c3k n SER 48 N -2.74 -3.68 -4.54 1.62 7.64 -1.26 -4.93 113.62 105.73 3c3k n SER 48 Ca 0.06 -0.47 -0.40 0.00 1.01 0.00 0.00 58.87 59.07 3c3k n SER 48 Cb 0.51 -3.04 -0.11 0.00 -1.01 0.00 0.00 64.21 60.56 3c3k n SER 48 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3c3k s ASP 49 N -2.80 6.06 0.33 6.43 -1.08 -0.43 -4.96 116.67 120.22 3c3k s ASP 49 Ca 0.45 -0.35 0.07 0.00 -0.52 0.00 0.00 52.55 52.19 3c3k s ASP 49 Cb -0.24 -2.14 0.59 0.00 -1.46 0.00 0.00 42.92 39.67 3c3k s ASP 49 CO 0.55 -0.21 1.81 0.25 0.52 0.00 0.00 175.17 178.09 3c3k h LEU 50 N 8.48 0.31 -0.27 -1.34 5.85 -1.91 -1.27 115.31 125.16 3c3k h LEU 50 Ca -0.32 -0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.23 3c3k h LEU 50 Cb 1.16 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 3c3k h LEU 50 CO 0.62 0.55 -0.16 0.00 -0.34 0.00 0.00 178.44 179.11 3c3k h ALA 51 N 1.48 0.38 -0.59 1.25 0.00 -1.95 -0.05 119.26 119.78 3c3k h ALA 51 Ca 0.05 -0.33 0.03 0.00 0.00 0.00 0.00 54.91 54.66 3c3k h ALA 51 Cb 0.56 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3c3k h ALA 51 CO 0.04 0.29 0.35 0.00 0.00 0.00 0.00 179.25 179.92 3c3k h ARG 52 N 0.32 0.66 -0.03 0.00 3.08 -1.74 -2.33 114.38 114.34 3c3k h ARG 52 Ca 0.06 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 3c3k h ARG 52 Cb 0.69 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.59 3c3k h ARG 52 CO 0.05 0.44 0.02 0.77 -1.07 0.00 0.00 179.97 180.17 3c3k h SER 53 N 0.68 0.04 -0.95 7.04 0.02 -0.93 -1.69 113.55 117.76 3c3k h SER 53 Ca 0.24 -0.09 0.09 0.00 -0.84 0.00 0.00 61.79 61.19 3c3k h SER 53 Cb 0.05 -0.01 -0.07 0.00 0.14 0.00 0.00 62.40 62.51 3c3k h SER 53 CO -0.12 0.12 0.61 0.03 -1.14 0.00 0.00 176.83 176.33 3c3k h ARG 54 N -0.04 0.99 -0.20 3.45 3.08 -0.96 -1.78 114.38 118.92 3c3k h ARG 54 Ca 0.01 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 59.92 3c3k h ARG 54 Cb 0.08 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 29.91 3c3k h ARG 54 CO -0.00 0.66 -0.18 1.03 -1.07 0.00 0.00 179.97 180.41 3c3k h SER 55 N 1.02 0.51 1.38 7.04 0.87 -1.01 -2.91 113.55 120.45 3c3k h SER 55 Ca 0.43 -0.46 -0.00 0.00 -1.23 0.00 0.00 61.79 60.53 3c3k h SER 55 Cb 0.32 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.14 3c3k h SER 55 CO -0.19 0.87 -0.00 0.00 -0.53 0.00 0.00 176.83 176.97 3c3k n LEU 57 N -3.10 0.00 0.33 0.00 4.77 -0.70 -2.21 117.00 116.09 3c3k n LEU 57 Ca 0.02 0.49 0.22 0.00 -0.03 0.00 0.00 56.01 56.71 3c3k n LEU 57 Cb 0.39 -0.49 1.18 0.00 -2.33 0.00 0.00 43.42 42.17 3c3k n LEU 57 CO 0.30 -0.15 1.17 0.71 -1.33 0.00 0.00 177.39 178.09 3c3k h THR 58 N 0.00 0.03 -0.13 -5.08 1.35 -1.45 -1.82 112.91 105.82 3c3k h THR 58 Ca 0.00 -0.03 -0.03 0.00 -0.55 0.00 0.00 66.41 65.80 3c3k h THR 58 Cb 0.34 1.03 -0.01 0.00 -1.73 0.00 0.00 68.15 67.79 3c3k h THR 58 CO 0.00 0.00 -0.05 -0.07 -0.25 0.00 0.00 175.52 175.15 3c3k h LEU 59 N 0.00 0.17 0.28 3.87 3.38 -1.67 0.52 115.31 121.86 3c3k h LEU 59 Ca -0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3c3k h LEU 59 Cb 0.03 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3c3k h LEU 59 CO 0.00 0.25 -0.13 -0.07 0.09 0.00 0.00 178.44 178.58 3c3k h LEU 60 N 0.18 -0.32 -0.51 1.67 3.38 -1.56 0.27 115.31 118.43 3c3k h LEU 60 Ca 0.04 -0.18 0.10 0.00 0.09 0.00 0.00 57.88 57.93 3c3k h LEU 60 Cb 0.22 0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.97 3c3k h LEU 60 CO 0.01 0.17 0.03 0.77 0.09 0.00 0.00 178.44 179.51 3c3k h SER 61 N -0.97 -0.16 0.00 -0.43 4.64 -1.54 0.20 113.55 115.29 3c3k h SER 61 Ca -0.04 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3c3k h SER 61 Cb 0.48 0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 3c3k h SER 61 CO 0.06 -0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 3c3k n GLY 62 N -1.31 -0.50 2.44 -0.77 0.00 0.18 -4.87 105.19 100.36 3c3k n GLY 62 Ca 0.06 -0.07 -0.20 0.00 0.00 0.00 0.00 46.02 45.81 3c3k n GLY 62 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3c3k n LYS 63 N -0.84 -1.54 0.09 1.61 5.02 0.06 -4.88 118.16 117.68 3c3k n LYS 63 Ca 0.08 1.05 0.09 0.00 -2.02 0.00 0.00 58.31 57.50 3c3k n LYS 63 Cb 0.04 -5.58 -0.01 0.00 -0.02 0.00 0.00 35.03 29.46 3c3k n LYS 63 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 3c3k h MET 64 N 0.00 0.00 -5.25 1.97 2.86 -0.73 -3.47 114.93 110.31 3c3k h MET 64 Ca -0.46 0.00 -0.39 0.00 -2.06 0.00 0.00 59.70 56.79 3c3k h MET 64 Cb 1.34 0.00 -0.20 0.00 0.06 0.00 0.00 31.60 32.80 3c3k h MET 64 CO 0.58 0.08 -0.76 0.14 1.06 0.00 0.00 176.91 178.00 3c3k s VAL 65 N -3.24 1.10 -2.43 -2.22 -7.23 -1.12 -4.22 120.40 101.03 3c3k s VAL 65 Ca -0.01 -1.44 0.27 0.00 -1.81 0.00 0.00 61.98 58.99 3c3k s VAL 65 Cb 0.09 -1.19 0.40 0.00 0.56 0.00 0.00 36.38 36.23 3c3k s VAL 65 CO 0.79 -0.33 1.58 0.47 -0.31 0.00 0.00 175.10 177.30 3c3k n ASP 66 N 1.01 1.73 0.00 4.85 9.92 0.36 -4.56 116.55 129.86 3c3k n ASP 66 Ca -0.19 -1.49 0.00 0.00 -0.53 0.00 0.00 54.79 52.58 3c3k n ASP 66 Cb 0.55 0.05 0.00 0.00 -0.64 0.00 0.00 41.12 41.09 3c3k n ASP 66 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3c3k n GLY 67 N 1.25 1.53 3.08 0.44 0.00 -1.26 -4.31 105.19 105.92 3c3k n GLY 67 Ca 0.16 -0.77 -0.26 0.00 0.00 0.00 0.00 46.02 45.16 3c3k n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c3k s VAL 68 N -2.00 1.31 -0.20 1.61 0.11 -0.56 -1.73 120.40 118.94 3c3k s VAL 68 Ca 0.00 -0.61 -0.05 0.00 -2.93 0.00 0.00 61.98 58.39 3c3k s VAL 68 Cb 0.00 -1.16 -0.02 0.00 -1.53 0.00 0.00 36.38 33.67 3c3k s VAL 68 CO 0.00 0.39 -0.00 -0.63 -3.33 0.00 0.00 175.10 171.53 3c3k s ILE 69 N 0.40 3.93 -0.06 7.04 1.01 -0.05 -1.81 121.20 131.65 3c3k s ILE 69 Ca -0.11 -0.32 0.03 0.00 0.00 0.00 0.00 60.65 60.25 3c3k s ILE 69 Cb -0.14 -2.77 -0.02 0.00 0.01 0.00 0.00 42.46 39.53 3c3k s ILE 69 CO 0.04 0.43 -0.13 0.28 0.00 0.00 0.00 174.94 175.55 3c3k s THR 70 N 0.99 3.12 -0.62 2.92 -1.32 -0.52 -0.74 115.64 119.47 3c3k s THR 70 Ca 0.02 -0.69 0.10 0.00 -1.21 0.00 0.00 61.69 59.90 3c3k s THR 70 Cb -0.14 -2.24 0.29 0.00 -1.51 0.00 0.00 72.50 68.89 3c3k s THR 70 CO 0.02 0.58 1.23 0.23 -2.21 0.00 0.00 174.62 174.47 3c3k n MET 71 N 2.47 2.85 -1.38 7.08 2.81 0.30 -0.32 117.12 130.93 3c3k n MET 71 Ca -0.17 -2.10 -0.29 0.00 -1.81 0.00 0.00 57.70 53.33 3c3k n MET 71 Cb 0.52 -1.32 0.14 0.00 -0.71 0.00 0.00 33.22 31.85 3c3k n MET 71 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3c3k s ASP 72 N -1.21 3.40 0.27 7.83 1.01 -1.26 -4.37 116.67 122.33 3c3k s ASP 72 Ca 0.22 1.16 -0.30 0.00 0.71 0.00 0.00 52.55 54.35 3c3k s ASP 72 Cb 0.14 -1.80 -0.14 0.00 1.01 0.00 0.00 42.92 42.13 3c3k s ASP 72 CO 0.11 -2.64 1.20 0.00 0.21 0.00 0.00 175.17 174.05 3c3k n ALA 73 N -3.85 0.35 -0.24 5.23 0.00 -1.26 -4.85 120.51 115.88 3c3k n ALA 73 Ca 0.06 0.40 0.17 0.00 0.00 0.00 0.00 53.44 54.08 3c3k n ALA 73 Cb 0.58 -2.14 0.48 0.00 0.00 0.00 0.00 19.45 18.37 3c3k n ALA 73 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3c3k h LEU 74 N 2.92 0.46 0.00 0.00 5.85 -1.93 -1.28 115.31 121.33 3c3k h LEU 74 Ca -0.43 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.33 3c3k h LEU 74 Cb 1.31 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.30 3c3k h LEU 74 CO 0.66 0.20 0.00 -1.54 -0.34 0.00 0.00 178.44 177.42 3c3k n SER 75 N -4.53 0.00 0.14 1.25 3.41 -1.26 -1.93 113.62 110.70 3c3k n SER 75 Ca 0.19 0.10 0.02 0.00 -0.26 0.00 0.00 58.87 58.92 3c3k n SER 75 Cb 0.64 -0.31 0.03 0.00 -0.26 0.00 0.00 64.21 64.31 3c3k n SER 75 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3c3k h GLU 76 N 0.00 0.00 -0.10 4.33 4.81 -1.58 -3.37 114.58 118.67 3c3k h GLU 76 Ca 0.00 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.27 3c3k h GLU 76 Cb 0.18 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.51 3c3k h GLU 76 CO 0.00 0.51 -0.22 -0.07 -0.73 0.00 0.00 179.01 178.50 3c3k h LEU 77 N 0.00 -0.67 -2.18 1.64 4.07 -1.54 -1.87 115.31 114.76 3c3k h LEU 77 Ca -0.01 0.11 -0.01 0.00 0.08 0.00 0.00 57.88 58.05 3c3k h LEU 77 Cb 1.38 0.30 -0.00 0.00 1.08 0.00 0.00 40.66 43.42 3c3k h LEU 77 CO 0.07 -0.27 -0.06 1.55 -1.08 0.00 0.00 178.44 178.64 3c3k h PRO 78 N -0.29 0.00 0.00 1.13 0.13 -1.79 -1.31 132.00 129.86 3c3k h PRO 78 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3c3k h PRO 78 Cb 0.43 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.56 3c3k h PRO 78 CO -0.27 0.06 0.00 0.93 -0.23 0.00 0.00 178.00 178.50 3c3k h GLU 79 N 0.00 0.00 -0.01 0.86 5.08 -1.53 -3.23 114.58 115.76 3c3k h GLU 79 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3c3k h GLU 79 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3c3k h GLU 79 CO 0.01 0.00 -0.04 1.28 -1.00 0.00 0.00 179.01 179.26 3c3k n LEU 80 N -2.38 1.22 0.13 1.33 4.77 -0.54 -4.69 117.00 116.84 3c3k n LEU 80 Ca 0.04 -0.91 0.03 0.00 -0.03 0.00 0.00 56.01 55.14 3c3k n LEU 80 Cb 0.35 0.00 0.43 0.00 -2.33 0.00 0.00 43.42 41.87 3c3k n LEU 80 CO 0.26 0.26 0.94 0.06 -1.33 0.00 0.00 177.39 177.58 3c3k h GLN 81 N 0.85 0.22 0.00 3.23 3.07 -1.45 -0.63 115.11 120.40 3c3k h GLN 81 Ca 0.00 -0.04 -0.10 0.00 0.09 0.00 0.00 58.65 58.60 3c3k h GLN 81 Cb 0.20 -0.04 -0.01 0.00 0.08 0.00 0.00 27.48 27.71 3c3k h GLN 81 CO 0.00 0.32 -0.47 -0.91 0.09 0.00 0.00 178.83 177.85 3c3k h ASN 82 N 0.22 0.00 0.15 0.06 2.35 -1.84 0.97 115.58 117.48 3c3k h ASN 82 Ca 0.05 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.58 3c3k h ASN 82 Cb 0.28 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.68 3c3k h ASN 82 CO 0.01 0.47 -0.96 0.40 -1.65 0.00 0.00 177.43 175.70 3c3k h ILE 83 N 0.00 1.44 0.11 2.81 2.04 -1.48 -3.38 117.51 119.05 3c3k h ILE 83 Ca -0.00 -2.52 -0.28 0.00 1.00 0.00 0.00 64.86 63.06 3c3k h ILE 83 Cb 0.98 3.07 -0.00 0.00 -0.74 0.00 0.00 36.82 40.12 3c3k h ILE 83 CO 0.06 0.73 -1.37 0.40 0.00 0.00 0.00 178.15 177.97 3c3k h ILE 84 N -0.18 1.34 0.00 -0.67 2.04 -1.17 -3.48 117.51 115.38 3c3k h ILE 84 Ca -0.16 -2.96 0.00 0.00 1.00 0.00 0.00 64.86 62.74 3c3k h ILE 84 Cb 1.74 2.84 0.00 0.00 -0.74 0.00 0.00 36.82 40.66 3c3k h ILE 84 CO 0.18 0.85 0.00 0.61 0.00 0.00 0.00 178.15 179.79 3c3k n GLY 85 N 1.58 3.41 0.35 5.37 0.00 0.32 -0.47 105.19 115.75 3c3k n GLY 85 Ca -0.12 -0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.02 3c3k n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c3k n ALA 86 N 10.90 2.66 -1.66 4.61 0.00 -1.26 -4.94 120.51 130.82 3c3k n ALA 86 Ca 0.00 -0.39 -0.40 0.00 0.00 0.00 0.00 53.44 52.65 3c3k n ALA 86 Cb 0.00 -1.23 0.03 0.00 0.00 0.00 0.00 19.45 18.25 3c3k n ALA 86 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3c3k n PHE 87 N -0.19 1.57 -1.63 0.00 3.72 0.38 -4.86 117.46 116.46 3c3k n PHE 87 Ca 0.19 0.49 -0.49 0.00 -0.05 0.00 0.00 57.45 57.59 3c3k n PHE 87 Cb 0.31 -2.28 -0.05 0.00 -0.94 0.00 0.00 39.48 36.53 3c3k n PHE 87 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 3c3k n PRO 88 N -0.36 1.65 -3.71 -1.08 -0.02 -1.26 -4.92 135.00 125.29 3c3k n PRO 88 Ca 0.10 0.59 -0.11 0.00 -2.02 0.00 0.00 63.50 62.06 3c3k n PRO 88 Cb 0.42 -2.28 -0.11 0.00 -0.02 0.00 0.00 33.50 31.51 3c3k n PRO 88 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 3c3k s TRP 89 N 0.58 -0.52 -0.03 6.00 -0.00 -1.26 -1.49 118.94 122.22 3c3k s TRP 89 Ca 0.80 1.17 -0.03 0.00 -0.00 0.00 0.00 56.10 58.03 3c3k s TRP 89 Cb -0.81 0.21 0.01 0.00 -0.00 0.00 0.00 33.47 32.88 3c3k s TRP 89 CO 0.43 -0.29 0.09 0.08 -0.00 0.00 0.00 176.95 177.27 3c3k s VAL 90 N 0.97 -0.00 -0.14 5.86 1.01 -0.75 -4.20 120.40 123.15 3c3k s VAL 90 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 61.98 61.88 3c3k s VAL 90 Cb -0.07 -0.14 -0.03 0.00 0.00 0.00 0.00 36.38 36.15 3c3k s VAL 90 CO -0.08 0.00 -0.01 -1.58 0.00 0.00 0.00 175.10 173.44 3c3k s GLN 91 N 0.06 3.57 -0.08 2.72 2.00 0.57 -1.44 119.66 127.06 3c3k s GLN 91 Ca -0.00 -0.45 -0.02 0.00 -2.00 0.00 0.00 55.36 52.88 3c3k s GLN 91 Cb -0.01 -2.95 -0.03 0.00 0.80 0.00 0.00 33.01 30.82 3c3k s GLN 91 CO 0.00 0.36 0.03 0.00 -0.50 0.00 0.00 175.29 175.19 3c3k n ALA 93 N 1.96 0.00 -2.34 0.00 0.00 -0.12 -4.48 120.51 115.53 3c3k n ALA 93 Ca -0.18 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.95 3c3k n ALA 93 Cb 0.54 -0.54 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 3c3k n ALA 93 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3c3k s GLU 94 N -0.61 2.06 -0.20 0.00 0.41 -1.26 -4.68 118.70 114.43 3c3k s GLU 94 Ca 0.00 -0.96 0.00 0.00 -0.41 0.00 0.00 54.97 53.60 3c3k s GLU 94 Cb 0.00 -2.06 0.05 0.00 -1.78 0.00 0.00 34.13 30.34 3c3k s GLU 94 CO 0.00 0.55 -0.07 -0.47 -0.49 0.00 0.00 175.26 174.78 3c3k s TYR 95 N -0.69 2.14 -0.21 1.61 5.04 -1.26 -4.69 117.35 119.30 3c3k s TYR 95 Ca 0.11 -1.44 -0.04 0.00 -2.44 0.00 0.00 57.07 53.25 3c3k s TYR 95 Cb -0.10 -1.50 0.07 0.00 0.35 0.00 0.00 41.96 40.78 3c3k s TYR 95 CO 0.00 -0.71 0.09 0.34 -1.34 0.00 0.00 175.55 173.93 3c3k s ASP 96 N 1.49 2.80 0.00 4.32 2.15 -1.26 -5.03 116.67 121.13 3c3k s ASP 96 Ca -0.02 -0.85 0.14 0.00 0.43 0.00 0.00 52.55 52.25 3c3k s ASP 96 Cb -0.17 -0.36 0.60 0.00 -0.30 0.00 0.00 42.92 42.69 3c3k s ASP 96 CO -0.08 -0.36 1.44 -0.81 -0.17 0.00 0.00 175.17 175.19 3c3k n PRO 97 N 5.21 0.01 0.00 4.34 -0.05 -1.26 -1.49 135.00 141.75 3c3k n PRO 97 Ca -0.07 0.26 0.12 0.00 -0.05 0.00 0.00 63.50 63.76 3c3k n PRO 97 Cb 0.47 -1.50 0.25 0.00 -0.05 0.00 0.00 33.50 32.67 3c3k n PRO 97 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 175.50 176.73 3c3k n LEU 98 N -1.49 0.50 -4.78 1.53 4.77 -1.26 -4.88 117.00 111.39 3c3k n LEU 98 Ca 0.03 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.65 3c3k n LEU 98 Cb 0.16 -0.25 -0.02 0.00 -2.33 0.00 0.00 43.42 40.98 3c3k n LEU 98 CO 0.13 0.12 0.79 -0.55 -1.33 0.00 0.00 177.39 176.55 3c3k s SER 99 N -3.00 6.40 0.00 -1.43 0.15 -0.56 -4.93 113.70 110.34 3c3k s SER 99 Ca 0.11 2.20 0.29 0.00 0.70 0.00 0.00 55.95 59.25 3c3k s SER 99 Cb 0.18 -2.60 1.27 0.00 -1.71 0.00 0.00 66.02 63.16 3c3k s SER 99 CO 0.70 -0.75 1.89 0.35 1.20 0.00 0.00 173.24 176.63 3c3k n THR 100 N -0.33 0.00 -3.25 6.45 -2.24 -1.26 -4.82 114.28 108.82 3c3k n THR 100 Ca 0.06 -0.06 -0.39 0.00 -2.27 0.00 0.00 64.05 61.39 3c3k n THR 100 Cb 0.49 -0.12 -0.07 0.00 -2.10 0.00 0.00 70.33 68.53 3c3k n THR 100 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3c3k s VAL 101 N -2.44 5.11 0.60 2.28 1.01 -1.26 -4.74 120.40 120.96 3c3k s VAL 101 Ca 0.30 0.95 -0.18 0.00 0.00 0.00 0.00 61.98 63.05 3c3k s VAL 101 Cb 0.20 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 3c3k s VAL 101 CO 0.46 0.19 1.20 -0.44 0.00 0.00 0.00 175.10 176.51 3c3k s SER 102 N 1.10 5.16 0.11 3.32 0.01 -1.26 -4.72 113.70 117.42 3c3k s SER 102 Ca 0.24 2.35 -0.04 0.00 1.31 0.00 0.00 55.95 59.80 3c3k s SER 102 Cb -0.15 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.46 3c3k s SER 102 CO 0.10 -1.61 0.12 -0.94 0.41 0.00 0.00 173.24 171.31 3c3k s SER 103 N -1.69 0.24 -0.11 2.44 1.04 -0.81 -0.32 113.70 114.50 3c3k s SER 103 Ca 0.76 -0.98 -0.05 0.00 0.48 0.00 0.00 55.95 56.17 3c3k s SER 103 Cb -0.29 0.32 0.05 0.00 0.10 0.00 0.00 66.02 66.20 3c3k s SER 103 CO 0.34 -0.75 0.24 0.54 0.98 0.00 0.00 173.24 174.60 3c3k s VAL 104 N -3.97 -0.12 0.22 5.02 0.11 -0.68 -1.09 120.40 119.89 3c3k s VAL 104 Ca 0.15 0.18 -0.20 0.00 -2.93 0.00 0.00 61.98 59.19 3c3k s VAL 104 Cb 0.06 -0.39 0.07 0.00 -1.53 0.00 0.00 36.38 34.59 3c3k s VAL 104 CO -0.03 0.07 0.97 -1.54 -3.33 0.00 0.00 175.10 171.24 3c3k n SER 105 N 4.48 -1.83 -4.95 3.54 3.41 -0.89 -0.95 113.62 116.44 3c3k n SER 105 Ca -0.21 -2.03 -0.20 0.00 -0.26 0.00 0.00 58.87 56.17 3c3k n SER 105 Cb 0.52 2.99 0.06 0.00 -0.26 0.00 0.00 64.21 67.52 3c3k n SER 105 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3c3k s ILE 106 N -2.08 2.34 -0.62 -1.33 -4.36 -1.26 -0.72 121.20 113.18 3c3k s ILE 106 Ca 0.21 -0.90 -0.20 0.00 -0.26 0.00 0.00 60.65 59.50 3c3k s ILE 106 Cb -0.03 -2.44 0.09 0.00 1.25 0.00 0.00 42.46 41.33 3c3k s ILE 106 CO 0.07 0.00 0.80 -0.62 0.24 0.00 0.00 174.94 175.43 3c3k s ASP 107 N -4.61 6.18 0.28 4.36 -1.08 -1.26 -4.87 116.67 115.68 3c3k s ASP 107 Ca 0.61 -1.24 0.02 0.00 -0.52 0.00 0.00 52.55 51.42 3c3k s ASP 107 Cb -0.07 -2.35 0.41 0.00 -1.46 0.00 0.00 42.92 39.46 3c3k s ASP 107 CO 0.39 -1.24 1.74 0.44 0.52 0.00 0.00 175.17 177.02 3c3k h ASP 108 N 9.33 0.53 -0.26 -0.34 3.32 -1.96 -2.36 116.42 124.68 3c3k h ASP 108 Ca -0.29 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 56.52 3c3k h ASP 108 Cb 1.08 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 3c3k h ASP 108 CO 1.13 0.74 -0.11 0.58 -1.72 0.00 0.00 179.24 179.85 3c3k h VAL 109 N 0.48 1.30 -0.42 -1.35 2.07 -1.92 -1.60 116.25 114.80 3c3k h VAL 109 Ca 0.08 -1.19 -0.05 0.00 0.82 0.00 0.00 66.70 66.36 3c3k h VAL 109 Cb 0.62 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 3c3k h VAL 109 CO 0.04 0.37 0.06 0.00 0.02 0.00 0.00 177.57 178.07 3c3k h ALA 110 N 0.74 0.56 -0.31 1.67 0.00 -1.92 -2.19 119.26 117.82 3c3k h ALA 110 Ca 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3c3k h ALA 110 Cb 0.62 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3c3k h ALA 110 CO 0.04 0.29 0.20 0.00 0.00 0.00 0.00 179.25 179.78 3c3k h ALA 111 N 0.93 0.39 -0.11 0.00 0.00 -1.44 -1.96 119.26 117.07 3c3k h ALA 111 Ca 0.13 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 3c3k h ALA 111 Cb 0.39 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3c3k h ALA 111 CO 0.01 -0.15 -0.50 0.66 0.00 0.00 0.00 179.25 179.27 3c3k h SER 112 N 0.41 0.31 -0.49 0.00 4.64 -1.16 -1.59 113.55 115.66 3c3k h SER 112 Ca 0.11 -0.15 -0.11 0.00 -0.47 0.00 0.00 61.79 61.17 3c3k h SER 112 Cb -0.04 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 61.94 3c3k h SER 112 CO -0.03 0.76 -0.13 -0.33 -0.87 0.00 0.00 176.83 176.23 3c3k h GLU 113 N 0.23 0.98 -0.68 4.77 5.08 -1.36 -2.40 114.58 121.20 3c3k h GLU 113 Ca 0.01 -0.37 0.02 0.00 -1.00 0.00 0.00 59.36 58.02 3c3k h GLU 113 Cb 0.96 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.11 3c3k h GLU 113 CO 0.08 1.04 0.44 -0.92 -1.00 0.00 0.00 179.01 178.65 3c3k h TYR 114 N 0.87 0.83 -0.12 4.33 5.03 -1.21 0.29 116.97 126.98 3c3k h TYR 114 Ca 0.13 0.02 0.05 0.00 2.58 0.00 0.00 58.73 61.51 3c3k h TYR 114 Cb 0.69 -0.28 -0.06 0.00 1.55 0.00 0.00 36.73 38.63 3c3k h TYR 114 CO 0.04 0.50 -0.29 0.28 -1.32 0.00 0.00 178.16 177.37 3c3k h VAL 115 N 0.88 0.33 -0.60 1.81 2.07 -1.10 -1.70 116.25 117.94 3c3k h VAL 115 Ca 0.26 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.78 3c3k h VAL 115 Cb -0.04 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.03 3c3k h VAL 115 CO -0.08 0.00 0.38 0.58 0.02 0.00 0.00 177.57 178.47 3c3k h VAL 116 N -0.37 1.16 -0.91 2.57 2.07 -1.21 -1.64 116.25 117.92 3c3k h VAL 116 Ca 0.10 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.32 3c3k h VAL 116 Cb 0.52 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 3c3k h VAL 116 CO -0.33 0.16 0.60 0.44 0.02 0.00 0.00 177.57 178.46 3c3k h ASP 117 N 0.81 1.02 -0.16 0.57 3.32 -0.74 -0.91 116.42 120.32 3c3k h ASP 117 Ca 0.22 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.19 3c3k h ASP 117 Cb -0.07 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.24 3c3k h ASP 117 CO -0.04 0.71 -0.13 1.56 -1.72 0.00 0.00 179.24 179.62 3c3k h GLN 118 N 1.19 0.37 -0.70 3.56 1.08 -0.86 -1.10 115.11 118.66 3c3k h GLN 118 Ca 0.35 -0.18 0.11 0.00 -1.45 0.00 0.00 58.65 57.48 3c3k h GLN 118 Cb -0.05 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 27.30 3c3k h GLN 118 CO -0.09 0.73 0.30 -0.07 -0.95 0.00 0.00 178.83 178.74 3c3k h LEU 119 N 0.02 0.34 -0.75 1.46 3.38 -1.11 -1.86 115.31 116.79 3c3k h LEU 119 Ca 0.03 0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 3c3k h LEU 119 Cb 0.64 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 3c3k h LEU 119 CO 0.03 0.17 -0.22 0.58 0.09 0.00 0.00 178.44 179.10 3c3k h VAL 120 N 0.50 1.27 -0.59 1.22 2.07 -0.99 -2.01 116.25 117.71 3c3k h VAL 120 Ca 0.36 -1.31 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 3c3k h VAL 120 Cb 0.46 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 3c3k h VAL 120 CO -0.32 0.43 0.34 0.11 0.02 0.00 0.00 177.57 178.15 3c3k h LYS 121 N 0.62 0.81 -0.04 1.57 1.57 -0.87 -0.88 116.57 119.35 3c3k h LYS 121 Ca 0.09 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3c3k h LYS 121 Cb 0.71 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.85 3c3k h LYS 121 CO 0.05 0.58 0.00 -1.13 -0.57 0.00 0.00 179.45 178.39 3c3k n SER 122 N -4.40 0.43 0.00 0.86 3.41 -0.73 -4.87 113.62 108.32 3c3k n SER 122 Ca 0.06 -1.45 0.00 0.00 -0.26 0.00 0.00 58.87 57.21 3c3k n SER 122 Cb 0.09 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 3c3k n SER 122 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3c3k n GLY 123 N 0.90 0.60 3.77 5.00 0.00 -0.34 -5.08 105.19 110.05 3c3k n GLY 123 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 3c3k n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c3k s LYS 124 N -0.94 4.52 0.00 1.61 -0.14 -0.79 -4.96 119.74 119.05 3c3k s LYS 124 Ca 0.00 1.58 0.00 0.00 -1.36 0.00 0.00 55.97 56.19 3c3k s LYS 124 Cb 0.00 -2.94 0.00 0.00 -1.68 0.00 0.00 37.83 33.21 3c3k s LYS 124 CO 0.00 0.17 0.00 1.63 -0.76 0.00 0.00 175.35 176.39 3c3k n LYS 125 N 0.74 2.31 -3.69 1.68 5.02 -1.26 -4.26 118.16 118.70 3c3k n LYS 125 Ca 0.01 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.02 3c3k n LYS 125 Cb 0.48 -0.23 -0.12 0.00 -0.02 0.00 0.00 35.03 35.14 3c3k n LYS 125 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3c3k s ARG 126 N -0.30 1.63 -0.22 1.97 0.52 -1.26 -4.50 118.95 116.78 3c3k s ARG 126 Ca 0.00 -2.55 -0.10 0.00 -0.52 0.00 0.00 55.73 52.56 3c3k s ARG 126 Cb 0.00 -2.49 -0.05 0.00 0.52 0.00 0.00 34.95 32.93 3c3k s ARG 126 CO 0.00 -1.27 0.14 0.42 0.02 0.00 0.00 175.30 174.61 3c3k s ILE 127 N -0.43 5.33 0.24 1.52 1.01 -1.26 -0.89 121.20 126.73 3c3k s ILE 127 Ca 0.25 0.17 0.07 0.00 0.00 0.00 0.00 60.65 61.13 3c3k s ILE 127 Cb -0.09 -3.47 -0.04 0.00 0.01 0.00 0.00 42.46 38.88 3c3k s ILE 127 CO -0.12 0.38 0.21 0.00 0.00 0.00 0.00 174.94 175.41 3c3k s ALA 128 N 0.80 3.62 -0.09 9.38 0.00 0.55 -4.18 121.76 131.85 3c3k s ALA 128 Ca 0.07 -1.38 0.04 0.00 0.00 0.00 0.00 51.96 50.69 3c3k s ALA 128 Cb -0.13 -1.36 0.00 0.00 0.00 0.00 0.00 23.12 21.64 3c3k s ALA 128 CO 0.02 0.27 -0.22 -1.17 0.00 0.00 0.00 175.76 174.66 3c3k s LEU 129 N -3.80 2.03 -0.38 0.00 2.96 0.54 -0.91 118.68 119.12 3c3k s LEU 129 Ca 0.33 -0.52 -0.12 0.00 -0.22 0.00 0.00 54.13 53.60 3c3k s LEU 129 Cb -0.08 -1.32 0.02 0.00 0.50 0.00 0.00 46.19 45.31 3c3k s LEU 129 CO 0.25 0.15 0.24 -0.63 -1.32 0.00 0.00 176.35 175.05 3c3k s ILE 130 N 0.31 4.89 0.47 6.68 1.01 -0.52 -0.65 121.20 133.40 3c3k s ILE 130 Ca -0.16 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 59.88 3c3k s ILE 130 Cb -0.17 -3.69 0.02 0.00 0.01 0.00 0.00 42.46 38.63 3c3k s ILE 130 CO 0.07 -0.21 0.48 0.21 0.00 0.00 0.00 174.94 175.49 3c3k s ASN 131 N 1.62 5.02 0.00 3.58 3.84 -0.23 -2.28 114.94 126.49 3c3k s ASN 131 Ca 0.04 -0.85 0.00 0.00 0.21 0.00 0.00 52.86 52.26 3c3k s ASN 131 Cb -0.19 -0.19 0.00 0.00 -0.55 0.00 0.00 41.25 40.32 3c3k s ASN 131 CO 0.08 -0.89 0.00 1.57 -2.79 0.00 0.00 177.10 175.07 3c3k n HIS 132 N -1.75 0.00 -3.94 0.43 -0.00 -1.26 0.27 115.22 108.97 3c3k n HIS 132 Ca 0.05 0.00 -0.31 0.00 -0.00 0.00 0.00 57.72 57.46 3c3k n HIS 132 Cb 0.62 0.00 -0.15 0.00 -0.00 0.00 0.00 29.99 30.46 3c3k n HIS 132 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 3c3k s ASP 133 N 1.00 4.42 0.00 0.26 2.15 -1.26 -4.41 116.67 118.82 3c3k s ASP 133 Ca 0.00 -1.82 0.11 0.00 0.43 0.00 0.00 52.55 51.27 3c3k s ASP 133 Cb 0.00 -1.36 0.59 0.00 -0.30 0.00 0.00 42.92 41.85 3c3k s ASP 133 CO 0.00 -0.35 1.22 0.18 -0.17 0.00 0.00 175.17 176.05 3c3k n LEU 134 N 4.48 0.00 0.27 -1.34 4.77 -1.26 -2.57 117.00 121.35 3c3k n LEU 134 Ca -0.01 0.22 0.12 0.00 -0.03 0.00 0.00 56.01 56.31 3c3k n LEU 134 Cb 0.42 -0.22 0.77 0.00 -2.33 0.00 0.00 43.42 42.06 3c3k n LEU 134 CO 0.19 -0.14 1.03 0.00 -1.33 0.00 0.00 177.39 177.14 3c3k h ALA 135 N 2.57 1.48 -2.60 -1.18 0.00 -1.99 -3.43 119.26 114.11 3c3k h ALA 135 Ca 0.00 -0.07 -0.55 0.00 0.00 0.00 0.00 54.91 54.30 3c3k h ALA 135 Cb 0.08 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 3c3k h ALA 135 CO 0.00 0.09 0.21 0.71 0.00 0.00 0.00 179.25 180.26 3c3k s TYR 136 N -4.48 3.67 0.35 0.00 1.51 -1.06 -4.56 117.35 112.78 3c3k s TYR 136 Ca -0.04 1.49 0.07 0.00 -1.01 0.00 0.00 57.07 57.59 3c3k s TYR 136 Cb 0.14 -2.92 0.64 0.00 -0.11 0.00 0.00 41.96 39.72 3c3k s TYR 136 CO 0.59 0.13 1.84 0.37 -1.11 0.00 0.00 175.55 177.37 3c3k h GLN 137 N 6.31 0.30 -0.21 -0.62 4.15 -1.91 0.34 115.11 123.47 3c3k h GLN 137 Ca -0.42 -0.09 -0.04 0.00 0.77 0.00 0.00 58.65 58.87 3c3k h GLN 137 Cb 1.21 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.85 3c3k h GLN 137 CO 0.73 0.49 -0.06 0.10 -1.93 0.00 0.00 178.83 178.16 3c3k h TYR 138 N 0.28 0.34 -0.06 3.99 -0.00 -1.92 0.66 116.97 120.25 3c3k h TYR 138 Ca 0.05 -0.03 -0.13 0.00 0.00 0.00 0.00 58.73 58.62 3c3k h TYR 138 Cb 0.50 -0.10 -0.01 0.00 0.00 0.00 0.00 36.73 37.12 3c3k h TYR 138 CO 0.01 0.40 -0.56 0.00 -0.00 0.00 0.00 178.16 178.01 3c3k h ALA 139 N 1.62 0.95 -0.39 0.10 0.00 -1.24 -1.64 119.26 118.66 3c3k h ALA 139 Ca 0.07 -0.51 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 3c3k h ALA 139 Cb 0.32 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3c3k h ALA 139 CO 0.01 0.70 -0.03 1.96 0.00 0.00 0.00 179.25 181.89 3c3k h GLN 140 N 0.14 0.72 -0.38 0.00 4.20 -0.54 -2.21 115.11 117.04 3c3k h GLN 140 Ca -0.00 -0.24 -0.12 0.00 0.06 0.00 0.00 58.65 58.34 3c3k h GLN 140 Cb 1.03 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.74 3c3k h GLN 140 CO 0.08 0.82 -0.26 0.45 -0.67 0.00 0.00 178.83 179.25 3c3k h HIS 141 N 0.54 0.90 -0.44 2.96 3.86 -0.74 -0.58 115.15 121.64 3c3k h HIS 141 Ca 0.11 -0.22 -0.14 0.00 -1.16 0.00 0.00 60.37 58.96 3c3k h HIS 141 Cb 0.52 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 3c3k h HIS 141 CO 0.04 0.96 -0.27 0.00 0.86 0.00 0.00 177.93 179.52 3c3k h ARG 142 N 0.67 0.96 -0.71 2.45 3.08 -1.28 0.05 114.38 119.60 3c3k h ARG 142 Ca 0.08 -0.44 -0.04 0.00 0.07 0.00 0.00 59.98 59.66 3c3k h ARG 142 Cb 0.79 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 3c3k h ARG 142 CO 0.06 1.10 0.29 1.49 -1.07 0.00 0.00 179.97 181.85 3c3k h GLU 143 N 0.81 1.05 -0.02 0.04 4.81 -1.04 -1.57 114.58 118.67 3c3k h GLU 143 Ca 0.09 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 3c3k h GLU 143 Cb 0.85 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.06 3c3k h GLU 143 CO 0.08 0.87 -0.03 0.77 -0.73 0.00 0.00 179.01 179.96 3c3k h SER 144 N 1.01 0.07 -0.50 1.04 0.02 -0.97 -1.13 113.55 113.08 3c3k h SER 144 Ca 0.24 -0.53 0.10 0.00 -0.84 0.00 0.00 61.79 60.76 3c3k h SER 144 Cb 0.20 -0.02 -0.09 0.00 0.14 0.00 0.00 62.40 62.64 3c3k h SER 144 CO -0.02 0.58 -0.05 1.23 -1.14 0.00 0.00 176.83 177.43 3c3k h GLY 145 N -0.44 0.45 0.99 -3.77 0.00 -0.99 0.71 103.07 100.01 3c3k h GLY 145 Ca 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 3c3k h GLY 145 CO 0.01 -0.16 -0.08 -1.82 0.00 0.00 0.00 176.54 174.49 3c3k h TYR 146 N 0.06 -0.20 -0.32 5.60 5.03 -1.11 -1.85 116.97 124.18 3c3k h TYR 146 Ca 0.25 -0.00 -0.08 0.00 2.58 0.00 0.00 58.73 61.47 3c3k h TYR 146 Cb 0.38 0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.72 3c3k h TYR 146 CO -0.36 -0.12 -0.13 -0.07 -1.32 0.00 0.00 178.16 176.16 3c3k h LEU 147 N -0.20 0.67 -1.05 2.82 3.38 -0.68 -2.34 115.31 117.91 3c3k h LEU 147 Ca -0.02 -0.39 -0.05 0.00 0.09 0.00 0.00 57.88 57.51 3c3k h LEU 147 Cb 0.16 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3c3k h LEU 147 CO 0.03 0.91 0.14 0.78 0.09 0.00 0.00 178.44 180.39 3c3k h ASN 148 N 0.42 0.77 0.92 -0.43 2.35 -0.91 -2.70 115.58 116.00 3c3k h ASN 148 Ca 0.08 -0.13 -0.17 0.00 -0.55 0.00 0.00 56.30 55.53 3c3k h ASN 148 Cb 0.64 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 3c3k h ASN 148 CO 0.04 0.75 -0.80 -0.09 -1.65 0.00 0.00 177.43 175.68 3c3k h ARG 149 N 0.80 0.00 -0.49 0.81 9.65 -1.17 0.36 114.38 124.35 3c3k h ARG 149 Ca 0.18 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 59.04 3c3k h ARG 149 Cb 0.27 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.83 3c3k h ARG 149 CO -0.00 0.80 0.24 -0.07 2.80 0.00 0.00 179.97 183.74 3c3k h LEU 150 N 0.00 0.63 -0.64 3.80 3.38 -1.27 -1.78 115.31 119.43 3c3k h LEU 150 Ca -0.01 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.71 3c3k h LEU 150 Cb 1.48 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.05 3c3k h LEU 150 CO 0.10 0.58 -0.33 0.11 0.09 0.00 0.00 178.44 178.99 3c3k h LYS 151 N 0.64 0.70 -0.55 1.13 1.79 -1.34 -1.00 116.57 117.95 3c3k h LYS 151 Ca 0.17 -0.33 0.05 0.00 -2.18 0.00 0.00 60.65 58.36 3c3k h LYS 151 Cb 0.11 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.72 3c3k h LYS 151 CO -0.02 0.93 0.36 0.35 -1.08 0.00 0.00 179.45 179.99 3c3k h PHE 152 N 0.59 0.55 -0.33 -1.35 3.57 -0.65 -1.25 116.94 118.06 3c3k h PHE 152 Ca 0.06 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.58 3c3k h PHE 152 Cb 0.85 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.41 3c3k h PHE 152 CO 0.04 0.30 0.00 0.72 -2.23 0.00 0.00 178.31 177.14 3c3k n HIS 153 N -4.47 0.43 -2.24 0.41 8.25 -0.69 -4.94 115.22 111.97 3c3k n HIS 153 Ca 0.07 -0.21 -0.19 0.00 -0.26 0.00 0.00 57.72 57.13 3c3k n HIS 153 Cb 0.20 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.29 3c3k n HIS 153 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3c3k n GLY 154 N 1.23 -0.08 3.75 -1.41 0.00 -0.47 -4.96 105.19 103.25 3c3k n GLY 154 Ca 0.16 -0.10 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3c3k n GLY 154 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3c3k s LEU 155 N -5.23 4.60 0.09 0.99 1.43 -0.44 -4.98 118.68 115.14 3c3k s LEU 155 Ca 0.00 2.03 0.10 0.00 -1.03 0.00 0.00 54.13 55.22 3c3k s LEU 155 Cb 0.00 -3.61 -0.19 0.00 0.03 0.00 0.00 46.19 42.42 3c3k s LEU 155 CO 0.00 0.03 1.11 -0.78 0.23 0.00 0.00 176.35 176.94 3c3k h ASP 156 N 4.28 0.00 -3.40 2.29 3.58 -1.88 -3.43 116.42 117.87 3c3k h ASP 156 Ca -0.45 0.00 -0.55 0.00 0.42 0.00 0.00 57.03 56.45 3c3k h ASP 156 Cb 1.20 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.21 3c3k h ASP 156 CO 0.68 0.94 0.16 -0.47 -2.88 0.00 0.00 179.24 177.67 3c3k s TYR 157 N -2.71 3.66 -0.02 0.28 5.04 -1.26 -5.03 117.35 117.30 3c3k s TYR 157 Ca -0.00 1.41 -0.00 0.00 -2.44 0.00 0.00 57.07 56.03 3c3k s TYR 157 Cb 0.09 -2.85 0.02 0.00 0.35 0.00 0.00 41.96 39.57 3c3k s TYR 157 CO 0.81 0.15 0.03 0.45 -1.34 0.00 0.00 175.55 175.65 3c3k s SER 158 N 0.47 0.04 -0.25 4.32 0.15 -1.26 -4.57 113.70 112.60 3c3k s SER 158 Ca 0.40 0.04 -0.26 0.00 0.70 0.00 0.00 55.95 56.83 3c3k s SER 158 Cb -0.19 -0.03 0.09 0.00 -1.71 0.00 0.00 66.02 64.18 3c3k s SER 158 CO 0.22 -0.09 0.85 0.00 1.20 0.00 0.00 173.24 175.42 3c3k s ARG 159 N 0.72 0.72 -0.05 5.44 1.70 -1.26 -5.06 118.95 121.15 3c3k s ARG 159 Ca -0.06 0.75 0.03 0.00 -0.47 0.00 0.00 55.73 55.98 3c3k s ARG 159 Cb -0.09 0.35 0.00 0.00 -0.57 0.00 0.00 34.95 34.65 3c3k s ARG 159 CO -0.02 -0.11 -0.14 0.42 -1.08 0.00 0.00 175.30 174.37 3c3k s ILE 160 N 0.12 1.21 -0.00 4.99 1.01 -1.26 -0.34 121.20 126.93 3c3k s ILE 160 Ca 0.00 -0.56 0.06 0.00 0.00 0.00 0.00 60.65 60.15 3c3k s ILE 160 Cb -0.04 -1.07 -0.02 0.00 0.01 0.00 0.00 42.46 41.34 3c3k s ILE 160 CO -0.01 0.36 -0.18 -0.55 0.00 0.00 0.00 174.94 174.56 3c3k s SER 161 N 0.34 2.12 -0.21 3.58 0.15 0.18 -4.98 113.70 114.87 3c3k s SER 161 Ca -0.09 -0.35 -0.06 0.00 0.70 0.00 0.00 55.95 56.15 3c3k s SER 161 Cb -0.13 -0.22 -0.03 0.00 -1.71 0.00 0.00 66.02 63.93 3c3k s SER 161 CO 0.03 0.20 0.03 -0.31 1.20 0.00 0.00 173.24 174.39 3c3k s TYR 162 N -0.48 3.08 0.12 3.44 2.02 -1.26 -1.07 117.35 123.20 3c3k s TYR 162 Ca 0.07 -0.38 -0.30 0.00 -0.37 0.00 0.00 57.07 56.09 3c3k s TYR 162 Cb -0.07 -2.12 -0.06 0.00 -0.40 0.00 0.00 41.96 39.31 3c3k s TYR 162 CO -0.00 -0.22 0.97 0.00 -1.57 0.00 0.00 175.55 174.73 3c3k s ALA 163 N 1.07 3.26 0.02 3.71 0.00 0.14 -4.86 121.76 125.10 3c3k s ALA 163 Ca 0.03 0.60 -0.19 0.00 0.00 0.00 0.00 51.96 52.40 3c3k s ALA 163 Cb -0.14 -3.28 -0.22 0.00 0.00 0.00 0.00 23.12 19.48 3c3k s ALA 163 CO 0.02 -0.03 1.15 1.49 0.00 0.00 0.00 175.76 178.39 3c3k h GLU 164 N 5.51 0.47 -6.08 0.00 4.81 -1.87 -3.42 114.58 114.01 3c3k h GLU 164 Ca -0.43 -0.47 -0.55 0.00 -0.13 0.00 0.00 59.36 57.79 3c3k h GLU 164 Cb 1.21 0.12 -0.08 0.00 0.63 0.00 0.00 28.75 30.63 3c3k h GLU 164 CO 0.72 1.11 -0.54 -0.80 -0.73 0.00 0.00 179.01 178.77 3c3k s ASN 165 N -6.78 4.65 -1.11 1.04 0.01 -1.26 -4.95 114.94 106.53 3c3k s ASN 165 Ca -0.13 -0.80 -0.13 0.00 -0.71 0.00 0.00 52.86 51.10 3c3k s ASN 165 Cb 0.04 -0.71 0.21 0.00 0.41 0.00 0.00 41.25 41.21 3c3k s ASN 165 CO 0.83 -0.31 1.23 -0.22 -1.51 0.00 0.00 177.10 177.12 3c3k s LEU 166 N -3.84 5.68 0.25 0.60 2.96 -1.26 -4.70 118.68 118.36 3c3k s LEU 166 Ca 0.38 -3.10 -0.18 0.00 -0.22 0.00 0.00 54.13 51.01 3c3k s LEU 166 Cb -0.02 -2.31 0.01 0.00 0.50 0.00 0.00 46.19 44.37 3c3k s LEU 166 CO 0.22 -0.59 0.59 1.51 -1.32 0.00 0.00 176.35 176.77 3c3k s ASP 167 N 2.29 -0.21 0.27 3.68 1.47 -1.26 -4.92 116.67 117.99 3c3k s ASP 167 Ca 0.35 -0.67 0.00 0.00 1.18 0.00 0.00 52.55 53.41 3c3k s ASP 167 Cb -0.06 0.65 0.38 0.00 -0.34 0.00 0.00 42.92 43.54 3c3k s ASP 167 CO -0.05 -1.20 1.75 0.10 0.68 0.00 0.00 175.17 176.45 3c3k h TYR 168 N 2.13 0.70 -0.87 2.11 -0.00 -1.93 -1.76 116.97 117.34 3c3k h TYR 168 Ca -0.24 -0.12 -0.00 0.00 0.00 0.00 0.00 58.73 58.37 3c3k h TYR 168 Cb 1.25 -0.18 -0.04 0.00 0.00 0.00 0.00 36.73 37.76 3c3k h TYR 168 CO 0.40 0.73 0.54 1.98 -0.00 0.00 0.00 178.16 181.81 3c3k h MET 169 N 0.59 1.17 -0.72 0.10 4.05 -1.95 -1.04 114.93 117.14 3c3k h MET 169 Ca 0.10 -0.09 -0.02 0.00 -0.28 0.00 0.00 59.70 59.41 3c3k h MET 169 Cb 0.54 -0.25 -0.03 0.00 -0.80 0.00 0.00 31.60 31.05 3c3k h MET 169 CO 0.03 0.81 0.36 0.00 0.23 0.00 0.00 176.91 178.34 3c3k h ALA 170 N 1.30 1.28 -0.80 0.39 0.00 -1.61 -0.04 119.26 119.78 3c3k h ALA 170 Ca 0.32 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 3c3k h ALA 170 Cb -0.08 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.38 3c3k h ALA 170 CO -0.06 0.56 0.35 0.78 0.00 0.00 0.00 179.25 180.88 3c3k h GLY 171 N 1.07 1.25 0.69 0.00 0.00 -0.82 -1.27 103.07 103.99 3c3k h GLY 171 Ca 0.25 -0.64 -0.07 0.00 0.00 0.00 0.00 47.33 46.87 3c3k h GLY 171 CO -0.04 0.61 -0.19 1.70 0.00 0.00 0.00 176.54 178.62 3c3k h LYS 172 N 1.14 0.32 -0.18 4.80 3.64 -0.74 -1.03 116.57 124.52 3c3k h LYS 172 Ca 0.27 -0.20 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3c3k h LYS 172 Cb 0.16 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 3c3k h LYS 172 CO -0.03 0.79 0.11 -0.07 -2.27 0.00 0.00 179.45 177.98 3c3k h LEU 173 N -0.11 0.22 -0.71 5.20 3.38 -0.96 -0.16 115.31 122.17 3c3k h LEU 173 Ca 0.01 -0.06 0.15 0.00 0.09 0.00 0.00 57.88 58.06 3c3k h LEU 173 Cb 0.77 -0.06 -0.11 0.00 0.09 0.00 0.00 40.66 41.36 3c3k h LEU 173 CO 0.04 0.22 0.15 0.00 0.09 0.00 0.00 178.44 178.95 3c3k h ALA 174 N 1.01 0.88 -0.23 1.53 0.00 -1.23 -1.44 119.26 119.79 3c3k h ALA 174 Ca 0.07 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3c3k h ALA 174 Cb 0.04 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3c3k h ALA 174 CO -0.01 -0.34 0.01 1.15 0.00 0.00 0.00 179.25 180.06 3c3k h THR 175 N 0.25 1.25 -0.91 0.00 2.02 -0.59 -2.30 112.91 112.62 3c3k h THR 175 Ca 0.39 -0.85 0.07 0.00 0.77 0.00 0.00 66.41 66.80 3c3k h THR 175 Cb 0.66 1.35 -0.07 0.00 -1.74 0.00 0.00 68.15 68.35 3c3k h THR 175 CO -0.50 0.26 0.57 -0.26 0.37 0.00 0.00 175.52 175.96 3c3k h PHE 176 N 0.18 1.05 -0.70 3.16 0.04 -0.83 -1.31 116.94 118.52 3c3k h PHE 176 Ca 0.07 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.87 3c3k h PHE 176 Cb 0.38 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 3c3k h PHE 176 CO 0.03 0.51 0.44 1.03 -0.60 0.00 0.00 178.31 179.72 3c3k h SER 177 N 1.01 0.82 1.05 2.17 0.87 -0.99 -1.77 113.55 116.71 3c3k h SER 177 Ca 0.41 -0.04 -0.14 0.00 -1.23 0.00 0.00 61.79 60.80 3c3k h SER 177 Cb 0.24 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 3c3k h SER 177 CO -0.20 0.62 -0.64 -0.07 -0.53 0.00 0.00 176.83 176.01 3c3k h LEU 178 N 0.96 0.00 -0.54 2.23 3.38 -0.72 -2.92 115.31 117.69 3c3k h LEU 178 Ca 0.25 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 3c3k h LEU 178 Cb -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3c3k h LEU 178 CO -0.05 0.64 -0.22 -0.07 0.09 0.00 0.00 178.44 178.84 3c3k h LEU 179 N 0.00 0.00 -7.39 1.67 3.38 -0.71 -3.39 115.31 108.88 3c3k h LEU 179 Ca -0.01 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 57.23 3c3k h LEU 179 Cb 1.35 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.95 3c3k h LEU 179 CO 0.08 0.22 1.73 0.29 0.09 0.00 0.00 178.44 180.85 3c3k n LYS 180 N -3.23 3.37 -3.50 1.13 5.02 -0.72 -4.84 118.16 115.39 3c3k n LYS 180 Ca 0.02 -3.62 -0.09 0.00 -2.02 0.00 0.00 58.31 52.59 3c3k n LYS 180 Cb 0.53 -3.11 -0.02 0.00 -0.02 0.00 0.00 35.03 32.41 3c3k n LYS 180 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3c3k s SER 181 N 2.66 -0.40 0.15 4.39 0.15 -1.26 -4.98 113.70 114.41 3c3k s SER 181 Ca 0.44 0.04 -0.24 0.00 0.70 0.00 0.00 55.95 56.89 3c3k s SER 181 Cb 0.02 0.41 0.02 0.00 -1.71 0.00 0.00 66.02 64.76 3c3k s SER 181 CO 0.01 -0.65 1.61 0.00 1.20 0.00 0.00 173.24 175.41 3c3k h ALA 182 N 2.05 -0.24 -3.07 5.45 0.00 -1.94 -3.37 119.26 118.15 3c3k h ALA 182 Ca -0.24 0.06 -0.64 0.00 0.00 0.00 0.00 54.91 54.09 3c3k h ALA 182 Cb 1.24 0.60 -0.22 0.00 0.00 0.00 0.00 17.79 19.41 3c3k h ALA 182 CO 0.32 -0.74 -0.63 0.08 0.00 0.00 0.00 179.25 178.28 3c3k s VAL 183 N -6.03 4.21 0.36 0.00 1.01 -1.26 -5.12 120.40 113.57 3c3k s VAL 183 Ca -0.15 -0.22 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 3c3k s VAL 183 Cb 0.12 -2.93 -0.06 0.00 0.00 0.00 0.00 36.38 33.51 3c3k s VAL 183 CO 0.67 0.39 0.68 -0.54 0.00 0.00 0.00 175.10 176.30 3c3k s LYS 184 N 1.18 3.71 0.61 2.72 -0.14 -1.26 -4.98 119.74 121.58 3c3k s LYS 184 Ca 0.04 0.26 -0.14 0.00 -1.36 0.00 0.00 55.97 54.77 3c3k s LYS 184 Cb -0.14 -2.50 -0.03 0.00 -1.68 0.00 0.00 37.83 33.47 3c3k s LYS 184 CO 0.02 0.07 1.04 -1.25 -0.76 0.00 0.00 175.35 174.48 3c3k s PRO 185 N -3.73 3.34 0.00 -1.68 0.04 -1.26 -4.92 135.00 126.78 3c3k s PRO 185 Ca 0.48 1.06 0.19 0.00 0.04 0.00 0.00 61.00 62.77 3c3k s PRO 185 Cb -0.10 -2.04 0.35 0.00 0.04 0.00 0.00 34.50 32.75 3c3k s PRO 185 CO 0.31 -0.78 1.29 -0.40 0.04 0.00 0.00 177.00 177.46 3c3k n ASP 186 N -2.31 3.15 -3.61 6.66 5.68 -0.07 -4.78 116.55 121.27 3c3k n ASP 186 Ca 0.08 -1.91 -0.12 0.00 -0.50 0.00 0.00 54.79 52.34 3c3k n ASP 186 Cb 0.53 -0.21 -0.07 0.00 -1.14 0.00 0.00 41.12 40.24 3c3k n ASP 186 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3c3k s ALA 187 N -1.31 -1.89 -0.11 2.12 0.00 -0.99 -1.88 121.76 117.70 3c3k s ALA 187 Ca 0.32 1.78 -0.00 0.00 0.00 0.00 0.00 51.96 54.07 3c3k s ALA 187 Cb 0.19 -1.03 0.02 0.00 0.00 0.00 0.00 23.12 22.30 3c3k s ALA 187 CO 0.26 -0.30 -0.09 0.42 0.00 0.00 0.00 175.76 176.06 3c3k s ILE 188 N -0.18 1.10 -0.30 0.00 1.01 0.77 -0.33 121.20 123.28 3c3k s ILE 188 Ca -0.01 -0.35 -0.06 0.00 0.00 0.00 0.00 60.65 60.23 3c3k s ILE 188 Cb -0.03 -1.10 0.02 0.00 0.01 0.00 0.00 42.46 41.36 3c3k s ILE 188 CO -0.01 0.38 0.06 0.12 0.00 0.00 0.00 174.94 175.50 3c3k s PHE 189 N 1.56 3.15 -0.00 3.97 5.36 -0.09 -0.37 117.98 131.57 3c3k s PHE 189 Ca 0.03 -1.13 -0.00 0.00 -0.96 0.00 0.00 56.93 54.87 3c3k s PHE 189 Cb -0.13 -2.23 -0.04 0.00 -0.34 0.00 0.00 43.02 40.28 3c3k s PHE 189 CO -0.07 -0.62 0.06 0.00 -1.46 0.00 0.00 175.22 173.13 3c3k s ALA 190 N 1.46 3.51 -1.79 11.12 0.00 0.12 -1.43 121.76 134.75 3c3k s ALA 190 Ca 0.02 -0.89 0.21 0.00 0.00 0.00 0.00 51.96 51.30 3c3k s ALA 190 Cb -0.17 -1.53 1.20 0.00 0.00 0.00 0.00 23.12 22.62 3c3k s ALA 190 CO 0.02 0.68 1.67 -0.89 0.00 0.00 0.00 175.76 177.23 3c3k n ILE 191 N 1.24 0.13 -3.67 0.00 -0.00 -0.97 -3.11 119.36 112.99 3c3k n ILE 191 Ca -0.13 0.03 -0.14 0.00 -0.00 0.00 0.00 62.75 62.50 3c3k n ILE 191 Cb 0.53 -0.69 -0.08 0.00 -0.00 0.00 0.00 39.64 39.39 3c3k n ILE 191 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 3c3k s SER 192 N -2.21 -0.50 0.52 4.38 0.15 -1.26 -4.59 113.70 110.19 3c3k s SER 192 Ca 0.28 0.79 0.24 0.00 0.70 0.00 0.00 55.95 57.96 3c3k s SER 192 Cb 0.15 0.80 1.37 0.00 -1.71 0.00 0.00 66.02 66.63 3c3k s SER 192 CO 0.27 -0.33 2.00 0.44 1.20 0.00 0.00 173.24 176.82 3c3k h ASP 193 N 4.50 0.02 -0.43 5.45 3.32 -1.38 -2.20 116.42 125.71 3c3k h ASP 193 Ca -0.28 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.74 3c3k h ASP 193 Cb 1.17 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 3c3k h ASP 193 CO 0.27 0.01 0.16 0.58 -1.72 0.00 0.00 179.24 178.54 3c3k h VAL 194 N 0.02 1.21 -0.14 -1.35 2.07 -1.96 -1.50 116.25 114.60 3c3k h VAL 194 Ca 0.25 -0.64 -0.13 0.00 0.82 0.00 0.00 66.70 66.99 3c3k h VAL 194 Cb 0.95 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 3c3k h VAL 194 CO -0.01 0.23 -0.47 -0.07 0.02 0.00 0.00 177.57 177.28 3c3k h LEU 195 N 0.55 0.37 -0.64 2.57 3.38 -1.66 -3.07 115.31 116.81 3c3k h LEU 195 Ca 0.14 -0.18 -0.15 0.00 0.09 0.00 0.00 57.88 57.79 3c3k h LEU 195 Cb 0.21 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3c3k h LEU 195 CO -0.01 0.79 -0.57 0.00 0.09 0.00 0.00 178.44 178.74 3c3k h ALA 196 N 1.23 0.82 -0.47 1.53 0.00 -1.11 -1.11 119.26 120.15 3c3k h ALA 196 Ca 0.02 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 3c3k h ALA 196 Cb 0.93 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3c3k h ALA 196 CO 0.08 0.70 0.19 0.00 0.00 0.00 0.00 179.25 180.22 3c3k h ALA 197 N 1.14 1.45 -0.06 0.00 0.00 -1.19 0.05 119.26 120.65 3c3k h ALA 197 Ca 0.00 -0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.60 3c3k h ALA 197 Cb 1.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3c3k h ALA 197 CO 0.09 0.42 -0.76 0.78 0.00 0.00 0.00 179.25 179.79 3c3k h GLY 198 N 0.81 0.40 0.94 0.00 0.00 -1.41 -2.04 103.07 101.78 3c3k h GLY 198 Ca 0.16 -0.59 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 3c3k h GLY 198 CO -0.02 0.52 0.16 0.00 0.00 0.00 0.00 176.54 177.21 3c3k h ALA 199 N 0.94 0.47 -0.51 3.60 0.00 -0.15 -0.78 119.26 122.83 3c3k h ALA 199 Ca -0.04 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.80 3c3k h ALA 199 Cb 1.34 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 3c3k h ALA 199 CO 0.13 0.04 0.28 0.82 0.00 0.00 0.00 179.25 180.51 3c3k h ILE 200 N 0.44 1.00 -0.20 0.00 2.04 -0.98 0.12 117.51 119.93 3c3k h ILE 200 Ca 0.12 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.82 3c3k h ILE 200 Cb 0.14 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 3c3k h ILE 200 CO -0.01 0.10 0.04 -0.61 0.00 0.00 0.00 178.15 177.67 3c3k h GLN 201 N 0.55 0.12 -0.62 2.37 4.15 -1.15 -1.34 115.11 119.18 3c3k h GLN 201 Ca 0.22 -0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.56 3c3k h GLN 201 Cb 0.09 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.72 3c3k h GLN 201 CO -0.13 0.08 0.13 0.00 -1.93 0.00 0.00 178.83 176.98 3c3k h ALA 202 N 1.14 1.05 -0.06 3.38 0.00 -0.74 -1.54 119.26 122.50 3c3k h ALA 202 Ca 0.09 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 3c3k h ALA 202 Cb 0.08 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3c3k h ALA 202 CO -0.12 0.62 0.04 -0.07 0.00 0.00 0.00 179.25 179.72 3c3k h LEU 203 N 0.94 0.07 -0.69 0.00 3.38 -0.82 -0.77 115.31 117.43 3c3k h LEU 203 Ca 0.20 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.14 3c3k h LEU 203 Cb 0.37 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 3c3k h LEU 203 CO 0.00 0.09 0.45 0.74 0.09 0.00 0.00 178.44 179.81 3c3k h THR 204 N 0.05 1.15 0.00 0.22 2.02 -1.16 -0.44 112.91 114.74 3c3k h THR 204 Ca 0.02 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.89 3c3k h THR 204 Cb 0.03 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 3c3k h THR 204 CO -0.00 0.16 0.00 -0.33 0.37 0.00 0.00 175.52 175.72 3c3k h GLU 205 N 0.90 0.00 -0.01 6.66 5.08 -1.11 -2.00 114.58 124.10 3c3k h GLU 205 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3c3k h GLU 205 Cb -0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 3c3k h GLU 205 CO -0.07 0.00 -0.37 0.43 -1.00 0.00 0.00 179.01 178.00 3c3k n SER 206 N -2.81 1.07 -0.17 1.42 7.64 -0.31 -4.95 113.62 115.51 3c3k n SER 206 Ca 0.02 -0.87 -0.02 0.00 1.01 0.00 0.00 58.87 59.01 3c3k n SER 206 Cb 0.32 0.25 -0.00 0.00 -1.01 0.00 0.00 64.21 63.77 3c3k n SER 206 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3c3k n GLY 207 N 1.39 0.36 3.88 0.23 0.00 -0.74 -5.04 105.19 105.27 3c3k n GLY 207 Ca 0.10 -0.88 -0.36 0.00 0.00 0.00 0.00 46.02 44.88 3c3k n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3c3k s LEU 208 N -0.44 4.39 0.15 0.99 1.43 -0.25 -5.02 118.68 119.93 3c3k s LEU 208 Ca 0.00 0.54 -0.19 0.00 -1.03 0.00 0.00 54.13 53.45 3c3k s LEU 208 Cb 0.00 -2.38 -0.07 0.00 0.03 0.00 0.00 46.19 43.76 3c3k s LEU 208 CO 0.00 0.33 0.63 -0.44 0.23 0.00 0.00 176.35 177.10 3c3k s SER 209 N -1.36 7.03 -0.12 2.29 0.01 -1.26 -4.23 113.70 116.06 3c3k s SER 209 Ca 0.21 1.29 0.01 0.00 1.31 0.00 0.00 55.95 58.78 3c3k s SER 209 Cb -0.13 -2.37 0.02 0.00 0.21 0.00 0.00 66.02 63.75 3c3k s SER 209 CO 0.11 0.14 -0.15 -0.63 0.41 0.00 0.00 173.24 173.12 3c3k s ILE 210 N -1.34 1.50 -1.67 1.44 1.01 -1.26 -0.96 121.20 119.91 3c3k s ILE 210 Ca 0.36 -0.63 0.28 0.00 0.00 0.00 0.00 60.65 60.66 3c3k s ILE 210 Cb -0.18 -1.38 0.41 0.00 0.01 0.00 0.00 42.46 41.32 3c3k s ILE 210 CO 0.20 0.44 1.78 -0.81 0.00 0.00 0.00 174.94 176.56 3c3k n PRO 211 N 4.31 0.72 -0.13 2.79 -0.04 -1.26 -4.86 135.00 136.54 3c3k n PRO 211 Ca -0.19 -0.30 -0.05 0.00 -0.04 0.00 0.00 63.50 62.92 3c3k n PRO 211 Cb 0.51 -1.49 0.03 0.00 -0.04 0.00 0.00 33.50 32.51 3c3k n PRO 211 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 3c3k h GLN 212 N 0.73 0.32 0.02 0.54 7.50 -1.93 -2.97 115.11 119.33 3c3k h GLN 212 Ca 0.00 -0.02 -0.13 0.00 0.50 0.00 0.00 58.65 59.00 3c3k h GLN 212 Cb 0.40 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 27.84 3c3k h GLN 212 CO 0.00 0.21 -0.70 -0.44 -1.50 0.00 0.00 178.83 176.40 3c3k h ASP 213 N 0.33 0.07 -3.11 1.46 3.32 -1.41 -3.47 116.42 113.60 3c3k h ASP 213 Ca 0.19 -0.79 -0.32 0.00 0.02 0.00 0.00 57.03 56.13 3c3k h ASP 213 Cb 0.15 -0.02 -0.37 0.00 0.22 0.00 0.00 39.33 39.31 3c3k h ASP 213 CO -0.18 1.29 -0.67 -0.69 -1.72 0.00 0.00 179.24 177.28 3c3k s VAL 214 N -2.32 -0.22 0.42 -1.35 1.01 -0.83 -4.49 120.40 112.62 3c3k s VAL 214 Ca -0.23 0.33 -0.18 0.00 0.00 0.00 0.00 61.98 61.90 3c3k s VAL 214 Cb 0.02 -0.29 -0.10 0.00 0.00 0.00 0.00 36.38 36.01 3c3k s VAL 214 CO 0.67 0.12 0.90 0.00 0.00 0.00 0.00 175.10 176.78 3c3k s ALA 215 N 2.26 3.13 -0.04 5.51 0.00 -0.79 -4.26 121.76 127.57 3c3k s ALA 215 Ca 0.04 0.25 0.03 0.00 0.00 0.00 0.00 51.96 52.28 3c3k s ALA 215 Cb -0.12 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 19.97 3c3k s ALA 215 CO -0.06 0.11 -0.13 0.08 0.00 0.00 0.00 175.76 175.76 3c3k s VAL 216 N -2.22 1.12 -0.03 0.00 1.01 -0.36 -0.16 120.40 119.75 3c3k s VAL 216 Ca 0.59 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 62.06 3c3k s VAL 216 Cb -0.09 -0.98 -0.00 0.00 0.00 0.00 0.00 36.38 35.31 3c3k s VAL 216 CO 0.18 0.33 -0.13 -0.69 0.00 0.00 0.00 175.10 174.80 3c3k s VAL 217 N 0.14 1.06 0.00 2.92 1.01 0.50 -4.06 120.40 121.98 3c3k s VAL 217 Ca -0.04 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.42 3c3k s VAL 217 Cb -0.10 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.35 3c3k s VAL 217 CO 0.01 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.04 3c3k n GLY 218 N 3.20 3.57 3.40 4.51 0.00 0.64 0.13 105.19 120.65 3c3k n GLY 218 Ca -0.18 -1.96 -0.09 0.00 0.00 0.00 0.00 46.02 43.79 3c3k n GLY 218 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3c3k s PHE 219 N 2.09 -0.78 0.00 1.61 2.19 -1.18 -3.24 117.98 118.67 3c3k s PHE 219 Ca 0.00 1.60 0.00 0.00 0.33 0.00 0.00 56.93 58.86 3c3k s PHE 219 Cb 0.00 0.40 0.00 0.00 -1.31 0.00 0.00 43.02 42.11 3c3k s PHE 219 CO 0.00 -0.42 0.00 -0.25 1.83 0.00 0.00 175.22 176.38 3c3k n ASP 220 N 4.36 0.00 -0.71 6.13 8.00 0.24 -1.08 116.55 133.48 3c3k n ASP 220 Ca -0.21 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.28 3c3k n ASP 220 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 3c3k n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3c3k n GLY 221 N 0.00 0.80 3.94 0.44 0.00 -1.21 -2.05 105.19 107.11 3c3k n GLY 221 Ca 0.00 -0.61 -0.25 0.00 0.00 0.00 0.00 46.02 45.16 3c3k n GLY 221 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3c3k s VAL 222 N -3.01 3.01 0.45 1.61 -7.23 -1.26 -4.86 120.40 109.11 3c3k s VAL 222 Ca 0.01 -0.28 0.17 0.00 -1.81 0.00 0.00 61.98 60.07 3c3k s VAL 222 Cb -0.01 -3.21 0.34 0.00 0.56 0.00 0.00 36.38 34.07 3c3k s VAL 222 CO 0.02 -0.20 1.98 0.44 -0.31 0.00 0.00 175.10 177.03 3c3k h ASP 223 N -0.22 0.29 -0.48 4.85 5.19 -1.97 -1.89 116.42 122.19 3c3k h ASP 223 Ca -0.44 0.01 0.12 0.00 -0.62 0.00 0.00 57.03 56.09 3c3k h ASP 223 Cb 1.29 -0.05 -0.02 0.00 0.18 0.00 0.00 39.33 40.72 3c3k h ASP 223 CO 0.59 0.17 0.34 -0.29 -3.12 0.00 0.00 179.24 176.92 3c3k h ILE 224 N 0.32 0.82 0.00 0.35 6.09 -1.95 0.32 117.51 123.45 3c3k h ILE 224 Ca 0.28 -0.04 0.00 0.00 -1.37 0.00 0.00 64.86 63.73 3c3k h ILE 224 Cb 0.68 0.68 0.00 0.00 0.47 0.00 0.00 36.82 38.65 3c3k h ILE 224 CO -0.07 0.02 0.00 0.77 -3.07 0.00 0.00 178.15 175.81 3c3k h SER 225 N 0.13 0.00 -0.27 2.19 4.64 -1.66 -1.43 113.55 117.16 3c3k h SER 225 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3c3k h SER 225 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 3c3k h SER 225 CO -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.93 3c3k n GLN 226 N -2.30 2.20 -0.03 4.77 6.02 0.11 -1.53 117.38 126.63 3c3k n GLN 226 Ca 0.01 -2.03 0.03 0.00 -0.01 0.00 0.00 57.00 55.00 3c3k n GLN 226 Cb 0.17 -1.43 -0.11 0.00 1.02 0.00 0.00 30.24 29.89 3c3k n GLN 226 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 3c3k n ILE 227 N 1.23 0.32 -1.69 5.09 5.41 -0.56 -4.97 119.36 124.20 3c3k n ILE 227 Ca 0.16 -0.42 -0.31 0.00 1.00 0.00 0.00 62.75 63.17 3c3k n ILE 227 Cb 0.53 -0.11 0.04 0.00 -0.71 0.00 0.00 39.64 39.40 3c3k n ILE 227 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 3c3k s THR 228 N -2.80 4.07 -0.18 1.39 -4.23 -1.09 -4.97 115.64 107.83 3c3k s THR 228 Ca -0.06 0.67 0.01 0.00 -1.18 0.00 0.00 61.69 61.13 3c3k s THR 228 Cb 0.08 -3.51 0.04 0.00 1.34 0.00 0.00 72.50 70.44 3c3k s THR 228 CO 0.60 -0.88 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.01 3c3k s VAL 229 N -3.13 1.57 0.78 2.29 1.01 -1.26 -2.23 120.40 119.43 3c3k s VAL 229 Ca 0.57 -0.87 -0.13 0.00 0.00 0.00 0.00 61.98 61.56 3c3k s VAL 229 Cb -0.13 -1.61 0.07 0.00 0.00 0.00 0.00 36.38 34.71 3c3k s VAL 229 CO 0.54 0.24 1.15 -2.16 0.00 0.00 0.00 175.10 174.88 3c3k s PRO 230 N 1.44 1.93 0.69 2.72 0.04 -1.26 -4.97 135.00 135.59 3c3k s PRO 230 Ca 0.01 1.52 -0.17 0.00 0.04 0.00 0.00 61.00 62.40 3c3k s PRO 230 Cb -0.15 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.56 3c3k s PRO 230 CO -0.09 -1.95 1.18 0.00 0.04 0.00 0.00 177.00 176.18 3c3k n ALA 231 N -3.29 0.55 -2.54 8.56 0.00 -0.95 -4.68 120.51 118.16 3c3k n ALA 231 Ca 0.12 -0.10 -0.41 0.00 0.00 0.00 0.00 53.44 53.05 3c3k n ALA 231 Cb 0.52 -2.25 -0.11 0.00 0.00 0.00 0.00 19.45 17.61 3c3k n ALA 231 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3c3k s LEU 232 N -4.14 4.62 0.30 0.00 2.96 -0.58 -1.57 118.68 120.28 3c3k s LEU 232 Ca 0.79 -0.54 -0.29 0.00 -0.22 0.00 0.00 54.13 53.86 3c3k s LEU 232 Cb -0.36 -2.13 -0.13 0.00 0.50 0.00 0.00 46.19 44.07 3c3k s LEU 232 CO 0.45 -0.28 1.36 0.41 -1.32 0.00 0.00 176.35 176.97 3c3k n THR 233 N 5.11 1.55 -3.79 3.68 -1.04 -1.26 -4.62 114.28 113.91 3c3k n THR 233 Ca -0.12 -0.39 -0.09 0.00 -2.04 0.00 0.00 64.05 61.41 3c3k n THR 233 Cb 0.49 -1.59 -0.03 0.00 -1.82 0.00 0.00 70.33 67.38 3c3k n THR 233 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3c3k s THR 234 N -0.64 0.01 -0.48 12.58 -1.32 -0.87 -0.26 115.64 124.65 3c3k s THR 234 Ca 0.60 -0.87 -0.19 0.00 -1.21 0.00 0.00 61.69 60.02 3c3k s THR 234 Cb -0.59 -1.74 0.04 0.00 -1.51 0.00 0.00 72.50 68.70 3c3k s THR 234 CO 0.57 -0.06 0.61 -0.69 -2.21 0.00 0.00 174.62 172.84 3c3k s VAL 235 N -3.90 4.88 -0.25 5.08 1.01 -1.20 -1.04 120.40 124.98 3c3k s VAL 235 Ca 0.11 -0.30 -0.29 0.00 0.00 0.00 0.00 61.98 61.49 3c3k s VAL 235 Cb -0.02 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.11 3c3k s VAL 235 CO 0.01 -0.71 1.16 -1.58 0.00 0.00 0.00 175.10 173.97 3c3k s GLN 236 N 2.64 4.13 0.17 2.72 2.00 0.74 0.80 119.66 132.86 3c3k s GLN 236 Ca 0.17 1.33 -0.10 0.00 -2.00 0.00 0.00 55.36 54.76 3c3k s GLN 236 Cb -0.17 -3.75 -0.07 0.00 0.80 0.00 0.00 33.01 29.82 3c3k s GLN 236 CO 0.14 -0.82 0.49 -0.65 -0.50 0.00 0.00 175.29 173.95 3c3k s GLN 237 N 3.60 3.81 -1.37 1.67 -0.21 -0.87 -1.34 119.66 124.94 3c3k s GLN 237 Ca 0.49 0.26 -0.15 0.00 0.02 0.00 0.00 55.36 55.99 3c3k s GLN 237 Cb -0.16 -2.82 0.07 0.00 1.00 0.00 0.00 33.01 31.11 3c3k s GLN 237 CO 0.14 0.43 1.99 -0.35 -2.12 0.00 0.00 175.29 175.38 3c3k n PRO 238 N 0.34 3.08 0.01 2.91 -0.04 -1.26 -4.81 135.00 135.24 3c3k n PRO 238 Ca -0.03 -3.00 -0.12 0.00 -0.04 0.00 0.00 63.50 60.31 3c3k n PRO 238 Cb 0.52 -3.29 -0.08 0.00 -0.04 0.00 0.00 33.50 30.62 3c3k n PRO 238 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 3c3k h SER 239 N 6.49 0.03 -0.45 3.54 0.02 -1.91 -0.07 113.55 121.21 3c3k h SER 239 Ca 0.50 -0.18 0.07 0.00 -0.84 0.00 0.00 61.79 61.33 3c3k h SER 239 Cb 0.72 -0.01 -0.06 0.00 0.14 0.00 0.00 62.40 63.19 3c3k h SER 239 CO 1.69 0.20 0.12 -0.08 -1.14 0.00 0.00 176.83 177.62 3c3k h GLU 240 N -0.14 0.26 -1.00 3.45 4.81 -1.87 -2.66 114.58 117.43 3c3k h GLU 240 Ca 0.01 -0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 3c3k h GLU 240 Cb 0.18 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.44 3c3k h GLU 240 CO -0.00 0.17 0.65 1.96 -0.73 0.00 0.00 179.01 181.06 3c3k h GLN 241 N 0.27 1.16 -0.32 1.92 4.20 -1.76 -0.54 115.11 120.05 3c3k h GLN 241 Ca 0.22 -0.07 0.07 0.00 0.06 0.00 0.00 58.65 58.93 3c3k h GLN 241 Cb 0.25 -0.26 -0.07 0.00 0.30 0.00 0.00 27.48 27.69 3c3k h GLN 241 CO -0.26 0.77 -0.18 0.82 -0.67 0.00 0.00 178.83 179.31 3c3k h ILE 242 N 1.20 0.47 -0.54 2.54 2.04 -0.77 -0.59 117.51 121.85 3c3k h ILE 242 Ca 0.42 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 66.23 3c3k h ILE 242 Cb 0.13 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 3c3k h ILE 242 CO -0.16 0.00 0.11 1.23 0.00 0.00 0.00 178.15 179.32 3c3k h GLY 243 N -0.14 0.95 1.20 5.37 0.00 -1.12 -1.14 103.07 108.18 3c3k h GLY 243 Ca 0.17 -0.62 -0.05 0.00 0.00 0.00 0.00 47.33 46.83 3c3k h GLY 243 CO -0.41 0.57 0.24 -0.33 0.00 0.00 0.00 176.54 176.61 3c3k h MET 244 N 0.77 1.01 -0.18 4.80 2.86 -0.94 -2.15 114.93 121.10 3c3k h MET 244 Ca 0.17 -0.19 -0.19 0.00 -2.06 0.00 0.00 59.70 57.43 3c3k h MET 244 Cb 0.38 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.88 3c3k h MET 244 CO 0.01 0.85 -0.65 -0.22 1.06 0.00 0.00 176.91 177.96 3c3k h LYS 245 N 0.99 0.67 -0.40 1.72 1.63 -1.02 -1.47 116.57 118.69 3c3k h LYS 245 Ca 0.22 -0.48 0.03 0.00 -0.85 0.00 0.00 60.65 59.58 3c3k h LYS 245 Cb 0.24 0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.91 3c3k h LYS 245 CO -0.01 1.10 0.19 0.00 -3.45 0.00 0.00 179.45 177.27 3c3k h ALA 246 N 0.79 0.49 -0.50 5.00 0.00 -0.84 0.21 119.26 124.40 3c3k h ALA 246 Ca -0.02 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.94 3c3k h ALA 246 Cb 1.24 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 3c3k h ALA 246 CO 0.13 -0.18 0.30 0.28 0.00 0.00 0.00 179.25 179.78 3c3k h VAL 247 N 0.39 1.06 -0.95 0.00 2.07 -1.18 -0.56 116.25 117.07 3c3k h VAL 247 Ca 0.17 -0.20 0.15 0.00 0.82 0.00 0.00 66.70 67.63 3c3k h VAL 247 Cb 0.09 0.41 -0.09 0.00 -1.52 0.00 0.00 31.29 30.17 3c3k h VAL 247 CO -0.13 0.11 0.56 0.28 0.02 0.00 0.00 177.57 178.41 3c3k h SER 248 N 0.60 0.76 0.06 0.57 0.02 -0.54 0.31 113.55 115.32 3c3k h SER 248 Ca 0.20 0.08 -0.15 0.00 -0.84 0.00 0.00 61.79 61.07 3c3k h SER 248 Cb 0.01 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 3c3k h SER 248 CO -0.09 0.34 -0.53 -0.07 -1.14 0.00 0.00 176.83 175.34 3c3k h LEU 249 N 0.81 0.57 -0.65 5.07 3.38 -0.24 -2.56 115.31 121.69 3c3k h LEU 249 Ca 0.51 -0.30 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 3c3k h LEU 249 Cb 0.65 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 3c3k h LEU 249 CO -0.33 0.99 -0.25 0.25 0.09 0.00 0.00 178.44 179.19 3c3k h LEU 250 N 0.40 0.81 -1.00 1.67 5.85 0.04 -2.97 115.31 120.11 3c3k h LEU 250 Ca 0.01 -0.31 -0.09 0.00 0.84 0.00 0.00 57.88 58.34 3c3k h LEU 250 Cb 1.06 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 3c3k h LEU 250 CO 0.10 1.02 -0.25 -0.07 -0.34 0.00 0.00 178.44 178.90 3c3k h LEU 251 N 0.68 0.42 -0.95 2.25 3.38 -0.34 -1.53 115.31 119.22 3c3k h LEU 251 Ca 0.09 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3c3k h LEU 251 Cb 0.78 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 3c3k h LEU 251 CO 0.06 0.68 0.51 -0.33 0.09 0.00 0.00 178.44 179.45 3c3k h GLU 252 N 0.38 1.24 -0.07 1.13 4.39 -1.32 0.19 114.58 120.52 3c3k h GLU 252 Ca 0.06 -0.13 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 3c3k h GLU 252 Cb 0.64 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 29.04 3c3k h GLU 252 CO 0.05 0.89 0.03 1.96 -1.16 0.00 0.00 179.01 180.78 3c3k h GLN 253 N 1.25 0.11 -0.64 2.33 4.20 -1.36 -3.17 115.11 117.81 3c3k h GLN 253 Ca 0.32 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.95 3c3k h GLN 253 Cb -0.00 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 3c3k h GLN 253 CO -0.05 0.23 0.17 0.82 -0.67 0.00 0.00 178.83 179.33 3c3k h ILE 254 N -0.05 1.25 -2.68 2.54 2.04 -0.91 -3.44 117.51 116.26 3c3k h ILE 254 Ca 0.02 -0.88 -0.52 0.00 1.00 0.00 0.00 64.86 64.48 3c3k h ILE 254 Cb 0.17 0.57 0.05 0.00 -0.74 0.00 0.00 36.82 36.87 3c3k h ILE 254 CO -0.00 0.34 1.00 -1.00 0.00 0.00 0.00 178.15 178.48 3c3k s HIS 255 N -5.29 2.84 0.33 1.37 3.76 0.65 -4.91 115.29 114.03 3c3k s HIS 255 Ca -0.11 0.35 0.03 0.00 -0.15 0.00 0.00 55.06 55.19 3c3k s HIS 255 Cb 0.15 -4.10 0.58 0.00 1.11 0.00 0.00 32.58 30.32 3c3k s HIS 255 CO 0.82 -4.20 1.89 0.77 -0.85 0.00 0.00 174.74 173.17 3c3k h SER 256 N 7.03 0.57 -0.18 1.40 0.02 -1.87 -3.21 113.55 117.32 3c3k h SER 256 Ca -0.43 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.43 3c3k h SER 256 Cb 1.20 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.59 3c3k h SER 256 CO 0.95 0.59 0.00 -0.90 -1.14 0.00 0.00 176.83 176.33 3c3k n ASP 257 N -4.30 1.85 -4.15 3.07 3.85 -1.26 -4.76 116.55 110.85 3c3k n ASP 257 Ca 0.02 -1.73 -0.26 0.00 -0.71 0.00 0.00 54.79 52.11 3c3k n ASP 257 Cb 0.21 -0.11 -0.16 0.00 -1.35 0.00 0.00 41.12 39.71 3c3k n ASP 257 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3c3k s VAL 258 N -1.78 1.49 -0.61 2.12 0.11 -1.22 -5.07 120.40 115.44 3c3k s VAL 258 Ca 0.33 -0.76 -0.21 0.00 -2.93 0.00 0.00 61.98 58.41 3c3k s VAL 258 Cb 0.18 -1.27 0.08 0.00 -1.53 0.00 0.00 36.38 33.84 3c3k s VAL 258 CO 0.27 0.43 0.84 -0.76 -3.33 0.00 0.00 175.10 172.54 3c3k s LEU 259 N -0.04 4.77 0.46 2.54 1.43 -1.26 -4.84 118.68 121.75 3c3k s LEU 259 Ca -0.02 -1.09 -0.24 0.00 -1.03 0.00 0.00 54.13 51.75 3c3k s LEU 259 Cb -0.11 -2.41 -0.07 0.00 0.03 0.00 0.00 46.19 43.62 3c3k s LEU 259 CO 0.02 -1.26 1.29 0.00 0.23 0.00 0.00 176.35 176.63 3c3k s ALA 260 N 3.43 3.07 0.37 4.21 0.00 -1.26 -5.04 121.76 126.53 3c3k s ALA 260 Ca 0.18 1.20 0.08 0.00 0.00 0.00 0.00 51.96 53.42 3c3k s ALA 260 Cb -0.19 -3.49 -0.05 0.00 0.00 0.00 0.00 23.12 19.39 3c3k s ALA 260 CO 0.10 -0.95 0.10 0.15 0.00 0.00 0.00 175.76 175.16 3c3k s LYS 261 N -2.54 2.20 0.18 0.00 -0.14 -1.26 -5.02 119.74 113.16 3c3k s LYS 261 Ca 0.63 -1.73 -0.31 0.00 -1.36 0.00 0.00 55.97 53.20 3c3k s LYS 261 Cb -0.37 -2.01 -0.09 0.00 -1.68 0.00 0.00 37.83 33.69 3c3k s LYS 261 CO 0.45 0.04 1.43 0.99 -0.76 0.00 0.00 175.35 177.51 3c3k s THR 262 N -2.52 2.92 0.01 2.17 2.01 -1.26 -4.95 115.64 114.01 3c3k s THR 262 Ca 0.38 0.71 0.00 0.00 0.31 0.00 0.00 61.69 63.09 3c3k s THR 262 Cb 0.01 -3.45 -0.01 0.00 0.01 0.00 0.00 72.50 69.05 3c3k s THR 262 CO 0.21 0.08 -0.01 0.68 -0.69 0.00 0.00 174.62 174.89 3c3k s VAL 263 N 0.58 0.06 -0.44 3.82 -7.23 -1.26 -5.03 120.40 110.90 3c3k s VAL 263 Ca 0.63 -0.44 0.03 0.00 -1.81 0.00 0.00 61.98 60.38 3c3k s VAL 263 Cb -0.40 -0.13 0.13 0.00 0.56 0.00 0.00 36.38 36.53 3c3k s VAL 263 CO 0.36 -0.24 0.21 -1.00 -0.31 0.00 0.00 175.10 174.12 3c3k s HIS 264 N -0.71 2.60 0.14 2.82 3.76 -1.26 -1.92 115.29 120.73 3c3k s HIS 264 Ca -0.08 -2.70 -0.30 0.00 -0.15 0.00 0.00 55.06 51.83 3c3k s HIS 264 Cb -0.05 -2.33 -0.07 0.00 1.11 0.00 0.00 32.58 31.24 3c3k s HIS 264 CO -0.00 -0.80 1.07 -1.01 -0.85 0.00 0.00 174.74 173.15 3c3k s HIS 265 N 0.30 3.64 -0.22 1.40 3.76 -0.25 -4.97 115.29 118.96 3c3k s HIS 265 Ca 0.16 1.63 -0.03 0.00 -0.15 0.00 0.00 55.06 56.66 3c3k s HIS 265 Cb -0.24 -3.22 -0.01 0.00 1.11 0.00 0.00 32.58 30.23 3c3k s HIS 265 CO -0.03 -0.42 -0.05 -0.51 -0.85 0.00 0.00 174.74 172.88 3c3k s LEU 266 N -0.08 2.85 0.06 0.89 1.43 -1.26 -2.08 118.68 120.49 3c3k s LEU 266 Ca 0.50 -0.42 -0.03 0.00 -1.03 0.00 0.00 54.13 53.15 3c3k s LEU 266 Cb -0.27 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 3c3k s LEU 266 CO 0.33 -0.02 0.25 -0.76 0.23 0.00 0.00 176.35 176.38 3c3k s LEU 267 N 1.46 4.34 0.21 1.79 1.43 0.10 -4.98 118.68 123.04 3c3k s LEU 267 Ca 0.06 0.41 -0.30 0.00 -1.03 0.00 0.00 54.13 53.26 3c3k s LEU 267 Cb -0.14 -2.92 -0.09 0.00 0.03 0.00 0.00 46.19 43.07 3c3k s LEU 267 CO -0.04 0.18 1.28 -2.16 0.23 0.00 0.00 176.35 175.83 3c3k s PRO 268 N -2.30 4.42 0.36 1.29 0.05 -1.26 -4.36 135.00 133.20 3c3k s PRO 268 Ca 0.34 2.02 -0.00 0.00 0.05 0.00 0.00 61.00 63.40 3c3k s PRO 268 Cb -0.13 -3.19 -0.03 0.00 0.05 0.00 0.00 34.50 31.20 3c3k s PRO 268 CO 0.23 -0.19 0.58 1.67 0.05 0.00 0.00 177.00 179.35 3c3k s TRP 269 N -0.10 3.51 -0.02 0.56 1.48 -1.26 -4.36 118.94 118.75 3c3k s TRP 269 Ca 0.55 0.42 0.04 0.00 -1.06 0.00 0.00 56.10 56.04 3c3k s TRP 269 Cb -0.36 -1.95 -0.00 0.00 -1.16 0.00 0.00 33.47 30.00 3c3k s TRP 269 CO 0.39 0.07 -0.12 0.21 -4.06 0.00 0.00 176.95 173.44 3c3k s LYS 270 N -4.36 1.12 -0.33 3.25 2.20 -0.45 -4.98 119.74 116.19 3c3k s LYS 270 Ca 0.41 -0.43 -0.23 0.00 -0.36 0.00 0.00 55.97 55.36 3c3k s LYS 270 Cb -0.10 -1.05 0.00 0.00 -1.51 0.00 0.00 37.83 35.18 3c3k s LYS 270 CO 0.37 0.22 0.76 0.12 -0.36 0.00 0.00 175.35 176.45 3c3k s PHE 271 N -0.09 3.17 -0.32 4.03 5.36 -1.26 -0.18 117.98 128.68 3c3k s PHE 271 Ca 0.01 0.66 -0.07 0.00 -0.96 0.00 0.00 56.93 56.57 3c3k s PHE 271 Cb -0.07 -3.25 0.02 0.00 -0.34 0.00 0.00 43.02 39.39 3c3k s PHE 271 CO 0.00 -0.62 0.11 0.08 -1.46 0.00 0.00 175.22 173.33 3c3k s VAL 272 N 2.95 3.97 -0.22 3.12 1.01 -0.21 -4.97 120.40 126.05 3c3k s VAL 272 Ca 0.31 -0.90 -0.26 0.00 0.00 0.00 0.00 61.98 61.12 3c3k s VAL 272 Cb -0.14 -3.16 -0.00 0.00 0.00 0.00 0.00 36.38 33.08 3c3k s VAL 272 CO 0.14 -0.07 0.90 -0.13 0.00 0.00 0.00 175.10 175.94 3c3k s ARG 273 N 1.47 4.23 0.00 2.72 0.52 -1.26 -2.06 118.95 124.57 3c3k s ARG 273 Ca 0.01 1.10 0.00 0.00 -0.52 0.00 0.00 55.73 56.31 3c3k s ARG 273 Cb -0.18 -3.63 0.00 0.00 0.52 0.00 0.00 34.95 31.66 3c3k s ARG 273 CO 0.03 -0.52 0.00 0.54 0.02 0.00 0.00 175.30 175.37 3c3k n ARG 274 N 5.96 2.94 0.25 3.54 1.74 -1.26 -4.92 116.66 124.92 3c3k n ARG 274 Ca 0.07 0.00 0.16 0.00 -0.77 0.00 0.00 57.85 57.31 3c3k n ARG 274 Cb 0.47 0.00 0.57 0.00 -1.02 0.00 0.00 32.46 32.48 3c3k n ARG 274 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 3c3k h GLN 275 N 0.00 0.00 0.00 5.56 4.15 -1.88 -2.44 115.11 120.50 3c3k h GLN 275 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3c3k h GLN 275 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 3c3k h GLN 275 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 178.83 175.77 3c3k n SER 276 N -3.02 0.55 0.00 -0.69 3.41 -0.61 -3.71 113.62 109.55 3c3k n SER 276 Ca 0.01 0.60 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 3c3k n SER 276 Cb 0.35 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 3c3k n SER 276 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3c3k n SER 277 N -2.07 3.22 0.00 4.04 3.41 -1.19 -1.23 113.62 119.80 3c3k n SER 277 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 3c3k n SER 277 Cb 0.28 0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 3c3k n SER 277 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09