#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kjx s LEU 9 N 0.00 2.82 0.18 1.53 1.43 -1.26 -5.12 118.68 118.27 3kjx s LEU 9 Ca 0.00 0.11 -0.05 0.00 -1.03 0.00 0.00 54.13 53.16 3kjx s LEU 9 Cb 0.00 -2.42 -0.02 0.00 0.03 0.00 0.00 46.19 43.77 3kjx s LEU 9 CO 0.00 -2.14 0.22 0.42 0.23 0.00 0.00 176.35 175.08 3kjx s THR 10 N -3.47 0.04 0.34 5.49 -4.23 -1.26 -5.02 115.64 107.54 3kjx s THR 10 Ca 0.68 -1.70 0.35 0.00 -1.18 0.00 0.00 61.69 59.84 3kjx s THR 10 Cb -0.06 -2.15 0.35 0.00 1.34 0.00 0.00 72.50 71.97 3kjx s THR 10 CO 0.48 -0.19 2.07 -0.07 -0.54 0.00 0.00 174.62 176.36 3kjx h LEU 11 N 2.59 0.00 -0.62 4.79 3.38 -1.99 -1.05 115.31 122.41 3kjx h LEU 11 Ca -0.33 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.50 3kjx h LEU 11 Cb 1.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 3kjx h LEU 11 CO 0.50 0.00 -0.40 -0.09 0.09 0.00 0.00 178.44 178.54 3kjx h ARG 12 N 0.00 0.64 -0.26 1.13 2.43 -1.96 -0.36 114.38 116.00 3kjx h ARG 12 Ca 0.00 -0.33 -0.13 0.00 -0.81 0.00 0.00 59.98 58.71 3kjx h ARG 12 Cb 0.06 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 3kjx h ARG 12 CO 0.00 0.93 -0.39 -0.44 -1.51 0.00 0.00 179.97 178.56 3kjx h ASP 13 N 0.53 0.64 0.17 -3.80 3.32 -1.60 -0.67 116.42 115.00 3kjx h ASP 13 Ca 0.05 -0.28 -0.15 0.00 0.02 0.00 0.00 57.03 56.67 3kjx h ASP 13 Cb 0.92 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.28 3kjx h ASP 13 CO 0.08 0.96 -0.54 0.58 -1.72 0.00 0.00 179.24 178.60 3kjx h VAL 14 N 0.50 1.34 0.29 -1.35 2.07 -1.46 -1.82 116.25 115.83 3kjx h VAL 14 Ca 0.05 -1.80 -0.01 0.00 0.82 0.00 0.00 66.70 65.75 3kjx h VAL 14 Cb 0.89 1.82 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 3kjx h VAL 14 CO 0.08 0.55 -0.14 -1.28 0.02 0.00 0.00 177.57 176.79 3kjx h SER 15 N 0.31 -0.34 -0.11 0.57 0.87 -0.70 -1.41 113.55 112.74 3kjx h SER 15 Ca 0.01 -0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.35 3kjx h SER 15 Cb 1.04 0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 63.07 3kjx h SER 15 CO 0.09 -0.02 -0.13 -0.33 -0.53 0.00 0.00 176.83 175.92 3kjx h GLU 16 N -0.67 0.45 0.00 2.24 5.08 -1.16 0.59 114.58 121.11 3kjx h GLU 16 Ca -0.04 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 3kjx h GLU 16 Cb 0.47 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3kjx h GLU 16 CO 0.07 0.58 -0.02 0.00 -1.00 0.00 0.00 179.01 178.63 3kjx h ALA 17 N 1.45 0.98 0.00 3.43 0.00 -1.34 -3.29 119.26 120.50 3kjx h ALA 17 Ca 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.79 3kjx h ALA 17 Cb 0.47 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 3kjx h ALA 17 CO 0.03 0.00 -2.01 0.45 0.00 0.00 0.00 179.25 177.72 3kjx n SER 18 N -2.34 1.00 0.00 0.00 2.88 -0.53 -4.87 113.62 109.76 3kjx n SER 18 Ca 0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 3kjx n SER 18 Cb 0.44 1.20 0.00 0.00 -0.75 0.00 0.00 64.21 65.10 3kjx n SER 18 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3kjx n GLY 19 N 1.84 0.58 3.54 0.46 0.00 0.20 -4.89 105.19 106.91 3kjx n GLY 19 Ca -0.19 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.50 3kjx n GLY 19 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kjx s VAL 20 N -2.00 2.59 0.77 1.61 -7.23 -1.14 -5.04 120.40 109.96 3kjx s VAL 20 Ca 0.00 -2.22 -0.12 0.00 -1.81 0.00 0.00 61.98 57.83 3kjx s VAL 20 Cb 0.00 -2.54 0.06 0.00 0.56 0.00 0.00 36.38 34.46 3kjx s VAL 20 CO 0.00 -0.32 1.14 -0.94 -0.31 0.00 0.00 175.10 174.67 3kjx s SER 21 N -3.59 4.18 0.00 4.85 1.04 -1.26 -4.54 113.70 114.38 3kjx s SER 21 Ca 0.32 2.08 0.00 0.00 0.48 0.00 0.00 55.95 58.83 3kjx s SER 21 Cb -0.03 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.54 3kjx s SER 21 CO 0.17 -2.26 0.32 -0.62 0.98 0.00 0.00 173.24 171.83 3kjx n GLU 22 N -3.25 0.21 0.00 4.02 1.02 -1.26 -0.97 120.64 120.40 3kjx n GLU 22 Ca 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 3kjx n GLU 22 Cb 0.52 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.54 3kjx n GLU 22 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 3kjx n THR 24 N 1.47 0.00 -0.28 2.62 -1.04 -1.26 -1.50 114.28 114.29 3kjx n THR 24 Ca 0.00 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.95 3kjx n THR 24 Cb 0.10 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 68.67 3kjx n THR 24 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3kjx h VAL 25 N 0.00 1.26 0.00 12.58 2.07 -1.37 -1.30 116.25 129.49 3kjx h VAL 25 Ca 0.00 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 3kjx h VAL 25 Cb 0.00 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 3kjx h VAL 25 CO 0.00 0.34 -0.05 -1.28 0.02 0.00 0.00 177.57 176.60 3kjx h SER 26 N 1.11 0.00 0.69 0.57 0.87 -1.52 -1.71 113.55 113.57 3kjx h SER 26 Ca 0.25 0.00 -0.25 0.00 -1.23 0.00 0.00 61.79 60.56 3kjx h SER 26 Cb 0.26 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.17 3kjx h SER 26 CO -0.02 0.05 -1.43 0.03 -0.53 0.00 0.00 176.83 174.93 3kjx h ARG 27 N 0.00 0.00 0.09 2.24 3.08 -1.55 -3.36 114.38 114.87 3kjx h ARG 27 Ca -0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 3kjx h ARG 27 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3kjx h ARG 27 CO 0.01 0.63 -0.04 0.28 -1.07 0.00 0.00 179.97 179.77 3kjx h VAL 28 N 0.00 1.17 0.00 2.04 2.07 -0.65 -1.91 116.25 118.97 3kjx h VAL 28 Ca -0.18 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.21 3kjx h VAL 28 Cb 1.89 1.88 0.00 0.00 -1.52 0.00 0.00 31.29 33.53 3kjx h VAL 28 CO 0.09 0.27 0.00 0.18 0.02 0.00 0.00 177.57 178.13 3kjx n LEU 29 N -4.90 0.35 0.00 2.57 4.32 -0.70 -1.73 117.00 116.92 3kjx n LEU 29 Ca -0.08 -0.18 0.00 0.00 -0.02 0.00 0.00 56.01 55.73 3kjx n LEU 29 Cb 0.27 -0.11 0.00 0.00 -1.62 0.00 0.00 43.42 41.96 3kjx n LEU 29 CO 0.31 0.07 0.00 0.54 -1.22 0.00 0.00 177.39 177.09 3kjx n ARG 30 N 0.54 0.00 -0.85 3.23 1.74 -1.19 -4.99 116.66 115.15 3kjx n ARG 30 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3kjx n ARG 30 Cb 0.07 -0.03 0.00 0.00 -1.02 0.00 0.00 32.46 31.48 3kjx n ARG 30 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3kjx n ASN 31 N 0.00 -1.54 -4.65 0.55 4.13 -0.70 -4.98 115.26 108.07 3kjx n ASN 31 Ca 0.00 0.00 -0.29 0.00 1.68 0.00 0.00 54.58 55.97 3kjx n ASN 31 Cb 0.06 -1.42 0.17 0.00 -1.54 0.00 0.00 39.78 37.05 3kjx n ASN 31 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 3kjx s ARG 32 N -0.63 0.55 0.34 3.52 3.52 -0.81 -4.89 118.95 120.55 3kjx s ARG 32 Ca 0.00 0.35 0.00 0.00 -0.13 0.00 0.00 55.73 55.95 3kjx s ARG 32 Cb 0.00 -1.77 0.00 0.00 -1.56 0.00 0.00 34.95 31.62 3kjx s ARG 32 CO 0.00 -2.61 0.00 0.41 -0.81 0.00 0.00 175.30 172.29 3kjx n GLY 33 N -1.58 -1.91 0.00 8.12 0.00 -1.26 -4.58 105.19 103.98 3kjx n GLY 33 Ca 0.06 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.92 3kjx n GLY 33 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3kjx n ASP 34 N -4.22 0.00 -2.15 1.61 -0.08 -1.26 -5.07 116.55 105.38 3kjx n ASP 34 Ca 0.01 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.29 3kjx n ASP 34 Cb 0.65 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.11 3kjx n ASP 34 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 3kjx n VAL 35 N -0.41-12.99 -1.67 5.18 0.31 -1.26 -4.86 118.33 102.63 3kjx n VAL 35 Ca 0.00 3.25 -0.40 0.00 -0.01 0.00 0.00 64.34 67.19 3kjx n VAL 35 Cb 0.00 -5.44 0.03 0.00 -0.91 0.00 0.00 33.84 27.52 3kjx n VAL 35 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3kjx n SER 36 N 1.94 1.81 0.00 4.52 3.41 -1.26 -4.81 113.62 119.24 3kjx n SER 36 Ca 0.00 0.98 0.02 0.00 -0.26 0.00 0.00 58.87 59.61 3kjx n SER 36 Cb 0.00 -1.45 0.13 0.00 -0.26 0.00 0.00 64.21 62.63 3kjx n SER 36 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3kjx n ASP 37 N -0.26 0.00 -0.06 4.04 8.00 -1.26 -1.93 116.55 125.08 3kjx n ASP 37 Ca 0.10 -0.44 -0.04 0.00 0.71 0.00 0.00 54.79 55.13 3kjx n ASP 37 Cb 0.43 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.41 3kjx n ASP 37 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kjx n ALA 38 N -0.74 1.86 0.11 2.24 0.00 -1.26 -4.40 120.51 118.31 3kjx n ALA 38 Ca 0.03 -0.80 -0.02 0.00 0.00 0.00 0.00 53.44 52.66 3kjx n ALA 38 Cb 0.02 -0.15 -0.04 0.00 0.00 0.00 0.00 19.45 19.27 3kjx n ALA 38 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3kjx h THR 39 N 0.00 1.22 -0.26 0.00 2.02 -1.74 -3.25 112.91 110.90 3kjx h THR 39 Ca -0.30 -2.72 -0.01 0.00 0.77 0.00 0.00 66.41 64.15 3kjx h THR 39 Cb 1.60 2.60 -0.01 0.00 -1.74 0.00 0.00 68.15 70.60 3kjx h THR 39 CO 0.02 0.69 0.11 0.03 0.37 0.00 0.00 175.52 176.74 3kjx h ARG 40 N 0.00 0.37 -0.84 6.66 3.08 -1.77 -2.19 114.38 119.69 3kjx h ARG 40 Ca -0.01 -0.06 0.15 0.00 0.07 0.00 0.00 59.98 60.13 3kjx h ARG 40 Cb 1.55 -0.06 -0.10 0.00 0.08 0.00 0.00 29.97 31.44 3kjx h ARG 40 CO 0.09 0.39 0.42 0.00 -1.07 0.00 0.00 179.97 179.80 3kjx h ALA 41 N 0.97 1.27 -0.09 0.04 0.00 -1.76 0.33 119.26 120.01 3kjx h ALA 41 Ca 0.09 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3kjx h ALA 41 Cb 0.14 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3kjx h ALA 41 CO -0.01 -0.12 0.04 0.00 0.00 0.00 0.00 179.25 179.16 3kjx h ARG 42 N 0.59 0.14 -0.43 0.00 3.08 -1.52 -1.08 114.38 115.16 3kjx h ARG 42 Ca 0.46 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.46 3kjx h ARG 42 Cb 0.68 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 3kjx h ARG 42 CO -0.38 0.22 0.14 0.28 -1.07 0.00 0.00 179.97 179.17 3kjx h VAL 43 N 0.01 1.22 -0.20 2.04 2.07 -0.63 -0.95 116.25 119.81 3kjx h VAL 43 Ca 0.03 -0.70 -0.08 0.00 0.82 0.00 0.00 66.70 66.78 3kjx h VAL 43 Cb 0.14 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 3kjx h VAL 43 CO -0.00 0.25 -0.20 -0.07 0.02 0.00 0.00 177.57 177.57 3kjx h LEU 44 N 0.55 0.35 -0.02 2.57 3.38 -0.34 -1.75 115.31 120.05 3kjx h LEU 44 Ca 0.14 -0.10 -0.21 0.00 0.09 0.00 0.00 57.88 57.80 3kjx h LEU 44 Cb 0.25 -0.09 0.02 0.00 0.09 0.00 0.00 40.66 40.92 3kjx h LEU 44 CO -0.01 0.57 -0.83 0.00 0.09 0.00 0.00 178.44 178.27 3kjx h ALA 45 N 1.46 0.12 -0.34 1.53 0.00 -1.03 -0.86 119.26 120.14 3kjx h ALA 45 Ca 0.06 -0.63 -0.02 0.00 0.00 0.00 0.00 54.91 54.32 3kjx h ALA 45 Cb 0.55 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3kjx h ALA 45 CO 0.04 0.54 0.13 0.00 0.00 0.00 0.00 179.25 179.95 3kjx h ALA 46 N 0.38 1.58 -0.13 0.00 0.00 -1.04 -0.39 119.26 119.67 3kjx h ALA 46 Ca -0.10 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 3kjx h ALA 46 Cb 1.50 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.14 3kjx h ALA 46 CO 0.16 0.33 -0.26 0.00 0.00 0.00 0.00 179.25 179.48 3kjx h ALA 47 N 1.66 0.21 -0.62 0.00 0.00 -1.24 -2.12 119.26 117.14 3kjx h ALA 47 Ca 0.12 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 3kjx h ALA 47 Cb 0.12 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3kjx h ALA 47 CO -0.01 0.20 0.14 -0.22 0.00 0.00 0.00 179.25 179.36 3kjx h LYS 48 N -0.00 0.99 0.00 0.00 3.64 -0.69 -1.03 116.57 119.47 3kjx h LYS 48 Ca 0.00 -0.22 -0.15 0.00 -1.27 0.00 0.00 60.65 59.01 3kjx h LYS 48 Cb 0.86 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.52 3kjx h LYS 48 CO 0.06 0.88 -0.71 1.05 -2.27 0.00 0.00 179.45 178.46 3kjx h GLU 49 N 0.94 0.00 0.04 1.90 4.11 -1.13 -3.26 114.58 117.19 3kjx h GLU 49 Ca 0.20 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.37 3kjx h GLU 49 Cb 0.35 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.61 3kjx h GLU 49 CO 0.00 0.71 -1.07 -0.07 0.07 0.00 0.00 179.01 178.65 3kjx h LEU 50 N 0.00 0.67 0.00 3.06 3.38 -1.20 -3.48 115.31 117.74 3kjx h LEU 50 Ca -0.01 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.38 3kjx h LEU 50 Cb 1.38 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.92 3kjx h LEU 50 CO 0.09 1.39 0.00 0.61 0.09 0.00 0.00 178.44 180.62 3kjx n GLY 51 N 1.14 1.16 3.71 0.83 0.00 -0.47 -5.08 105.19 106.48 3kjx n GLY 51 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 3kjx n GLY 51 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3kjx s TYR 52 N -2.00 3.45 -0.17 1.61 5.04 -0.73 -5.02 117.35 119.54 3kjx s TYR 52 Ca 0.00 1.39 -0.00 0.00 -2.44 0.00 0.00 57.07 56.02 3kjx s TYR 52 Cb 0.00 -3.34 0.00 0.00 0.35 0.00 0.00 41.96 38.97 3kjx s TYR 52 CO 0.00 -0.95 -0.14 0.08 -1.34 0.00 0.00 175.55 173.19 3kjx s VAL 53 N 1.26 2.69 0.82 3.14 1.01 -1.26 -4.60 120.40 123.45 3kjx s VAL 53 Ca 0.56 -0.75 -0.12 0.00 0.00 0.00 0.00 61.98 61.67 3kjx s VAL 53 Cb -0.26 -2.15 0.09 0.00 0.00 0.00 0.00 36.38 34.05 3kjx s VAL 53 CO 0.27 0.50 1.16 -2.16 0.00 0.00 0.00 175.10 174.88 3kjx s PRO 54 N 0.98 1.69 0.00 2.72 0.04 -1.26 -4.97 135.00 134.21 3kjx s PRO 54 Ca -0.02 1.55 -0.26 0.00 0.04 0.00 0.00 61.00 62.31 3kjx s PRO 54 Cb -0.15 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 3kjx s PRO 54 CO -0.02 -2.13 0.82 1.21 0.04 0.00 0.00 177.00 176.91 3kjx s ASN 55 N -2.58 7.21 -0.04 6.66 3.84 -1.26 -4.93 114.94 123.84 3kjx s ASN 55 Ca 0.68 1.45 0.06 0.00 0.21 0.00 0.00 52.86 55.27 3kjx s ASN 55 Cb -0.24 -2.49 0.09 0.00 -0.55 0.00 0.00 41.25 38.07 3kjx s ASN 55 CO 0.53 -0.10 1.00 0.29 -2.79 0.00 0.00 177.10 176.02 3kjx n LYS 56 N 3.38 0.63 0.00 0.43 5.02 -1.26 -4.72 118.16 121.64 3kjx n LYS 56 Ca 0.00 -1.50 0.05 0.00 -2.02 0.00 0.00 58.31 54.85 3kjx n LYS 56 Cb 0.51 -0.86 -0.03 0.00 -0.02 0.00 0.00 35.03 34.62 3kjx n LYS 56 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 3kjx n ILE 57 N -0.51 0.00 0.63 -0.18 -5.35 -1.26 -4.63 119.36 108.06 3kjx n ILE 57 Ca 0.05 -0.31 0.01 0.00 -0.27 0.00 0.00 62.75 62.22 3kjx n ILE 57 Cb 0.63 1.07 0.03 0.00 -1.74 0.00 0.00 39.64 39.63 3kjx n ILE 57 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3kjx n ALA 58 N -0.73 1.82 -1.00 -1.28 0.00 -1.26 -4.62 120.51 113.44 3kjx n ALA 58 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3kjx n ALA 58 Cb 0.21 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.64 3kjx n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kjx n GLY 59 N -0.21 -2.32 0.00 0.00 0.00 -1.26 -5.11 105.19 96.28 3kjx n GLY 59 Ca 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3kjx n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kjx n ALA 60 N -3.00 0.00 -1.00 4.61 0.00 0.11 -4.91 120.51 116.33 3kjx n ALA 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3kjx n ALA 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3kjx n ALA 60 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3kjx n LEU 61 N 0.00 0.00 0.20 0.00 4.32 -1.26 -4.14 117.00 116.12 3kjx n LEU 61 Ca 0.00 0.00 0.17 0.00 -0.02 0.00 0.00 56.01 56.16 3kjx n LEU 61 Cb 0.00 0.00 0.82 0.00 -1.62 0.00 0.00 43.42 42.62 3kjx n LEU 61 CO 0.00 0.00 1.15 0.00 -1.22 0.00 0.00 177.39 177.32 3kjx h ALA 62 N -2.00 1.82 0.12 -1.18 0.00 -1.99 -2.32 119.26 113.72 3kjx h ALA 62 Ca 0.00 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.67 3kjx h ALA 62 Cb 0.00 0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.83 3kjx h ALA 62 CO 0.00 -0.33 -1.00 0.77 0.00 0.00 0.00 179.25 178.69 3kjx h SER 63 N 0.00 0.67 -4.13 0.00 0.02 -2.00 -3.41 113.55 104.70 3kjx h SER 63 Ca 0.10 -0.86 -0.63 0.00 -0.84 0.00 0.00 61.79 59.55 3kjx h SER 63 Cb 0.54 -0.21 -0.41 0.00 0.14 0.00 0.00 62.40 62.46 3kjx h SER 63 CO -0.00 1.47 -0.65 0.20 -1.14 0.00 0.00 176.83 176.71 3kjx s ASN 64 N -7.16 4.19 0.93 3.07 0.01 -0.87 -4.94 114.94 110.16 3kjx s ASN 64 Ca -0.12 -2.98 -0.02 0.00 -0.71 0.00 0.00 52.86 49.03 3kjx s ASN 64 Cb 0.03 -1.51 0.03 0.00 0.41 0.00 0.00 41.25 40.21 3kjx s ASN 64 CO 0.88 -0.23 0.19 0.54 -1.51 0.00 0.00 177.10 176.97 3kjx n ARG 65 N 3.13 -0.10 -4.34 -0.60 5.12 -1.24 -0.71 116.66 117.92 3kjx n ARG 65 Ca 0.07 -0.32 -0.24 0.00 -1.93 0.00 0.00 57.85 55.43 3kjx n ARG 65 Cb 0.33 -0.19 -0.13 0.00 -1.16 0.00 0.00 32.46 31.31 3kjx n ARG 65 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3kjx s VAL 66 N -1.28 1.70 -0.65 1.55 1.01 -0.30 -4.75 120.40 117.68 3kjx s VAL 66 Ca 0.11 -1.49 0.00 0.00 0.00 0.00 0.00 61.98 60.61 3kjx s VAL 66 Cb -0.00 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.84 3kjx s VAL 66 CO 0.08 -0.02 0.44 -0.46 0.00 0.00 0.00 175.10 175.14 3kjx n ASN 67 N 1.21 1.12 -4.74 3.32 6.94 -1.26 -2.80 115.26 119.04 3kjx n ASN 67 Ca -0.19 -1.31 -0.40 0.00 -0.02 0.00 0.00 54.58 52.66 3kjx n ASN 67 Cb 0.53 -0.33 -0.05 0.00 -2.36 0.00 0.00 39.78 37.58 3kjx n ASN 67 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3kjx s LEU 68 N 0.00 4.43 -0.28 -4.53 0.20 -1.26 -0.77 118.68 116.47 3kjx s LEU 68 Ca 0.00 1.38 -0.02 0.00 0.69 0.00 0.00 54.13 56.18 3kjx s LEU 68 Cb 0.00 -3.17 0.04 0.00 -0.43 0.00 0.00 46.19 42.63 3kjx s LEU 68 CO 0.00 0.01 -0.03 -0.69 -0.29 0.00 0.00 176.35 175.36 3kjx s VAL 69 N 0.02 2.97 -0.04 1.68 1.01 -0.73 0.47 120.40 125.78 3kjx s VAL 69 Ca 0.37 -1.19 -0.30 0.00 0.00 0.00 0.00 61.98 60.86 3kjx s VAL 69 Cb -0.20 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 3kjx s VAL 69 CO 0.22 0.04 1.05 0.00 0.00 0.00 0.00 175.10 176.41 3kjx s ALA 70 N 1.30 3.33 -0.31 5.51 0.00 0.41 -1.87 121.76 130.13 3kjx s ALA 70 Ca -0.02 0.53 0.02 0.00 0.00 0.00 0.00 51.96 52.49 3kjx s ALA 70 Cb -0.18 -3.42 0.08 0.00 0.00 0.00 0.00 23.12 19.60 3kjx s ALA 70 CO -0.02 -0.48 -0.01 0.08 0.00 0.00 0.00 175.76 175.33 3kjx s VAL 71 N 1.57 2.40 -0.29 0.00 1.01 -0.68 0.55 120.40 124.98 3kjx s VAL 71 Ca 0.52 -1.92 -0.07 0.00 0.00 0.00 0.00 61.98 60.52 3kjx s VAL 71 Cb -0.22 -2.57 0.00 0.00 0.00 0.00 0.00 36.38 33.60 3kjx s VAL 71 CO 0.24 -0.31 0.07 -0.63 0.00 0.00 0.00 175.10 174.47 3kjx s ILE 72 N 1.04 3.98 0.21 2.22 1.01 0.26 -0.67 121.20 129.25 3kjx s ILE 72 Ca 0.01 -0.61 0.05 0.00 0.00 0.00 0.00 60.65 60.09 3kjx s ILE 72 Cb -0.20 -3.02 -0.05 0.00 0.01 0.00 0.00 42.46 39.21 3kjx s ILE 72 CO -0.06 0.13 -0.07 0.27 0.00 0.00 0.00 174.94 175.21 3kjx s ILE 73 N 1.51 1.33 -0.00 2.92 -4.36 -0.59 -1.17 121.20 120.84 3kjx s ILE 73 Ca 0.03 -2.10 -0.25 0.00 -0.26 0.00 0.00 60.65 58.08 3kjx s ILE 73 Cb -0.17 -2.15 -0.19 0.00 1.25 0.00 0.00 42.46 41.20 3kjx s ILE 73 CO 0.02 -0.50 1.33 1.55 0.24 0.00 0.00 174.94 177.59 3kjx h PRO 74 N 2.55 0.04 0.00 0.37 0.13 -1.92 -0.70 132.00 132.46 3kjx h PRO 74 Ca -0.38 -0.02 0.13 0.00 -0.87 0.00 0.00 66.00 64.86 3kjx h PRO 74 Cb 1.21 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 3kjx h PRO 74 CO 0.64 0.45 0.41 -1.13 -0.23 0.00 0.00 178.00 178.14 3kjx n SER 75 N -4.85 -1.00 0.00 1.44 3.41 -1.26 0.80 113.62 112.15 3kjx n SER 75 Ca -0.08 -1.47 0.00 0.00 -0.26 0.00 0.00 58.87 57.06 3kjx n SER 75 Cb 0.23 1.61 0.00 0.00 -0.26 0.00 0.00 64.21 65.79 3kjx n SER 75 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3kjx n LEU 76 N 0.00 0.76 0.11 1.04 4.77 -1.26 -4.64 117.00 117.78 3kjx n LEU 76 Ca -0.00 -0.76 0.10 0.00 -0.03 0.00 0.00 56.01 55.32 3kjx n LEU 76 Cb 0.36 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 41.90 3kjx n LEU 76 CO 0.12 0.19 0.80 -1.20 -1.33 0.00 0.00 177.39 175.97 3kjx n SER 77 N -0.13 0.48 0.00 -1.43 7.64 -1.26 -4.83 113.62 114.09 3kjx n SER 77 Ca 0.00 0.65 0.00 0.00 1.01 0.00 0.00 58.87 60.53 3kjx n SER 77 Cb 0.27 -0.74 0.00 0.00 -1.01 0.00 0.00 64.21 62.72 3kjx n SER 77 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3kjx n ASN 78 N -2.07 0.00 0.00 6.43 0.23 -1.26 -4.85 115.26 113.74 3kjx n ASN 78 Ca 0.01 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.06 3kjx n ASN 78 Cb 0.14 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.84 3kjx n ASN 78 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 3kjx n VAL 80 N 0.00 0.00 0.25 3.53 0.31 -1.26 -4.77 118.33 116.39 3kjx n VAL 80 Ca 0.00 0.00 0.09 0.00 -0.01 0.00 0.00 64.34 64.42 3kjx n VAL 80 Cb 0.00 0.00 0.62 0.00 -0.91 0.00 0.00 33.84 33.55 3kjx n VAL 80 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 3kjx h PHE 81 N 0.00 0.00 -0.86 3.52 0.04 -1.92 -2.65 116.94 115.07 3kjx h PHE 81 Ca 0.00 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.84 3kjx h PHE 81 Cb 0.00 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.09 3kjx h PHE 81 CO 0.00 0.14 0.53 -1.35 -0.60 0.00 0.00 178.31 177.02 3kjx h PRO 82 N 0.00 0.92 0.00 1.51 0.11 -1.88 0.12 132.00 132.77 3kjx h PRO 82 Ca -0.00 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 3kjx h PRO 82 Cb 0.28 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 31.18 3kjx h PRO 82 CO 0.02 0.61 -0.06 1.49 -0.21 0.00 0.00 178.00 179.85 3kjx h GLU 83 N 0.94 0.00 0.03 1.05 4.57 -1.85 -1.41 114.58 117.91 3kjx h GLU 83 Ca 0.38 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 58.42 3kjx h GLU 83 Cb 0.22 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.82 3kjx h GLU 83 CO -0.19 0.06 -0.58 0.28 -1.18 0.00 0.00 179.01 177.39 3kjx h VAL 84 N 0.00 1.47 -0.20 0.32 2.07 -0.75 -2.99 116.25 116.17 3kjx h VAL 84 Ca -0.00 -2.17 -0.03 0.00 0.82 0.00 0.00 66.70 65.32 3kjx h VAL 84 Cb 0.56 2.78 -0.01 0.00 -1.52 0.00 0.00 31.29 33.10 3kjx h VAL 84 CO 0.01 0.62 0.00 -0.07 0.02 0.00 0.00 177.57 178.15 3kjx h LEU 85 N -0.24 0.26 -0.01 2.57 3.38 -0.66 -1.85 115.31 118.76 3kjx h LEU 85 Ca -0.08 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3kjx h LEU 85 Cb 1.34 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 3kjx h LEU 85 CO 0.11 0.31 0.00 0.74 0.09 0.00 0.00 178.44 179.70 3kjx h THR 86 N 0.28 1.10 -0.66 0.22 2.02 -1.27 -1.05 112.91 113.55 3kjx h THR 86 Ca 0.07 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 66.90 3kjx h THR 86 Cb 0.20 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 3kjx h THR 86 CO 0.00 0.08 0.25 1.23 0.37 0.00 0.00 175.52 177.46 3kjx h GLY 87 N -0.11 1.05 0.97 2.16 0.00 -1.31 -1.20 103.07 104.63 3kjx h GLY 87 Ca 0.00 -0.56 -0.02 0.00 0.00 0.00 0.00 47.33 46.76 3kjx h GLY 87 CO -0.00 0.53 0.22 -2.22 0.00 0.00 0.00 176.54 175.07 3kjx h ILE 88 N 0.96 1.18 -0.72 2.60 2.04 -1.19 -2.66 117.51 119.73 3kjx h ILE 88 Ca 0.22 -0.50 -0.04 0.00 1.00 0.00 0.00 64.86 65.54 3kjx h ILE 88 Cb 0.20 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 3kjx h ILE 88 CO -0.02 0.20 0.31 0.78 0.00 0.00 0.00 178.15 179.41 3kjx h ASN 89 N 0.58 0.96 -0.21 1.72 4.21 -0.62 -2.11 115.58 120.11 3kjx h ASN 89 Ca 0.15 -0.13 -0.00 0.00 1.21 0.00 0.00 56.30 57.53 3kjx h ASN 89 Cb 0.11 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 37.05 3kjx h ASN 89 CO -0.02 0.84 0.12 1.56 -1.29 0.00 0.00 177.43 178.63 3kjx h GLN 90 N 1.03 0.29 -0.58 0.81 4.20 -0.95 0.23 115.11 120.14 3kjx h GLN 90 Ca 0.24 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.84 3kjx h GLN 90 Cb 0.17 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 3kjx h GLN 90 CO -0.02 0.26 0.04 0.28 -0.67 0.00 0.00 178.83 178.72 3kjx h VAL 91 N 0.23 1.26 0.00 -0.54 2.07 -1.39 -3.03 116.25 114.86 3kjx h VAL 91 Ca 0.07 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.53 3kjx h VAL 91 Cb 0.06 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3kjx h VAL 91 CO -0.01 0.39 -0.17 0.18 0.02 0.00 0.00 177.57 177.97 3kjx n LEU 92 N -4.27 0.29 -0.35 2.57 4.77 -0.80 -3.70 117.00 115.49 3kjx n LEU 92 Ca 0.02 0.36 0.07 0.00 -0.03 0.00 0.00 56.01 56.44 3kjx n LEU 92 Cb 0.31 -0.39 0.23 0.00 -2.33 0.00 0.00 43.42 41.24 3kjx n LEU 92 CO 0.43 0.00 1.22 -0.33 -1.33 0.00 0.00 177.39 177.38 3kjx h GLU 93 N 0.00 0.94 -0.99 3.23 4.39 -0.41 0.86 114.58 122.60 3kjx h GLU 93 Ca 0.00 -0.06 -0.12 0.00 0.34 0.00 0.00 59.36 59.53 3kjx h GLU 93 Cb 0.55 -0.21 -0.07 0.00 -0.10 0.00 0.00 28.75 28.92 3kjx h GLU 93 CO 0.00 0.62 0.15 -0.25 -1.16 0.00 0.00 179.01 178.37 3kjx n ASP 94 N -4.64 3.07 -4.06 1.42 8.00 -1.24 -4.86 116.55 114.23 3kjx n ASP 94 Ca 0.18 -2.40 -0.16 0.00 0.71 0.00 0.00 54.79 53.13 3kjx n ASP 94 Cb 0.35 -0.58 -0.10 0.00 -0.02 0.00 0.00 41.12 40.77 3kjx n ASP 94 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3kjx s THR 95 N -0.94 0.22 -2.53 -3.53 2.01 0.29 -5.03 115.64 106.13 3kjx s THR 95 Ca 0.15 -2.00 0.26 0.00 0.31 0.00 0.00 61.69 60.41 3kjx s THR 95 Cb 0.12 -2.53 0.47 0.00 0.01 0.00 0.00 72.50 70.57 3kjx s THR 95 CO 0.03 0.00 1.62 -0.62 -0.69 0.00 0.00 174.62 174.96 3kjx n GLU 96 N -0.45 1.82 -3.09 4.92 -0.58 -1.26 -4.92 120.64 117.07 3kjx n GLU 96 Ca 0.02 -1.19 -0.39 0.00 -0.42 0.00 0.00 57.16 55.17 3kjx n GLU 96 Cb 0.65 -1.46 -0.06 0.00 -0.57 0.00 0.00 31.44 30.00 3kjx n GLU 96 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3kjx s LEU 97 N -1.90 4.54 -0.35 -4.62 1.43 -1.26 -4.88 118.68 111.64 3kjx s LEU 97 Ca 0.35 1.46 -0.00 0.00 -1.03 0.00 0.00 54.13 54.91 3kjx s LEU 97 Cb 0.20 -3.13 0.09 0.00 0.03 0.00 0.00 46.19 43.38 3kjx s LEU 97 CO 0.32 0.20 0.08 -1.58 0.23 0.00 0.00 176.35 175.59 3kjx s GLN 98 N -0.91 2.01 -0.00 1.70 2.00 0.05 -4.85 119.66 119.65 3kjx s GLN 98 Ca 0.34 -1.64 -0.30 0.00 -2.00 0.00 0.00 55.36 51.75 3kjx s GLN 98 Cb -0.21 -3.32 -0.04 0.00 0.80 0.00 0.00 33.01 30.24 3kjx s GLN 98 CO 0.23 -0.87 1.09 -1.25 -0.50 0.00 0.00 175.29 173.98 3kjx s PRO 99 N 1.11 4.47 0.01 1.67 0.04 -1.26 -1.77 135.00 139.26 3kjx s PRO 99 Ca 0.04 1.56 0.08 0.00 0.04 0.00 0.00 61.00 62.72 3kjx s PRO 99 Cb -0.21 -3.45 -0.02 0.00 0.04 0.00 0.00 34.50 30.86 3kjx s PRO 99 CO -0.04 -0.21 -0.23 0.14 0.04 0.00 0.00 177.00 176.69 3kjx s VAL 100 N 1.36 1.85 -0.15 -0.36 -7.23 -0.78 -4.93 120.40 110.15 3kjx s VAL 100 Ca 0.54 -1.12 -0.09 0.00 -1.81 0.00 0.00 61.98 59.51 3kjx s VAL 100 Cb -0.24 -1.56 -0.04 0.00 0.56 0.00 0.00 36.38 35.10 3kjx s VAL 100 CO 0.26 0.41 0.15 -0.69 -0.31 0.00 0.00 175.10 174.92 3kjx s VAL 101 N -0.65 5.45 -0.06 1.32 1.01 -1.26 -1.68 120.40 124.53 3kjx s VAL 101 Ca 0.09 0.22 0.05 0.00 0.00 0.00 0.00 61.98 62.35 3kjx s VAL 101 Cb -0.09 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 3kjx s VAL 101 CO 0.00 0.54 -0.24 -0.83 0.00 0.00 0.00 175.10 174.57 3kjx s GLY 102 N -0.40 1.24 -0.06 4.51 0.00 0.16 -4.98 107.32 107.80 3kjx s GLY 102 Ca 0.12 -0.98 -0.03 0.00 0.00 0.00 0.00 44.72 43.84 3kjx s GLY 102 CO 0.02 -0.54 0.08 0.14 0.00 0.00 0.00 173.10 172.80 3kjx s VAL 103 N -0.04 4.88 -0.06 1.40 1.01 -1.26 -1.54 120.40 124.79 3kjx s VAL 103 Ca -0.06 -0.18 0.03 0.00 0.00 0.00 0.00 61.98 61.77 3kjx s VAL 103 Cb -0.14 -3.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 3kjx s VAL 103 CO 0.04 0.49 0.10 0.35 0.00 0.00 0.00 175.10 176.08 3kjx n THR 104 N 1.64 0.00 -1.44 3.92 -2.24 -0.27 -4.90 114.28 110.98 3kjx n THR 104 Ca -0.16 -0.20 -0.15 0.00 -2.27 0.00 0.00 64.05 61.26 3kjx n THR 104 Cb 0.54 0.64 -0.07 0.00 -2.10 0.00 0.00 70.33 69.34 3kjx n THR 104 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3kjx n ASP 105 N -1.42 -5.14 0.00 3.42 8.00 0.24 -1.84 116.55 119.82 3kjx n ASP 105 Ca -0.00 0.38 0.00 0.00 0.71 0.00 0.00 54.79 55.88 3kjx n ASP 105 Cb 0.07 -3.98 0.00 0.00 -0.02 0.00 0.00 41.12 37.19 3kjx n ASP 105 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3kjx n TYR 106 N -2.46 0.00 -2.92 1.24 4.01 -1.25 -5.00 117.16 110.79 3kjx n TYR 106 Ca -0.15 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.17 3kjx n TYR 106 Cb 0.55 -0.27 -0.05 0.00 -0.31 0.00 0.00 39.34 39.26 3kjx n TYR 106 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3kjx s LEU 107 N 0.00 4.08 0.44 7.72 1.43 -0.76 -4.94 118.68 126.64 3kjx s LEU 107 Ca 0.00 0.63 0.15 0.00 -1.03 0.00 0.00 54.13 53.89 3kjx s LEU 107 Cb 0.00 -3.11 1.07 0.00 0.03 0.00 0.00 46.19 44.17 3kjx s LEU 107 CO 0.00 -0.67 1.96 -0.65 0.23 0.00 0.00 176.35 177.22 3kjx h PRO 108 N 8.20 0.37 -0.24 1.29 0.11 -1.94 0.29 132.00 140.08 3kjx h PRO 108 Ca -0.24 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.67 3kjx h PRO 108 Cb 1.09 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 3kjx h PRO 108 CO 0.90 0.24 -0.55 0.93 -0.21 0.00 0.00 178.00 179.32 3kjx h GLU 109 N 0.38 0.72 -0.30 1.05 3.07 -1.95 -1.78 114.58 115.78 3kjx h GLU 109 Ca 0.31 -0.46 -0.16 0.00 -0.50 0.00 0.00 59.36 58.55 3kjx h GLU 109 Cb 0.70 0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 28.66 3kjx h GLU 109 CO -0.09 1.08 -0.45 -0.22 -1.40 0.00 0.00 179.01 177.93 3kjx h LYS 110 N 0.56 0.84 -0.76 2.33 3.64 -1.36 -2.32 116.57 119.50 3kjx h LYS 110 Ca 0.01 -0.50 -0.05 0.00 -1.27 0.00 0.00 60.65 58.84 3kjx h LYS 110 Cb 1.13 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.96 3kjx h LYS 110 CO 0.11 1.13 0.28 1.49 -2.27 0.00 0.00 179.45 180.20 3kjx h GLU 111 N 0.61 1.14 -0.47 1.90 4.81 -0.47 -1.75 114.58 120.36 3kjx h GLU 111 Ca 0.03 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 59.02 3kjx h GLU 111 Cb 1.05 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.23 3kjx h GLU 111 CO 0.10 0.94 0.23 1.49 -0.73 0.00 0.00 179.01 181.05 3kjx h GLU 112 N 1.10 0.67 -0.01 1.92 4.81 -1.23 -0.99 114.58 120.84 3kjx h GLU 112 Ca 0.25 -0.10 -0.14 0.00 -0.13 0.00 0.00 59.36 59.24 3kjx h GLU 112 Cb 0.24 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 3kjx h GLU 112 CO -0.02 0.56 -0.64 -0.22 -0.73 0.00 0.00 179.01 177.97 3kjx h LYS 113 N 0.61 0.05 -0.11 1.92 3.64 -1.24 -1.40 116.57 120.04 3kjx h LYS 113 Ca 0.16 -0.04 -0.23 0.00 -1.27 0.00 0.00 60.65 59.27 3kjx h LYS 113 Cb 0.11 0.01 0.01 0.00 -0.41 0.00 0.00 32.23 31.95 3kjx h LYS 113 CO -0.02 0.67 -0.84 0.28 -2.27 0.00 0.00 179.45 177.27 3kjx h VAL 114 N 0.04 1.28 -0.36 2.00 2.07 -1.21 -1.92 116.25 118.15 3kjx h VAL 114 Ca -0.01 -2.05 -0.10 0.00 0.82 0.00 0.00 66.70 65.37 3kjx h VAL 114 Cb 1.14 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 3kjx h VAL 114 CO 0.09 0.64 -0.15 0.25 0.02 0.00 0.00 177.57 178.42 3kjx h LEU 115 N 0.50 0.76 0.32 2.57 5.85 -1.16 -3.15 115.31 121.00 3kjx h LEU 115 Ca -0.07 -0.40 -0.00 0.00 0.84 0.00 0.00 57.88 58.25 3kjx h LEU 115 Cb 1.48 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.28 3kjx h LEU 115 CO 0.17 0.99 -0.28 0.22 -0.34 0.00 0.00 178.44 179.20 3kjx h TYR 116 N 0.53 -0.75 0.00 1.25 3.20 -1.26 0.94 116.97 120.89 3kjx h TYR 116 Ca 0.08 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.96 3kjx h TYR 116 Cb 0.69 0.29 0.00 0.00 1.54 0.00 0.00 36.73 39.25 3kjx h TYR 116 CO 0.06 -0.41 0.00 0.39 -1.64 0.00 0.00 178.16 176.55 3kjx n GLU 117 N -5.41 0.00 0.00 1.82 -0.58 -0.72 -1.31 120.64 114.44 3kjx n GLU 117 Ca -0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 3kjx n GLU 117 Cb 0.31 -0.87 0.00 0.00 -0.57 0.00 0.00 31.44 30.31 3kjx n GLU 117 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3kjx n LEU 119 N 0.09 0.00 0.17 -4.62 4.77 0.33 -3.23 117.00 114.50 3kjx n LEU 119 Ca 0.00 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.11 3kjx n LEU 119 Cb 0.00 0.00 0.55 0.00 -2.33 0.00 0.00 43.42 41.64 3kjx n LEU 119 CO 0.00 0.00 0.89 0.77 -1.33 0.00 0.00 177.39 177.72 3kjx h SER 120 N 0.00 0.00 -0.12 -1.43 4.64 -1.43 -1.56 113.55 113.65 3kjx h SER 120 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3kjx h SER 120 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3kjx h SER 120 CO 0.00 0.00 0.00 0.79 -0.87 0.00 0.00 176.83 176.75 3kjx n TRP 121 N -2.42 0.14 -3.25 4.77 8.01 -1.20 -5.00 117.44 118.50 3kjx n TRP 121 Ca 0.01 -0.07 -0.06 0.00 -1.31 0.00 0.00 57.50 56.07 3kjx n TRP 121 Cb 0.22 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.52 3kjx n TRP 121 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.69 177.22 3kjx n ARG 122 N 0.68 -1.38 -1.79 -0.99 5.12 -0.59 -4.57 116.66 113.14 3kjx n ARG 122 Ca 0.17 1.31 -0.30 0.00 -1.93 0.00 0.00 57.85 57.10 3kjx n ARG 122 Cb 0.44 -4.89 0.19 0.00 -1.16 0.00 0.00 32.46 27.03 3kjx n ARG 122 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3kjx s PRO 123 N -3.50 0.45 0.05 5.56 0.04 -1.26 -1.15 135.00 135.19 3kjx s PRO 123 Ca 0.00 -0.31 0.21 0.00 0.04 0.00 0.00 61.00 60.94 3kjx s PRO 123 Cb -0.00 -1.81 -0.17 0.00 0.04 0.00 0.00 34.50 32.56 3kjx s PRO 123 CO 0.79 -2.56 0.71 0.43 0.04 0.00 0.00 177.00 176.40 3kjx n SER 124 N -3.89 0.48 -3.51 6.66 7.64 0.17 -4.58 113.62 116.59 3kjx n SER 124 Ca 0.14 0.19 -0.10 0.00 1.01 0.00 0.00 58.87 60.11 3kjx n SER 124 Cb 0.60 0.98 -0.02 0.00 -1.01 0.00 0.00 64.21 64.75 3kjx n SER 124 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3kjx s GLY 125 N -4.62 -0.51 -0.05 0.23 0.00 -1.23 -4.04 107.32 97.11 3kjx s GLY 125 Ca -0.05 0.47 0.02 0.00 0.00 0.00 0.00 44.72 45.17 3kjx s GLY 125 CO 0.84 0.16 -0.09 0.14 0.00 0.00 0.00 173.10 174.15 3kjx s VAL 126 N -3.63 0.87 -0.23 1.40 1.01 -0.75 -0.44 120.40 118.61 3kjx s VAL 126 Ca 0.04 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.70 3kjx s VAL 126 Cb -0.02 -0.81 0.05 0.00 0.00 0.00 0.00 36.38 35.60 3kjx s VAL 126 CO -0.09 0.29 -0.10 -0.63 0.00 0.00 0.00 175.10 174.57 3kjx s ILE 127 N 0.66 1.86 -0.03 2.22 1.01 0.19 -0.34 121.20 126.77 3kjx s ILE 127 Ca -0.12 -1.33 0.06 0.00 0.00 0.00 0.00 60.65 59.26 3kjx s ILE 127 Cb -0.14 -1.99 -0.01 0.00 0.01 0.00 0.00 42.46 40.33 3kjx s ILE 127 CO 0.02 0.03 -0.21 -0.51 0.00 0.00 0.00 174.94 174.27 3kjx s ILE 128 N 1.26 1.69 0.21 2.92 2.07 0.09 -0.58 121.20 128.86 3kjx s ILE 128 Ca -0.05 -0.89 -0.30 0.00 -1.41 0.00 0.00 60.65 58.00 3kjx s ILE 128 Cb -0.18 -1.42 -0.08 0.00 0.13 0.00 0.00 42.46 40.91 3kjx s ILE 128 CO -0.07 0.48 0.95 0.00 -1.91 0.00 0.00 174.94 174.39 3kjx s ALA 129 N -0.30 3.32 0.00 1.50 0.00 -0.32 -0.97 121.76 124.98 3kjx s ALA 129 Ca 0.03 0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.60 3kjx s ALA 129 Cb -0.10 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.79 3kjx s ALA 129 CO 0.01 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.33 3kjx n GLY 130 N 1.68 -1.93 0.00 0.00 0.00 -0.31 -4.84 105.19 99.79 3kjx n GLY 130 Ca -0.01 -1.51 0.06 0.00 0.00 0.00 0.00 46.02 44.56 3kjx n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kjx n LEU 131 N -2.21 0.36 -4.66 0.99 4.77 -1.26 -4.59 117.00 110.39 3kjx n LEU 131 Ca 0.00 -0.29 -0.38 0.00 -0.03 0.00 0.00 56.01 55.31 3kjx n LEU 131 Cb 0.00 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 3kjx n LEU 131 CO 0.00 0.09 0.08 -1.61 -1.33 0.00 0.00 177.39 174.62 3kjx s GLU 132 N -2.54 4.15 0.08 3.23 8.01 -1.26 -5.06 118.70 125.32 3kjx s GLU 132 Ca 0.01 0.16 -0.06 0.00 0.01 0.00 0.00 54.97 55.09 3kjx s GLU 132 Cb 0.09 -3.55 -0.02 0.00 -4.31 0.00 0.00 34.13 26.35 3kjx s GLU 132 CO 0.55 -0.06 0.12 -1.01 0.01 0.00 0.00 175.26 174.88 3kjx s HIS 133 N 1.37 0.31 1.10 1.61 3.76 -1.26 -5.04 115.29 117.14 3kjx s HIS 133 Ca 0.18 -0.77 -0.12 0.00 -0.15 0.00 0.00 55.06 54.20 3kjx s HIS 133 Cb -0.15 -0.18 0.25 0.00 1.11 0.00 0.00 32.58 33.61 3kjx s HIS 133 CO 0.08 -0.50 1.06 -1.54 -0.85 0.00 0.00 174.74 172.98 3kjx s SER 134 N -2.89 1.42 0.18 1.40 1.04 -1.26 -4.70 113.70 108.89 3kjx s SER 134 Ca 0.07 1.73 -0.11 0.00 0.48 0.00 0.00 55.95 58.11 3kjx s SER 134 Cb 0.06 -2.40 0.09 0.00 0.10 0.00 0.00 66.02 63.87 3kjx s SER 134 CO -0.09 -3.96 1.76 -0.08 0.98 0.00 0.00 173.24 171.84 3kjx h GLU 135 N -2.46 0.92 -0.15 4.02 4.81 -1.99 -1.35 114.58 118.39 3kjx h GLU 135 Ca -0.57 -0.15 -0.18 0.00 -0.13 0.00 0.00 59.36 58.33 3kjx h GLU 135 Cb 1.32 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.53 3kjx h GLU 135 CO 0.47 0.75 -0.66 0.00 -0.73 0.00 0.00 179.01 178.85 3kjx h ALA 136 N 1.12 0.57 -0.58 2.92 0.00 -1.99 -2.42 119.26 118.88 3kjx h ALA 136 Ca 0.22 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 3kjx h ALA 136 Cb 0.15 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3kjx h ALA 136 CO -0.02 0.71 0.27 0.00 0.00 0.00 0.00 179.25 180.21 3kjx h ALA 137 N 0.85 0.75 -0.12 0.00 0.00 -1.86 -2.51 119.26 116.37 3kjx h ALA 137 Ca -0.02 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 3kjx h ALA 137 Cb 1.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3kjx h ALA 137 CO 0.12 0.31 -0.38 -0.09 0.00 0.00 0.00 179.25 179.22 3kjx h ARG 138 N 0.79 0.25 -1.37 0.00 2.43 -1.20 -2.60 114.38 112.68 3kjx h ARG 138 Ca 0.20 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 3kjx h ARG 138 Cb 0.13 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 3kjx h ARG 138 CO -0.02 0.60 0.00 0.00 -1.51 0.00 0.00 179.97 179.03 3kjx n ALA 139 N -2.48 1.71 0.00 2.80 0.00 -0.92 -1.61 120.51 120.01 3kjx n ALA 139 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3kjx n ALA 139 Cb 0.46 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.91 3kjx n ALA 139 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3kjx n LEU 141 N 0.73 0.00 0.16 0.00 4.77 -0.98 -1.11 117.00 120.57 3kjx n LEU 141 Ca 0.00 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.02 3kjx n LEU 141 Cb 0.13 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.41 3kjx n LEU 141 CO 0.00 0.00 0.57 -0.78 -1.33 0.00 0.00 177.39 175.85 3kjx h ASP 142 N 0.00 0.00 0.89 -1.43 3.58 -1.59 -3.18 116.42 114.69 3kjx h ASP 142 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3kjx h ASP 142 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 3kjx h ASP 142 CO 0.00 0.46 -0.75 0.00 -2.88 0.00 0.00 179.24 176.07 3kjx h ALA 143 N 1.54 0.54 -2.91 -0.78 0.00 -1.38 -3.47 119.26 112.80 3kjx h ALA 143 Ca -0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 3kjx h ALA 143 Cb 1.13 0.00 0.13 0.00 0.00 0.00 0.00 17.79 19.05 3kjx h ALA 143 CO 0.06 0.00 0.48 0.00 0.00 0.00 0.00 179.25 179.79 3kjx s ALA 144 N -3.23 2.48 -0.37 0.00 0.00 -1.20 -4.91 121.76 114.53 3kjx s ALA 144 Ca 0.04 1.07 0.06 0.00 0.00 0.00 0.00 51.96 53.13 3kjx s ALA 144 Cb 0.12 -3.48 0.53 0.00 0.00 0.00 0.00 23.12 20.29 3kjx s ALA 144 CO 0.75 -1.32 1.60 0.41 0.00 0.00 0.00 175.76 177.19 3kjx n GLY 145 N 0.62 5.11 3.38 0.00 0.00 -1.26 -4.97 105.19 108.07 3kjx n GLY 145 Ca 0.14 -1.49 -0.19 0.00 0.00 0.00 0.00 46.02 44.48 3kjx n GLY 145 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3kjx s ILE 146 N -3.61 1.72 0.33 -0.61 -4.36 -1.26 -5.06 121.20 108.35 3kjx s ILE 146 Ca 0.50 -2.19 -0.29 0.00 -0.26 0.00 0.00 60.65 58.42 3kjx s ILE 146 Cb 0.44 -2.19 -0.11 0.00 1.25 0.00 0.00 42.46 41.84 3kjx s ILE 146 CO 0.02 -0.49 1.53 -2.84 0.24 0.00 0.00 174.94 173.40 3kjx s PRO 147 N -3.67 4.13 -0.09 0.37 0.02 -1.26 -4.88 135.00 129.62 3kjx s PRO 147 Ca 0.25 2.55 0.02 0.00 0.02 0.00 0.00 61.00 63.85 3kjx s PRO 147 Cb 0.01 -3.00 0.01 0.00 0.02 0.00 0.00 34.50 31.54 3kjx s PRO 147 CO 0.09 -0.56 -0.14 0.08 -0.33 0.00 0.00 177.00 176.13 3kjx s VAL 148 N -0.56 1.35 -0.17 3.83 1.01 -1.26 -1.82 120.40 122.79 3kjx s VAL 148 Ca 0.58 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.98 3kjx s VAL 148 Cb -0.47 -1.23 0.03 0.00 0.00 0.00 0.00 36.38 34.71 3kjx s VAL 148 CO 0.55 0.41 -0.12 -0.69 0.00 0.00 0.00 175.10 175.25 3kjx s VAL 149 N 0.79 1.55 -0.21 2.92 1.01 0.54 -0.87 120.40 126.12 3kjx s VAL 149 Ca -0.11 -0.76 -0.18 0.00 0.00 0.00 0.00 61.98 60.92 3kjx s VAL 149 Cb -0.16 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.66 3kjx s VAL 149 CO 0.02 0.33 0.53 -1.61 0.00 0.00 0.00 175.10 174.36 3kjx s GLU 150 N 1.47 4.17 -0.58 2.72 2.02 -0.77 -0.73 118.70 127.00 3kjx s GLU 150 Ca 0.02 0.41 -0.01 0.00 0.02 0.00 0.00 54.97 55.42 3kjx s GLU 150 Cb -0.14 -3.58 0.15 0.00 0.10 0.00 0.00 34.13 30.66 3kjx s GLU 150 CO -0.09 -0.20 0.37 0.96 0.02 0.00 0.00 175.26 176.32 3kjx s ILE 151 N 1.80 3.35 0.25 -1.63 -4.36 -0.14 -1.54 121.20 118.93 3kjx s ILE 151 Ca 0.24 -3.00 0.00 0.00 -0.26 0.00 0.00 60.65 57.63 3kjx s ILE 151 Cb -0.15 -3.23 0.00 0.00 1.25 0.00 0.00 42.46 40.33 3kjx s ILE 151 CO 0.09 -0.84 0.00 -0.67 0.24 0.00 0.00 174.94 173.76 3kjx n ASP 153 N 3.45 -7.22 -0.65 4.36 -0.08 -1.26 -1.17 116.55 113.99 3kjx n ASP 153 Ca 0.07 1.32 0.08 0.00 -1.51 0.00 0.00 54.79 54.74 3kjx n ASP 153 Cb 0.37 -4.35 0.08 0.00 2.34 0.00 0.00 41.12 39.55 3kjx n ASP 153 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 3kjx n SER 154 N 1.04 2.39 -3.47 1.67 3.41 -0.29 -4.65 113.62 113.72 3kjx n SER 154 Ca 0.00 -1.68 -0.37 0.00 -0.26 0.00 0.00 58.87 56.56 3kjx n SER 154 Cb 0.00 -0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 63.90 3kjx n SER 154 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3kjx n ASP 155 N 0.89 5.02 0.00 4.04 8.00 -1.26 -3.50 116.55 129.74 3kjx n ASP 155 Ca 0.10 -2.61 0.00 0.00 0.71 0.00 0.00 54.79 52.99 3kjx n ASP 155 Cb 0.40 -1.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.13 3kjx n ASP 155 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kjx n GLY 156 N 3.99 0.06 2.96 0.44 0.00 -1.26 -5.06 105.19 106.32 3kjx n GLY 156 Ca 0.56 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.40 3kjx n GLY 156 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kjx n LYS 157 N 0.00 -0.96 -4.00 1.61 5.02 -1.23 -4.97 118.16 113.63 3kjx n LYS 157 Ca 0.00 0.94 -0.12 0.00 -2.02 0.00 0.00 58.31 57.11 3kjx n LYS 157 Cb 0.00 -1.28 -0.03 0.00 -0.02 0.00 0.00 35.03 33.70 3kjx n LYS 157 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3kjx s PRO 158 N -1.49 1.88 1.12 1.97 0.04 -1.26 -5.07 135.00 132.19 3kjx s PRO 158 Ca 0.17 -1.55 0.00 0.00 0.04 0.00 0.00 61.00 59.67 3kjx s PRO 158 Cb -0.02 0.49 0.00 0.00 0.04 0.00 0.00 34.50 35.01 3kjx s PRO 158 CO 0.39 -0.81 0.00 0.28 0.04 0.00 0.00 177.00 176.91 3kjx n VAL 159 N -0.51 0.00 0.00 -0.36 0.31 -1.26 -4.52 118.33 111.99 3kjx n VAL 159 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 3kjx n VAL 159 Cb 0.61 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.54 3kjx n VAL 159 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3kjx n ASP 160 N 2.82 0.00 -1.58 4.52 -0.08 -1.26 -4.99 116.55 115.98 3kjx n ASP 160 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 3kjx n ASP 160 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 3kjx n ASP 160 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3kjx n ALA 161 N -3.00 0.00 -3.33 -1.67 0.00 -0.05 -4.87 120.51 107.60 3kjx n ALA 161 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 3kjx n ALA 161 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 3kjx n ALA 161 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3kjx s VAL 163 N 1.11 -0.17 -0.46 0.00 1.01 -0.59 -1.85 120.40 119.46 3kjx s VAL 163 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61.98 61.98 3kjx s VAL 163 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.38 3kjx s VAL 163 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.71 3kjx n GLY 164 N 4.44 -1.10 3.51 4.51 0.00 -0.89 -4.08 105.19 111.58 3kjx n GLY 164 Ca -0.09 -0.79 -0.24 0.00 0.00 0.00 0.00 46.02 44.90 3kjx n GLY 164 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3kjx s ILE 165 N -3.00 1.45 -0.37 -0.61 -4.36 -1.26 -1.23 121.20 111.82 3kjx s ILE 165 Ca 0.00 -2.00 -0.20 0.00 -0.26 0.00 0.00 60.65 58.19 3kjx s ILE 165 Cb 0.00 -2.85 0.00 0.00 1.25 0.00 0.00 42.46 40.86 3kjx s ILE 165 CO 0.00 0.00 0.59 -0.55 0.24 0.00 0.00 174.94 175.22 3kjx s SER 166 N -3.57 6.37 0.26 4.36 0.15 -1.26 -1.14 113.70 118.87 3kjx s SER 166 Ca 0.36 0.00 0.06 0.00 0.70 0.00 0.00 55.95 57.07 3kjx s SER 166 Cb 0.09 -2.30 0.32 0.00 -1.71 0.00 0.00 66.02 62.41 3kjx s SER 166 CO 0.16 -0.58 1.60 0.45 1.20 0.00 0.00 173.24 176.07 3kjx h HIS 167 N 8.53 0.22 -0.55 3.44 -0.00 -1.90 -0.45 115.15 124.44 3kjx h HIS 167 Ca -0.27 -0.08 -0.02 0.00 -0.00 0.00 0.00 60.37 60.01 3kjx h HIS 167 Cb 1.11 -0.04 -0.03 0.00 -0.00 0.00 0.00 27.41 28.46 3kjx h HIS 167 CO 0.74 0.71 0.28 -0.09 -0.00 0.00 0.00 177.93 179.56 3kjx h ARG 168 N 0.13 0.78 -0.21 2.45 2.43 -1.88 0.84 114.38 118.92 3kjx h ARG 168 Ca -0.00 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 3kjx h ARG 168 Cb 1.05 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 3kjx h ARG 168 CO 0.09 0.62 0.04 -0.09 -1.51 0.00 0.00 179.97 179.12 3kjx h ARG 169 N 0.74 0.34 -0.65 0.20 1.12 -1.78 -1.24 114.38 113.11 3kjx h ARG 169 Ca 0.19 -0.09 0.12 0.00 -1.11 0.00 0.00 59.98 59.09 3kjx h ARG 169 Cb 0.09 -0.04 -0.09 0.00 -0.01 0.00 0.00 29.97 29.92 3kjx h ARG 169 CO -0.03 0.47 0.20 0.00 -3.11 0.00 0.00 179.97 177.51 3kjx h ALA 170 N 0.85 0.83 -0.63 2.80 0.00 -0.61 0.19 119.26 122.69 3kjx h ALA 170 Ca 0.06 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 3kjx h ALA 170 Cb 0.29 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 3kjx h ALA 170 CO 0.00 -0.25 0.28 0.78 0.00 0.00 0.00 179.25 180.06 3kjx h GLY 171 N 0.35 0.96 1.10 0.00 0.00 -0.39 -3.00 103.07 102.09 3kjx h GLY 171 Ca 0.34 -0.46 -0.21 0.00 0.00 0.00 0.00 47.33 47.00 3kjx h GLY 171 CO -0.38 0.44 -0.74 3.21 0.00 0.00 0.00 176.54 179.07 3kjx h ARG 172 N 0.89 0.72 -0.30 4.80 3.08 -0.04 -2.61 114.38 120.91 3kjx h ARG 172 Ca 0.22 -0.61 0.00 0.00 0.07 0.00 0.00 59.98 59.66 3kjx h ARG 172 Cb 0.12 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.30 3kjx h ARG 172 CO -0.03 1.22 0.00 -1.91 -1.07 0.00 0.00 179.97 178.18 3kjx n GLU 173 N -4.00 0.00 0.00 0.04 4.07 -0.06 -1.47 120.64 119.21 3kjx n GLU 173 Ca -0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 3kjx n GLU 173 Cb 0.73 -1.01 0.00 0.00 -0.06 0.00 0.00 31.44 31.10 3kjx n GLU 173 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3kjx n ALA 175 N 0.52 0.00 0.09 4.31 0.00 -1.17 -1.75 120.51 122.50 3kjx n ALA 175 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 3kjx n ALA 175 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 3kjx n ALA 175 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3kjx h GLN 176 N 0.00 -0.18 -0.81 0.00 1.08 -1.56 -1.90 115.11 111.74 3kjx h GLN 176 Ca 0.00 0.01 0.11 0.00 -1.45 0.00 0.00 58.65 57.32 3kjx h GLN 176 Cb 0.00 0.04 -0.08 0.00 -0.05 0.00 0.00 27.48 27.39 3kjx h GLN 176 CO 0.00 0.05 0.44 0.00 -0.95 0.00 0.00 178.83 178.36 3kjx h ALA 177 N 0.45 1.17 -0.05 3.87 0.00 -1.62 0.71 119.26 123.79 3kjx h ALA 177 Ca -0.02 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3kjx h ALA 177 Cb 0.31 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3kjx h ALA 177 CO 0.03 0.01 -0.00 0.82 0.00 0.00 0.00 179.25 180.11 3kjx h ILE 178 N 0.70 1.26 -0.05 0.00 2.04 -1.82 -2.22 117.51 117.42 3kjx h ILE 178 Ca 0.41 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.48 3kjx h ILE 178 Cb 0.46 1.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.23 3kjx h ILE 178 CO -0.29 0.21 0.03 -0.07 0.00 0.00 0.00 178.15 178.04 3kjx h LEU 179 N -0.21 0.06 -1.57 1.44 3.38 -0.99 -1.77 115.31 115.65 3kjx h LEU 179 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3kjx h LEU 179 Cb 0.34 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3kjx h LEU 179 CO 0.00 0.06 0.00 0.50 0.09 0.00 0.00 178.44 179.09 3kjx h LYS 180 N 0.06 0.00 -0.00 1.13 3.64 -0.86 -1.20 116.57 119.34 3kjx h LYS 180 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3kjx h LYS 180 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 3kjx h LYS 180 CO -0.00 0.00 -0.54 0.00 -2.27 0.00 0.00 179.45 176.64 3kjx n ALA 181 N -1.81 3.68 0.00 5.00 0.00 -0.69 -4.96 120.51 121.73 3kjx n ALA 181 Ca -0.01 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.00 3kjx n ALA 181 Cb 0.05 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.47 3kjx n ALA 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kjx n GLY 182 N 1.46 1.18 3.75 0.00 0.00 -0.45 -4.77 105.19 106.35 3kjx n GLY 182 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3kjx n GLY 182 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kjx s TYR 183 N -2.13 3.48 0.18 1.61 1.51 -1.08 -5.02 117.35 115.89 3kjx s TYR 183 Ca 0.00 1.56 -0.04 0.00 -1.01 0.00 0.00 57.07 57.57 3kjx s TYR 183 Cb 0.00 -3.37 -0.03 0.00 -0.11 0.00 0.00 41.96 38.45 3kjx s TYR 183 CO 0.00 -0.91 0.20 1.03 -1.11 0.00 0.00 175.55 174.75 3kjx s ARG 184 N -0.88 1.18 -0.27 -0.62 1.81 -1.26 -4.39 118.95 114.52 3kjx s ARG 184 Ca 0.49 -1.43 -0.09 0.00 -1.72 0.00 0.00 55.73 52.97 3kjx s ARG 184 Cb -0.33 0.32 0.01 0.00 -0.45 0.00 0.00 34.95 34.50 3kjx s ARG 184 CO 0.40 -0.40 0.35 0.54 -0.68 0.00 0.00 175.30 175.50 3kjx n ARG 185 N -0.23 -1.66 -5.13 3.54 1.74 -1.26 -4.36 116.66 109.30 3kjx n ARG 185 Ca -0.02 1.63 -0.29 0.00 -0.77 0.00 0.00 57.85 58.39 3kjx n ARG 185 Cb 0.64 -4.21 -0.16 0.00 -1.02 0.00 0.00 32.46 27.72 3kjx n ARG 185 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3kjx s ILE 186 N -1.94 1.89 0.11 0.55 1.01 -1.26 -2.44 121.20 119.12 3kjx s ILE 186 Ca 0.14 -1.06 0.08 0.00 0.00 0.00 0.00 60.65 59.81 3kjx s ILE 186 Cb -0.04 -1.57 -0.04 0.00 0.01 0.00 0.00 42.46 40.82 3kjx s ILE 186 CO 0.51 0.49 -0.14 -0.83 0.00 0.00 0.00 174.94 174.97 3kjx s GLY 187 N -0.66 1.74 0.24 6.18 0.00 -0.23 -0.02 107.32 114.57 3kjx s GLY 187 Ca 0.09 -1.30 0.01 0.00 0.00 0.00 0.00 44.72 43.53 3kjx s GLY 187 CO -0.00 -1.27 0.05 0.33 0.00 0.00 0.00 173.10 172.20 3kjx n PHE 188 N 0.76 0.30 0.00 1.90 7.35 -0.31 -0.99 117.46 126.47 3kjx n PHE 188 Ca -0.15 -1.40 0.00 0.00 -0.76 0.00 0.00 57.45 55.14 3kjx n PHE 188 Cb 0.52 -0.07 0.00 0.00 0.35 0.00 0.00 39.48 40.28 3kjx n PHE 188 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3kjx n GLY 190 N 1.05 2.23 3.41 7.13 0.00 -1.26 -2.42 105.19 115.34 3kjx n GLY 190 Ca -0.06 -1.03 -0.16 0.00 0.00 0.00 0.00 46.02 44.77 3kjx n GLY 190 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kjx s THR 191 N -2.00 0.00 -1.04 2.61 -4.23 -1.24 -1.60 115.64 108.14 3kjx s THR 191 Ca 0.00 -1.75 -0.02 0.00 -1.18 0.00 0.00 61.69 58.74 3kjx s THR 191 Cb 0.00 -2.56 -0.02 0.00 1.34 0.00 0.00 72.50 71.25 3kjx s THR 191 CO 0.00 0.00 0.88 1.17 -0.54 0.00 0.00 174.62 176.13 3kjx n LYS 192 N -0.55 -4.49 0.00 3.99 3.00 0.15 -4.81 118.16 115.46 3kjx n LYS 192 Ca 0.03 0.78 0.00 0.00 -0.00 0.00 0.00 58.31 59.12 3kjx n LYS 192 Cb 0.62 -5.52 0.00 0.00 0.00 0.00 0.00 35.03 30.13 3kjx n LYS 192 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 3kjx n PRO 194 N -3.55 0.00 -0.01 1.64 -0.04 -1.26 -0.14 135.00 131.64 3kjx n PRO 194 Ca -0.19 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.09 3kjx n PRO 194 Cb 0.64 -0.75 -0.14 0.00 -0.04 0.00 0.00 33.50 33.20 3kjx n PRO 194 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 3kjx n LEU 195 N 0.41 2.21 -4.48 1.53 7.94 -1.26 -4.71 117.00 118.64 3kjx n LEU 195 Ca 0.00 0.24 -0.42 0.00 -1.11 0.00 0.00 56.01 54.72 3kjx n LEU 195 Cb 0.00 -0.80 -0.04 0.00 0.53 0.00 0.00 43.42 43.12 3kjx n LEU 195 CO 0.00 0.75 0.90 -0.62 -1.11 0.00 0.00 177.39 177.31 3kjx s ASP 196 N -6.78 6.19 0.46 1.96 -1.08 0.80 -4.88 116.67 113.34 3kjx s ASP 196 Ca -0.19 -0.86 0.23 0.00 -0.52 0.00 0.00 52.55 51.21 3kjx s ASP 196 Cb 0.07 -2.46 1.13 0.00 -1.46 0.00 0.00 42.92 40.20 3kjx s ASP 196 CO 0.78 -1.56 1.95 1.88 0.52 0.00 0.00 175.17 178.74 3kjx h TYR 197 N 9.70 0.00 -0.32 -5.34 -1.99 -1.90 -2.32 116.97 114.80 3kjx h TYR 197 Ca -0.26 0.00 -0.17 0.00 2.00 0.00 0.00 58.73 60.29 3kjx h TYR 197 Cb 1.06 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.79 3kjx h TYR 197 CO 1.03 0.21 -0.47 0.00 -0.00 0.00 0.00 178.16 178.93 3kjx h ARG 198 N 0.00 0.88 -0.24 4.88 3.08 -1.99 -1.68 114.38 119.30 3kjx h ARG 198 Ca -0.00 -0.51 -0.01 0.00 0.07 0.00 0.00 59.98 59.53 3kjx h ARG 198 Cb 0.53 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 3kjx h ARG 198 CO 0.03 1.15 0.11 0.00 -1.07 0.00 0.00 179.97 180.19 3kjx h ALA 199 N 0.76 0.31 -0.76 0.04 0.00 -1.83 -2.18 119.26 115.60 3kjx h ALA 199 Ca 0.04 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.90 3kjx h ALA 199 Cb 1.07 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 3kjx h ALA 199 CO 0.11 -0.12 0.50 0.00 0.00 0.00 0.00 179.25 179.73 3kjx h ARG 200 N 0.25 0.85 -0.05 0.00 3.08 -1.34 -1.34 114.38 115.84 3kjx h ARG 200 Ca 0.08 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 59.98 3kjx h ARG 200 Cb 0.13 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 3kjx h ARG 200 CO -0.01 0.56 -0.44 0.87 -1.07 0.00 0.00 179.97 179.88 3kjx h LYS 201 N 0.88 0.11 -0.16 0.04 1.57 -0.91 -0.29 116.57 117.80 3kjx h LYS 201 Ca 0.31 -0.05 -0.22 0.00 -1.87 0.00 0.00 60.65 58.82 3kjx h LYS 201 Cb 0.13 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.45 3kjx h LYS 201 CO -0.10 0.53 -0.76 0.00 -0.57 0.00 0.00 179.45 178.56 3kjx h ARG 202 N 0.09 0.78 -0.44 3.15 3.08 -0.66 -1.76 114.38 118.62 3kjx h ARG 202 Ca 0.01 -0.62 -0.09 0.00 0.07 0.00 0.00 59.98 59.34 3kjx h ARG 202 Cb 0.82 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.98 3kjx h ARG 202 CO 0.06 1.23 -0.09 0.35 -1.07 0.00 0.00 179.97 180.45 3kjx h PHE 203 N 0.54 0.85 0.01 3.04 3.57 -1.10 0.32 116.94 124.16 3kjx h PHE 203 Ca -0.05 -0.15 -0.00 0.00 3.53 0.00 0.00 57.97 61.31 3kjx h PHE 203 Cb 1.38 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.90 3kjx h PHE 203 CO 0.08 0.83 -0.00 0.93 -2.23 0.00 0.00 178.31 177.92 3kjx h GLU 204 N 0.71 -0.01 -0.82 1.11 5.08 -1.02 -1.12 114.58 118.51 3kjx h GLU 204 Ca 0.12 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 3kjx h GLU 204 Cb 0.57 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 3kjx h GLU 204 CO 0.03 0.33 0.54 0.78 -1.00 0.00 0.00 179.01 179.70 3kjx h GLY 205 N -0.35 1.15 0.34 -3.84 0.00 -1.22 -0.99 103.07 98.16 3kjx h GLY 205 Ca -0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 3kjx h GLY 205 CO 0.00 0.41 -0.29 -2.75 0.00 0.00 0.00 176.54 173.92 3kjx h PHE 206 N 1.10 -0.79 0.00 5.60 3.57 -0.54 -2.84 116.94 123.05 3kjx h PHE 206 Ca 0.30 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 3kjx h PHE 206 Cb -0.11 0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.92 3kjx h PHE 206 CO -0.02 -0.40 -0.03 1.79 -2.23 0.00 0.00 178.31 177.43 3kjx h THR 207 N -0.61 0.19 -0.26 4.41 1.35 -1.14 -2.56 112.91 114.28 3kjx h THR 207 Ca -0.04 -0.26 -0.09 0.00 -0.55 0.00 0.00 66.41 65.46 3kjx h THR 207 Cb 0.52 1.21 -0.01 0.00 -1.73 0.00 0.00 68.15 68.14 3kjx h THR 207 CO -0.00 0.03 -0.19 -0.08 -0.25 0.00 0.00 175.52 175.03 3kjx h GLU 208 N 0.00 0.59 -0.02 4.72 4.81 -1.04 -1.12 114.58 122.52 3kjx h GLU 208 Ca -0.00 -0.29 -0.11 0.00 -0.13 0.00 0.00 59.36 58.83 3kjx h GLU 208 Cb 0.21 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 3kjx h GLU 208 CO 0.00 0.87 -0.52 0.28 -0.73 0.00 0.00 179.01 178.92 3kjx h VAL 209 N 0.32 1.37 0.01 0.32 2.07 -1.23 -2.46 116.25 116.65 3kjx h VAL 209 Ca 0.05 -1.78 -0.19 0.00 0.82 0.00 0.00 66.70 65.60 3kjx h VAL 209 Cb 0.72 1.93 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 3kjx h VAL 209 CO 0.05 0.51 -0.88 -0.07 0.02 0.00 0.00 177.57 177.20 3kjx h LEU 210 N 0.05 0.16 -0.84 2.57 3.38 -1.40 -3.15 115.31 116.09 3kjx h LEU 210 Ca -0.00 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.72 3kjx h LEU 210 Cb 0.93 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 3kjx h LEU 210 CO 0.07 0.96 -0.56 1.23 0.09 0.00 0.00 178.44 180.23 3kjx h GLY 211 N 2.11 0.00 -2.88 0.83 0.00 -1.06 0.11 103.07 102.18 3kjx h GLY 211 Ca -0.03 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.14 3kjx h GLY 211 CO 0.13 0.00 0.20 0.28 0.00 0.00 0.00 176.54 177.15 3kjx n LYS 212 N -3.79 1.38 -0.16 4.80 4.76 -0.94 -2.40 118.16 121.82 3kjx n LYS 212 Ca -0.01 -0.82 0.00 0.00 -2.87 0.00 0.00 58.31 54.61 3kjx n LYS 212 Cb 0.58 -1.32 0.00 0.00 -1.84 0.00 0.00 35.03 32.45 3kjx n LYS 212 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3kjx n ASN 213 N 0.47 0.00 0.00 4.39 3.02 -1.09 -5.00 115.26 117.05 3kjx n ASN 213 Ca 0.16 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 3kjx n ASN 213 Cb 0.68 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.84 3kjx n ASN 213 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kjx n GLY 214 N 0.00 1.02 3.76 7.41 0.00 -1.01 -4.99 105.19 111.38 3kjx n GLY 214 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3kjx n GLY 214 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kjx s VAL 215 N -2.79 4.76 0.05 1.61 1.01 0.00 -4.97 120.40 120.08 3kjx s VAL 215 Ca 0.00 1.42 0.06 0.00 0.00 0.00 0.00 61.98 63.47 3kjx s VAL 215 Cb 0.00 -4.01 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 3kjx s VAL 215 CO 0.00 0.43 -0.18 -0.70 0.00 0.00 0.00 175.10 174.65 3kjx s GLU 216 N -0.38 1.17 -0.13 2.72 2.12 -1.26 -2.92 118.70 120.02 3kjx s GLU 216 Ca 0.34 -0.87 -0.34 0.00 0.36 0.00 0.00 54.97 54.46 3kjx s GLU 216 Cb -0.20 -1.25 -0.11 0.00 0.26 0.00 0.00 34.13 32.83 3kjx s GLU 216 CO 0.20 0.31 1.95 -0.89 -0.54 0.00 0.00 175.26 176.30 3kjx n ILE 217 N 1.82 0.53 0.19 -3.70 2.08 -1.26 -4.56 119.36 114.47 3kjx n ILE 217 Ca -0.18 -0.16 0.03 0.00 0.56 0.00 0.00 62.75 63.01 3kjx n ILE 217 Cb 0.54 -1.93 0.38 0.00 -0.75 0.00 0.00 39.64 37.88 3kjx n ILE 217 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 3kjx h GLU 218 N 10.15 0.00 -1.61 0.38 4.81 -0.79 -3.46 114.58 124.06 3kjx h GLU 218 Ca -0.46 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 58.83 3kjx h GLU 218 Cb 1.27 0.00 -0.25 0.00 0.63 0.00 0.00 28.75 30.40 3kjx h GLU 218 CO 0.96 0.35 0.45 0.34 -0.73 0.00 0.00 179.01 180.38 3kjx s ASP 219 N -6.88 -0.45 -0.14 1.04 2.15 -1.16 -5.00 116.67 106.22 3kjx s ASP 219 Ca -0.03 0.81 -0.29 0.00 0.43 0.00 0.00 52.55 53.47 3kjx s ASP 219 Cb 0.14 0.81 0.10 0.00 -0.30 0.00 0.00 42.92 43.67 3kjx s ASP 219 CO 0.72 -0.19 0.85 0.00 -0.17 0.00 0.00 175.17 176.38 3kjx s ARG 220 N 0.01 0.79 -0.27 4.34 1.04 -1.26 -1.16 118.95 122.44 3kjx s ARG 220 Ca 0.02 0.33 -0.04 0.00 -1.04 0.00 0.00 55.73 55.01 3kjx s ARG 220 Cb -0.04 0.37 0.10 0.00 -2.04 0.00 0.00 34.95 33.34 3kjx s ARG 220 CO -0.05 -0.22 0.15 -1.83 -0.04 0.00 0.00 175.30 173.32 3kjx s GLU 221 N -0.82 0.19 0.00 3.89 -1.05 -1.02 -4.96 118.70 114.94 3kjx s GLU 221 Ca -0.05 -0.40 0.00 0.00 -0.15 0.00 0.00 54.97 54.37 3kjx s GLU 221 Cb -0.01 -1.17 0.00 0.00 -0.44 0.00 0.00 34.13 32.51 3kjx s GLU 221 CO 0.04 -0.97 0.00 1.19 0.95 0.00 0.00 175.26 176.47 3kjx n PHE 222 N 5.26 -1.65 -3.64 4.83 3.01 -1.26 -4.07 117.46 119.94 3kjx n PHE 222 Ca -0.06 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.37 3kjx n PHE 222 Cb 0.44 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.85 3kjx n PHE 222 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 3kjx s TYR 223 N -0.61 -0.08 -2.12 1.38 5.04 -0.63 -4.76 117.35 115.57 3kjx s TYR 223 Ca 0.00 0.18 0.18 0.00 -2.44 0.00 0.00 57.07 54.99 3kjx s TYR 223 Cb 0.00 0.48 0.11 0.00 0.35 0.00 0.00 41.96 42.90 3kjx s TYR 223 CO 0.00 -0.05 1.04 -1.13 -1.34 0.00 0.00 175.55 174.07 3kjx n SER 224 N 1.27 2.33 -4.37 4.32 3.41 -1.26 -1.25 113.62 118.07 3kjx n SER 224 Ca -0.07 -1.66 -0.20 0.00 -0.26 0.00 0.00 58.87 56.67 3kjx n SER 224 Cb 0.57 0.12 0.10 0.00 -0.26 0.00 0.00 64.21 64.74 3kjx n SER 224 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kjx n GLY 225 N 1.08 0.92 3.65 5.00 0.00 -1.26 -3.85 105.19 110.72 3kjx n GLY 225 Ca 0.10 -2.06 -0.30 0.00 0.00 0.00 0.00 46.02 43.75 3kjx n GLY 225 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kjx s GLY 226 N -4.75 1.66 0.08 -0.02 0.00 -1.26 -0.67 107.32 102.36 3kjx s GLY 226 Ca 0.59 0.42 -0.30 0.00 0.00 0.00 0.00 44.72 45.43 3kjx s GLY 226 CO 0.39 0.89 0.99 -0.45 0.00 0.00 0.00 173.10 174.92 3kjx s SER 227 N -2.71 7.43 -0.03 1.64 0.15 -1.26 -4.80 113.70 114.13 3kjx s SER 227 Ca 0.67 1.78 -0.23 0.00 0.70 0.00 0.00 55.95 58.87 3kjx s SER 227 Cb -0.23 -2.58 0.05 0.00 -1.71 0.00 0.00 66.02 61.55 3kjx s SER 227 CO 0.59 -0.15 0.50 0.00 1.20 0.00 0.00 173.24 175.37 3kjx s ALA 228 N 0.34 -1.28 0.19 5.45 0.00 -1.26 -4.93 121.76 120.27 3kjx s ALA 228 Ca 0.49 0.81 0.13 0.00 0.00 0.00 0.00 51.96 53.39 3kjx s ALA 228 Cb -0.23 0.06 0.39 0.00 0.00 0.00 0.00 23.12 23.34 3kjx s ALA 228 CO 0.30 -0.33 1.61 -0.07 0.00 0.00 0.00 175.76 177.27 3kjx h LEU 229 N 3.38 0.00 -0.25 0.00 4.07 -1.97 -1.99 115.31 118.55 3kjx h LEU 229 Ca -0.28 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.47 3kjx h LEU 229 Cb 1.16 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.91 3kjx h LEU 229 CO 0.40 0.56 -0.68 0.00 -1.08 0.00 0.00 178.44 177.64 3kjx h ALA 230 N 1.44 0.41 -0.38 1.53 0.00 -1.95 -2.22 119.26 118.09 3kjx h ALA 230 Ca -0.01 -0.57 0.01 0.00 0.00 0.00 0.00 54.91 54.34 3kjx h ALA 230 Cb 1.11 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 3kjx h ALA 230 CO 0.07 0.69 0.25 -0.22 0.00 0.00 0.00 179.25 180.04 3kjx h LYS 231 N 0.56 0.49 -0.82 0.00 1.63 -1.92 0.19 116.57 116.71 3kjx h LYS 231 Ca -0.02 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.72 3kjx h LYS 231 Cb 1.30 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.78 3kjx h LYS 231 CO 0.14 0.32 0.42 0.78 -3.45 0.00 0.00 179.45 177.66 3kjx h GLY 232 N 0.50 1.24 0.58 5.01 0.00 -1.29 -2.98 103.07 106.12 3kjx h GLY 232 Ca 0.14 -0.59 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 3kjx h GLY 232 CO -0.04 0.56 -0.01 -0.09 0.00 0.00 0.00 176.54 176.97 3kjx h ARG 233 N 1.16 0.02 0.00 4.80 2.43 -0.89 -2.41 114.38 119.49 3kjx h ARG 233 Ca 0.28 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 3kjx h ARG 233 Cb 0.08 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 3kjx h ARG 233 CO -0.04 0.45 0.00 -1.91 -1.51 0.00 0.00 179.97 176.96 3kjx n GLU 234 N -4.86 0.00 0.00 0.20 2.13 0.63 -1.81 120.64 116.93 3kjx n GLU 234 Ca -0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.74 3kjx n GLU 234 Cb 0.23 -0.88 0.00 0.00 0.27 0.00 0.00 31.44 31.06 3kjx n GLU 234 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 3kjx n THR 236 N 0.06 0.00 -0.28 6.31 -1.04 -0.90 -2.36 114.28 116.07 3kjx n THR 236 Ca 0.00 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.99 3kjx n THR 236 Cb 0.00 0.00 0.10 0.00 -1.82 0.00 0.00 70.33 68.61 3kjx n THR 236 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 3kjx h GLN 237 N 0.00 0.92 -0.65 -2.82 4.15 -1.64 -1.42 115.11 113.65 3kjx h GLN 237 Ca 0.00 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.36 3kjx h GLN 237 Cb 0.00 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.48 3kjx h GLN 237 CO 0.00 0.61 0.00 0.00 -1.93 0.00 0.00 178.83 177.51 3kjx n ALA 238 N -2.33 1.50 0.00 3.38 0.00 -1.00 -2.16 120.51 119.91 3kjx n ALA 238 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3kjx n ALA 238 Cb 0.10 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.55 3kjx n ALA 238 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3kjx n LEU 240 N 0.49 0.00 -0.01 0.00 4.77 -0.54 -2.35 117.00 119.37 3kjx n LEU 240 Ca 0.00 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.78 3kjx n LEU 240 Cb 0.09 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.04 3kjx n LEU 240 CO 0.00 0.00 -0.20 -0.08 -1.33 0.00 0.00 177.39 175.78 3kjx h GLU 241 N 0.00 0.18 -0.00 3.23 4.57 -1.68 -2.93 114.58 117.95 3kjx h GLU 241 Ca 0.00 -0.31 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 3kjx h GLU 241 Cb 0.00 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 3kjx h GLU 241 CO 0.00 1.15 -0.57 2.89 -1.18 0.00 0.00 179.01 181.30 3kjx n ARG 242 N -4.15 0.33 -2.95 1.92 1.85 -0.99 -4.48 116.66 108.19 3kjx n ARG 242 Ca -0.21 -0.23 -0.13 0.00 -1.00 0.00 0.00 57.85 56.28 3kjx n ARG 242 Cb 0.78 -1.50 0.03 0.00 -1.05 0.00 0.00 32.46 30.72 3kjx n ARG 242 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 3kjx n SER 243 N -1.13 -0.32 0.00 2.89 7.64 -1.26 -5.00 113.62 116.44 3kjx n SER 243 Ca 0.07 -3.16 0.01 0.00 1.01 0.00 0.00 58.87 56.79 3kjx n SER 243 Cb 0.35 0.33 0.04 0.00 -1.01 0.00 0.00 64.21 63.92 3kjx n SER 243 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3kjx n PRO 244 N 0.21 0.05 0.00 1.43 -0.04 -1.11 -2.70 135.00 132.84 3kjx n PRO 244 Ca 0.15 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.70 3kjx n PRO 244 Cb 0.70 -1.46 -0.02 0.00 -0.04 0.00 0.00 33.50 32.68 3kjx n PRO 244 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3kjx n ASP 245 N -0.96 1.59 -4.56 3.54 8.00 -1.26 -5.00 116.55 117.90 3kjx n ASP 245 Ca 0.01 -1.29 -0.40 0.00 0.71 0.00 0.00 54.79 53.82 3kjx n ASP 245 Cb 0.00 0.58 0.03 0.00 -0.02 0.00 0.00 41.12 41.71 3kjx n ASP 245 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3kjx n LEU 246 N -0.35 2.07 0.00 0.64 4.77 -1.10 -4.92 117.00 118.12 3kjx n LEU 246 Ca 0.07 0.89 0.00 0.00 -0.03 0.00 0.00 56.01 56.94 3kjx n LEU 246 Cb 0.36 -1.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 3kjx n LEU 246 CO 0.26 -2.13 0.24 -0.90 -1.33 0.00 0.00 177.39 173.52 3kjx n ASP 247 N 0.31 0.94 -3.67 -1.43 5.75 -1.02 -4.78 116.55 112.65 3kjx n ASP 247 Ca 0.11 -1.05 -0.10 0.00 -0.01 0.00 0.00 54.79 53.74 3kjx n ASP 247 Cb 0.43 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.44 3kjx n ASP 247 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 3kjx s PHE 248 N -0.05 -0.79 -0.19 2.11 5.36 -1.23 -1.40 117.98 121.78 3kjx s PHE 248 Ca 0.00 1.71 0.01 0.00 -0.96 0.00 0.00 56.93 57.69 3kjx s PHE 248 Cb 0.00 0.39 0.03 0.00 -0.34 0.00 0.00 43.02 43.11 3kjx s PHE 248 CO 0.00 -0.40 -0.14 -0.51 -1.46 0.00 0.00 175.22 172.70 3kjx s LEU 249 N 1.11 2.30 -0.18 6.12 1.43 -0.45 -1.07 118.68 127.94 3kjx s LEU 249 Ca -0.06 -0.81 -0.06 0.00 -1.03 0.00 0.00 54.13 52.16 3kjx s LEU 249 Cb -0.06 -1.36 -0.04 0.00 0.03 0.00 0.00 46.19 44.77 3kjx s LEU 249 CO -0.11 -0.09 0.04 -0.47 0.23 0.00 0.00 176.35 175.95 3kjx s TYR 250 N 1.33 3.19 0.05 0.29 5.04 -0.16 -2.82 117.35 124.27 3kjx s TYR 250 Ca 0.01 -0.03 0.04 0.00 -2.44 0.00 0.00 57.07 54.65 3kjx s TYR 250 Cb -0.15 -2.05 -0.04 0.00 0.35 0.00 0.00 41.96 40.07 3kjx s TYR 250 CO -0.10 0.10 -0.02 0.71 -1.34 0.00 0.00 175.55 174.90 3kjx s TYR 251 N 0.38 2.97 -0.18 4.97 2.02 -0.58 -4.26 117.35 122.66 3kjx s TYR 251 Ca 0.01 -0.01 0.28 0.00 -0.37 0.00 0.00 57.07 56.98 3kjx s TYR 251 Cb -0.13 -1.58 1.24 0.00 -0.40 0.00 0.00 41.96 41.09 3kjx s TYR 251 CO 0.01 0.45 1.84 0.66 -1.57 0.00 0.00 175.55 176.93 3kjx h SER 252 N 3.95 0.00 -5.03 2.29 4.64 -1.94 -3.37 113.55 114.08 3kjx h SER 252 Ca -0.48 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.81 3kjx h SER 252 Cb 1.17 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.14 3kjx h SER 252 CO 0.57 0.00 0.10 0.54 -0.87 0.00 0.00 176.83 177.17 3kjx s ASN 253 N -4.69 -0.42 0.00 4.97 2.20 -1.26 -4.41 114.94 111.33 3kjx s ASN 253 Ca 0.02 -0.16 0.00 0.00 -0.94 0.00 0.00 52.86 51.78 3kjx s ASN 253 Cb 0.09 0.55 0.00 0.00 -2.00 0.00 0.00 41.25 39.90 3kjx s ASN 253 CO 0.41 -0.94 0.29 0.47 -2.94 0.00 0.00 177.10 174.39 3kjx n ASP 254 N -0.32 0.81 0.00 3.54 8.00 -0.06 -2.61 116.55 125.91 3kjx n ASP 254 Ca -0.16 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.44 3kjx n ASP 254 Cb 0.64 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.58 3kjx n ASP 254 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 3kjx n ILE 256 N 1.51 0.00 0.02 0.53 -5.35 -1.26 0.47 119.36 115.27 3kjx n ILE 256 Ca 0.00 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.44 3kjx n ILE 256 Cb 0.09 0.00 0.19 0.00 -1.74 0.00 0.00 39.64 38.18 3kjx n ILE 256 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3kjx h ALA 257 N 0.00 1.06 -0.52 -1.28 0.00 -1.85 -2.68 119.26 113.99 3kjx h ALA 257 Ca 0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 3kjx h ALA 257 Cb 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3kjx h ALA 257 CO 0.00 0.57 0.11 0.00 0.00 0.00 0.00 179.25 179.94 3kjx h ALA 258 N 1.28 0.69 -0.52 0.00 0.00 -0.27 0.18 119.26 120.62 3kjx h ALA 258 Ca 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3kjx h ALA 258 Cb 0.71 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 3kjx h ALA 258 CO 0.05 0.40 0.34 0.78 0.00 0.00 0.00 179.25 180.82 3kjx h GLY 259 N 0.73 0.73 0.97 0.00 0.00 -1.63 -1.83 103.07 102.04 3kjx h GLY 259 Ca 0.16 -0.28 -0.22 0.00 0.00 0.00 0.00 47.33 46.99 3kjx h GLY 259 CO 0.00 0.27 -0.90 -1.33 0.00 0.00 0.00 176.54 174.58 3kjx h GLY 260 N 0.71 0.57 0.84 4.60 0.00 -1.13 -2.81 103.07 105.85 3kjx h GLY 260 Ca 0.19 -1.11 0.10 0.00 0.00 0.00 0.00 47.33 46.51 3kjx h GLY 260 CO -0.04 0.98 0.51 -2.00 0.00 0.00 0.00 176.54 175.99 3kjx h LEU 261 N 0.05 0.62 -0.00 3.11 5.85 -0.18 0.19 115.31 124.96 3kjx h LEU 261 Ca -0.13 0.02 -0.27 0.00 0.84 0.00 0.00 57.88 58.34 3kjx h LEU 261 Cb 1.61 -0.11 0.02 0.00 0.37 0.00 0.00 40.66 42.55 3kjx h LEU 261 CO 0.17 0.37 -1.05 -0.07 -0.34 0.00 0.00 178.44 177.53 3kjx h LEU 262 N 0.69 0.92 -0.44 2.25 3.38 -1.40 -1.97 115.31 118.74 3kjx h LEU 262 Ca 0.36 -0.74 -0.00 0.00 0.09 0.00 0.00 57.88 57.59 3kjx h LEU 262 Cb 0.48 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3kjx h LEU 262 CO -0.14 1.54 0.26 0.22 0.09 0.00 0.00 178.44 180.41 3kjx h TYR 263 N 0.40 0.59 -0.15 1.13 3.20 -1.09 -1.14 116.97 119.92 3kjx h TYR 263 Ca -0.13 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.74 3kjx h TYR 263 Cb 1.70 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.77 3kjx h TYR 263 CO 0.10 0.42 0.07 -0.07 -1.64 0.00 0.00 178.16 177.05 3kjx h LEU 264 N 0.58 0.11 -1.31 2.82 4.07 -1.02 -1.49 115.31 119.07 3kjx h LEU 264 Ca 0.16 0.01 0.01 0.00 0.08 0.00 0.00 57.88 58.13 3kjx h LEU 264 Cb 0.02 -0.01 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 3kjx h LEU 264 CO -0.03 0.08 0.45 -0.07 -1.08 0.00 0.00 178.44 177.80 3kjx h LEU 265 N 0.15 0.80 -0.62 1.67 3.38 -1.07 -2.19 115.31 117.43 3kjx h LEU 265 Ca 0.06 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3kjx h LEU 265 Cb 0.01 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 3kjx h LEU 265 CO -0.04 0.58 0.29 -0.33 0.09 0.00 0.00 178.44 179.03 3kjx h GLU 266 N 0.94 0.89 0.00 1.13 5.08 -0.72 -1.33 114.58 120.58 3kjx h GLU 266 Ca 0.25 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3kjx h GLU 266 Cb -0.10 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 28.99 3kjx h GLU 266 CO -0.05 0.73 0.00 1.04 -1.00 0.00 0.00 179.01 179.72 3kjx n GLN 267 N -4.50 0.64 -1.08 2.33 1.13 -0.61 -4.87 117.38 110.42 3kjx n GLN 267 Ca 0.04 0.01 -0.03 0.00 -1.94 0.00 0.00 57.00 55.08 3kjx n GLN 267 Cb 0.13 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 28.97 3kjx n GLN 267 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3kjx n GLY 268 N 0.36 0.47 3.78 1.08 0.00 -0.50 -4.99 105.19 105.38 3kjx n GLY 268 Ca 0.16 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 3kjx n GLY 268 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3kjx s ILE 269 N -1.66 3.88 0.02 -0.61 -4.36 -1.15 -5.00 121.20 112.32 3kjx s ILE 269 Ca 0.00 1.55 -0.30 0.00 -0.26 0.00 0.00 60.65 61.64 3kjx s ILE 269 Cb 0.00 -3.86 -0.05 0.00 1.25 0.00 0.00 42.46 39.80 3kjx s ILE 269 CO 0.00 0.12 1.27 -0.62 0.24 0.00 0.00 174.94 175.95 3kjx s ASP 270 N -1.48 6.98 -0.16 4.36 -1.08 -1.26 -4.68 116.67 119.35 3kjx s ASP 270 Ca 0.53 2.02 0.01 0.00 -0.52 0.00 0.00 52.55 54.58 3kjx s ASP 270 Cb -0.22 -2.57 0.01 0.00 -1.46 0.00 0.00 42.92 38.67 3kjx s ASP 270 CO 0.28 -0.59 -0.17 -0.63 0.52 0.00 0.00 175.17 174.58 3kjx s ILE 271 N 1.74 2.44 -2.70 4.11 -1.09 -1.26 -1.57 121.20 122.86 3kjx s ILE 271 Ca 0.60 -0.84 0.26 0.00 -2.23 0.00 0.00 60.65 58.45 3kjx s ILE 271 Cb -0.29 -2.02 0.41 0.00 -1.58 0.00 0.00 42.46 38.97 3kjx s ILE 271 CO 0.27 0.52 1.55 -0.81 -1.23 0.00 0.00 174.94 175.24 3kjx n PRO 272 N 4.25 1.93 -0.27 2.79 -0.04 -1.26 -4.89 135.00 137.51 3kjx n PRO 272 Ca -0.20 -1.34 -0.06 0.00 -0.04 0.00 0.00 63.50 61.86 3kjx n PRO 272 Cb 0.51 -1.47 -0.04 0.00 -0.04 0.00 0.00 33.50 32.46 3kjx n PRO 272 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3kjx n GLY 273 N 1.24 -1.60 0.13 0.55 0.00 -1.21 -2.38 105.19 101.91 3kjx n GLY 273 Ca 0.17 0.76 -0.22 0.00 0.00 0.00 0.00 46.02 46.72 3kjx n GLY 273 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3kjx n GLN 274 N -4.84 0.65 -3.89 1.61 7.27 -0.61 -4.95 117.38 112.61 3kjx n GLN 274 Ca 0.03 0.35 -0.15 0.00 0.07 0.00 0.00 57.00 57.29 3kjx n GLN 274 Cb 0.19 -1.66 -0.15 0.00 2.41 0.00 0.00 30.24 31.03 3kjx n GLN 274 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 3kjx s ILE 275 N -2.48 0.09 0.29 1.69 1.01 -1.00 -4.47 121.20 116.32 3kjx s ILE 275 Ca -0.29 0.07 0.09 0.00 0.00 0.00 0.00 60.65 60.52 3kjx s ILE 275 Cb 0.08 -0.16 -0.04 0.00 0.01 0.00 0.00 42.46 42.35 3kjx s ILE 275 CO 0.64 0.09 0.04 -0.83 0.00 0.00 0.00 174.94 174.88 3kjx s GLY 276 N 0.66 1.74 0.19 6.18 0.00 -0.49 -3.99 107.32 111.61 3kjx s GLY 276 Ca -0.06 -1.71 -0.16 0.00 0.00 0.00 0.00 44.72 42.79 3kjx s GLY 276 CO -0.01 -1.73 0.48 0.48 0.00 0.00 0.00 173.10 172.32 3kjx s LEU 277 N -3.73 0.23 0.13 0.66 2.34 -1.26 -1.34 118.68 115.71 3kjx s LEU 277 Ca 0.33 -0.56 -0.24 0.00 0.06 0.00 0.00 54.13 53.72 3kjx s LEU 277 Cb -0.05 1.98 0.07 0.00 -0.56 0.00 0.00 46.19 47.63 3kjx s LEU 277 CO 0.21 -1.03 0.64 0.00 -1.06 0.00 0.00 176.35 175.11 3kjx s ALA 278 N -3.89 -1.64 0.00 1.48 0.00 -1.13 -3.88 121.76 112.70 3kjx s ALA 278 Ca 0.11 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.67 3kjx s ALA 278 Cb -0.00 0.78 0.00 0.00 0.00 0.00 0.00 23.12 23.90 3kjx s ALA 278 CO -0.02 -0.74 0.00 0.41 0.00 0.00 0.00 175.76 175.41 3kjx n GLY 279 N -0.29 5.37 3.33 0.00 0.00 0.05 -1.53 105.19 112.11 3kjx n GLY 279 Ca -0.16 -1.29 -0.13 0.00 0.00 0.00 0.00 46.02 44.44 3kjx n GLY 279 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3kjx s PHE 280 N 1.30 -0.27 0.00 1.61 5.36 -1.26 -4.45 117.98 120.27 3kjx s PHE 280 Ca 0.00 0.24 0.00 0.00 -0.96 0.00 0.00 56.93 56.21 3kjx s PHE 280 Cb 0.00 0.23 0.00 0.00 -0.34 0.00 0.00 43.02 42.91 3kjx s PHE 280 CO 0.00 -0.58 0.00 0.09 -1.46 0.00 0.00 175.22 173.27 3kjx n ASN 281 N 0.50 0.00 -2.45 6.13 3.02 -1.26 -0.88 115.26 120.32 3kjx n ASN 281 Ca -0.18 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.25 3kjx n ASN 281 Cb 0.60 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.82 3kjx n ASN 281 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3kjx n ASN 282 N 0.76 -2.74 -4.74 6.41 5.15 -1.26 -2.10 115.26 116.74 3kjx n ASN 282 Ca 0.00 -0.36 -0.34 0.00 -0.60 0.00 0.00 54.58 53.28 3kjx n ASN 282 Cb 0.00 -3.30 0.07 0.00 -0.53 0.00 0.00 39.78 36.02 3kjx n ASN 282 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3kjx s VAL 283 N -3.21 2.68 0.37 3.44 -7.23 -1.26 -4.92 120.40 110.26 3kjx s VAL 283 Ca 0.10 0.34 0.08 0.00 -1.81 0.00 0.00 61.98 60.69 3kjx s VAL 283 Cb -0.04 -2.93 0.31 0.00 0.56 0.00 0.00 36.38 34.28 3kjx s VAL 283 CO 0.44 -0.17 1.93 -0.08 -0.31 0.00 0.00 175.10 176.91 3kjx h GLU 284 N 0.04 0.67 -1.17 4.82 4.22 -2.03 -1.66 114.58 119.47 3kjx h GLU 284 Ca -0.48 -0.04 0.33 0.00 0.08 0.00 0.00 59.36 59.25 3kjx h GLU 284 Cb 1.28 -0.15 -0.06 0.00 0.50 0.00 0.00 28.75 30.32 3kjx h GLU 284 CO 0.52 0.44 0.82 1.25 -2.18 0.00 0.00 179.01 179.86 3kjx h LEU 285 N 0.69 0.11 -2.10 1.64 6.46 -2.02 0.19 115.31 120.28 3kjx h LEU 285 Ca 0.36 0.02 0.04 0.00 -0.12 0.00 0.00 57.88 58.18 3kjx h LEU 285 Cb 0.46 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.40 3kjx h LEU 285 CO -0.13 0.01 0.10 -0.07 -0.62 0.00 0.00 178.44 177.73 3kjx h LEU 286 N 0.09 0.00 0.00 2.25 4.07 -1.66 -2.01 115.31 118.05 3kjx h LEU 286 Ca 0.58 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.54 3kjx h LEU 286 Cb 2.13 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.87 3kjx h LEU 286 CO -0.08 0.00 0.00 0.00 -1.08 0.00 0.00 178.44 177.28 3kjx n GLN 287 N -4.31 0.13 -0.28 1.13 3.00 0.67 -3.10 117.38 114.62 3kjx n GLN 287 Ca 0.00 0.13 0.07 0.00 -0.01 0.00 0.00 57.00 57.19 3kjx n GLN 287 Cb 0.22 -1.50 0.21 0.00 0.00 0.00 0.00 30.24 29.17 3kjx n GLN 287 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3kjx n GLY 288 N 0.55 2.90 3.93 1.08 0.00 -0.76 -5.00 105.19 107.89 3kjx n GLY 288 Ca 0.07 -0.57 -0.26 0.00 0.00 0.00 0.00 46.02 45.27 3kjx n GLY 288 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kjx s LEU 289 N -1.32 4.16 0.00 0.99 1.43 -1.18 -5.00 118.68 117.77 3kjx s LEU 289 Ca 0.32 0.41 0.11 0.00 -1.03 0.00 0.00 54.13 53.94 3kjx s LEU 289 Cb 0.19 -3.21 0.50 0.00 0.03 0.00 0.00 46.19 43.70 3kjx s LEU 289 CO 0.18 -0.13 1.35 -0.81 0.23 0.00 0.00 176.35 177.17 3kjx n PRO 290 N -1.10 0.02 -3.87 1.29 -0.04 -1.26 -4.68 135.00 125.36 3kjx n PRO 290 Ca -0.05 0.29 -0.11 0.00 -0.04 0.00 0.00 63.50 63.58 3kjx n PRO 290 Cb 0.55 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.39 3kjx n PRO 290 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3kjx s ARG 291 N -2.94 0.28 -0.70 0.54 1.81 -1.26 -5.11 118.95 111.57 3kjx s ARG 291 Ca 0.06 -0.16 -0.26 0.00 -1.72 0.00 0.00 55.73 53.65 3kjx s ARG 291 Cb 0.08 0.12 0.04 0.00 -0.45 0.00 0.00 34.95 34.74 3kjx s ARG 291 CO 0.20 -0.05 1.16 0.15 -0.68 0.00 0.00 175.30 176.08 3kjx s LYS 292 N -0.69 3.19 0.15 3.54 1.02 -1.26 -5.00 119.74 120.70 3kjx s LYS 292 Ca -0.08 -0.40 -0.31 0.00 0.02 0.00 0.00 55.97 55.21 3kjx s LYS 292 Cb -0.05 -4.18 -0.09 0.00 -0.52 0.00 0.00 37.83 33.00 3kjx s LYS 292 CO 0.00 -1.99 1.43 -1.17 -0.92 0.00 0.00 175.35 172.71 3kjx s LEU 293 N 5.09 4.38 0.23 3.17 0.20 -1.26 -0.53 118.68 129.95 3kjx s LEU 293 Ca 0.31 2.45 -0.30 0.00 0.69 0.00 0.00 54.13 57.28 3kjx s LEU 293 Cb -0.11 -3.59 -0.10 0.00 -0.43 0.00 0.00 46.19 41.96 3kjx s LEU 293 CO 0.14 -0.69 1.45 0.00 -0.29 0.00 0.00 176.35 176.97 3kjx s ALA 294 N 0.89 3.65 0.00 5.97 0.00 -1.26 -4.49 121.76 126.52 3kjx s ALA 294 Ca 0.65 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.92 3kjx s ALA 294 Cb -0.39 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.16 3kjx s ALA 294 CO 0.33 -0.74 0.00 -2.37 0.00 0.00 0.00 175.76 172.98 3kjx n THR 295 N 2.71 0.00 -5.01 0.00 5.66 0.15 -0.77 114.28 117.01 3kjx n THR 295 Ca 0.08 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.76 3kjx n THR 295 Cb 0.40 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.04 3kjx n THR 295 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3kjx s ASP 297 N 2.00 3.70 0.00 1.09 2.15 -1.26 0.96 116.67 125.31 3kjx s ASP 297 Ca 0.00 -0.31 0.29 0.00 0.43 0.00 0.00 52.55 52.97 3kjx s ASP 297 Cb 0.00 -0.82 1.31 0.00 -0.30 0.00 0.00 42.92 43.10 3kjx s ASP 297 CO 0.00 0.31 1.89 0.00 -0.17 0.00 0.00 175.17 177.20 3kjx n ALA 298 N 2.55 2.67 -3.38 3.66 0.00 -0.89 -4.72 120.51 120.40 3kjx n ALA 298 Ca -0.17 -0.34 -0.18 0.00 0.00 0.00 0.00 53.44 52.75 3kjx n ALA 298 Cb 0.52 -1.29 0.08 0.00 0.00 0.00 0.00 19.45 18.75 3kjx n ALA 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kjx h ARG 300 N -2.04 -0.11 -0.28 0.00 3.08 -1.91 0.14 114.38 113.26 3kjx h ARG 300 Ca -0.53 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 59.51 3kjx h ARG 300 Cb 1.32 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.38 3kjx h ARG 300 CO 0.48 -0.07 0.09 1.25 -1.07 0.00 0.00 179.97 180.64 3kjx h LEU 301 N -0.12 0.41 -0.29 3.04 5.85 -1.92 -2.43 115.31 119.86 3kjx h LEU 301 Ca 0.01 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.57 3kjx h LEU 301 Cb 0.14 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.01 3kjx h LEU 301 CO -0.09 0.51 -0.03 -0.33 -0.34 0.00 0.00 178.44 178.16 3kjx h GLU 302 N 0.29 0.04 -0.32 1.25 3.07 -1.90 -0.75 114.58 116.26 3kjx h GLU 302 Ca 0.09 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 3kjx h GLU 302 Cb 0.25 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.13 3kjx h GLU 302 CO -0.00 0.03 0.21 0.82 -1.40 0.00 0.00 179.01 178.67 3kjx h ILE 303 N 0.05 1.09 -0.54 3.13 2.04 -0.91 -0.95 117.51 121.42 3kjx h ILE 303 Ca 0.14 -0.16 0.01 0.00 1.00 0.00 0.00 64.86 65.85 3kjx h ILE 303 Cb 0.20 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 3kjx h ILE 303 CO -0.26 0.08 0.35 1.23 0.00 0.00 0.00 178.15 179.55 3kjx h GLY 304 N 0.43 0.76 0.73 5.37 0.00 -0.99 0.05 103.07 109.42 3kjx h GLY 304 Ca 0.12 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.15 3kjx h GLY 304 CO -0.02 0.25 -0.04 3.21 0.00 0.00 0.00 176.54 179.94 3kjx h ARG 305 N 0.70 0.25 -0.53 4.80 3.08 -1.02 -2.72 114.38 118.94 3kjx h ARG 305 Ca 0.20 -0.10 0.07 0.00 0.07 0.00 0.00 59.98 60.23 3kjx h ARG 305 Cb -0.05 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 29.93 3kjx h ARG 305 CO -0.06 0.56 0.20 -0.22 -1.07 0.00 0.00 179.97 179.38 3kjx h LYS 306 N -0.07 0.37 -0.60 0.04 1.63 -1.01 0.28 116.57 117.21 3kjx h LYS 306 Ca 0.03 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 59.78 3kjx h LYS 306 Cb 0.47 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.99 3kjx h LYS 306 CO 0.01 0.25 0.25 0.00 -3.45 0.00 0.00 179.45 176.51 3kjx h ALA 307 N 1.35 0.78 -0.88 5.00 0.00 -0.98 -2.24 119.26 122.30 3kjx h ALA 307 Ca 0.25 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3kjx h ALA 307 Cb 0.27 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3kjx h ALA 307 CO -0.25 0.39 0.58 0.00 0.00 0.00 0.00 179.25 179.97 3kjx h ALA 308 N 1.09 1.12 -0.10 0.00 0.00 -1.03 -1.96 119.26 118.38 3kjx h ALA 308 Ca 0.20 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3kjx h ALA 308 Cb 0.19 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3kjx h ALA 308 CO -0.02 0.53 0.05 0.93 0.00 0.00 0.00 179.25 180.74 3kjx h GLU 309 N 1.20 0.14 -0.94 0.00 5.08 -0.59 -0.22 114.58 119.25 3kjx h GLU 309 Ca 0.32 -0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.75 3kjx h GLU 309 Cb -0.13 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.02 3kjx h GLU 309 CO -0.07 0.18 0.59 0.82 -1.00 0.00 0.00 179.01 179.53 3kjx h ILE 310 N 0.06 1.00 0.84 3.13 2.04 -1.13 0.32 117.51 123.76 3kjx h ILE 310 Ca 0.03 -0.35 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 3kjx h ILE 310 Cb 0.08 -0.11 0.01 0.00 -0.74 0.00 0.00 36.82 36.06 3kjx h ILE 310 CO -0.01 0.18 -0.40 0.40 0.00 0.00 0.00 178.15 178.33 3kjx h ILE 311 N 1.01 0.00 -0.47 -0.67 1.08 -0.90 0.10 117.51 117.66 3kjx h ILE 311 Ca 0.43 -0.14 0.09 0.00 -0.39 0.00 0.00 64.86 64.86 3kjx h ILE 311 Cb 0.30 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 33.96 3kjx h ILE 311 CO -0.21 0.00 -0.10 0.00 -0.69 0.00 0.00 178.15 177.15 3kjx h ALA 312 N -1.35 0.34 -0.38 1.87 0.00 -0.71 -1.08 119.26 117.94 3kjx h ALA 312 Ca -0.12 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3kjx h ALA 312 Cb 0.86 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 3kjx h ALA 312 CO 0.19 -0.44 0.20 -0.22 0.00 0.00 0.00 179.25 178.99 3kjx h LYS 313 N 0.02 0.53 -0.94 0.00 3.64 -0.38 0.72 116.57 120.17 3kjx h LYS 313 Ca 0.23 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.59 3kjx h LYS 313 Cb 0.35 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 32.01 3kjx h LYS 313 CO -0.47 0.44 0.61 0.00 -2.27 0.00 0.00 179.45 177.77 3kjx h ARG 314 N 0.48 1.12 -0.10 1.90 2.47 -0.19 -1.07 114.38 119.00 3kjx h ARG 314 Ca 0.13 -0.07 -0.20 0.00 -1.26 0.00 0.00 59.98 58.58 3kjx h ARG 314 Cb 0.07 -0.25 0.01 0.00 -1.65 0.00 0.00 29.97 28.15 3kjx h ARG 314 CO -0.02 0.74 -0.73 -0.07 0.56 0.00 0.00 179.97 180.46 3kjx h LEU 315 N 1.16 0.81 0.30 3.04 3.38 -0.93 -2.64 115.31 120.43 3kjx h LEU 315 Ca 0.38 -0.66 -0.00 0.00 0.09 0.00 0.00 57.88 57.68 3kjx h LEU 315 Cb 0.05 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3kjx h LEU 315 CO -0.12 1.35 -0.25 -0.08 0.09 0.00 0.00 178.44 179.42 3kjx h GLU 316 N 0.33 -0.55 -2.74 1.13 4.81 -0.46 -3.39 114.58 113.71 3kjx h GLU 316 Ca -0.06 0.04 -0.56 0.00 -0.13 0.00 0.00 59.36 58.64 3kjx h GLU 316 Cb 1.37 0.12 -0.40 0.00 0.63 0.00 0.00 28.75 30.48 3kjx h GLU 316 CO 0.15 -0.37 -0.81 0.34 -0.73 0.00 0.00 179.01 177.59 3kjx s ASP 317 N -4.71 3.30 0.63 1.04 2.15 -0.44 -5.00 116.67 113.63 3kjx s ASP 317 Ca -0.16 -1.78 0.36 0.00 0.43 0.00 0.00 52.55 51.40 3kjx s ASP 317 Cb 0.06 -0.42 2.05 0.00 -0.30 0.00 0.00 42.92 44.31 3kjx s ASP 317 CO 0.64 -0.37 2.26 -0.65 -0.17 0.00 0.00 175.17 176.88 3kjx h PRO 318 N 7.67 0.00 -0.02 4.34 0.11 -1.68 -1.32 132.00 141.10 3kjx h PRO 318 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 3kjx h PRO 318 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3kjx h PRO 318 CO 0.36 0.00 -0.00 0.39 -0.21 0.00 0.00 178.00 178.54 3kjx n GLU 319 N -3.46 1.89 -0.17 1.05 -0.58 -1.26 -4.46 120.64 113.65 3kjx n GLU 319 Ca -0.02 -1.29 0.02 0.00 -0.42 0.00 0.00 57.16 55.45 3kjx n GLU 319 Cb 0.13 -1.47 0.30 0.00 -0.57 0.00 0.00 31.44 29.83 3kjx n GLU 319 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3kjx h ALA 320 N 4.47 1.56 -4.89 0.62 0.00 -1.60 -3.48 119.26 115.94 3kjx h ALA 320 Ca 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3kjx h ALA 320 Cb 0.67 -0.25 -0.11 0.00 0.00 0.00 0.00 17.79 18.09 3kjx h ALA 320 CO 0.00 0.39 -1.49 -1.91 0.00 0.00 0.00 179.25 176.24 3kjx n GLU 321 N -4.44 -4.65 -2.47 0.00 4.07 -1.26 -5.07 120.64 106.82 3kjx n GLU 321 Ca 0.08 3.48 -0.05 0.00 -0.06 0.00 0.00 57.16 60.61 3kjx n GLU 321 Cb 0.08 -4.95 -0.01 0.00 -0.06 0.00 0.00 31.44 26.49 3kjx n GLU 321 CO 0.00 0.00 0.00 0.44 -0.06 0.00 0.00 177.13 177.51 3kjx n ILE 322 N 1.70 0.00 -2.77 6.31 -5.35 -1.26 -5.10 119.36 112.90 3kjx n ILE 322 Ca -0.36 -0.47 -0.43 0.00 -0.27 0.00 0.00 62.75 61.23 3kjx n ILE 322 Cb 0.55 0.17 -0.03 0.00 -1.74 0.00 0.00 39.64 38.59 3kjx n ILE 322 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 3kjx s GLU 323 N -2.31 3.90 0.00 6.28 2.12 -1.26 -4.90 118.70 122.54 3kjx s GLU 323 Ca 0.04 0.70 0.14 0.00 0.36 0.00 0.00 54.97 56.22 3kjx s GLU 323 Cb 0.00 -3.79 -0.15 0.00 0.26 0.00 0.00 34.13 30.46 3kjx s GLU 323 CO 0.03 -0.94 0.62 0.25 -0.54 0.00 0.00 175.26 174.68 3kjx n THR 324 N 5.96 0.00 -3.90 -1.70 -2.24 -1.26 -4.82 114.28 106.32 3kjx n THR 324 Ca 0.08 -0.17 -0.30 0.00 -2.27 0.00 0.00 64.05 61.39 3kjx n THR 324 Cb 0.48 1.01 -0.14 0.00 -2.10 0.00 0.00 70.33 69.57 3kjx n THR 324 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3kjx s ARG 325 N -2.33 1.59 -0.17 -0.78 0.52 -1.26 -4.41 118.95 112.10 3kjx s ARG 325 Ca 0.06 -2.16 -0.07 0.00 -0.52 0.00 0.00 55.73 53.04 3kjx s ARG 325 Cb 0.11 -2.97 -0.04 0.00 0.52 0.00 0.00 34.95 32.57 3kjx s ARG 325 CO 0.58 -1.06 0.06 0.42 0.02 0.00 0.00 175.30 175.32 3kjx s ILE 326 N 0.33 4.82 -0.27 1.52 1.01 -1.26 -5.01 121.20 122.34 3kjx s ILE 326 Ca 0.15 -0.02 0.02 0.00 0.00 0.00 0.00 60.65 60.80 3kjx s ILE 326 Cb -0.23 -3.16 0.07 0.00 0.01 0.00 0.00 42.46 39.15 3kjx s ILE 326 CO -0.04 0.48 -0.05 -0.89 0.00 0.00 0.00 174.94 174.43 3kjx s THR 327 N 0.22 1.93 0.40 2.92 2.01 -1.26 -2.10 115.64 119.76 3kjx s THR 327 Ca 0.04 -1.65 -0.11 0.00 0.31 0.00 0.00 61.69 60.29 3kjx s THR 327 Cb -0.12 -2.19 -0.07 0.00 0.01 0.00 0.00 72.50 70.13 3kjx s THR 327 CO 0.00 -0.20 0.78 -0.76 -0.69 0.00 0.00 174.62 173.75 3kjx s LEU 328 N 1.17 3.84 -0.53 4.42 1.43 -0.37 -5.00 118.68 123.65 3kjx s LEU 328 Ca -0.03 1.16 0.04 0.00 -1.03 0.00 0.00 54.13 54.27 3kjx s LEU 328 Cb -0.19 -4.04 0.16 0.00 0.03 0.00 0.00 46.19 42.15 3kjx s LEU 328 CO -0.07 -0.39 0.37 -1.61 0.23 0.00 0.00 176.35 174.88 3kjx s GLU 329 N -3.78 1.58 0.72 1.70 2.02 -1.26 -4.41 118.70 115.27 3kjx s GLU 329 Ca 0.52 -2.54 -0.15 0.00 0.02 0.00 0.00 54.97 52.82 3kjx s GLU 329 Cb -0.10 -2.40 0.03 0.00 0.10 0.00 0.00 34.13 31.76 3kjx s GLU 329 CO 0.30 -1.29 1.19 -1.25 0.02 0.00 0.00 175.26 174.23 3kjx s PRO 330 N -0.42 2.25 0.25 0.39 0.04 -1.26 -5.03 135.00 131.22 3kjx s PRO 330 Ca 0.26 1.71 0.08 0.00 0.04 0.00 0.00 61.00 63.08 3kjx s PRO 330 Cb -0.07 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 3kjx s PRO 330 CO -0.13 -1.74 0.14 0.15 0.04 0.00 0.00 177.00 175.46 3kjx s LYS 331 N -3.92 2.76 0.43 4.56 -0.14 -1.26 -4.98 119.74 117.19 3kjx s LYS 331 Ca 0.73 -1.13 -0.26 0.00 -1.36 0.00 0.00 55.97 53.95 3kjx s LYS 331 Cb -0.28 -2.47 -0.09 0.00 -1.68 0.00 0.00 37.83 33.32 3kjx s LYS 331 CO 0.44 0.40 1.37 0.42 -0.76 0.00 0.00 175.35 177.22 3kjx s ILE 332 N -2.15 2.33 -0.46 2.17 1.01 -1.26 -4.39 121.20 118.45 3kjx s ILE 332 Ca 0.32 0.30 -0.06 0.00 0.00 0.00 0.00 60.65 61.22 3kjx s ILE 332 Cb -0.08 -3.18 0.12 0.00 0.01 0.00 0.00 42.46 39.34 3kjx s ILE 332 CO 0.23 0.04 0.30 -0.55 0.00 0.00 0.00 174.94 174.96 3kjx s SER 333 N -0.61 5.46 0.53 3.58 0.15 0.27 -4.99 113.70 118.09 3kjx s SER 333 Ca 0.59 -2.09 0.28 0.00 0.70 0.00 0.00 55.95 55.43 3kjx s SER 333 Cb -0.41 -1.91 1.51 0.00 -1.71 0.00 0.00 66.02 63.50 3kjx s SER 333 CO 0.53 -0.59 2.09 1.88 1.20 0.00 0.00 173.24 178.36 3kjx h TYR 334 N 8.09 0.00 0.00 3.44 0.05 -1.90 0.41 116.97 127.07 3kjx h TYR 334 Ca -0.14 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.64 3kjx h TYR 334 Cb 1.05 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.79 3kjx h TYR 334 CO 0.61 0.10 0.00 0.41 -1.05 0.00 0.00 178.16 178.23 3kjx n GLY 335 N -0.72 0.97 0.46 3.88 0.00 -1.26 -3.53 105.19 105.00 3kjx n GLY 335 Ca -0.02 -0.59 0.05 0.00 0.00 0.00 0.00 46.02 45.46 3kjx n GLY 335 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3kjx n ASP 336 N -3.42 2.36 -2.34 1.61 5.68 0.31 -4.91 116.55 115.83 3kjx n ASP 336 Ca 0.00 -1.75 -0.03 0.00 -0.50 0.00 0.00 54.79 52.51 3kjx n ASP 336 Cb 0.00 -0.11 0.01 0.00 -1.14 0.00 0.00 41.12 39.88 3kjx n ASP 336 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3kjx n THR 337 N 0.41 0.00 0.00 2.12 -2.24 -1.23 -4.36 114.28 108.98 3kjx n THR 337 Ca 0.08 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 3kjx n THR 337 Cb 0.33 -1.24 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 3kjx n THR 337 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3kjx n LEU 338 N 0.00 0.00 -4.64 3.22 0.00 -1.25 -4.79 117.00 109.53 3kjx n LEU 338 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 56.01 55.60 3kjx n LEU 338 Cb 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 43.42 43.46 3kjx n LEU 338 CO 0.05 0.00 1.67 0.29 0.00 0.00 0.00 177.39 179.40 3kjx n LYS 339 N 0.00 2.56 0.00 1.96 5.02 -1.26 -4.87 118.16 121.57 3kjx n LYS 339 Ca 0.00 0.89 0.14 0.00 -2.02 0.00 0.00 58.31 57.32 3kjx n LYS 339 Cb 0.00 -3.04 0.46 0.00 -0.02 0.00 0.00 35.03 32.42 3kjx n LYS 339 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42