#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k1q s PRO 2 N 0.00 4.40 0.28 0.03 0.04 -1.26 -4.26 135.00 134.23 3k1q s PRO 2 Ca 0.00 0.95 -0.30 0.00 0.04 0.00 0.00 61.00 61.69 3k1q s PRO 2 Cb 0.00 -3.49 -0.12 0.00 0.04 0.00 0.00 34.50 30.93 3k1q s PRO 2 CO 0.00 -0.06 1.53 -0.11 0.04 0.00 0.00 177.00 178.40 3k1q n LEU 3 N 4.20 3.99 -4.12 -3.56 7.94 -1.26 -5.04 117.00 119.15 3k1q n LEU 3 Ca 0.01 1.15 -0.08 0.00 -1.11 0.00 0.00 56.01 55.97 3k1q n LEU 3 Cb 0.51 -1.54 -0.10 0.00 0.53 0.00 0.00 43.42 42.81 3k1q n LEU 3 CO 0.48 -0.05 -0.37 -1.00 -1.11 0.00 0.00 177.39 175.33 3k1q s HIS 4 N -0.09 0.66 -1.05 1.96 3.76 -1.26 -4.75 115.29 114.52 3k1q s HIS 4 Ca 0.65 -0.99 -0.15 0.00 -0.15 0.00 0.00 55.06 54.41 3k1q s HIS 4 Cb -0.54 -0.44 -0.01 0.00 1.11 0.00 0.00 32.58 32.70 3k1q s HIS 4 CO 0.50 -0.28 0.78 -1.33 -0.85 0.00 0.00 174.74 173.56 3k1q n MET 5 N 0.09 -1.36 0.25 1.40 2.81 -1.26 -4.71 117.12 114.33 3k1q n MET 5 Ca -0.14 0.65 -0.16 0.00 -1.81 0.00 0.00 57.70 56.25 3k1q n MET 5 Cb 0.61 -4.33 -0.08 0.00 -0.71 0.00 0.00 33.22 28.71 3k1q n MET 5 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 3k1q h ILE 6 N -1.38 0.41 -0.57 2.02 5.03 -2.00 -2.03 117.51 118.98 3k1q h ILE 6 Ca -0.58 0.00 0.17 0.00 -0.12 0.00 0.00 64.86 64.33 3k1q h ILE 6 Cb 1.32 0.41 -0.02 0.00 -3.03 0.00 0.00 36.82 35.50 3k1q h ILE 6 CO 0.44 0.00 0.45 -0.65 -0.68 0.00 0.00 178.15 177.71 3k1q h PRO 7 N -0.68 0.00 0.02 2.37 0.11 -1.95 -1.51 132.00 130.37 3k1q h PRO 7 Ca -0.04 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 3k1q h PRO 7 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.68 3k1q h PRO 7 CO 0.02 0.00 -0.01 1.96 -0.21 0.00 0.00 178.00 179.76 3k1q h GLN 8 N 0.00 -0.03 0.00 1.05 7.50 -1.76 -1.15 115.11 120.73 3k1q h GLN 8 Ca 0.27 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.42 3k1q h GLN 8 Cb 1.17 0.01 -0.00 0.00 0.05 0.00 0.00 27.48 28.71 3k1q h GLN 8 CO -0.00 0.71 -0.03 0.28 -1.50 0.00 0.00 178.83 178.28 3k1q h VAL 9 N -0.92 0.86 -0.51 -0.54 2.07 -1.29 -0.51 116.25 115.40 3k1q h VAL 9 Ca -0.00 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 3k1q h VAL 9 Cb 0.74 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 3k1q h VAL 9 CO 0.00 0.03 0.27 0.00 0.02 0.00 0.00 177.57 177.89 3k1q h ALA 10 N 1.97 0.66 -0.56 1.67 0.00 -1.34 0.70 119.26 122.36 3k1q h ALA 10 Ca -0.00 -0.11 0.11 0.00 0.00 0.00 0.00 54.91 54.91 3k1q h ALA 10 Cb 0.06 -0.20 -0.11 0.00 0.00 0.00 0.00 17.79 17.53 3k1q h ALA 10 CO 0.00 0.20 -0.27 0.45 0.00 0.00 0.00 179.25 179.64 3k1q h HIS 11 N 0.68 -0.70 -0.41 0.00 -0.00 -0.49 -0.61 115.15 113.63 3k1q h HIS 11 Ca 0.18 0.06 -0.05 0.00 -0.00 0.00 0.00 60.37 60.57 3k1q h HIS 11 Cb 0.08 0.39 -0.02 0.00 -0.00 0.00 0.00 27.41 27.87 3k1q h HIS 11 CO -0.01 -0.34 0.07 0.00 -0.00 0.00 0.00 177.93 177.65 3k1q h ALA 12 N 1.18 0.54 -0.33 2.45 0.00 -0.96 0.16 119.26 122.30 3k1q h ALA 12 Ca 0.25 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 55.01 3k1q h ALA 12 Cb 0.52 -0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.07 3k1q h ALA 12 CO -0.64 0.24 -0.39 1.98 0.00 0.00 0.00 179.25 180.44 3k1q h MET 13 N 0.52 -0.33 0.00 0.00 -1.53 0.07 -2.10 114.93 111.56 3k1q h MET 13 Ca 0.12 0.02 -0.03 0.00 -3.44 0.00 0.00 59.70 56.38 3k1q h MET 13 Cb 0.36 0.08 -0.00 0.00 -0.55 0.00 0.00 31.60 31.48 3k1q h MET 13 CO 0.01 -0.22 -0.14 -0.24 0.14 0.00 0.00 176.91 176.45 3k1q h VAL 14 N -0.35 0.80 -0.25 -5.77 3.04 -0.81 -1.92 116.25 110.99 3k1q h VAL 14 Ca 0.13 -0.55 -0.07 0.00 -1.01 0.00 0.00 66.70 65.20 3k1q h VAL 14 Cb 0.58 1.32 -0.01 0.00 -2.01 0.00 0.00 31.29 31.17 3k1q h VAL 14 CO -0.52 0.14 -0.16 -0.09 -1.01 0.00 0.00 177.57 175.93 3k1q h ARG 15 N 0.00 0.43 -0.59 4.17 9.65 -0.48 -0.29 114.38 127.27 3k1q h ARG 15 Ca -0.00 -0.13 -0.05 0.00 -1.10 0.00 0.00 59.98 58.70 3k1q h ARG 15 Cb 0.31 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.82 3k1q h ARG 15 CO 0.02 0.58 0.17 0.00 2.80 0.00 0.00 179.97 183.55 3k1q h ALA 16 N 1.44 1.19 -0.32 2.80 0.00 -0.72 -2.40 119.26 121.26 3k1q h ALA 16 Ca 0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3k1q h ALA 16 Cb 0.52 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3k1q h ALA 16 CO 0.03 0.56 0.14 0.00 0.00 0.00 0.00 179.25 179.98 3k1q h ALA 17 N 1.32 0.42 0.00 0.00 0.00 -1.36 -2.74 119.26 116.91 3k1q h ALA 17 Ca 0.19 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 3k1q h ALA 17 Cb 0.27 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3k1q h ALA 17 CO -0.01 0.00 -0.28 0.00 0.00 0.00 0.00 179.25 178.96 3k1q h ALA 18 N 0.99 1.33 -0.82 0.00 0.00 -0.94 -2.90 119.26 116.92 3k1q h ALA 18 Ca 0.11 -0.26 -0.52 0.00 0.00 0.00 0.00 54.91 54.24 3k1q h ALA 18 Cb 0.16 -0.05 -0.28 0.00 0.00 0.00 0.00 17.79 17.62 3k1q h ALA 18 CO -0.01 0.35 0.31 0.00 0.00 0.00 0.00 179.25 179.91 3k1q n ALA 19 N -2.40 5.54 0.00 0.00 0.00 -0.91 -4.94 120.51 117.81 3k1q n ALA 19 Ca -0.02 -3.36 0.00 0.00 0.00 0.00 0.00 53.44 50.07 3k1q n ALA 19 Cb 0.36 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.59 3k1q n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k1q n GLY 20 N -0.97 0.49 3.56 0.00 0.00 -1.06 -4.81 105.19 102.40 3k1q n GLY 20 Ca 0.53 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.25 3k1q n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k1q s ARG 21 N 0.00 2.50 -0.15 1.61 1.81 -1.07 -4.69 118.95 118.96 3k1q s ARG 21 Ca 0.00 0.07 0.00 0.00 -1.72 0.00 0.00 55.73 54.08 3k1q s ARG 21 Cb 0.00 -4.84 0.03 0.00 -0.45 0.00 0.00 34.95 29.69 3k1q s ARG 21 CO 0.00 -3.26 -0.11 -1.17 -0.68 0.00 0.00 175.30 170.08 3k1q s LEU 22 N 10.17 1.60 -1.06 2.53 2.96 -1.21 -4.61 118.68 129.06 3k1q s LEU 22 Ca 0.72 -0.50 -0.25 0.00 -0.22 0.00 0.00 54.13 53.88 3k1q s LEU 22 Cb -0.09 -1.06 -0.13 0.00 0.50 0.00 0.00 46.19 45.41 3k1q s LEU 22 CO 0.07 -0.10 2.04 0.42 -1.32 0.00 0.00 176.35 177.46 3k1q s THR 23 N 1.56 3.32 -1.35 3.68 -4.23 -1.26 -4.89 115.64 112.46 3k1q s THR 23 Ca 0.04 -0.47 -0.06 0.00 -1.18 0.00 0.00 61.69 60.01 3k1q s THR 23 Cb -0.13 -4.13 0.10 0.00 1.34 0.00 0.00 72.50 69.67 3k1q s THR 23 CO -0.09 -0.61 2.44 -0.11 -0.54 0.00 0.00 174.62 175.70 3k1q n LEU 24 N 16.31 8.11 -4.41 4.79 7.94 -1.26 -3.09 117.00 145.40 3k1q n LEU 24 Ca 0.43 -4.84 -0.43 0.00 -1.11 0.00 0.00 56.01 50.07 3k1q n LEU 24 Cb 0.46 -1.38 -0.10 0.00 0.53 0.00 0.00 43.42 42.93 3k1q n LEU 24 CO 0.62 2.06 -0.06 -0.47 -1.11 0.00 0.00 177.39 178.43 3k1q s TYR 25 N -0.80 3.25 0.50 1.96 6.04 -1.19 -0.45 117.35 126.65 3k1q s TYR 25 Ca 0.56 -0.82 -0.05 0.00 0.04 0.00 0.00 57.07 56.80 3k1q s TYR 25 Cb 0.18 -2.74 -0.02 0.00 -1.04 0.00 0.00 41.96 38.34 3k1q s TYR 25 CO -0.09 -0.68 0.79 -0.08 -1.54 0.00 0.00 175.55 173.96 3k1q s THR 26 N 1.63 4.57 0.00 4.34 -1.32 -0.54 0.78 115.64 125.10 3k1q s THR 26 Ca 0.04 0.07 0.00 0.00 -1.21 0.00 0.00 61.69 60.59 3k1q s THR 26 Cb -0.21 -3.74 0.00 0.00 -1.51 0.00 0.00 72.50 67.04 3k1q s THR 26 CO 0.08 -0.71 0.00 -2.11 -2.21 0.00 0.00 174.62 169.67 3k1q n ARG 27 N -2.30 0.00 0.01 7.08 0.00 -1.26 0.07 116.66 120.26 3k1q n ARG 27 Ca 0.01 0.00 -0.04 0.00 -0.00 0.00 0.00 57.85 57.83 3k1q n ARG 27 Cb 0.56 0.00 -0.10 0.00 -0.00 0.00 0.00 32.46 32.91 3k1q n ARG 27 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.63 179.42 3k1q h THR 28 N 0.00 0.66 -3.72 8.89 1.35 -2.01 -3.48 112.91 114.60 3k1q h THR 28 Ca 0.00 -2.31 -0.64 0.00 -0.55 0.00 0.00 66.41 62.91 3k1q h THR 28 Cb 0.00 2.21 -0.19 0.00 -1.73 0.00 0.00 68.15 68.44 3k1q h THR 28 CO 0.00 0.38 -0.56 -0.60 -0.25 0.00 0.00 175.52 174.48 3k1q s ARG 29 N -2.79 3.84 0.51 4.72 3.52 0.11 -5.01 118.95 123.85 3k1q s ARG 29 Ca -0.03 -0.38 0.20 0.00 -0.13 0.00 0.00 55.73 55.39 3k1q s ARG 29 Cb 0.08 -3.48 1.28 0.00 -1.56 0.00 0.00 34.95 31.28 3k1q s ARG 29 CO 0.82 -0.12 2.04 1.15 -0.81 0.00 0.00 175.30 178.37 3k1q h THR 30 N 5.37 0.85 -4.16 4.11 2.02 -1.89 -1.43 112.91 117.77 3k1q h THR 30 Ca -0.37 -0.03 -0.46 0.00 0.77 0.00 0.00 66.41 66.32 3k1q h THR 30 Cb 1.18 0.74 -0.29 0.00 -1.74 0.00 0.00 68.15 68.05 3k1q h THR 30 CO 0.58 0.02 -0.80 -0.70 0.37 0.00 0.00 175.52 174.99 3k1q s GLU 31 N -5.11 1.04 -0.96 6.66 2.56 -1.26 -3.48 118.70 118.14 3k1q s GLU 31 Ca -0.06 -0.48 -0.20 0.00 0.00 0.00 0.00 54.97 54.23 3k1q s GLU 31 Cb 0.19 -1.00 -0.10 0.00 2.00 0.00 0.00 34.13 35.21 3k1q s GLU 31 CO 0.72 0.27 1.98 2.41 -0.56 0.00 0.00 175.26 180.09 3k1q n THR 32 N 2.71 2.23 0.28 -1.70 -1.04 0.40 -4.73 114.28 112.45 3k1q n THR 32 Ca -0.14 -2.00 -0.12 0.00 -2.04 0.00 0.00 64.05 59.75 3k1q n THR 32 Cb 0.56 -2.37 -0.06 0.00 -1.82 0.00 0.00 70.33 66.64 3k1q n THR 32 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 3k1q h THR 33 N 4.55 0.00 -4.31 12.58 1.35 -1.90 -3.45 112.91 121.72 3k1q h THR 33 Ca 0.44 -0.40 -0.50 0.00 -0.55 0.00 0.00 66.41 65.40 3k1q h THR 33 Cb 0.69 0.00 0.05 0.00 -1.73 0.00 0.00 68.15 67.17 3k1q h THR 33 CO 1.87 0.00 0.40 0.54 -0.25 0.00 0.00 175.52 178.09 3k1q s ASN 34 N -4.55 6.21 0.00 5.36 2.20 -1.26 -4.96 114.94 117.93 3k1q s ASN 34 Ca -0.11 1.49 0.00 0.00 -0.94 0.00 0.00 52.86 53.30 3k1q s ASN 34 Cb 0.01 -2.48 0.00 0.00 -2.00 0.00 0.00 41.25 36.78 3k1q s ASN 34 CO 0.34 -0.88 0.66 0.33 -2.94 0.00 0.00 177.10 174.61 3k1q n PHE 35 N -2.50 0.00 -2.63 1.54 -0.00 -1.26 -4.64 117.46 107.96 3k1q n PHE 35 Ca 0.06 -0.33 -0.43 0.00 -0.00 0.00 0.00 57.45 56.75 3k1q n PHE 35 Cb 0.54 -0.22 0.00 0.00 -0.00 0.00 0.00 39.48 39.80 3k1q n PHE 35 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 3k1q n ASP 36 N 0.92 5.03 0.00 -2.13 2.03 -1.26 -4.68 116.55 116.46 3k1q n ASP 36 Ca 0.00 -2.99 0.00 0.00 0.52 0.00 0.00 54.79 52.32 3k1q n ASP 36 Cb 0.28 -1.59 0.00 0.00 -0.72 0.00 0.00 41.12 39.08 3k1q n ASP 36 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3k1q n HIS 37 N 5.80 0.00 -0.88 -0.67 -0.00 -1.26 -4.73 115.22 113.48 3k1q n HIS 37 Ca 0.41 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.80 3k1q n HIS 37 Cb 0.42 0.00 0.13 0.00 -0.00 0.00 0.00 29.99 30.54 3k1q n HIS 37 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3k1q n ALA 38 N 0.00 -1.37 -0.01 1.59 0.00 -1.26 -4.31 120.51 115.15 3k1q n ALA 38 Ca 0.00 -0.49 -0.02 0.00 0.00 0.00 0.00 53.44 52.93 3k1q n ALA 38 Cb 0.00 -2.02 -0.02 0.00 0.00 0.00 0.00 19.45 17.41 3k1q n ALA 38 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3k1q n GLU 39 N -2.69 1.48 -3.59 0.00 2.13 0.55 -0.27 120.64 118.26 3k1q n GLU 39 Ca 0.10 0.01 -0.29 0.00 0.66 0.00 0.00 57.16 57.65 3k1q n GLU 39 Cb 0.52 -1.06 -0.12 0.00 0.27 0.00 0.00 31.44 31.05 3k1q n GLU 39 CO 0.00 0.00 0.00 1.52 -0.41 0.00 0.00 177.13 178.24 3k1q s TYR 40 N -2.06 1.59 -0.47 4.31 -0.85 0.23 -3.79 117.35 116.32 3k1q s TYR 40 Ca -0.03 -2.28 -0.13 0.00 -0.52 0.00 0.00 57.07 54.11 3k1q s TYR 40 Cb 0.01 -1.48 0.09 0.00 0.38 0.00 0.00 41.96 40.96 3k1q s TYR 40 CO 0.08 -0.78 0.37 0.08 -1.52 0.00 0.00 175.55 173.78 3k1q s VAL 41 N 0.29 4.81 -1.07 -3.49 1.01 0.10 -3.19 120.40 118.86 3k1q s VAL 41 Ca 0.22 -1.33 -0.26 0.00 0.00 0.00 0.00 61.98 60.61 3k1q s VAL 41 Cb -0.15 -3.97 -0.22 0.00 0.00 0.00 0.00 36.38 32.04 3k1q s VAL 41 CO -0.06 -0.64 2.07 0.35 0.00 0.00 0.00 175.10 176.82 3k1q n THR 42 N 5.09 0.34 -2.70 3.92 -2.24 -1.26 -0.74 114.28 116.70 3k1q n THR 42 Ca -0.11 -0.35 -0.43 0.00 -2.27 0.00 0.00 64.05 60.88 3k1q n THR 42 Cb 0.42 -2.03 0.00 0.00 -2.10 0.00 0.00 70.33 66.62 3k1q n THR 42 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k1q n GLY 44 N 3.99 -1.20 4.31 0.00 0.00 -1.26 -1.86 105.19 109.17 3k1q n GLY 44 Ca 0.40 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.94 3k1q n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k1q n ARG 45 N -2.80 0.00 -2.02 1.61 5.12 -1.26 -4.97 116.66 112.33 3k1q n ARG 45 Ca -0.16 0.00 -0.28 0.00 -1.93 0.00 0.00 57.85 55.48 3k1q n ARG 45 Cb 0.60 -0.65 -0.05 0.00 -1.16 0.00 0.00 32.46 31.21 3k1q n ARG 45 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 3k1q s TYR 46 N -0.02 1.75 -0.94 -1.55 2.02 -0.78 -4.89 117.35 112.95 3k1q s TYR 46 Ca 0.00 0.71 -0.26 0.00 -0.37 0.00 0.00 57.07 57.15 3k1q s TYR 46 Cb 0.00 -4.02 -0.17 0.00 -0.40 0.00 0.00 41.96 37.37 3k1q s TYR 46 CO 0.00 -1.82 2.24 0.95 -1.57 0.00 0.00 175.55 175.35 3k1q s THR 47 N 10.15 3.06 0.24 -0.71 -4.23 -1.25 0.11 115.64 123.01 3k1q s THR 47 Ca 0.71 -0.08 -0.31 0.00 -1.18 0.00 0.00 61.69 60.83 3k1q s THR 47 Cb -0.08 -3.56 -0.12 0.00 1.34 0.00 0.00 72.50 70.08 3k1q s THR 47 CO 0.03 -0.11 1.61 -0.38 -0.54 0.00 0.00 174.62 175.23 3k1q n ILE 48 N 8.83 0.52 -3.91 2.99 5.41 0.09 -1.72 119.36 131.57 3k1q n ILE 48 Ca 0.44 -0.13 -0.30 0.00 1.00 0.00 0.00 62.75 63.75 3k1q n ILE 48 Cb 0.45 -1.85 -0.15 0.00 -0.71 0.00 0.00 39.64 37.38 3k1q n ILE 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3k1q h ALA 50 N 7.85 1.72 -0.71 0.00 0.00 -0.85 0.30 119.26 127.57 3k1q h ALA 50 Ca -0.11 -0.15 0.25 0.00 0.00 0.00 0.00 54.91 54.90 3k1q h ALA 50 Cb 1.03 -0.03 -0.13 0.00 0.00 0.00 0.00 17.79 18.66 3k1q h ALA 50 CO 0.47 0.21 0.21 1.19 0.00 0.00 0.00 179.25 181.34 3k1q n PHE 51 N -4.34 0.66 -0.50 0.00 3.72 -0.97 -2.14 117.46 113.88 3k1q n PHE 51 Ca -0.02 0.85 0.01 0.00 -0.05 0.00 0.00 57.45 58.24 3k1q n PHE 51 Cb 0.23 -1.16 0.01 0.00 -0.94 0.00 0.00 39.48 37.62 3k1q n PHE 51 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k1q n LEU 53 N -0.41 0.00 0.00 0.00 4.77 -0.66 -4.13 117.00 116.56 3k1q n LEU 53 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 3k1q n LEU 53 Cb 0.38 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 3k1q n LEU 53 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.39 176.47 3k1q n THR 54 N -0.22 0.00 -4.02 -5.08 -1.04 -1.24 -4.62 114.28 98.05 3k1q n THR 54 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 3k1q n THR 54 Cb 0.00 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.40 3k1q n THR 54 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 3k1q s THR 55 N 0.00 0.32 0.00 12.58 -4.23 -1.26 -0.72 115.64 122.33 3k1q s THR 55 Ca 0.00 -1.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.50 3k1q s THR 55 Cb 0.00 -0.45 0.00 0.00 1.34 0.00 0.00 72.50 73.39 3k1q s THR 55 CO 0.00 -0.45 0.00 0.18 -0.54 0.00 0.00 174.62 173.81 3k1q n LEU 56 N 1.51 0.00 -4.73 4.79 4.77 -0.70 -4.73 117.00 117.91 3k1q n LEU 56 Ca -0.23 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.41 3k1q n LEU 56 Cb 0.55 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.56 3k1q n LEU 56 CO 0.20 0.00 -0.28 0.00 -1.33 0.00 0.00 177.39 175.98 3k1q s ALA 57 N 0.00 3.44 0.62 -1.18 0.00 -1.26 -4.84 121.76 118.54 3k1q s ALA 57 Ca 0.00 -0.87 -0.19 0.00 0.00 0.00 0.00 51.96 50.91 3k1q s ALA 57 Cb 0.00 -1.51 -0.02 0.00 0.00 0.00 0.00 23.12 21.59 3k1q s ALA 57 CO 0.00 0.65 1.31 -1.25 0.00 0.00 0.00 175.76 176.47 3k1q s PRO 58 N -1.43 2.69 0.18 0.00 0.04 -1.26 -4.49 135.00 130.73 3k1q s PRO 58 Ca 0.19 2.10 -0.11 0.00 0.04 0.00 0.00 61.00 63.23 3k1q s PRO 58 Cb -0.12 -1.94 0.09 0.00 0.04 0.00 0.00 34.50 32.57 3k1q s PRO 58 CO 0.09 -1.50 1.72 0.45 0.04 0.00 0.00 177.00 177.80 3k1q h HIS 59 N 0.76 1.00 -4.43 0.56 3.86 -1.90 -3.46 115.15 111.55 3k1q h HIS 59 Ca -0.51 -0.10 -0.36 0.00 -1.16 0.00 0.00 60.37 58.25 3k1q h HIS 59 Cb 1.33 -0.29 -0.10 0.00 1.06 0.00 0.00 27.41 29.41 3k1q h HIS 59 CO 0.42 0.81 -0.30 0.00 0.86 0.00 0.00 177.93 179.73 3k1q s ALA 60 N -5.44 1.21 -0.89 2.45 0.00 -1.26 -5.02 121.76 112.81 3k1q s ALA 60 Ca -0.13 -1.75 0.02 0.00 0.00 0.00 0.00 51.96 50.10 3k1q s ALA 60 Cb 0.13 1.28 0.10 0.00 0.00 0.00 0.00 23.12 24.63 3k1q s ALA 60 CO 0.81 -0.74 0.66 0.09 0.00 0.00 0.00 175.76 176.58 3k1q n ASN 61 N -1.50 1.60 -4.30 0.00 4.13 -1.26 -4.73 115.26 109.21 3k1q n ASN 61 Ca 0.03 -2.11 -0.44 0.00 1.68 0.00 0.00 54.58 53.75 3k1q n ASN 61 Cb 0.62 -0.52 -0.01 0.00 -1.54 0.00 0.00 39.78 38.33 3k1q n ASN 61 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 3k1q n VAL 62 N 0.08 4.39 0.24 2.41 0.31 -1.26 -4.89 118.33 119.61 3k1q n VAL 62 Ca 0.03 -5.37 0.16 0.00 -0.01 0.00 0.00 64.34 59.16 3k1q n VAL 62 Cb 0.37 -2.55 0.69 0.00 -0.91 0.00 0.00 33.84 31.44 3k1q n VAL 62 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 3k1q h LYS 63 N 6.52 0.00 0.03 5.55 6.56 -1.98 -0.68 116.57 132.57 3k1q h LYS 63 Ca 0.18 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.77 3k1q h LYS 63 Cb 0.86 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.52 3k1q h LYS 63 CO 1.01 0.00 -0.01 1.79 -2.06 0.00 0.00 179.45 180.17 3k1q h THR 64 N 0.00 1.11 -0.18 -0.16 1.35 -1.98 0.53 112.91 113.58 3k1q h THR 64 Ca 0.08 -0.45 -0.13 0.00 -0.55 0.00 0.00 66.41 65.36 3k1q h THR 64 Cb 1.04 1.42 -0.01 0.00 -1.73 0.00 0.00 68.15 68.86 3k1q h THR 64 CO -0.00 0.12 -0.45 0.16 -0.25 0.00 0.00 175.52 175.10 3k1q h ILE 65 N -0.24 1.31 -0.54 6.82 3.07 -1.59 -2.01 117.51 124.34 3k1q h ILE 65 Ca -0.00 -1.63 -0.03 0.00 1.55 0.00 0.00 64.86 64.74 3k1q h ILE 65 Cb 0.22 1.66 -0.02 0.00 -0.27 0.00 0.00 36.82 38.41 3k1q h ILE 65 CO 0.01 0.50 0.21 1.56 -1.05 0.00 0.00 178.15 179.38 3k1q h GLN 66 N 0.36 0.81 -0.36 0.16 7.50 -1.22 0.17 115.11 122.54 3k1q h GLN 66 Ca 0.03 -0.15 -0.06 0.00 0.50 0.00 0.00 58.65 58.97 3k1q h GLN 66 Cb 0.93 -0.13 -0.02 0.00 0.05 0.00 0.00 27.48 28.31 3k1q h GLN 66 CO 0.08 0.71 -0.02 -0.44 -1.50 0.00 0.00 178.83 177.66 3k1q h ASP 67 N 0.74 0.54 -0.56 1.46 3.32 -0.98 -2.61 116.42 118.32 3k1q h ASP 67 Ca 0.18 -0.11 0.02 0.00 0.02 0.00 0.00 57.03 57.14 3k1q h ASP 67 Cb 0.21 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 3k1q h ASP 67 CO -0.01 0.63 0.35 0.28 -1.72 0.00 0.00 179.24 178.76 3k1q h SER 68 N 0.54 0.57 -0.84 6.45 0.02 -1.03 0.53 113.55 119.80 3k1q h SER 68 Ca 0.11 -0.00 0.21 0.00 -0.84 0.00 0.00 61.79 61.27 3k1q h SER 68 Cb 0.38 -0.12 -0.14 0.00 0.14 0.00 0.00 62.40 62.65 3k1q h SER 68 CO 0.02 0.40 0.08 0.45 -1.14 0.00 0.00 176.83 176.64 3k1q h HIS 69 N 0.69 0.07 0.15 3.45 3.86 -0.31 -0.57 115.15 122.49 3k1q h HIS 69 Ca 0.22 0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.48 3k1q h HIS 69 Cb -0.00 0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.57 3k1q h HIS 69 CO -0.05 -0.27 -0.08 0.00 0.86 0.00 0.00 177.93 178.39 3k1q h ALA 70 N 1.78 -1.04 -1.07 2.45 0.00 -1.09 -3.04 119.26 117.25 3k1q h ALA 70 Ca 0.49 -0.05 0.38 0.00 0.00 0.00 0.00 54.91 55.74 3k1q h ALA 70 Cb 0.94 0.10 -0.12 0.00 0.00 0.00 0.00 17.79 18.71 3k1q h ALA 70 CO -0.71 -1.02 0.67 0.00 0.00 0.00 0.00 179.25 178.18 3k1q h SER 72 N 0.00 0.19 -0.29 0.00 0.02 -0.98 0.23 113.55 112.72 3k1q h SER 72 Ca 0.71 0.10 -0.15 0.00 -0.84 0.00 0.00 61.79 61.62 3k1q h SER 72 Cb 2.22 0.10 -0.09 0.00 0.14 0.00 0.00 62.40 64.77 3k1q h SER 72 CO -0.43 0.09 0.19 -2.11 -1.14 0.00 0.00 176.83 173.43 3k1q n ARG 73 N -5.03 1.40 -0.34 3.45 1.85 0.16 -4.33 116.66 113.81 3k1q n ARG 73 Ca 0.11 -0.89 0.17 0.00 -1.00 0.00 0.00 57.85 56.25 3k1q n ARG 73 Cb 0.35 -1.36 0.40 0.00 -1.05 0.00 0.00 32.46 30.79 3k1q n ARG 73 CO 0.00 0.00 0.00 0.37 -0.01 0.00 0.00 177.63 177.99 3k1q h GLN 74 N 0.33 0.58 -0.86 2.89 5.75 -0.45 0.12 115.11 123.47 3k1q h GLN 74 Ca 0.18 -0.03 0.07 0.00 -0.15 0.00 0.00 58.65 58.71 3k1q h GLN 74 Cb 1.53 -0.13 -0.06 0.00 1.07 0.00 0.00 27.48 29.89 3k1q h GLN 74 CO 0.32 0.38 0.56 -1.35 -2.65 0.00 0.00 178.83 176.09 3k1q h PRO 75 N 0.59 0.92 -0.04 -2.39 0.11 -1.82 -2.43 132.00 126.94 3k1q h PRO 75 Ca 0.60 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 66.58 3k1q h PRO 75 Cb 1.18 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3k1q h PRO 75 CO -0.39 0.61 -0.27 -0.97 -0.21 0.00 0.00 178.00 176.77 3k1q h ASN 76 N 0.95 0.31 0.27 -2.05 -0.73 -1.31 0.21 115.58 113.23 3k1q h ASN 76 Ca 0.37 -0.69 0.01 0.00 1.87 0.00 0.00 56.30 57.86 3k1q h ASN 76 Cb 0.22 -0.09 -0.03 0.00 0.27 0.00 0.00 38.32 38.69 3k1q h ASN 76 CO -0.13 0.95 -0.37 -0.08 -0.37 0.00 0.00 177.43 177.43 3k1q h GLU 77 N -0.31 -0.67 -0.83 6.67 4.81 -0.92 -1.54 114.58 121.79 3k1q h GLU 77 Ca -0.02 0.05 0.13 0.00 -0.13 0.00 0.00 59.36 59.38 3k1q h GLU 77 Cb 0.96 0.15 -0.09 0.00 0.63 0.00 0.00 28.75 30.40 3k1q h GLU 77 CO 0.06 -0.44 0.44 0.00 -0.73 0.00 0.00 179.01 178.33 3k1q h ALA 78 N -0.20 1.22 -0.41 2.92 0.00 -1.38 -1.18 119.26 120.24 3k1q h ALA 78 Ca -0.01 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3k1q h ALA 78 Cb 0.66 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3k1q h ALA 78 CO -0.12 -0.03 0.11 -0.84 0.00 0.00 0.00 179.25 178.36 3k1q h ILE 79 N 0.67 1.23 0.17 0.00 3.07 -0.96 -1.28 117.51 120.40 3k1q h ILE 79 Ca 0.43 -0.76 0.01 0.00 1.55 0.00 0.00 64.86 66.09 3k1q h ILE 79 Cb 0.54 0.95 -0.02 0.00 -0.27 0.00 0.00 36.82 38.03 3k1q h ILE 79 CO -0.32 0.27 -0.20 -0.09 -1.05 0.00 0.00 178.15 176.76 3k1q h ARG 80 N 0.51 -0.39 -0.69 0.16 1.12 -0.62 -0.31 114.38 114.17 3k1q h ARG 80 Ca 0.13 0.03 0.02 0.00 -1.11 0.00 0.00 59.98 59.05 3k1q h ARG 80 Cb 0.30 0.09 -0.04 0.00 -0.01 0.00 0.00 29.97 30.30 3k1q h ARG 80 CO -0.00 -0.26 0.43 0.77 -3.11 0.00 0.00 179.97 177.80 3k1q h SER 81 N -0.41 0.72 -0.30 -3.80 0.02 -1.05 -1.94 113.55 106.79 3k1q h SER 81 Ca 0.01 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 3k1q h SER 81 Cb 0.40 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 3k1q h SER 81 CO -0.07 0.51 0.13 0.25 -1.14 0.00 0.00 176.83 176.51 3k1q h LEU 82 N 0.86 0.40 -0.54 5.07 5.85 -0.94 0.94 115.31 126.95 3k1q h LEU 82 Ca 0.27 -0.14 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 3k1q h LEU 82 Cb -0.01 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 3k1q h LEU 82 CO -0.10 0.43 -0.18 0.58 -0.34 0.00 0.00 178.44 178.84 3k1q h VAL 83 N 0.34 1.27 0.06 1.05 2.07 -1.00 0.01 116.25 120.04 3k1q h VAL 83 Ca 0.10 -1.34 0.01 0.00 0.82 0.00 0.00 66.70 66.29 3k1q h VAL 83 Cb 0.15 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 3k1q h VAL 83 CO -0.01 0.47 -0.30 -0.33 0.02 0.00 0.00 177.57 177.42 3k1q h GLU 84 N 0.87 -0.40 -0.19 1.57 4.39 -0.32 -1.85 114.58 118.64 3k1q h GLU 84 Ca 0.12 0.03 0.02 0.00 0.34 0.00 0.00 59.36 59.86 3k1q h GLU 84 Cb 0.75 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.47 3k1q h GLU 84 CO 0.06 -0.27 -0.11 0.28 -1.16 0.00 0.00 179.01 177.81 3k1q n VAL 85 N -4.14 -0.13 -0.15 3.13 0.31 0.17 -1.16 118.33 116.37 3k1q n VAL 85 Ca -0.05 1.31 0.19 0.00 -0.01 0.00 0.00 64.34 65.78 3k1q n VAL 85 Cb 0.23 -1.70 0.57 0.00 -0.91 0.00 0.00 33.84 32.03 3k1q n VAL 85 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3k1q h SER 86 N 0.00 0.26 -1.09 4.52 0.02 -0.81 0.72 113.55 117.18 3k1q h SER 86 Ca 0.03 0.02 -0.68 0.00 -0.84 0.00 0.00 61.79 60.32 3k1q h SER 86 Cb 0.08 -0.03 -0.30 0.00 0.14 0.00 0.00 62.40 62.29 3k1q h SER 86 CO -0.18 0.13 0.76 0.47 -1.14 0.00 0.00 176.83 176.87 3k1q n ASP 87 N -4.44 7.47 0.00 3.07 8.00 -0.31 -4.04 116.55 126.30 3k1q n ASP 87 Ca 0.15 -3.79 0.00 0.00 0.71 0.00 0.00 54.79 51.86 3k1q n ASP 87 Cb 0.63 -0.94 0.00 0.00 -0.02 0.00 0.00 41.12 40.80 3k1q n ASP 87 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3k1q n LYS 88 N -0.86 0.00 -3.65 -1.24 5.02 -0.55 -1.71 118.16 115.17 3k1q n LYS 88 Ca 0.60 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.89 3k1q n LYS 88 Cb 0.64 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.58 3k1q n LYS 88 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k1q s ALA 89 N -1.83 -2.48 0.27 7.82 0.00 0.25 -3.28 121.76 122.51 3k1q s ALA 89 Ca 0.00 2.05 -0.20 0.00 0.00 0.00 0.00 51.96 53.81 3k1q s ALA 89 Cb 0.00 -1.85 0.06 0.00 0.00 0.00 0.00 23.12 21.32 3k1q s ALA 89 CO 0.00 -0.32 0.89 1.14 0.00 0.00 0.00 175.76 177.47 3k1q s GLN 90 N 1.09 1.71 -0.48 0.00 1.03 -1.26 -3.99 119.66 117.76 3k1q s GLN 90 Ca -0.07 -1.06 -0.21 0.00 0.04 0.00 0.00 55.36 54.05 3k1q s GLN 90 Cb -0.03 0.51 -0.12 0.00 0.03 0.00 0.00 33.01 33.39 3k1q s GLN 90 CO -0.12 -0.80 1.47 0.25 -2.54 0.00 0.00 175.29 173.56 3k1q n THR 91 N -0.56 0.00 -1.65 3.63 -2.24 -1.26 -4.77 114.28 107.43 3k1q n THR 91 Ca -0.06 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.33 3k1q n THR 91 Cb 0.60 -0.30 0.03 0.00 -2.10 0.00 0.00 70.33 68.56 3k1q n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k1q n ALA 92 N 5.54 0.60 -1.61 6.98 0.00 -1.26 -4.76 120.51 126.00 3k1q n ALA 92 Ca 0.37 0.13 -0.15 0.00 0.00 0.00 0.00 53.44 53.79 3k1q n ALA 92 Cb 0.00 -2.17 -0.11 0.00 0.00 0.00 0.00 19.45 17.17 3k1q n ALA 92 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3k1q s LEU 93 N -1.77 2.37 -0.73 0.00 2.96 -1.26 -4.84 118.68 115.41 3k1q s LEU 93 Ca 0.69 -0.96 -0.23 0.00 -0.22 0.00 0.00 54.13 53.40 3k1q s LEU 93 Cb -0.47 -2.60 0.07 0.00 0.50 0.00 0.00 46.19 43.69 3k1q s LEU 93 CO 0.52 -4.75 1.08 -0.69 -1.32 0.00 0.00 176.35 171.20 3k1q s VAL 94 N 16.97 4.20 0.48 1.68 1.01 -1.26 -4.85 120.40 138.63 3k1q s VAL 94 Ca 0.82 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.47 3k1q s VAL 94 Cb -0.05 -4.77 0.00 0.00 0.00 0.00 0.00 36.38 31.56 3k1q s VAL 94 CO 0.18 -1.59 0.00 0.61 0.00 0.00 0.00 175.10 174.30 3k1q n GLY 95 N 5.45 -3.48 2.86 4.51 0.00 -1.26 -1.55 105.19 111.72 3k1q n GLY 95 Ca 0.03 -1.05 -0.19 0.00 0.00 0.00 0.00 46.02 44.81 3k1q n GLY 95 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3k1q s SER 96 N -5.83 0.71 0.10 1.61 0.15 -1.26 -1.99 113.70 107.19 3k1q s SER 96 Ca 0.00 -0.09 -0.29 0.00 0.70 0.00 0.00 55.95 56.27 3k1q s SER 96 Cb 0.00 -0.35 -0.11 0.00 -1.71 0.00 0.00 66.02 63.85 3k1q s SER 96 CO 0.00 -0.07 1.48 0.03 1.20 0.00 0.00 173.24 175.88 3k1q h ARG 97 N 7.19 -0.49 -1.94 5.44 3.08 -1.88 -3.33 114.38 122.45 3k1q h ARG 97 Ca -0.40 0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.64 3k1q h ARG 97 Cb 1.14 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 31.29 3k1q h ARG 97 CO 0.48 -0.33 0.05 0.25 -1.07 0.00 0.00 179.97 179.35 3k1q n THR 98 N -5.04 2.11 0.00 2.04 -2.24 -1.26 -4.91 114.28 104.97 3k1q n THR 98 Ca -0.05 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 3k1q n THR 98 Cb 0.33 -1.48 0.00 0.00 -2.10 0.00 0.00 70.33 67.07 3k1q n THR 98 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3k1q n VAL 99 N 1.36 0.00 -2.87 2.28 0.31 -1.25 -4.07 118.33 114.08 3k1q n VAL 99 Ca 0.04 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.37 3k1q n VAL 99 Cb 0.51 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.45 3k1q n VAL 99 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3k1q s ASP 100 N -4.00 -0.83 -0.06 4.52 2.15 -1.26 -4.89 116.67 112.30 3k1q s ASP 100 Ca 0.00 -0.60 0.13 0.00 0.43 0.00 0.00 52.55 52.51 3k1q s ASP 100 Cb 0.00 1.07 0.49 0.00 -0.30 0.00 0.00 42.92 44.17 3k1q s ASP 100 CO 0.00 -0.07 1.36 -1.22 -0.17 0.00 0.00 175.17 175.07 3k1q n TYR 101 N 3.58 0.95 -4.23 -5.34 4.02 -0.35 -4.92 117.16 110.87 3k1q n TYR 101 Ca 0.10 -0.39 -0.13 0.00 -0.01 0.00 0.00 57.90 57.46 3k1q n TYR 101 Cb 0.61 -0.15 -0.10 0.00 -0.02 0.00 0.00 39.34 39.68 3k1q n TYR 101 CO 0.00 0.00 0.00 -3.38 -1.01 0.00 0.00 176.86 172.47 3k1q s HIS 102 N -1.66 1.18 -0.14 -0.72 -3.43 -1.26 -1.00 115.29 108.26 3k1q s HIS 102 Ca 0.35 -0.92 -0.12 0.00 -0.80 0.00 0.00 55.06 53.57 3k1q s HIS 102 Cb 0.22 -0.66 0.04 0.00 -1.43 0.00 0.00 32.58 30.75 3k1q s HIS 102 CO 0.18 -0.10 0.37 -2.00 -2.00 0.00 0.00 174.74 171.19 3k1q s GLU 103 N -3.85 0.42 -0.72 -0.38 2.56 -0.40 -5.02 118.70 111.31 3k1q s GLU 103 Ca 0.19 0.54 -0.06 0.00 0.00 0.00 0.00 54.97 55.64 3k1q s GLU 103 Cb 0.05 0.18 0.19 0.00 2.00 0.00 0.00 34.13 36.54 3k1q s GLU 103 CO 0.01 -0.07 0.58 -1.17 -0.56 0.00 0.00 175.26 174.06 3k1q s LEU 104 N 0.34 5.71 -1.04 2.70 2.96 -1.26 -2.06 118.68 126.04 3k1q s LEU 104 Ca -0.01 -2.92 -0.09 0.00 -0.22 0.00 0.00 54.13 50.89 3k1q s LEU 104 Cb -0.03 -1.97 0.26 0.00 0.50 0.00 0.00 46.19 44.95 3k1q s LEU 104 CO -0.01 -0.40 1.01 -1.81 -1.32 0.00 0.00 176.35 173.82 3k1q s ASP 105 N 1.01 7.05 0.00 3.68 -0.00 0.11 -4.93 116.67 123.58 3k1q s ASP 105 Ca 0.19 -3.47 -0.02 0.00 -0.00 0.00 0.00 52.55 49.25 3k1q s ASP 105 Cb -0.16 -2.17 -0.08 0.00 -0.00 0.00 0.00 42.92 40.52 3k1q s ASP 105 CO -0.06 -0.32 1.91 1.33 -0.00 0.00 0.00 175.17 178.04 3k1q n VAL 106 N 2.85 1.67 -3.21 -1.27 0.24 -1.26 -1.66 118.33 115.68 3k1q n VAL 106 Ca 0.22 -0.63 -0.36 0.00 -2.04 0.00 0.00 64.34 61.53 3k1q n VAL 106 Cb 0.40 -1.55 -0.03 0.00 -1.47 0.00 0.00 33.84 31.19 3k1q n VAL 106 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3k1q n LYS 107 N 2.06 3.57 0.00 7.34 5.02 -1.26 -4.83 118.16 130.07 3k1q n LYS 107 Ca 0.12 -4.60 0.00 0.00 -2.02 0.00 0.00 58.31 51.81 3k1q n LYS 107 Cb 0.47 -2.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.08 3k1q n LYS 107 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k1q n ALA 108 N 1.18 0.00 -2.60 7.82 0.00 -1.26 -4.50 120.51 121.15 3k1q n ALA 108 Ca 0.27 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.31 3k1q n ALA 108 Cb 0.37 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.74 3k1q n ALA 108 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3k1q s GLY 109 N 0.00 1.81 -0.79 0.00 0.00 -1.26 -4.11 107.32 102.97 3k1q s GLY 109 Ca 0.00 -0.70 -0.26 0.00 0.00 0.00 0.00 44.72 43.76 3k1q s GLY 109 CO 0.00 1.33 1.62 -1.36 0.00 0.00 0.00 173.10 174.70 3k1q s PHE 110 N 2.45 2.04 -1.03 1.90 0.40 0.21 -4.82 117.98 119.13 3k1q s PHE 110 Ca 0.22 0.19 -0.23 0.00 -0.60 0.00 0.00 56.93 56.51 3k1q s PHE 110 Cb -0.15 -4.36 0.00 0.00 0.51 0.00 0.00 43.02 39.01 3k1q s PHE 110 CO 0.11 -2.06 1.72 0.08 0.70 0.00 0.00 175.22 175.78 3k1q s VAL 111 N 7.46 3.73 -0.59 -0.44 1.01 -0.67 -2.33 120.40 128.58 3k1q s VAL 111 Ca 0.54 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.74 3k1q s VAL 111 Cb -0.08 -4.63 0.15 0.00 0.00 0.00 0.00 36.38 31.82 3k1q s VAL 111 CO 0.09 -1.48 0.37 0.00 0.00 0.00 0.00 175.10 174.09 3k1q s ALA 112 N 7.47 3.49 0.14 5.51 0.00 0.14 0.04 121.76 138.55 3k1q s ALA 112 Ca 0.58 -3.32 -0.30 0.00 0.00 0.00 0.00 51.96 48.92 3k1q s ALA 112 Cb -0.02 -2.42 -0.07 0.00 0.00 0.00 0.00 23.12 20.61 3k1q s ALA 112 CO -0.02 -2.07 1.11 -1.25 0.00 0.00 0.00 175.76 173.53 3k1q s PRO 113 N -0.28 4.55 -0.26 0.00 0.04 -0.87 -0.90 135.00 137.28 3k1q s PRO 113 Ca 0.18 1.71 -0.05 0.00 0.04 0.00 0.00 61.00 62.87 3k1q s PRO 113 Cb -0.22 -3.31 -0.00 0.00 0.04 0.00 0.00 34.50 31.01 3k1q s PRO 113 CO -0.02 -0.01 0.03 0.99 0.04 0.00 0.00 177.00 178.02 3k1q s THR 114 N 0.15 3.75 -0.13 1.26 2.01 0.13 -1.28 115.64 121.54 3k1q s THR 114 Ca 0.52 -0.54 0.01 0.00 0.31 0.00 0.00 61.69 61.98 3k1q s THR 114 Cb -0.29 -2.82 0.02 0.00 0.01 0.00 0.00 72.50 69.42 3k1q s THR 114 CO 0.33 0.26 -0.13 0.00 -0.69 0.00 0.00 174.62 174.38 3k1q s ALA 115 N 1.50 1.69 0.00 7.40 0.00 -0.17 -0.58 121.76 131.61 3k1q s ALA 115 Ca 0.04 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.23 3k1q s ALA 115 Cb -0.16 -0.94 0.00 0.00 0.00 0.00 0.00 23.12 22.02 3k1q s ALA 115 CO 0.00 -0.28 0.00 -3.47 0.00 0.00 0.00 175.76 172.02 3k1q n ASP 116 N 4.59 0.00 -3.61 0.00 -0.08 0.93 -3.65 116.55 114.73 3k1q n ASP 116 Ca -0.17 0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 52.79 3k1q n ASP 116 Cb 0.50 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.91 3k1q n ASP 116 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 3k1q n GLU 117 N 0.00 3.05 0.00 -0.67 1.02 -1.26 -4.26 120.64 118.53 3k1q n GLU 117 Ca 0.00 -4.64 0.00 0.00 -0.02 0.00 0.00 57.16 52.50 3k1q n GLU 117 Cb 0.00 -2.33 0.00 0.00 -0.02 0.00 0.00 31.44 29.09 3k1q n GLU 117 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3k1q n THR 118 N 1.05 0.00 -3.91 2.62 -2.24 -1.24 -4.14 114.28 106.41 3k1q n THR 118 Ca 0.28 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 62.09 3k1q n THR 118 Cb 0.39 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.63 3k1q n THR 118 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 3k1q s ILE 119 N 0.00 0.00 -0.48 2.28 -4.36 -0.73 -1.21 121.20 116.70 3k1q s ILE 119 Ca 0.00 -0.18 0.03 0.00 -0.26 0.00 0.00 60.65 60.24 3k1q s ILE 119 Cb 0.00 -2.77 0.14 0.00 1.25 0.00 0.00 42.46 41.08 3k1q s ILE 119 CO 0.00 0.00 0.28 0.00 0.24 0.00 0.00 174.94 175.46 3k1q s ALA 120 N -2.09 2.48 0.22 2.27 0.00 -1.21 -0.92 121.76 122.51 3k1q s ALA 120 Ca 0.26 -2.84 -0.08 0.00 0.00 0.00 0.00 51.96 49.30 3k1q s ALA 120 Cb 0.01 -1.94 0.17 0.00 0.00 0.00 0.00 23.12 21.36 3k1q s ALA 120 CO -0.01 -2.05 1.80 -1.00 0.00 0.00 0.00 175.76 174.49 3k1q h PRO 121 N 6.45 1.21 -6.62 0.00 0.13 -1.88 -3.46 132.00 127.82 3k1q h PRO 121 Ca 0.02 -0.19 -0.57 0.00 -0.87 0.00 0.00 66.00 64.39 3k1q h PRO 121 Cb 0.90 -0.21 0.08 0.00 0.13 0.00 0.00 31.00 31.90 3k1q h PRO 121 CO 0.54 0.95 0.73 0.45 -0.23 0.00 0.00 178.00 180.44 3k1q n SER 122 N -4.30 3.15 -0.06 1.44 2.88 -1.12 -4.93 113.62 110.68 3k1q n SER 122 Ca 0.08 1.13 -0.07 0.00 -1.33 0.00 0.00 58.87 58.68 3k1q n SER 122 Cb 0.16 -1.48 -0.07 0.00 -0.75 0.00 0.00 64.21 62.07 3k1q n SER 122 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 3k1q n LYS 123 N 2.44 1.46 0.00 -1.46 3.00 -1.26 -5.00 118.16 117.34 3k1q n LYS 123 Ca 0.12 0.03 0.00 0.00 -0.00 0.00 0.00 58.31 58.46 3k1q n LYS 123 Cb 0.32 -1.27 0.00 0.00 0.00 0.00 0.00 35.03 34.08 3k1q n LYS 123 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 3k1q n ASP 124 N -2.60 0.00 0.00 3.14 8.00 -1.26 -4.87 116.55 118.96 3k1q n ASP 124 Ca -0.20 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.30 3k1q n ASP 124 Cb 0.81 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.91 3k1q n ASP 124 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 3k1q n ILE 125 N 0.00 0.00 -0.57 0.53 -5.35 -1.26 -3.98 119.36 108.73 3k1q n ILE 125 Ca 0.00 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.18 3k1q n ILE 125 Cb 0.00 0.00 0.22 0.00 -1.74 0.00 0.00 39.64 38.12 3k1q n ILE 125 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 3k1q n VAL 126 N 0.00 0.00 -2.78 7.28 0.31 -1.20 -1.48 118.33 120.46 3k1q n VAL 126 Ca 0.00 -0.38 -0.14 0.00 -0.01 0.00 0.00 64.34 63.81 3k1q n VAL 126 Cb 0.00 -0.82 0.03 0.00 -0.91 0.00 0.00 33.84 32.14 3k1q n VAL 126 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3k1q n GLU 127 N -3.63 -3.28 -0.35 5.55 1.02 -1.22 -3.90 120.64 114.83 3k1q n GLU 127 Ca 0.02 0.57 0.11 0.00 -0.02 0.00 0.00 57.16 57.84 3k1q n GLU 127 Cb 0.58 -4.73 0.30 0.00 -0.02 0.00 0.00 31.44 27.56 3k1q n GLU 127 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3k1q h LEU 128 N -0.96 0.83 -8.15 -4.62 5.85 -1.57 -2.40 115.31 104.30 3k1q h LEU 128 Ca -0.34 0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.35 3k1q h LEU 128 Cb 1.23 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 3k1q h LEU 128 CO 0.36 0.37 0.30 -2.16 -0.34 0.00 0.00 178.44 176.97 3k1q s PRO 129 N -5.88 1.67 -0.93 5.25 0.04 -1.26 -4.36 135.00 129.53 3k1q s PRO 129 Ca -0.11 -0.30 -0.07 0.00 0.04 0.00 0.00 61.00 60.55 3k1q s PRO 129 Cb 0.24 -4.98 0.07 0.00 0.04 0.00 0.00 34.50 29.86 3k1q s PRO 129 CO 0.80 -4.72 0.28 1.19 0.04 0.00 0.00 177.00 174.59 3k1q n PHE 130 N 17.87 -1.69 -4.33 0.56 3.72 -1.23 -4.95 117.46 127.40 3k1q n PHE 130 Ca 0.43 0.28 -0.17 0.00 -0.05 0.00 0.00 57.45 57.95 3k1q n PHE 130 Cb 0.46 -2.10 -0.10 0.00 -0.94 0.00 0.00 39.48 36.80 3k1q n PHE 130 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3k1q s ARG 131 N -5.75 1.37 -0.17 -1.08 1.81 -0.90 -5.05 118.95 109.17 3k1q s ARG 131 Ca 0.28 -1.71 -0.29 0.00 -1.72 0.00 0.00 55.73 52.29 3k1q s ARG 131 Cb -0.16 -0.54 -0.01 0.00 -0.45 0.00 0.00 34.95 33.79 3k1q s ARG 131 CO 0.35 -0.15 1.24 0.95 -0.68 0.00 0.00 175.30 177.00 3k1q s THR 132 N -3.50 4.33 0.18 0.02 -4.23 -1.24 -4.39 115.64 106.81 3k1q s THR 132 Ca 0.31 1.61 -0.16 0.00 -1.18 0.00 0.00 61.69 62.27 3k1q s THR 132 Cb 0.07 -4.04 0.16 0.00 1.34 0.00 0.00 72.50 70.03 3k1q s THR 132 CO 0.10 -0.14 1.26 0.00 -0.54 0.00 0.00 174.62 175.30 3k1q s ASP 134 N -5.31 6.37 1.70 0.00 1.01 -1.26 -4.02 116.67 115.17 3k1q s ASP 134 Ca -0.11 -2.15 0.00 0.00 0.71 0.00 0.00 52.55 51.00 3k1q s ASP 134 Cb 0.16 -2.20 0.00 0.00 1.01 0.00 0.00 42.92 41.89 3k1q s ASP 134 CO 0.57 -0.74 0.00 0.18 0.21 0.00 0.00 175.17 175.39 3k1q n LEU 135 N 4.74 0.00 -1.55 1.23 4.77 -1.16 -0.22 117.00 124.80 3k1q n LEU 135 Ca -0.03 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.83 3k1q n LEU 135 Cb 0.43 0.00 0.18 0.00 -2.33 0.00 0.00 43.42 41.69 3k1q n LEU 135 CO 0.46 0.00 0.86 -0.67 -1.33 0.00 0.00 177.39 176.71 3k1q n ASP 136 N 7.51 3.19 -0.04 -1.43 2.03 -1.26 -3.73 116.55 122.83 3k1q n ASP 136 Ca 0.00 -3.75 -0.03 0.00 0.52 0.00 0.00 54.79 51.53 3k1q n ASP 136 Cb 0.00 -0.70 -0.07 0.00 -0.72 0.00 0.00 41.12 39.64 3k1q n ASP 136 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 3k1q n ASP 137 N -1.10 2.95 -0.08 1.67 5.75 0.69 -4.49 116.55 121.93 3k1q n ASP 137 Ca 0.42 0.00 0.02 0.00 -0.01 0.00 0.00 54.79 55.23 3k1q n ASP 137 Cb 1.18 0.81 0.05 0.00 -1.03 0.00 0.00 41.12 42.12 3k1q n ASP 137 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 3k1q n SER 138 N -2.23 -0.05 0.19 -1.12 7.64 -1.06 -1.38 113.62 115.61 3k1q n SER 138 Ca -0.12 0.38 -0.16 0.00 1.01 0.00 0.00 58.87 59.98 3k1q n SER 138 Cb 0.69 -0.13 -0.08 0.00 -1.01 0.00 0.00 64.21 63.68 3k1q n SER 138 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3k1q h SER 139 N 0.00 -1.24 -0.18 6.43 4.64 -1.90 -0.01 113.55 121.29 3k1q h SER 139 Ca 0.12 0.12 -0.10 0.00 -0.47 0.00 0.00 61.79 61.46 3k1q h SER 139 Cb 0.22 0.44 -0.00 0.00 -0.31 0.00 0.00 62.40 62.75 3k1q h SER 139 CO -0.22 -0.54 -0.27 0.00 -0.87 0.00 0.00 176.83 174.93 3k1q h ALA 140 N -0.40 0.28 -0.21 5.18 0.00 -1.74 -3.25 119.26 119.12 3k1q h ALA 140 Ca -0.01 -0.39 -0.14 0.00 0.00 0.00 0.00 54.91 54.37 3k1q h ALA 140 Cb 0.73 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3k1q h ALA 140 CO -0.16 0.28 -0.44 1.79 0.00 0.00 0.00 179.25 180.72 3k1q h THR 141 N 0.17 1.31 -0.13 0.00 1.35 -0.89 -2.12 112.91 112.59 3k1q h THR 141 Ca 0.02 -1.62 0.04 0.00 -0.55 0.00 0.00 66.41 64.29 3k1q h THR 141 Cb 0.85 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 68.88 3k1q h THR 141 CO 0.06 0.51 0.11 0.00 -0.25 0.00 0.00 175.52 175.95 3k1q h ALA 142 N 1.10 1.92 -0.50 6.62 0.00 -1.07 0.34 119.26 127.66 3k1q h ALA 142 Ca 0.03 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.00 3k1q h ALA 142 Cb 0.94 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.65 3k1q h ALA 142 CO 0.08 -0.17 -0.50 0.00 0.00 0.00 0.00 179.25 178.66 3k1q h VAL 144 N -0.30 0.98 0.00 0.00 2.07 -1.40 -2.96 116.25 114.63 3k1q h VAL 144 Ca 0.13 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.64 3k1q h VAL 144 Cb 0.57 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3k1q h VAL 144 CO -0.65 0.00 0.00 0.54 0.02 0.00 0.00 177.57 177.48 3k1q n ARG 145 N -5.10 0.88 0.02 1.57 1.74 0.02 -0.37 116.66 115.42 3k1q n ARG 145 Ca -0.07 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 3k1q n ARG 145 Cb 0.04 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 30.10 3k1q n ARG 145 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3k1q n ASN 146 N 0.14 -0.00 -0.06 0.55 2.85 -0.68 -2.04 115.26 116.02 3k1q n ASN 146 Ca 0.00 0.08 -0.20 0.00 -0.11 0.00 0.00 54.58 54.35 3k1q n ASN 146 Cb 0.25 0.06 -0.13 0.00 1.24 0.00 0.00 39.78 41.21 3k1q n ASN 146 CO 0.00 0.00 0.00 -0.74 -2.11 0.00 0.00 177.26 174.41 3k1q h HIS 147 N 0.00 0.15 0.12 1.20 6.17 -1.39 -3.40 115.15 118.00 3k1q h HIS 147 Ca 0.00 -0.11 -0.01 0.00 0.71 0.00 0.00 60.37 60.97 3k1q h HIS 147 Cb 0.10 -0.01 0.00 0.00 2.52 0.00 0.00 27.41 30.03 3k1q h HIS 147 CO 0.00 1.43 -0.06 0.00 0.71 0.00 0.00 177.93 180.02 3k1q n GLN 149 N -3.90 0.73 -1.54 0.00 7.27 0.50 -1.32 117.38 119.13 3k1q n GLN 149 Ca -0.02 -2.85 -0.26 0.00 0.07 0.00 0.00 57.00 53.94 3k1q n GLN 149 Cb 0.06 -1.28 -0.10 0.00 2.41 0.00 0.00 30.24 31.34 3k1q n GLN 149 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3k1q n ALA 150 N 1.44 0.60 -0.94 1.69 0.00 -1.24 -3.76 120.51 118.31 3k1q n ALA 150 Ca 0.18 -1.00 -0.17 0.00 0.00 0.00 0.00 53.44 52.45 3k1q n ALA 150 Cb 0.56 -2.97 0.03 0.00 0.00 0.00 0.00 19.45 17.07 3k1q n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k1q n GLY 151 N 6.29 4.12 1.03 0.00 0.00 -0.86 -4.12 105.19 111.65 3k1q n GLY 151 Ca 0.50 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 45.37 3k1q n GLY 151 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3k1q n HIS 152 N 0.40 0.00 -0.66 1.61 8.25 -0.10 -2.79 115.22 121.93 3k1q n HIS 152 Ca 0.31 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.48 3k1q n HIS 152 Cb 0.58 0.17 0.15 0.00 1.12 0.00 0.00 29.99 32.01 3k1q n HIS 152 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 3k1q n ASP 153 N -2.02 -2.63 0.00 0.41 5.68 -1.04 -0.44 116.55 116.50 3k1q n ASP 153 Ca 0.00 -0.20 0.00 0.00 -0.50 0.00 0.00 54.79 54.09 3k1q n ASP 153 Cb 0.00 -0.85 0.00 0.00 -1.14 0.00 0.00 41.12 39.13 3k1q n ASP 153 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3k1q n GLY 154 N 2.32 -0.52 0.00 6.12 0.00 -1.25 -1.77 105.19 110.09 3k1q n GLY 154 Ca 0.02 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3k1q n GLY 154 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3k1q n VAL 155 N 0.00 0.00 -1.87 1.61 0.31 -1.26 -2.65 118.33 114.47 3k1q n VAL 155 Ca 0.00 1.07 -0.39 0.00 -0.01 0.00 0.00 64.34 65.01 3k1q n VAL 155 Cb 0.00 -1.97 0.04 0.00 -0.91 0.00 0.00 33.84 31.00 3k1q n VAL 155 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 3k1q n ILE 156 N -0.81 3.56 -3.94 2.52 -5.35 -1.26 -3.90 119.36 110.17 3k1q n ILE 156 Ca 0.00 -4.17 -0.19 0.00 -0.27 0.00 0.00 62.75 58.12 3k1q n ILE 156 Cb 0.00 -1.23 -0.17 0.00 -1.74 0.00 0.00 39.64 36.50 3k1q n ILE 156 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 3k1q s HIS 157 N -4.03 0.49 0.00 4.28 3.76 -1.08 -4.35 115.29 114.36 3k1q s HIS 157 Ca 0.53 -0.07 -0.00 0.00 -0.15 0.00 0.00 55.06 55.37 3k1q s HIS 157 Cb 0.45 -0.56 0.00 0.00 1.11 0.00 0.00 32.58 33.58 3k1q s HIS 157 CO -0.36 -0.19 0.01 -0.11 -0.85 0.00 0.00 174.74 173.23 3k1q n LEU 158 N 4.39 -3.32 -3.92 0.89 7.94 -1.26 -3.74 117.00 117.98 3k1q n LEU 158 Ca -0.21 1.89 -0.43 0.00 -1.11 0.00 0.00 56.01 56.15 3k1q n LEU 158 Cb 0.50 -2.35 0.01 0.00 0.53 0.00 0.00 43.42 42.11 3k1q n LEU 158 CO 0.19 -2.27 1.55 -0.81 -1.11 0.00 0.00 177.39 174.94 3k1q n PRO 159 N 1.95 4.08 0.00 1.96 -0.04 -1.26 -3.60 135.00 138.09 3k1q n PRO 159 Ca -0.01 -4.05 0.00 0.00 -0.04 0.00 0.00 63.50 59.40 3k1q n PRO 159 Cb 0.02 -2.71 0.00 0.00 -0.04 0.00 0.00 33.50 30.77 3k1q n PRO 159 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3k1q n ILE 160 N 2.27 0.00 1.09 0.52 -5.35 -0.45 -1.80 119.36 115.65 3k1q n ILE 160 Ca 0.33 0.29 0.03 0.00 -0.27 0.00 0.00 62.75 63.13 3k1q n ILE 160 Cb 0.34 -0.72 0.19 0.00 -1.74 0.00 0.00 39.64 37.71 3k1q n ILE 160 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3k1q n LEU 161 N -0.18 0.00 -3.77 7.28 4.77 0.24 -1.44 117.00 123.89 3k1q n LEU 161 Ca 0.00 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.69 3k1q n LEU 161 Cb 0.00 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 40.96 3k1q n LEU 161 CO 0.00 0.00 -0.20 -0.55 -1.33 0.00 0.00 177.39 175.31 3k1q s SER 162 N -1.65 3.80 0.00 -1.43 0.15 -0.44 -2.05 113.70 112.09 3k1q s SER 162 Ca 0.09 -3.00 0.00 0.00 0.70 0.00 0.00 55.95 53.74 3k1q s SER 162 Cb 0.04 -1.22 0.00 0.00 -1.71 0.00 0.00 66.02 63.13 3k1q s SER 162 CO 0.07 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.91 3k1q n GLY 163 N 3.06 2.08 2.67 9.45 0.00 -0.97 -4.71 105.19 116.76 3k1q n GLY 163 Ca 0.12 -0.71 -0.36 0.00 0.00 0.00 0.00 46.02 45.07 3k1q n GLY 163 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3k1q n ASP 164 N 0.00 7.26 0.00 1.61 5.68 -0.55 -4.93 116.55 125.61 3k1q n ASP 164 Ca 0.00 -3.51 0.00 0.00 -0.50 0.00 0.00 54.79 50.78 3k1q n ASP 164 Cb 0.00 -1.18 0.00 0.00 -1.14 0.00 0.00 41.12 38.80 3k1q n ASP 164 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 3k1q n PHE 165 N 0.34 0.00 -3.93 2.11 3.01 -0.52 -3.88 117.46 114.59 3k1q n PHE 165 Ca 0.52 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.68 3k1q n PHE 165 Cb 0.34 0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 39.65 3k1q n PHE 165 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3k1q s LYS 166 N -1.58 1.57 0.00 -1.08 -0.14 -1.26 -4.29 119.74 112.95 3k1q s LYS 166 Ca 0.00 -0.94 0.26 0.00 -1.36 0.00 0.00 55.97 53.94 3k1q s LYS 166 Cb 0.00 -2.54 1.37 0.00 -1.68 0.00 0.00 37.83 34.98 3k1q s LYS 166 CO 0.00 -0.59 1.90 1.28 -0.76 0.00 0.00 175.35 177.17 3k1q n LEU 167 N 4.70 0.00 0.02 3.17 4.32 -1.25 -0.76 117.00 127.20 3k1q n LEU 167 Ca -0.12 0.23 0.22 0.00 -0.02 0.00 0.00 56.01 56.32 3k1q n LEU 167 Cb 0.44 -0.23 0.73 0.00 -1.62 0.00 0.00 43.42 42.74 3k1q n LEU 167 CO 0.18 -0.03 1.20 -0.65 -1.22 0.00 0.00 177.39 176.86 3k1q h PRO 168 N 0.00 0.00 0.00 3.23 0.11 -1.88 -3.15 132.00 130.30 3k1q h PRO 168 Ca 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.05 3k1q h PRO 168 Cb 0.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.30 3k1q h PRO 168 CO 0.00 0.00 -1.24 0.09 -0.21 0.00 0.00 178.00 176.64 3k1q n ASN 169 N -3.98 4.10 -4.71 -2.05 4.13 -0.20 -2.04 115.26 110.52 3k1q n ASN 169 Ca 0.10 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 56.01 3k1q n ASN 169 Cb 0.67 0.68 -0.08 0.00 -1.54 0.00 0.00 39.78 39.51 3k1q n ASN 169 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 3k1q s GLU 170 N -2.12 4.14 0.20 3.52 2.02 0.06 -4.84 118.70 121.69 3k1q s GLU 170 Ca -0.02 -0.25 -0.07 0.00 0.02 0.00 0.00 54.97 54.66 3k1q s GLU 170 Cb 0.01 -3.38 0.32 0.00 0.10 0.00 0.00 34.13 31.18 3k1q s GLU 170 CO 0.15 0.28 1.15 1.58 0.02 0.00 0.00 175.26 178.45 3k1q n HIS 171 N 3.56 0.24 -0.13 1.61 -0.00 -1.26 -4.49 115.22 114.74 3k1q n HIS 171 Ca -0.16 0.90 0.00 0.00 0.46 0.00 0.00 57.72 58.92 3k1q n HIS 171 Cb 0.52 -0.91 0.00 0.00 -0.12 0.00 0.00 29.99 29.48 3k1q n HIS 171 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 3k1q n PRO 172 N -5.19 0.35 -4.32 1.57 -0.04 -1.26 -3.68 135.00 122.43 3k1q n PRO 172 Ca 0.11 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.30 3k1q n PRO 172 Cb 0.36 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.72 3k1q n PRO 172 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3k1q s THR 173 N -0.30 2.96 -0.31 0.52 -4.23 -1.26 -2.23 115.64 110.79 3k1q s THR 173 Ca 0.00 -1.70 -0.06 0.00 -1.18 0.00 0.00 61.69 58.75 3k1q s THR 173 Cb 0.00 -2.44 0.03 0.00 1.34 0.00 0.00 72.50 71.43 3k1q s THR 173 CO 0.00 -0.07 0.07 -0.54 -0.54 0.00 0.00 174.62 173.54 3k1q s LYS 174 N -2.66 2.82 0.34 3.99 1.02 0.09 -4.90 119.74 120.43 3k1q s LYS 174 Ca 0.23 -1.03 -0.27 0.00 0.02 0.00 0.00 55.97 54.91 3k1q s LYS 174 Cb -0.09 -3.36 -0.09 0.00 -0.52 0.00 0.00 37.83 33.77 3k1q s LYS 174 CO 0.13 -0.55 1.10 -2.14 -0.92 0.00 0.00 175.35 172.98 3k1q s PRO 175 N 1.43 4.36 -0.52 -1.68 0.02 -1.26 -2.07 135.00 135.27 3k1q s PRO 175 Ca 0.00 1.73 -0.22 0.00 0.02 0.00 0.00 61.00 62.54 3k1q s PRO 175 Cb -0.18 -2.88 0.05 0.00 0.02 0.00 0.00 34.50 31.51 3k1q s PRO 175 CO 0.02 -0.02 0.78 -1.17 -0.33 0.00 0.00 177.00 176.28 3k1q s LEU 176 N -2.05 4.52 -0.51 -5.54 2.96 -1.26 -2.49 118.68 114.31 3k1q s LEU 176 Ca 0.51 -0.61 -0.26 0.00 -0.22 0.00 0.00 54.13 53.56 3k1q s LEU 176 Cb -0.29 -2.65 -0.07 0.00 0.50 0.00 0.00 46.19 43.68 3k1q s LEU 176 CO 0.37 -1.05 2.40 -0.62 -1.32 0.00 0.00 176.35 176.12 3k1q s ASP 177 N 2.73 4.42 -0.07 3.68 2.15 0.41 -4.37 116.67 125.63 3k1q s ASP 177 Ca 0.23 1.01 -0.03 0.00 0.43 0.00 0.00 52.55 54.19 3k1q s ASP 177 Cb -0.16 -2.50 0.04 0.00 -0.30 0.00 0.00 42.92 40.00 3k1q s ASP 177 CO 0.16 -2.93 0.14 1.51 -0.17 0.00 0.00 175.17 173.88 3k1q s ASP 178 N 12.06 0.14 0.16 -0.34 -4.77 -1.26 -3.29 116.67 119.36 3k1q s ASP 178 Ca 0.96 0.29 -0.18 0.00 -3.30 0.00 0.00 52.55 50.32 3k1q s ASP 178 Cb -0.17 0.19 0.06 0.00 -1.09 0.00 0.00 42.92 41.91 3k1q s ASP 178 CO 0.25 -0.17 1.67 0.71 0.70 0.00 0.00 175.17 178.33 3k1q h THR 179 N 6.17 0.63 -1.90 2.11 1.35 -1.53 -3.41 112.91 116.33 3k1q h THR 179 Ca -0.35 0.00 -0.64 0.00 -0.55 0.00 0.00 66.41 64.86 3k1q h THR 179 Cb 1.13 0.63 0.05 0.00 -1.73 0.00 0.00 68.15 68.23 3k1q h THR 179 CO 0.35 0.00 0.62 1.57 -0.25 0.00 0.00 175.52 177.81 3k1q n HIS 180 N -5.29 1.84 -1.48 4.73 -0.00 -0.60 -4.73 115.22 109.70 3k1q n HIS 180 Ca 0.01 0.48 -0.44 0.00 -0.00 0.00 0.00 57.72 57.77 3k1q n HIS 180 Cb 0.20 -2.42 -0.09 0.00 -0.00 0.00 0.00 29.99 27.68 3k1q n HIS 180 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 3k1q n PRO 181 N 3.10 0.63 -2.84 1.57 -0.04 -1.26 -2.92 135.00 133.24 3k1q n PRO 181 Ca 0.18 0.09 -0.15 0.00 -0.04 0.00 0.00 63.50 63.58 3k1q n PRO 181 Cb 0.23 -2.35 -0.01 0.00 -0.04 0.00 0.00 33.50 31.33 3k1q n PRO 181 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3k1q n HIS 182 N 11.62 -1.64 0.49 0.54 8.25 -1.24 -4.62 115.22 128.61 3k1q n HIS 182 Ca 0.49 0.19 0.00 0.00 -0.26 0.00 0.00 57.72 58.15 3k1q n HIS 182 Cb 0.23 -2.55 0.00 0.00 1.12 0.00 0.00 29.99 28.79 3k1q n HIS 182 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 3k1q n ASP 183 N -1.96 2.54 -4.55 0.41 5.68 -1.15 -4.57 116.55 112.96 3k1q n ASP 183 Ca -0.07 -1.57 -0.13 0.00 -0.50 0.00 0.00 54.79 52.52 3k1q n ASP 183 Cb 0.56 -0.46 -0.10 0.00 -1.14 0.00 0.00 41.12 39.98 3k1q n ASP 183 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3k1q n LYS 184 N 0.86 0.22 -3.04 0.11 4.01 -1.26 -4.82 118.16 114.22 3k1q n LYS 184 Ca 0.00 -1.37 -0.45 0.00 -0.51 0.00 0.00 58.31 55.98 3k1q n LYS 184 Cb 0.36 -3.72 -0.03 0.00 -0.51 0.00 0.00 35.03 31.14 3k1q n LYS 184 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 3k1q s VAL 185 N 15.80 4.93 -1.17 -0.18 -7.23 -1.26 -0.65 120.40 130.64 3k1q s VAL 185 Ca 0.83 -1.64 -0.22 0.00 -1.81 0.00 0.00 61.98 59.14 3k1q s VAL 185 Cb -0.08 -4.66 -0.02 0.00 0.56 0.00 0.00 36.38 32.17 3k1q s VAL 185 CO 0.16 -1.34 1.84 -0.76 -0.31 0.00 0.00 175.10 174.69 3k1q s LEU 186 N 2.16 3.34 -0.04 1.32 1.02 -0.48 -4.56 118.68 121.44 3k1q s LEU 186 Ca 0.26 -1.76 -0.36 0.00 0.02 0.00 0.00 54.13 52.29 3k1q s LEU 186 Cb -0.09 -2.58 -0.14 0.00 0.02 0.00 0.00 46.19 43.40 3k1q s LEU 186 CO -0.06 -2.34 1.70 0.41 0.02 0.00 0.00 176.35 176.08 3k1q n THR 187 N 7.32 0.30 -0.88 5.49 -1.04 -0.88 -2.35 114.28 122.23 3k1q n THR 187 Ca 0.44 -0.05 -0.31 0.00 -2.04 0.00 0.00 64.05 62.09 3k1q n THR 187 Cb 0.47 -1.50 0.15 0.00 -1.82 0.00 0.00 70.33 67.63 3k1q n THR 187 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3k1q s ARG 188 N 2.66 1.21 0.42 -2.82 0.52 -0.48 -0.73 118.95 119.73 3k1q s ARG 188 Ca 0.89 1.33 -0.26 0.00 -0.52 0.00 0.00 55.73 57.17 3k1q s ARG 188 Cb -0.81 -1.77 -0.09 0.00 0.52 0.00 0.00 34.95 32.81 3k1q s ARG 188 CO 0.50 -2.42 1.40 0.00 0.02 0.00 0.00 175.30 174.81 3k1q h PRO 190 N 2.59 0.57 -0.02 0.00 0.11 -1.70 -1.75 132.00 131.81 3k1q h PRO 190 Ca -0.50 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.54 3k1q h PRO 190 Cb 1.25 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3k1q h PRO 190 CO 0.62 0.38 -0.14 0.87 -0.21 0.00 0.00 178.00 179.52 3k1q h LYS 191 N 0.59 0.03 0.00 1.05 1.79 -1.66 -2.00 116.57 116.38 3k1q h LYS 191 Ca 0.53 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.99 3k1q h LYS 191 Cb 0.86 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.50 3k1q h LYS 191 CO -0.42 0.17 0.42 1.15 -1.08 0.00 0.00 179.45 179.69 3k1q h THR 192 N 0.03 0.00 0.00 -0.16 2.02 -1.61 -3.46 112.91 109.73 3k1q h THR 192 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3k1q h THR 192 Cb 0.27 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 3k1q h THR 192 CO 0.02 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.52 3k1q n GLY 193 N -1.27 0.89 3.28 2.16 0.00 -0.75 -4.78 105.19 104.73 3k1q n GLY 193 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 3k1q n GLY 193 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3k1q s LEU 194 N 0.00 4.85 -0.70 0.99 2.96 -1.26 -4.90 118.68 120.62 3k1q s LEU 194 Ca 0.00 -1.35 -0.17 0.00 -0.22 0.00 0.00 54.13 52.39 3k1q s LEU 194 Cb 0.00 -1.95 0.15 0.00 0.50 0.00 0.00 46.19 44.88 3k1q s LEU 194 CO 0.00 -0.45 0.76 -0.76 -1.32 0.00 0.00 176.35 174.57 3k1q s LEU 195 N 1.42 5.86 0.43 -0.68 1.02 -1.26 -4.91 118.68 120.56 3k1q s LEU 195 Ca 0.02 -1.95 0.03 0.00 0.02 0.00 0.00 54.13 52.25 3k1q s LEU 195 Cb -0.21 -2.28 0.00 0.00 0.02 0.00 0.00 46.19 43.72 3k1q s LEU 195 CO 0.03 -0.91 0.63 -0.76 0.02 0.00 0.00 176.35 175.35 3k1q s LEU 196 N 1.79 3.68 -0.10 1.79 1.43 -1.26 0.08 118.68 126.09 3k1q s LEU 196 Ca 0.15 0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.35 3k1q s LEU 196 Cb -0.18 -2.98 -0.01 0.00 0.03 0.00 0.00 46.19 43.05 3k1q s LEU 196 CO -0.01 -0.70 -0.20 0.54 0.23 0.00 0.00 176.35 176.21 3k1q s VAL 197 N -2.48 2.47 -0.40 -1.59 0.11 -1.26 -1.38 120.40 115.87 3k1q s VAL 197 Ca 0.49 -0.88 0.03 0.00 -2.93 0.00 0.00 61.98 58.70 3k1q s VAL 197 Cb -0.10 -1.98 0.11 0.00 -1.53 0.00 0.00 36.38 32.89 3k1q s VAL 197 CO 0.36 0.55 0.14 -1.38 -3.33 0.00 0.00 175.10 171.43 3k1q s HIS 198 N 0.22 3.29 -0.32 1.54 -3.43 -0.99 -4.66 115.29 110.94 3k1q s HIS 198 Ca -0.13 -2.93 -0.28 0.00 -0.80 0.00 0.00 55.06 50.93 3k1q s HIS 198 Cb -0.16 -2.73 -0.04 0.00 -1.43 0.00 0.00 32.58 28.22 3k1q s HIS 198 CO 0.07 -0.86 2.03 0.34 -2.00 0.00 0.00 174.74 174.31 3k1q s ASP 199 N 0.53 5.53 -1.21 7.38 -1.08 -1.25 -1.38 116.67 125.19 3k1q s ASP 199 Ca 0.13 1.43 -0.21 0.00 -0.52 0.00 0.00 52.55 53.38 3k1q s ASP 199 Cb -0.22 -2.52 -0.04 0.00 -1.46 0.00 0.00 42.92 38.69 3k1q s ASP 199 CO -0.06 -1.98 1.87 0.42 0.52 0.00 0.00 175.17 175.95 3k1q s THR 200 N 8.14 3.71 0.60 1.71 -4.23 0.17 -4.86 115.64 120.88 3k1q s THR 200 Ca 0.89 -1.19 0.28 0.00 -1.18 0.00 0.00 61.69 60.49 3k1q s THR 200 Cb -0.25 -4.74 0.41 0.00 1.34 0.00 0.00 72.50 69.25 3k1q s THR 200 CO 0.32 -1.29 1.46 0.45 -0.54 0.00 0.00 174.62 175.02 3k1q h HIS 201 N 9.15 0.00 -2.66 3.99 3.86 -1.85 -3.33 115.15 124.31 3k1q h HIS 201 Ca 0.28 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 59.19 3k1q h HIS 201 Cb 0.92 0.00 -0.35 0.00 1.06 0.00 0.00 27.41 29.04 3k1q h HIS 201 CO 1.27 0.00 -0.62 0.00 0.86 0.00 0.00 177.93 179.45 3k1q s ALA 202 N -4.50 -0.29 -0.71 2.45 0.00 -1.24 -1.36 121.76 116.11 3k1q s ALA 202 Ca -0.03 0.39 -0.14 0.00 0.00 0.00 0.00 51.96 52.18 3k1q s ALA 202 Cb 0.15 -1.20 0.18 0.00 0.00 0.00 0.00 23.12 22.25 3k1q s ALA 202 CO 0.51 -1.03 0.66 -1.58 0.00 0.00 0.00 175.76 174.31 3k1q s HIS 203 N 2.33 3.57 0.09 0.00 2.46 0.00 -4.54 115.29 119.21 3k1q s HIS 203 Ca 0.05 -1.77 0.00 0.00 0.47 0.00 0.00 55.06 53.81 3k1q s HIS 203 Cb -0.15 -3.79 0.00 0.00 -0.13 0.00 0.00 32.58 28.52 3k1q s HIS 203 CO -0.11 -1.00 0.00 0.00 -2.47 0.00 0.00 174.74 171.17 3k1q n ALA 204 N 4.42 0.00 -1.42 1.58 0.00 -1.26 -1.42 120.51 122.41 3k1q n ALA 204 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3k1q n ALA 204 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 3k1q n ALA 204 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3k1q n THR 205 N -2.46 0.00 0.47 0.00 -2.24 -1.26 -4.51 114.28 104.28 3k1q n THR 205 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 3k1q n THR 205 Cb 0.00 -1.69 0.40 0.00 -2.10 0.00 0.00 70.33 66.93 3k1q n THR 205 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k1q h ALA 206 N -1.52 1.00 0.00 6.98 0.00 -1.85 -3.47 119.26 120.40 3k1q h ALA 206 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k1q h ALA 206 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3k1q h ALA 206 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.58 3k1q n VAL 207 N -2.50 0.00 0.08 0.00 0.24 -1.13 -3.73 118.33 111.29 3k1q n VAL 207 Ca 0.04 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.45 3k1q n VAL 207 Cb 0.40 0.00 0.58 0.00 -1.47 0.00 0.00 33.84 33.35 3k1q n VAL 207 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 3k1q h VAL 208 N 0.00 0.94 -0.75 3.34 3.04 -1.82 -3.21 116.25 117.79 3k1q h VAL 208 Ca 0.00 -0.07 0.14 0.00 -1.01 0.00 0.00 66.70 65.76 3k1q h VAL 208 Cb 0.00 0.72 -0.10 0.00 -2.01 0.00 0.00 31.29 29.91 3k1q h VAL 208 CO 0.00 0.04 0.29 0.00 -1.01 0.00 0.00 177.57 176.88 3k1q h ALA 209 N 1.83 1.04 0.12 3.17 0.00 -1.64 0.49 119.26 124.26 3k1q h ALA 209 Ca 0.15 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 3k1q h ALA 209 Cb 0.33 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3k1q h ALA 209 CO -0.02 -0.22 -0.06 1.15 0.00 0.00 0.00 179.25 180.10 3k1q h THR 210 N 0.43 1.04 -0.81 0.00 2.02 -1.00 -2.85 112.91 111.73 3k1q h THR 210 Ca 0.41 -1.21 0.20 0.00 0.77 0.00 0.00 66.41 66.58 3k1q h THR 210 Cb 0.63 1.74 -0.14 0.00 -1.74 0.00 0.00 68.15 68.64 3k1q h THR 210 CO -0.41 0.26 0.11 0.00 0.37 0.00 0.00 175.52 175.86 3k1q h ALA 211 N -0.09 1.01 0.52 6.16 0.00 -1.55 0.18 119.26 125.50 3k1q h ALA 211 Ca -0.02 0.23 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 3k1q h ALA 211 Cb 0.55 0.37 0.01 0.00 0.00 0.00 0.00 17.79 18.72 3k1q h ALA 211 CO 0.03 -0.44 -0.25 0.00 0.00 0.00 0.00 179.25 178.59 3k1q h ALA 212 N 1.74 -0.70 -0.85 0.00 0.00 -0.12 -3.20 119.26 116.12 3k1q h ALA 212 Ca 0.48 -0.18 0.19 0.00 0.00 0.00 0.00 54.91 55.40 3k1q h ALA 212 Cb 0.90 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 3k1q h ALA 212 CO -0.66 -0.68 0.57 1.79 0.00 0.00 0.00 179.25 180.26 3k1q h THR 213 N -1.13 0.70 -0.99 0.00 1.35 -1.18 -1.49 112.91 110.17 3k1q h THR 213 Ca -0.07 -0.13 0.27 0.00 -0.55 0.00 0.00 66.41 65.93 3k1q h THR 213 Cb 0.59 0.30 -0.06 0.00 -1.73 0.00 0.00 68.15 67.25 3k1q h THR 213 CO 0.12 0.07 0.68 -0.09 -0.25 0.00 0.00 175.52 176.05 3k1q h ARG 214 N 0.37 0.17 0.00 4.72 2.43 -0.97 -2.27 114.38 118.83 3k1q h ARG 214 Ca 0.43 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.59 3k1q h ARG 214 Cb 1.11 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 3k1q h ARG 214 CO -0.14 0.11 0.00 0.00 -1.51 0.00 0.00 179.97 178.43 3k1q h ALA 215 N 1.55 1.00 0.00 2.80 0.00 -1.32 0.21 119.26 123.49 3k1q h ALA 215 Ca 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.39 3k1q h ALA 215 Cb 1.67 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.46 3k1q h ALA 215 CO -0.11 0.00 -0.10 -0.84 0.00 0.00 0.00 179.25 178.20 3k1q h ILE 216 N 0.00 0.36 0.11 0.00 -0.00 -1.55 -1.93 117.51 114.50 3k1q h ILE 216 Ca 0.00 -0.60 0.01 0.00 -0.00 0.00 0.00 64.86 64.28 3k1q h ILE 216 Cb 0.25 1.44 -0.03 0.00 -0.00 0.00 0.00 36.82 38.48 3k1q h ILE 216 CO 0.00 0.10 -0.21 0.25 -0.00 0.00 0.00 178.15 178.29 3k1q h LEU 217 N 0.00 -0.58 -0.52 0.16 6.46 -0.74 -0.81 115.31 119.28 3k1q h LEU 217 Ca -0.00 0.07 0.10 0.00 -0.12 0.00 0.00 57.88 57.93 3k1q h LEU 217 Cb 0.43 0.22 -0.09 0.00 -0.73 0.00 0.00 40.66 40.49 3k1q h LEU 217 CO 0.01 -0.29 -0.04 0.24 -0.62 0.00 0.00 178.44 177.74 3k1q h MET 218 N -0.40 0.07 0.00 1.25 2.86 -1.53 -1.41 114.93 115.77 3k1q h MET 218 Ca 0.03 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3k1q h MET 218 Cb 0.42 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.06 3k1q h MET 218 CO -0.12 0.05 0.00 0.72 1.06 0.00 0.00 176.91 178.62 3k1q n HIS 219 N -5.28 0.00 -0.33 -0.22 8.25 -0.92 -2.82 115.22 113.89 3k1q n HIS 219 Ca 0.06 0.00 0.34 0.00 -0.26 0.00 0.00 57.72 57.86 3k1q n HIS 219 Cb 0.28 -0.36 0.72 0.00 1.12 0.00 0.00 29.99 31.75 3k1q n HIS 219 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 3k1q h ASP 220 N 0.00 0.06 0.15 0.41 3.32 -0.55 -1.12 116.42 118.69 3k1q h ASP 220 Ca 0.00 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3k1q h ASP 220 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3k1q h ASP 220 CO 0.00 0.01 -0.07 -0.07 -1.72 0.00 0.00 179.24 177.38 3k1q h LEU 221 N 0.05 -0.17 0.00 1.55 3.38 -1.11 -1.95 115.31 117.05 3k1q h LEU 221 Ca 0.58 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3k1q h LEU 221 Cb 2.21 0.04 0.00 0.00 0.09 0.00 0.00 40.66 43.00 3k1q h LEU 221 CO -0.05 0.38 -0.38 0.18 0.09 0.00 0.00 178.44 178.66 3k1q n LEU 222 N -4.92 0.46 -0.03 1.67 4.77 -0.93 -1.12 117.00 116.89 3k1q n LEU 222 Ca -0.08 0.22 -0.00 0.00 -0.03 0.00 0.00 56.01 56.12 3k1q n LEU 222 Cb 0.27 -0.29 -0.00 0.00 -2.33 0.00 0.00 43.42 41.06 3k1q n LEU 222 CO 0.26 0.03 0.01 0.74 -1.33 0.00 0.00 177.39 177.10 3k1q h THR 223 N 0.00 0.00 -1.70 -5.08 2.02 -1.37 -3.44 112.91 103.34 3k1q h THR 223 Ca 0.00 -0.85 -0.65 0.00 0.77 0.00 0.00 66.41 65.68 3k1q h THR 223 Cb 0.58 0.00 -0.37 0.00 -1.74 0.00 0.00 68.15 66.63 3k1q h THR 223 CO 0.00 0.00 -0.09 -0.24 0.37 0.00 0.00 175.52 175.56 3k1q n SER 224 N -4.41 5.72 0.00 4.18 2.88 -0.73 -4.97 113.62 116.28 3k1q n SER 224 Ca -0.00 -3.76 0.00 0.00 -1.33 0.00 0.00 58.87 53.78 3k1q n SER 224 Cb 0.01 -0.68 0.00 0.00 -0.75 0.00 0.00 64.21 62.79 3k1q n SER 224 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3k1q n ALA 225 N -0.50 0.00 -3.25 -1.46 0.00 -0.28 -4.67 120.51 110.35 3k1q n ALA 225 Ca 0.44 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.75 3k1q n ALA 225 Cb 0.50 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.85 3k1q n ALA 225 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3k1q s ASN 226 N 0.00 -0.33 -0.67 0.00 0.01 -1.18 -4.70 114.94 108.07 3k1q s ASN 226 Ca 0.00 0.56 -0.26 0.00 -0.71 0.00 0.00 52.86 52.45 3k1q s ASN 226 Cb 0.00 0.63 -0.05 0.00 0.41 0.00 0.00 41.25 42.23 3k1q s ASN 226 CO 0.00 -0.21 2.08 0.00 -1.51 0.00 0.00 177.10 177.46 3k1q s ALA 227 N -0.21 1.74 -0.44 0.60 0.00 -1.25 -4.62 121.76 117.57 3k1q s ALA 227 Ca -0.04 -0.68 -0.28 0.00 0.00 0.00 0.00 51.96 50.96 3k1q s ALA 227 Cb -0.03 -4.40 -0.01 0.00 0.00 0.00 0.00 23.12 18.68 3k1q s ALA 227 CO 0.02 -4.49 1.65 0.34 0.00 0.00 0.00 175.76 173.27 3k1q s ASP 228 N 9.46 5.93 0.00 0.00 2.15 -1.26 -4.50 116.67 128.45 3k1q s ASP 228 Ca 0.78 0.82 0.00 0.00 0.43 0.00 0.00 52.55 54.59 3k1q s ASP 228 Cb -0.12 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.96 3k1q s ASP 228 CO 0.16 -1.77 0.00 0.47 -0.17 0.00 0.00 175.17 173.86 3k1q n ASP 229 N 10.27 0.00 0.00 -0.34 9.92 -1.26 -4.90 116.55 130.23 3k1q n ASP 229 Ca 0.19 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.45 3k1q n ASP 229 Cb 0.48 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.96 3k1q n ASP 229 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3k1q n GLY 230 N 0.00 0.45 0.42 0.44 0.00 -1.26 -1.03 105.19 104.21 3k1q n GLY 230 Ca 0.00 0.74 0.22 0.00 0.00 0.00 0.00 46.02 46.98 3k1q n GLY 230 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3k1q h HIS 231 N 0.00 0.42 -1.03 1.61 -0.00 -1.93 0.44 115.15 114.66 3k1q h HIS 231 Ca 0.00 0.01 0.25 0.00 -0.00 0.00 0.00 60.37 60.64 3k1q h HIS 231 Cb 0.00 -0.13 -0.10 0.00 -0.00 0.00 0.00 27.41 27.18 3k1q h HIS 231 CO 0.00 0.09 0.65 0.37 -0.00 0.00 0.00 177.93 179.04 3k1q h GLN 232 N 0.30 0.44 0.06 5.26 -0.00 -1.49 0.35 115.11 120.03 3k1q h GLN 232 Ca 0.48 -0.03 -0.26 0.00 -0.00 0.00 0.00 58.65 58.85 3k1q h GLN 232 Cb 1.38 -0.10 -0.02 0.00 0.00 0.00 0.00 27.48 28.74 3k1q h GLN 232 CO -0.15 0.29 -1.36 0.00 0.00 0.00 0.00 178.83 177.61 3k1q h ALA 233 N 1.64 0.25 -0.48 3.38 0.00 -1.66 -3.41 119.26 118.98 3k1q h ALA 233 Ca 0.60 -1.15 0.14 0.00 0.00 0.00 0.00 54.91 54.50 3k1q h ALA 233 Cb 1.40 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 19.76 3k1q h ALA 233 CO -0.33 0.81 0.36 0.00 0.00 0.00 0.00 179.25 180.09 3k1q h ARG 234 N -0.56 0.00 0.96 0.00 3.08 0.43 -2.32 114.38 115.96 3k1q h ARG 234 Ca -0.32 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.68 3k1q h ARG 234 Cb 1.58 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.64 3k1q h ARG 234 CO -0.05 0.00 -0.46 0.66 -1.07 0.00 0.00 179.97 179.05 3k1q h SER 235 N 0.00 -1.09 0.41 7.04 4.64 -0.55 -1.65 113.55 122.36 3k1q h SER 235 Ca 0.23 0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 61.57 3k1q h SER 235 Cb 0.95 0.28 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 3k1q h SER 235 CO -0.00 -0.76 -0.20 0.00 -0.87 0.00 0.00 176.83 175.00 3k1q h ALA 236 N -1.29 -0.55 -0.91 5.18 0.00 -1.80 -3.38 119.26 116.51 3k1q h ALA 236 Ca -0.13 -0.14 0.34 0.00 0.00 0.00 0.00 54.91 54.97 3k1q h ALA 236 Cb 0.98 0.21 -0.17 0.00 0.00 0.00 0.00 17.79 18.82 3k1q h ALA 236 CO 0.22 -0.77 0.32 0.00 0.00 0.00 0.00 179.25 179.02 3k1q s TYR 238 N -5.57 2.93 -0.00 0.00 1.51 -0.63 -5.07 117.35 110.52 3k1q s TYR 238 Ca -0.10 -1.02 -0.01 0.00 -1.01 0.00 0.00 57.07 54.93 3k1q s TYR 238 Cb 0.30 -2.07 -0.00 0.00 -0.11 0.00 0.00 41.96 40.07 3k1q s TYR 238 CO 0.71 -0.57 0.02 0.41 -1.11 0.00 0.00 175.55 175.01 3k1q n GLY 239 N 4.74 -0.00 3.68 0.71 0.00 -1.26 -2.33 105.19 110.72 3k1q n GLY 239 Ca -0.19 0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 3k1q n GLY 239 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k1q s PRO 240 N 0.01 4.21 -0.41 1.61 0.04 -1.26 -2.00 135.00 137.19 3k1q s PRO 240 Ca 0.02 2.21 -0.28 0.00 0.04 0.00 0.00 61.00 62.99 3k1q s PRO 240 Cb -0.02 -3.71 0.00 0.00 0.04 0.00 0.00 34.50 30.80 3k1q s PRO 240 CO 0.01 -0.73 1.54 0.00 0.04 0.00 0.00 177.00 177.86 3k1q s ALA 241 N 3.02 2.93 -0.08 8.56 0.00 -1.21 -2.82 121.76 132.16 3k1q s ALA 241 Ca 0.72 -0.12 0.03 0.00 0.00 0.00 0.00 51.96 52.59 3k1q s ALA 241 Cb -0.36 -4.00 0.01 0.00 0.00 0.00 0.00 23.12 18.77 3k1q s ALA 241 CO 0.30 -2.59 -0.17 0.12 0.00 0.00 0.00 175.76 173.43 3k1q s PHE 242 N 6.06 1.85 0.63 0.00 5.36 -1.26 -5.04 117.98 125.58 3k1q s PHE 242 Ca 0.66 -0.71 0.00 0.00 -0.96 0.00 0.00 56.93 55.92 3k1q s PHE 242 Cb -0.16 -1.30 0.00 0.00 -0.34 0.00 0.00 43.02 41.23 3k1q s PHE 242 CO 0.32 -0.32 0.00 0.27 -1.46 0.00 0.00 175.22 174.03 3k1q n ASN 243 N 3.68 -7.80 0.00 6.13 6.94 -1.26 -4.56 115.26 118.38 3k1q n ASN 243 Ca -0.21 1.46 0.00 0.00 -0.02 0.00 0.00 54.58 55.81 3k1q n ASN 243 Cb 0.52 -4.96 0.00 0.00 -2.36 0.00 0.00 39.78 32.98 3k1q n ASN 243 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 3k1q n ASN 244 N -4.33 0.00 -3.80 0.53 6.94 -1.26 -4.85 115.26 108.48 3k1q n ASN 244 Ca -0.10 0.00 -0.28 0.00 -0.02 0.00 0.00 54.58 54.19 3k1q n ASN 244 Cb 0.68 0.00 0.04 0.00 -2.36 0.00 0.00 39.78 38.15 3k1q n ASN 244 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3k1q n LEU 245 N -2.07 -2.86 -3.77 -4.53 4.32 -1.26 -5.03 117.00 101.80 3k1q n LEU 245 Ca 0.00 -0.71 -0.26 0.00 -0.02 0.00 0.00 56.01 55.02 3k1q n LEU 245 Cb 0.00 -2.72 -0.17 0.00 -1.62 0.00 0.00 43.42 38.92 3k1q n LEU 245 CO 0.00 0.52 -0.38 -0.89 -1.22 0.00 0.00 177.39 175.42 3k1q s THR 246 N -3.32 0.58 0.00 -5.08 2.01 -1.23 -4.94 115.64 103.65 3k1q s THR 246 Ca 0.60 -0.39 0.00 0.00 0.31 0.00 0.00 61.69 62.21 3k1q s THR 246 Cb -0.29 -0.95 0.00 0.00 0.01 0.00 0.00 72.50 71.27 3k1q s THR 246 CO 0.80 -0.03 0.00 0.49 -0.69 0.00 0.00 174.62 175.18 3k1q n PHE 247 N 5.05 0.00 -3.93 4.92 3.01 -1.13 -4.89 117.46 120.48 3k1q n PHE 247 Ca -0.09 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.27 3k1q n PHE 247 Cb 0.48 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.84 3k1q n PHE 247 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3k1q s ALA 248 N -0.01 -0.01 0.00 4.37 0.00 -0.46 -3.71 121.76 121.94 3k1q s ALA 248 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 51.96 51.60 3k1q s ALA 248 Cb 0.00 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.22 3k1q s ALA 248 CO 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 175.76 175.62 3k1q n HIS 250 N -0.23 0.00 0.00 0.00 -0.00 -1.26 -0.82 115.22 112.91 3k1q n HIS 250 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 3k1q n HIS 250 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 3k1q n HIS 250 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 3k1q n SER 251 N 0.00 0.00 0.00 0.26 7.64 -0.50 -4.75 113.62 116.26 3k1q n SER 251 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3k1q n SER 251 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 3k1q n SER 251 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3k1q n THR 252 N 0.00 0.00 0.12 0.44 -2.24 -1.26 -2.16 114.28 109.18 3k1q n THR 252 Ca 0.00 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.64 3k1q n THR 252 Cb 0.00 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.15 3k1q n THR 252 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k1q h ALA 254 N 0.37 1.43 0.00 0.00 0.00 -1.66 -0.50 119.26 118.89 3k1q h ALA 254 Ca -0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3k1q h ALA 254 Cb 0.32 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3k1q h ALA 254 CO 0.04 0.11 -0.11 0.77 0.00 0.00 0.00 179.25 180.06 3k1q h SER 255 N 0.00 0.00 0.00 0.00 0.02 -1.02 -2.53 113.55 110.02 3k1q h SER 255 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3k1q h SER 255 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 3k1q h SER 255 CO 0.01 0.11 -0.01 0.47 -1.14 0.00 0.00 176.83 176.27 3k1q n ASP 256 N -4.07 0.03 0.00 3.07 9.92 -0.73 -4.41 116.55 120.36 3k1q n ASP 256 Ca -0.02 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.24 3k1q n ASP 256 Cb 0.20 -0.33 0.00 0.00 -0.64 0.00 0.00 41.12 40.35 3k1q n ASP 256 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 3k1q n MET 257 N -2.53 0.00 -0.07 -1.24 0.00 -0.27 -2.09 117.12 110.91 3k1q n MET 257 Ca -0.00 0.73 0.04 0.00 -0.00 0.00 0.00 57.70 58.47 3k1q n MET 257 Cb 0.01 -1.42 0.38 0.00 0.00 0.00 0.00 33.22 32.18 3k1q n MET 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3k1q h ALA 258 N -1.48 1.66 0.82 -5.12 0.00 -1.66 0.29 119.26 113.78 3k1q h ALA 258 Ca 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3k1q h ALA 258 Cb 0.00 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.60 3k1q h ALA 258 CO 0.00 0.30 -0.40 1.25 0.00 0.00 0.00 179.25 180.40 3k1q h HIS 259 N 0.68 -1.03 -0.07 0.00 6.17 -1.41 -2.66 115.15 116.84 3k1q h HIS 259 Ca 0.20 -0.02 -0.07 0.00 0.71 0.00 0.00 60.37 61.19 3k1q h HIS 259 Cb -0.02 0.34 0.00 0.00 2.52 0.00 0.00 27.41 30.26 3k1q h HIS 259 CO -0.00 -0.64 -0.24 0.74 0.71 0.00 0.00 177.93 178.50 3k1q h PHE 260 N -1.28 0.38 0.00 5.26 -1.00 -1.27 -3.33 116.94 115.71 3k1q h PHE 260 Ca -0.11 -0.16 0.00 0.00 2.81 0.00 0.00 57.97 60.51 3k1q h PHE 260 Cb 0.85 -0.06 0.00 0.00 3.61 0.00 0.00 35.95 40.35 3k1q h PHE 260 CO 0.00 0.86 0.00 -0.25 -1.61 0.00 0.00 178.31 177.31 3k1q n ASP 261 N -4.50 0.00 -0.25 2.17 8.00 0.10 -1.14 116.55 120.94 3k1q n ASP 261 Ca -0.08 -0.95 -0.07 0.00 0.71 0.00 0.00 54.79 54.40 3k1q n ASP 261 Cb 0.45 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.59 3k1q n ASP 261 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k1q n GLY 263 N -0.76 0.08 4.02 0.00 0.00 -0.71 -0.60 105.19 107.23 3k1q n GLY 263 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3k1q n GLY 263 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3k1q n GLN 264 N -1.46 0.00 0.00 1.61 7.27 -0.29 -2.24 117.38 122.26 3k1q n GLN 264 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 3k1q n GLN 264 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 3k1q n GLN 264 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 177.06 176.24 3k1q n ILE 265 N 0.00 0.00 -0.02 1.69 5.41 -1.22 -4.69 119.36 120.53 3k1q n ILE 265 Ca 0.00 0.03 0.09 0.00 1.00 0.00 0.00 62.75 63.87 3k1q n ILE 265 Cb 0.00 -0.26 0.49 0.00 -0.71 0.00 0.00 39.64 39.16 3k1q n ILE 265 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3k1q h VAL 266 N 0.00 0.98 0.00 1.39 2.07 -1.45 -3.45 116.25 115.78 3k1q h VAL 266 Ca 0.00 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3k1q h VAL 266 Cb 0.00 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 3k1q h VAL 266 CO 0.00 0.07 0.00 0.61 0.02 0.00 0.00 177.57 178.27 3k1q n GLY 267 N -1.51 1.07 3.54 2.17 0.00 -0.95 -4.85 105.19 104.66 3k1q n GLY 267 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 3k1q n GLY 267 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k1q s LEU 268 N 0.00 2.98 -0.05 0.99 1.43 -1.26 -0.05 118.68 122.72 3k1q s LEU 268 Ca 0.00 -0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 52.94 3k1q s LEU 268 Cb 0.00 -1.67 0.03 0.00 0.03 0.00 0.00 46.19 44.58 3k1q s LEU 268 CO 0.00 0.32 0.00 -0.62 0.23 0.00 0.00 176.35 176.29 3k1q s ASP 269 N -1.03 1.15 0.10 2.29 -1.08 0.25 -5.02 116.67 113.33 3k1q s ASP 269 Ca 0.14 -0.05 0.08 0.00 -0.52 0.00 0.00 52.55 52.20 3k1q s ASP 269 Cb -0.11 -0.35 -0.04 0.00 -1.46 0.00 0.00 42.92 40.97 3k1q s ASP 269 CO 0.03 -0.16 -0.21 -0.76 0.52 0.00 0.00 175.17 174.59 3k1q s LEU 270 N 1.61 2.30 -0.06 -1.34 1.02 -1.17 -0.69 118.68 120.34 3k1q s LEU 270 Ca -0.01 -0.69 0.02 0.00 0.02 0.00 0.00 54.13 53.47 3k1q s LEU 270 Cb -0.13 -0.89 0.01 0.00 0.02 0.00 0.00 46.19 45.20 3k1q s LEU 270 CO -0.03 0.06 -0.13 -2.28 0.02 0.00 0.00 176.35 173.99 3k1q s HIS 271 N -1.16 1.50 -0.57 0.29 2.46 -0.08 -4.81 115.29 112.91 3k1q s HIS 271 Ca 0.07 -0.55 0.06 0.00 0.47 0.00 0.00 55.06 55.11 3k1q s HIS 271 Cb -0.10 -1.09 -0.00 0.00 -0.13 0.00 0.00 32.58 31.26 3k1q s HIS 271 CO 0.04 -0.27 0.49 1.33 -2.47 0.00 0.00 174.74 173.86 3k1q n VAL 272 N 3.76 0.00 -3.23 0.89 0.24 -0.98 0.25 118.33 119.26 3k1q n VAL 272 Ca -0.22 -0.43 -0.39 0.00 -2.04 0.00 0.00 64.34 61.26 3k1q n VAL 272 Cb 0.52 1.07 -0.06 0.00 -1.47 0.00 0.00 33.84 33.90 3k1q n VAL 272 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3k1q s GLU 273 N -1.04 4.29 -0.57 7.34 8.01 -1.21 0.64 118.70 136.15 3k1q s GLU 273 Ca 0.05 0.71 -0.31 0.00 0.01 0.00 0.00 54.97 55.44 3k1q s GLU 273 Cb 0.05 -3.33 -0.13 0.00 -4.31 0.00 0.00 34.13 26.41 3k1q s GLU 273 CO 0.16 0.40 2.41 -0.35 0.01 0.00 0.00 175.26 177.89 3k1q n PRO 274 N 2.63 0.79 0.00 0.39 -0.04 -1.26 -3.85 135.00 133.66 3k1q n PRO 274 Ca -0.07 0.11 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 3k1q n PRO 274 Cb 0.51 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.40 3k1q n PRO 274 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3k1q n SER 275 N 12.27 0.00 0.00 3.54 3.41 -1.26 -4.99 113.62 126.58 3k1q n SER 275 Ca 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.07 3k1q n SER 275 Cb 0.29 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 3k1q n SER 275 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35