#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmd n MET 29 N 0.00 -1.60 0.00 -0.41 2.00 -1.26 -4.97 117.12 110.88 2kmd n MET 29 Ca 0.00 1.25 -0.20 0.00 0.00 0.00 0.00 57.70 58.75 2kmd n MET 29 Cb 0.00 -5.60 -0.14 0.00 0.00 0.00 0.00 33.22 27.48 2kmd n MET 29 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 2kmd h GLU 30 N -0.11 0.21 -5.15 0.03 4.39 -1.93 -3.43 114.58 108.58 2kmd h GLU 30 Ca -0.23 -0.36 -0.65 0.00 0.34 0.00 0.00 59.36 58.45 2kmd h GLU 30 Cb 1.12 0.13 -0.27 0.00 -0.10 0.00 0.00 28.75 29.64 2kmd h GLU 30 CO 0.35 1.17 -0.73 0.00 -1.16 0.00 0.00 179.01 178.64 2kmd n ALA 32 N 4.18 0.88 -0.08 0.00 0.00 -1.26 -4.90 120.51 119.33 2kmd n ALA 32 Ca -0.18 -0.81 -0.12 0.00 0.00 0.00 0.00 53.44 52.33 2kmd n ALA 32 Cb 0.52 0.02 -0.04 0.00 0.00 0.00 0.00 19.45 19.95 2kmd n ALA 32 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2kmd n ASP 33 N -4.44 1.72 -4.20 0.00 2.03 -1.26 -4.93 116.55 105.47 2kmd n ASP 33 Ca -0.22 0.29 -0.33 0.00 0.52 0.00 0.00 54.79 55.04 2kmd n ASP 33 Cb 0.57 -0.66 -0.16 0.00 -0.72 0.00 0.00 41.12 40.15 2kmd n ASP 33 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2kmd s VAL 34 N -2.63 2.32 0.62 5.18 1.01 -1.26 -5.06 120.40 120.57 2kmd s VAL 34 Ca -0.26 -0.88 -0.16 0.00 0.00 0.00 0.00 61.98 60.68 2kmd s VAL 34 Cb 0.06 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 2kmd s VAL 34 CO 0.36 0.53 1.08 -2.16 0.00 0.00 0.00 175.10 174.91 2kmd s PRO 35 N 0.89 3.11 -0.05 2.72 0.04 -1.26 -4.86 135.00 135.59 2kmd s PRO 35 Ca -0.05 1.29 -0.06 0.00 0.04 0.00 0.00 61.00 62.22 2kmd s PRO 35 Cb -0.15 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.40 2kmd s PRO 35 CO -0.03 -0.99 0.17 -1.17 0.04 0.00 0.00 177.00 175.02 2kmd s LEU 36 N -4.62 1.38 0.00 -3.56 2.96 -1.26 -5.12 118.68 108.46 2kmd s LEU 36 Ca 0.65 0.25 0.00 0.00 -0.22 0.00 0.00 54.13 54.81 2kmd s LEU 36 Cb -0.18 0.60 0.00 0.00 0.50 0.00 0.00 46.19 47.11 2kmd s LEU 36 CO 0.38 -0.11 0.00 0.18 -1.32 0.00 0.00 176.35 175.48 2kmd n LEU 37 N 2.72 0.00 0.00 -0.68 4.32 -1.26 -5.05 117.00 117.05 2kmd n LEU 37 Ca -0.14 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.85 2kmd n LEU 37 Cb 0.58 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.38 2kmd n LEU 37 CO 0.21 0.00 0.00 -0.81 -1.22 0.00 0.00 177.39 175.57 2kmd n PRO 39 N 0.00 -3.09 0.00 3.23 -0.04 -1.26 -5.02 135.00 128.83 2kmd n PRO 39 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2kmd n PRO 39 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2kmd n PRO 39 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2kmd n SER 40 N 0.00 0.00 0.00 3.54 3.41 -1.26 -2.51 113.62 116.81 2kmd n SER 40 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2kmd n SER 40 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2kmd n SER 40 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2kmd n LYS 42 N 0.06 0.00 -0.27 4.33 3.00 -1.26 -4.11 118.16 119.91 2kmd n LYS 42 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.35 2kmd n LYS 42 Cb 0.00 0.00 0.26 0.00 0.00 0.00 0.00 35.03 35.29 2kmd n LYS 42 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2kmd h GLU 43 N 0.00 0.95 -0.88 1.64 3.07 -1.90 -1.37 114.58 116.08 2kmd h GLU 43 Ca 0.00 -0.06 0.07 0.00 -0.50 0.00 0.00 59.36 58.87 2kmd h GLU 43 Cb 0.00 -0.21 -0.07 0.00 -0.84 0.00 0.00 28.75 27.63 2kmd h GLU 43 CO 0.00 0.63 0.55 0.52 -1.40 0.00 0.00 179.01 179.31 2kmd h MET 44 N 0.98 0.94 -0.38 2.33 2.86 -1.90 0.35 114.93 120.12 2kmd h MET 44 Ca 0.36 -0.06 -0.09 0.00 -2.06 0.00 0.00 59.70 57.85 2kmd h MET 44 Cb 0.18 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 2kmd h MET 44 CO -0.13 0.62 -0.12 0.52 1.06 0.00 0.00 176.91 178.86 2kmd h MET 45 N 0.97 0.75 -0.42 1.72 2.86 -1.66 -2.94 114.93 116.22 2kmd h MET 45 Ca 0.40 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 2kmd h MET 45 Cb 0.22 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 2kmd h MET 45 CO -0.19 0.91 0.24 0.77 1.06 0.00 0.00 176.91 179.70 2kmd h SER 46 N 0.55 0.50 -0.40 1.22 0.02 -0.59 -2.79 113.55 112.07 2kmd h SER 46 Ca 0.09 -0.03 0.08 0.00 -0.84 0.00 0.00 61.79 61.10 2kmd h SER 46 Cb 0.65 -0.13 -0.09 0.00 0.14 0.00 0.00 62.40 62.97 2kmd h SER 46 CO 0.04 0.41 -0.24 -0.61 -1.14 0.00 0.00 176.83 175.29 2kmd h GLN 47 N 0.58 -0.17 -0.03 3.45 4.15 -0.76 0.35 115.11 122.69 2kmd h GLN 47 Ca 0.15 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.59 2kmd h GLN 47 Cb 0.01 0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.73 2kmd h GLN 47 CO -0.03 -0.11 0.01 0.00 -1.93 0.00 0.00 178.83 176.77 2kmd h ALA 48 N 1.01 0.03 -0.53 3.38 0.00 -1.56 -2.43 119.26 119.15 2kmd h ALA 48 Ca 0.19 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.12 2kmd h ALA 48 Cb 0.47 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2kmd h ALA 48 CO -0.50 -0.48 0.34 -0.07 0.00 0.00 0.00 179.25 178.53 2kmd h LEU 49 N 0.02 0.57 -1.04 0.00 3.38 -1.34 0.49 115.31 117.39 2kmd h LEU 49 Ca 0.01 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2kmd h LEU 49 Cb 0.01 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.56 2kmd h LEU 49 CO -0.01 0.41 0.64 0.50 0.09 0.00 0.00 178.44 180.06 2kmd h LYS 50 N 0.69 1.10 0.01 1.13 3.64 -0.15 -1.04 116.57 121.94 2kmd h LYS 50 Ca 0.20 -0.07 -0.23 0.00 -1.27 0.00 0.00 60.65 59.28 2kmd h LYS 50 Cb -0.04 -0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 31.50 2kmd h LYS 50 CO -0.07 0.73 -1.20 0.00 -2.27 0.00 0.00 179.45 176.65 2kmd h ALA 51 N 1.47 0.45 -0.13 5.00 0.00 -1.06 -3.32 119.26 121.67 2kmd h ALA 51 Ca 0.43 -1.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.16 2kmd h ALA 51 Cb 0.19 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2kmd h ALA 51 CO -0.17 1.32 -0.47 1.15 0.00 0.00 0.00 179.25 181.08 2kmd h THR 52 N 0.00 1.33 -0.72 0.00 2.02 -0.43 -3.11 112.91 112.00 2kmd h THR 52 Ca -0.09 -1.68 -0.46 0.00 0.77 0.00 0.00 66.41 64.96 2kmd h THR 52 Cb 1.84 1.75 -0.19 0.00 -1.74 0.00 0.00 68.15 69.81 2kmd h THR 52 CO 0.12 0.51 0.57 0.49 0.37 0.00 0.00 175.52 177.58 2kmd n PHE 53 N -3.98 2.10 0.44 3.16 3.72 -0.44 -4.44 117.46 118.02 2kmd n PHE 53 Ca -0.02 -2.30 0.13 0.00 -0.05 0.00 0.00 57.45 55.21 2kmd n PHE 53 Cb 0.53 -1.15 0.42 0.00 -0.94 0.00 0.00 39.48 38.35 2kmd n PHE 53 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2kmd h SER 54 N 1.79 0.00 1.29 4.37 4.64 -1.69 -3.06 113.55 120.88 2kmd h SER 54 Ca 0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 2kmd h SER 54 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2kmd h SER 54 CO 1.04 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.61 2kmd n GLY 55 N 0.76 -1.60 0.10 -0.77 0.00 -1.26 -3.04 105.19 99.37 2kmd n GLY 55 Ca 0.04 -0.02 -0.19 0.00 0.00 0.00 0.00 46.02 45.85 2kmd n GLY 55 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2kmd h PHE 56 N 0.00 0.00 -0.83 1.61 3.57 -1.90 -3.30 116.94 116.09 2kmd h PHE 56 Ca 0.00 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.58 2kmd h PHE 56 Cb 0.64 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.32 2kmd h PHE 56 CO 0.00 1.28 0.49 1.15 -2.23 0.00 0.00 178.31 179.00 2kmd h THR 57 N -1.00 0.97 -0.39 4.41 2.02 -1.66 0.23 112.91 117.48 2kmd h THR 57 Ca -0.28 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.61 2kmd h THR 57 Cb 1.18 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 2kmd h THR 57 CO -0.17 0.16 0.26 0.07 0.37 0.00 0.00 175.52 176.21 2kmd h LYS 58 N 0.86 0.51 0.06 6.66 2.10 -1.72 -1.61 116.57 123.43 2kmd h LYS 58 Ca 0.38 -0.03 -0.21 0.00 -2.00 0.00 0.00 60.65 58.79 2kmd h LYS 58 Cb 0.27 -0.12 0.02 0.00 -0.90 0.00 0.00 32.23 31.51 2kmd h LYS 58 CO -0.21 0.34 -0.85 1.49 -2.00 0.00 0.00 179.45 178.22 2kmd h GLU 59 N 0.53 0.47 0.00 0.07 4.22 -1.16 -3.26 114.58 115.44 2kmd h GLU 59 Ca 0.14 -0.58 -0.01 0.00 0.08 0.00 0.00 59.36 58.99 2kmd h GLU 59 Cb -0.06 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 2kmd h GLU 59 CO -0.03 1.23 -0.02 1.96 -2.18 0.00 0.00 179.01 179.96 2kmd h GLN 60 N -0.02 0.00 0.00 1.92 4.20 -0.15 -0.85 115.11 120.20 2kmd h GLN 60 Ca -0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2kmd h GLN 60 Cb 1.57 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.35 2kmd h GLN 60 CO 0.16 0.02 -0.03 1.04 -0.67 0.00 0.00 178.83 179.36 2kmd n GLN 61 N -4.12 0.24 0.05 1.46 1.13 -0.65 0.11 117.38 115.59 2kmd n GLN 61 Ca -0.03 0.19 -0.15 0.00 -1.94 0.00 0.00 57.00 55.07 2kmd n GLN 61 Cb 0.11 -1.77 -0.14 0.00 0.11 0.00 0.00 30.24 28.55 2kmd n GLN 61 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2kmd h ARG 62 N 0.00 0.18 0.00 -1.09 3.08 -1.20 -3.38 114.38 111.97 2kmd h ARG 62 Ca 0.00 -0.31 -0.13 0.00 0.07 0.00 0.00 59.98 59.61 2kmd h ARG 62 Cb 0.72 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.86 2kmd h ARG 62 CO 0.00 1.01 -1.90 1.28 -1.07 0.00 0.00 179.97 179.29 2kmd n LEU 63 N -3.38 0.00 0.00 3.04 4.32 -1.14 -5.01 117.00 114.83 2kmd n LEU 63 Ca -0.15 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.84 2kmd n LEU 63 Cb 1.03 0.17 0.00 0.00 -1.62 0.00 0.00 43.42 43.01 2kmd n LEU 63 CO 0.49 0.17 0.00 0.61 -1.22 0.00 0.00 177.39 177.44 2kmd n GLY 64 N 1.78 0.99 3.68 -0.72 0.00 0.12 -5.05 105.19 105.98 2kmd n GLY 64 Ca -0.13 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.43 2kmd n GLY 64 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2kmd n ILE 65 N -2.01 0.26 -1.43 -0.61 5.41 -0.54 -4.97 119.36 115.46 2kmd n ILE 65 Ca 0.00 -0.05 -0.30 0.00 1.00 0.00 0.00 62.75 63.41 2kmd n ILE 65 Cb 0.00 -1.80 0.20 0.00 -0.71 0.00 0.00 39.64 37.33 2kmd n ILE 65 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2kmd s PRO 66 N 2.27 -0.04 -0.62 0.38 0.04 -1.26 -4.74 135.00 131.03 2kmd s PRO 66 Ca 0.83 -0.04 -0.01 0.00 0.04 0.00 0.00 61.00 61.81 2kmd s PRO 66 Cb -0.63 -1.73 0.45 0.00 0.04 0.00 0.00 34.50 32.63 2kmd s PRO 66 CO 0.41 -2.93 2.02 1.63 0.04 0.00 0.00 177.00 178.18 2kmd n LYS 67 N -4.21 2.57 -3.44 4.56 4.76 -1.26 -4.84 118.16 116.30 2kmd n LYS 67 Ca 0.12 -3.10 -0.14 0.00 -2.87 0.00 0.00 58.31 52.32 2kmd n LYS 67 Cb 0.59 -2.22 -0.11 0.00 -1.84 0.00 0.00 35.03 31.46 2kmd n LYS 67 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2kmd s ASP 68 N -1.60 0.82 0.32 4.39 1.01 -1.26 -4.58 116.67 115.77 2kmd s ASP 68 Ca 0.61 0.02 0.02 0.00 0.71 0.00 0.00 52.55 53.91 2kmd s ASP 68 Cb 0.48 0.73 0.60 0.00 1.01 0.00 0.00 42.92 45.74 2kmd s ASP 68 CO 0.00 -0.31 1.92 -0.65 0.21 0.00 0.00 175.17 176.34 2kmd h PRO 69 N 8.25 0.92 -0.23 8.23 0.11 -1.88 -1.37 132.00 146.03 2kmd h PRO 69 Ca -0.18 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.84 2kmd h PRO 69 Cb 1.15 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 2kmd h PRO 69 CO 0.27 0.61 -0.03 0.00 -0.21 0.00 0.00 178.00 178.64 2kmd h ARG 70 N 0.94 0.35 -1.15 1.05 -0.00 -1.93 -2.33 114.38 111.32 2kmd h ARG 70 Ca 0.37 -0.07 -0.54 0.00 -0.50 0.00 0.00 59.98 59.24 2kmd h ARG 70 Cb 0.23 -0.06 -0.24 0.00 0.00 0.00 0.00 29.97 29.91 2kmd h ARG 70 CO -0.14 0.40 0.70 1.04 0.00 0.00 0.00 179.97 181.98 2kmd n GLN 71 N -4.32 2.34 -4.21 0.04 3.00 -0.52 -3.02 117.38 110.69 2kmd n GLN 71 Ca 0.00 -2.68 -0.25 0.00 -0.01 0.00 0.00 57.00 54.06 2kmd n GLN 71 Cb 0.22 -2.05 -0.08 0.00 0.00 0.00 0.00 30.24 28.33 2kmd n GLN 71 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 2kmd s TRP 72 N -3.10 2.59 0.32 1.08 0.52 -0.88 -4.85 118.94 114.63 2kmd s TRP 72 Ca 0.53 -0.58 0.04 0.00 0.02 0.00 0.00 56.10 56.11 2kmd s TRP 72 Cb 0.42 -1.88 -0.01 0.00 -1.15 0.00 0.00 33.47 30.84 2kmd s TRP 72 CO 0.00 0.25 0.14 -2.37 0.02 0.00 0.00 176.95 175.00 2kmd n THR 73 N -1.17 0.00 -0.31 2.01 5.66 -1.26 -1.62 114.28 117.59 2kmd n THR 73 Ca -0.02 -1.94 0.12 0.00 -3.05 0.00 0.00 64.05 59.16 2kmd n THR 73 Cb 0.65 0.75 0.30 0.00 -1.55 0.00 0.00 70.33 70.47 2kmd n THR 73 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 2kmd h GLU 74 N 0.00 0.50 0.01 1.09 5.08 -1.86 0.11 114.58 119.50 2kmd h GLU 74 Ca -0.25 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2kmd h GLU 74 Cb 0.99 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2kmd h GLU 74 CO 0.39 0.33 -0.00 1.15 -1.00 0.00 0.00 179.01 179.87 2kmd h THR 75 N 0.51 1.27 -0.59 1.13 2.02 -1.95 -1.80 112.91 113.50 2kmd h THR 75 Ca 0.55 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.90 2kmd h THR 75 Cb 0.98 1.83 -0.03 0.00 -1.74 0.00 0.00 68.15 69.19 2kmd h THR 75 CO -0.47 0.21 0.32 0.45 0.37 0.00 0.00 175.52 176.41 2kmd h HIS 76 N -0.36 0.82 0.16 3.16 3.86 -1.74 0.41 115.15 121.46 2kmd h HIS 76 Ca -0.00 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.18 2kmd h HIS 76 Cb 0.35 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 28.56 2kmd h HIS 76 CO 0.05 0.60 -0.09 0.28 0.86 0.00 0.00 177.93 179.62 2kmd h VAL 77 N 0.81 0.81 -0.21 2.45 2.07 -0.83 -1.70 116.25 119.66 2kmd h VAL 77 Ca 0.21 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.61 2kmd h VAL 77 Cb 0.05 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2kmd h VAL 77 CO -0.03 0.00 -0.35 -0.09 0.02 0.00 0.00 177.57 177.12 2kmd h ARG 78 N -0.23 0.60 -0.97 1.57 2.43 -1.21 -1.88 114.38 114.68 2kmd h ARG 78 Ca -0.02 -0.37 0.07 0.00 -0.81 0.00 0.00 59.98 58.86 2kmd h ARG 78 Cb 0.19 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 29.71 2kmd h ARG 78 CO 0.02 0.98 0.63 0.22 -1.51 0.00 0.00 179.97 180.31 2kmd h ASP 79 N 0.28 0.98 0.56 -3.80 3.58 -0.16 0.27 116.42 118.12 2kmd h ASP 79 Ca 0.02 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.45 2kmd h ASP 79 Cb 0.94 -0.20 0.01 0.00 1.72 0.00 0.00 39.33 41.80 2kmd h ASP 79 CO 0.08 0.61 -0.27 -0.25 -2.88 0.00 0.00 179.24 176.53 2kmd h TRP 80 N 1.10 -0.70 -0.87 0.28 7.01 -1.27 -0.87 115.95 120.63 2kmd h TRP 80 Ca 0.42 -0.02 0.12 0.00 2.11 0.00 0.00 58.89 61.53 2kmd h TRP 80 Cb 0.22 0.23 -0.14 0.00 -2.10 0.00 0.00 29.16 27.37 2kmd h TRP 80 CO -0.00 -0.43 -0.43 0.28 -2.79 0.00 0.00 178.44 175.06 2kmd h VAL 81 N -1.15 0.03 -0.52 2.65 2.07 -1.08 0.21 116.25 118.47 2kmd h VAL 81 Ca -0.08 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.51 2kmd h VAL 81 Cb 0.58 0.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.33 2kmd h VAL 81 CO 0.13 0.00 0.22 -0.03 0.02 0.00 0.00 177.57 177.90 2kmd h MET 82 N -0.06 0.41 -0.80 1.57 1.85 -0.52 -0.86 114.93 116.51 2kmd h MET 82 Ca 0.27 -0.02 0.07 0.00 -0.61 0.00 0.00 59.70 59.40 2kmd h MET 82 Cb 0.55 -0.09 -0.05 0.00 0.43 0.00 0.00 31.60 32.44 2kmd h MET 82 CO -0.89 0.27 0.52 2.35 -0.40 0.00 0.00 176.91 178.76 2kmd h TRP 83 N 0.42 0.86 0.00 1.39 7.01 0.76 0.28 115.95 126.67 2kmd h TRP 83 Ca 0.24 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.27 2kmd h TRP 83 Cb 0.23 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 27.00 2kmd h TRP 83 CO -0.14 0.44 0.00 0.00 -2.79 0.00 0.00 178.44 175.95 2kmd h ALA 84 N 1.57 1.00 0.14 2.65 0.00 0.67 0.30 119.26 125.59 2kmd h ALA 84 Ca 0.35 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.96 2kmd h ALA 84 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2kmd h ALA 84 CO -0.13 0.00 -1.40 0.28 0.00 0.00 0.00 179.25 178.00 2kmd h VAL 85 N 0.00 1.32 0.00 0.00 2.07 -0.33 -2.33 116.25 116.99 2kmd h VAL 85 Ca 0.00 -2.90 -0.30 0.00 0.82 0.00 0.00 66.70 64.32 2kmd h VAL 85 Cb 0.54 2.88 -0.05 0.00 -1.52 0.00 0.00 31.29 33.14 2kmd h VAL 85 CO 0.00 0.85 -1.77 0.59 0.02 0.00 0.00 177.57 177.26 2kmd n ASN 86 N -3.52 0.86 0.07 0.57 3.02 -0.93 -0.38 115.26 114.94 2kmd n ASN 86 Ca -0.13 0.38 -0.19 0.00 -0.03 0.00 0.00 54.58 54.61 2kmd n ASN 86 Cb 1.04 -0.02 -0.10 0.00 -0.61 0.00 0.00 39.78 40.09 2kmd n ASN 86 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2kmd h GLU 87 N 0.00 0.60 -0.43 3.52 4.57 -0.54 -3.30 114.58 119.00 2kmd h GLU 87 Ca -0.31 -0.70 0.00 0.00 -1.18 0.00 0.00 59.36 57.17 2kmd h GLU 87 Cb 2.03 0.21 0.00 0.00 -0.16 0.00 0.00 28.75 30.83 2kmd h GLU 87 CO 0.08 1.29 0.00 1.19 -1.18 0.00 0.00 179.01 180.39 2kmd n PHE 88 N -3.80 0.67 -3.92 0.92 3.72 -0.88 -5.00 117.46 109.17 2kmd n PHE 88 Ca -0.11 -0.54 -0.35 0.00 -0.05 0.00 0.00 57.45 56.40 2kmd n PHE 88 Cb 0.91 -0.06 0.01 0.00 -0.94 0.00 0.00 39.48 39.40 2kmd n PHE 88 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2kmd n SER 89 N 0.68 -3.40 -4.81 4.37 2.88 -0.67 -4.96 113.62 107.70 2kmd n SER 89 Ca 0.16 -1.13 -0.24 0.00 -1.33 0.00 0.00 58.87 56.33 2kmd n SER 89 Cb 0.53 -2.62 0.08 0.00 -0.75 0.00 0.00 64.21 61.46 2kmd n SER 89 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2kmd s LEU 90 N -6.97 2.99 0.03 2.46 1.43 0.49 -5.00 118.68 114.11 2kmd s LEU 90 Ca 0.35 0.07 -0.22 0.00 -1.03 0.00 0.00 54.13 53.30 2kmd s LEU 90 Cb -0.15 -2.66 0.05 0.00 0.03 0.00 0.00 46.19 43.45 2kmd s LEU 90 CO 0.91 -1.62 0.49 -1.59 0.23 0.00 0.00 176.35 174.77 2kmd s LYS 91 N -5.12 0.98 0.00 1.70 0.00 -1.26 -4.86 119.74 111.17 2kmd s LYS 91 Ca 0.62 -0.21 0.00 0.00 0.00 0.00 0.00 55.97 56.38 2kmd s LYS 91 Cb -0.09 0.45 0.00 0.00 0.00 0.00 0.00 37.83 38.19 2kmd s LYS 91 CO 0.43 -0.34 0.00 0.41 0.00 0.00 0.00 175.35 175.85 2kmd n GLY 92 N 0.55 1.72 3.73 0.59 0.00 -1.26 -4.76 105.19 105.75 2kmd n GLY 92 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 2kmd n GLY 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kmd s VAL 93 N -3.02 4.33 -0.13 1.61 0.11 -1.26 -4.23 120.40 117.80 2kmd s VAL 93 Ca 0.00 1.87 -0.05 0.00 -2.93 0.00 0.00 61.98 60.87 2kmd s VAL 93 Cb 0.00 -4.20 -0.04 0.00 -1.53 0.00 0.00 36.38 30.62 2kmd s VAL 93 CO 0.00 0.26 0.05 -1.81 -3.33 0.00 0.00 175.10 170.26 2kmd s ASP 94 N 0.25 5.56 0.04 3.54 1.11 -1.26 -5.00 116.67 120.91 2kmd s ASP 94 Ca 0.50 0.17 0.13 0.00 0.18 0.00 0.00 52.55 53.53 2kmd s ASP 94 Cb -0.25 -1.77 -0.17 0.00 1.07 0.00 0.00 42.92 41.79 2kmd s ASP 94 CO 0.31 0.30 0.87 -0.26 1.18 0.00 0.00 175.17 177.57 2kmd h PHE 95 N 5.73 0.00 -0.43 4.23 0.04 -1.95 -3.32 116.94 121.25 2kmd h PHE 95 Ca -0.46 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.30 2kmd h PHE 95 Cb 1.19 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.32 2kmd h PHE 95 CO 0.63 0.83 0.22 1.96 -0.60 0.00 0.00 178.31 181.35 2kmd h GLN 96 N 0.00 0.59 -0.29 1.51 4.20 -1.98 -1.72 115.11 117.42 2kmd h GLN 96 Ca -0.18 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.38 2kmd h GLN 96 Cb 1.80 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 29.44 2kmd h GLN 96 CO 0.08 0.45 -0.20 0.87 -0.67 0.00 0.00 178.83 179.36 2kmd h LYS 97 N 0.60 0.53 -0.98 1.46 1.79 -1.88 -2.92 116.57 115.17 2kmd h LYS 97 Ca 0.15 -0.18 -0.58 0.00 -2.18 0.00 0.00 60.65 57.86 2kmd h LYS 97 Cb 0.04 -0.04 -0.30 0.00 -1.58 0.00 0.00 32.23 30.36 2kmd h LYS 97 CO -0.02 0.70 0.71 1.19 -1.08 0.00 0.00 179.45 180.95 2kmd n PHE 98 N -4.15 3.09 -2.03 -1.35 3.72 -0.68 -4.79 117.46 111.26 2kmd n PHE 98 Ca 0.00 -2.33 -0.41 0.00 -0.05 0.00 0.00 57.45 54.65 2kmd n PHE 98 Cb 0.38 -1.14 -0.00 0.00 -0.94 0.00 0.00 39.48 37.78 2kmd n PHE 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2kmd s MET 100 N 0.69 1.80 0.64 0.00 0.23 -1.26 -5.00 119.30 116.41 2kmd s MET 100 Ca 0.48 -1.06 -0.13 0.00 -1.03 0.00 0.00 55.69 53.94 2kmd s MET 100 Cb 0.13 0.59 -0.01 0.00 -1.53 0.00 0.00 34.83 34.02 2kmd s MET 100 CO -0.04 -0.82 1.06 -1.12 -2.03 0.00 0.00 175.02 172.07 2kmd s SER 101 N -2.95 5.54 0.34 -1.18 0.01 -1.26 -3.03 113.70 111.18 2kmd s SER 101 Ca 0.13 1.74 0.02 0.00 1.31 0.00 0.00 55.95 59.15 2kmd s SER 101 Cb -0.05 -2.52 0.62 0.00 0.21 0.00 0.00 66.02 64.28 2kmd s SER 101 CO 0.08 -1.33 2.00 1.23 0.41 0.00 0.00 173.24 175.62 2kmd h GLY 102 N -0.12 0.90 0.66 3.44 0.00 -1.43 -1.89 103.07 104.63 2kmd h GLY 102 Ca -0.45 -0.35 0.09 0.00 0.00 0.00 0.00 47.33 46.62 2kmd h GLY 102 CO 0.57 0.34 0.63 0.00 0.00 0.00 0.00 176.54 178.07 2kmd h ALA 103 N 1.58 1.50 -0.11 3.60 0.00 -1.49 0.03 119.26 124.37 2kmd h ALA 103 Ca 0.23 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.98 2kmd h ALA 103 Cb -0.07 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.47 2kmd h ALA 103 CO -0.05 0.32 -0.52 0.00 0.00 0.00 0.00 179.25 179.00 2kmd h ALA 104 N 1.51 0.22 -0.60 0.00 0.00 -1.73 -2.58 119.26 116.08 2kmd h ALA 104 Ca 0.45 -0.51 0.06 0.00 0.00 0.00 0.00 54.91 54.90 2kmd h ALA 104 Cb 0.32 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 2kmd h ALA 104 CO -0.20 0.41 0.31 1.25 0.00 0.00 0.00 179.25 181.02 2kmd h LEU 105 N 0.17 0.44 -0.58 0.00 5.85 -0.68 -0.20 115.31 120.31 2kmd h LEU 105 Ca -0.03 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 2kmd h LEU 105 Cb 1.16 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 2kmd h LEU 105 CO 0.11 0.29 -0.04 0.00 -0.34 0.00 0.00 178.44 178.45 2kmd h ALA 107 N 0.96 1.21 -0.24 0.00 0.00 -0.97 -2.85 119.26 117.38 2kmd h ALA 107 Ca 0.16 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2kmd h ALA 107 Cb 0.61 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2kmd h ALA 107 CO 0.04 0.16 -0.33 -0.07 0.00 0.00 0.00 179.25 179.05 2kmd h LEU 108 N 0.00 0.53 0.00 0.00 3.38 -0.71 -3.50 115.31 115.01 2kmd h LEU 108 Ca -0.00 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2kmd h LEU 108 Cb 0.40 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2kmd h LEU 108 CO 0.02 0.83 0.00 0.61 0.09 0.00 0.00 178.44 179.98 2kmd n GLY 109 N -0.19 -0.95 0.08 0.83 0.00 -1.08 -3.82 105.19 100.07 2kmd n GLY 109 Ca -0.01 -1.66 -0.11 0.00 0.00 0.00 0.00 46.02 44.24 2kmd n GLY 109 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2kmd h LYS 110 N 0.00 0.16 -0.32 1.61 3.64 -1.91 -0.95 116.57 118.80 2kmd h LYS 110 Ca 0.00 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.43 2kmd h LYS 110 Cb 0.00 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 31.71 2kmd h LYS 110 CO 0.00 0.18 -0.18 1.05 -2.27 0.00 0.00 179.45 178.23 2kmd h GLU 111 N 0.10 -0.14 -0.56 1.90 4.11 -1.99 0.45 114.58 118.45 2kmd h GLU 111 Ca 0.04 0.01 -0.11 0.00 0.07 0.00 0.00 59.36 59.37 2kmd h GLU 111 Cb 0.07 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2kmd h GLU 111 CO -0.01 -0.09 -0.06 0.00 0.07 0.00 0.00 179.01 178.92 2kmd h PHE 113 N 0.93 0.77 0.00 0.00 3.57 -0.39 -2.19 116.94 119.63 2kmd h PHE 113 Ca 0.15 -0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 2kmd h PHE 113 Cb 0.62 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2kmd h PHE 113 CO 0.04 0.63 -0.22 -0.07 -2.23 0.00 0.00 178.31 176.47 2kmd h LEU 114 N 0.69 0.00 -0.84 0.59 4.07 0.00 -1.84 115.31 117.98 2kmd h LEU 114 Ca 0.17 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.08 2kmd h LEU 114 Cb 0.18 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.91 2kmd h LEU 114 CO -0.02 0.22 -0.24 -0.33 -1.08 0.00 0.00 178.44 176.99 2kmd h GLU 115 N 0.00 0.00 0.09 1.13 5.08 -0.75 -3.20 114.58 116.93 2kmd h GLU 115 Ca -0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 2kmd h GLU 115 Cb 0.53 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 2kmd h GLU 115 CO 0.03 0.24 -1.59 -0.07 -1.00 0.00 0.00 179.01 176.62 2kmd h LEU 116 N 0.00 0.31-10.00 1.33 3.38 -0.91 -3.47 115.31 105.95 2kmd h LEU 116 Ca -0.00 -0.48 -0.49 0.00 0.09 0.00 0.00 57.88 57.00 2kmd h LEU 116 Cb 0.87 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 2kmd h LEU 116 CO 0.03 1.40 -0.49 0.00 0.09 0.00 0.00 178.44 179.48 2kmd s ALA 117 N -2.61 3.72 1.37 1.53 0.00 -0.83 -4.46 121.76 120.48 2kmd s ALA 117 Ca -0.09 -1.45 -0.20 0.00 0.00 0.00 0.00 51.96 50.21 2kmd s ALA 117 Cb 0.07 -1.34 0.35 0.00 0.00 0.00 0.00 23.12 22.19 2kmd s ALA 117 CO 0.84 0.18 0.89 -0.35 0.00 0.00 0.00 175.76 177.31 2kmd n PRO 118 N -1.28 -3.99 0.09 0.00 -0.04 -1.26 -4.63 135.00 123.89 2kmd n PRO 118 Ca -0.06 -1.17 0.09 0.00 -0.04 0.00 0.00 63.50 62.32 2kmd n PRO 118 Cb 0.58 -1.99 0.40 0.00 -0.04 0.00 0.00 33.50 32.46 2kmd n PRO 118 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2kmd n ASP 119 N -5.33 0.39 -0.05 3.54 9.92 -1.26 -2.45 116.55 121.31 2kmd n ASP 119 Ca 0.09 0.62 -0.09 0.00 -0.53 0.00 0.00 54.79 54.88 2kmd n ASP 119 Cb 0.57 -0.70 -0.03 0.00 -0.64 0.00 0.00 41.12 40.33 2kmd n ASP 119 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 2kmd n PHE 120 N -1.96 0.00 0.15 1.24 3.72 -1.26 -4.68 117.46 114.66 2kmd n PHE 120 Ca 0.01 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.45 2kmd n PHE 120 Cb 0.14 -0.38 0.45 0.00 -0.94 0.00 0.00 39.48 38.75 2kmd n PHE 120 CO 0.00 0.00 0.00 -0.39 -0.05 0.00 0.00 176.76 176.32 2kmd h VAL 121 N -0.57 1.13 -0.81 -4.37 -1.51 -1.86 -2.92 116.25 105.35 2kmd h VAL 121 Ca -0.14 -0.56 0.17 0.00 -1.23 0.00 0.00 66.70 64.94 2kmd h VAL 121 Cb 0.85 1.11 -0.11 0.00 -2.13 0.00 0.00 31.29 31.01 2kmd h VAL 121 CO -0.09 0.18 0.31 1.23 -1.23 0.00 0.00 177.57 177.97 2kmd h GLY 122 N 0.56 1.27 0.48 5.19 0.00 -1.74 0.17 103.07 109.01 2kmd h GLY 122 Ca 0.04 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 2kmd h GLY 122 CO 0.01 -0.18 -0.04 -1.80 0.00 0.00 0.00 176.54 174.54 2kmd h ASP 123 N 0.40 0.06 0.09 0.19 3.58 -1.78 -2.70 116.42 116.27 2kmd h ASP 123 Ca 0.47 -0.56 0.02 0.00 0.42 0.00 0.00 57.03 57.38 2kmd h ASP 123 Cb 0.80 -0.02 -0.04 0.00 1.72 0.00 0.00 39.33 41.79 2kmd h ASP 123 CO -0.47 0.61 -0.33 0.40 -2.88 0.00 0.00 179.24 176.58 2kmd h ILE 124 N -0.48 0.30 0.10 2.25 2.04 -1.35 0.40 117.51 120.77 2kmd h ILE 124 Ca 0.00 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.87 2kmd h ILE 124 Cb 0.60 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 2kmd h ILE 124 CO 0.01 0.00 -0.18 -0.07 0.00 0.00 0.00 178.15 177.90 2kmd h LEU 125 N -0.53 -0.51 -2.03 1.44 4.07 -0.79 -2.05 115.31 114.91 2kmd h LEU 125 Ca 0.04 0.06 -0.01 0.00 0.08 0.00 0.00 57.88 58.05 2kmd h LEU 125 Cb 0.58 0.19 -0.00 0.00 1.08 0.00 0.00 40.66 42.51 2kmd h LEU 125 CO -0.21 -0.26 -0.06 -0.25 -1.08 0.00 0.00 178.44 176.58 2kmd h TRP 126 N -0.35 0.00 0.40 1.13 7.01 -1.33 0.59 115.95 123.40 2kmd h TRP 126 Ca 0.02 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.01 2kmd h TRP 126 Cb 0.37 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.44 2kmd h TRP 126 CO -0.18 0.06 -0.19 0.93 -2.79 0.00 0.00 178.44 176.27 2kmd h GLU 127 N 0.00 -0.51 -0.10 2.65 5.08 -0.21 0.55 114.58 122.04 2kmd h GLU 127 Ca -0.00 0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.23 2kmd h GLU 127 Cb 0.12 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2kmd h GLU 127 CO 0.01 -0.24 -0.64 1.25 -1.00 0.00 0.00 179.01 178.39 2kmd h HIS 128 N -0.73 0.48 -0.42 4.33 2.76 -1.16 -2.85 115.15 117.56 2kmd h HIS 128 Ca -0.05 -0.19 -0.01 0.00 -2.20 0.00 0.00 60.37 57.91 2kmd h HIS 128 Cb 0.51 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.37 2kmd h HIS 128 CO -0.00 0.90 0.22 1.25 -1.30 0.00 0.00 177.93 179.00 2kmd h LEU 129 N 0.27 0.53 -1.38 0.26 5.85 0.22 -1.96 115.31 119.09 2kmd h LEU 129 Ca -0.01 -0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.54 2kmd h LEU 129 Cb 1.18 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 2kmd h LEU 129 CO 0.11 0.49 -0.29 -0.08 -0.34 0.00 0.00 178.44 178.32 2kmd h GLU 130 N 0.54 0.00 -0.37 1.25 4.81 -0.88 -2.51 114.58 117.42 2kmd h GLU 130 Ca 0.15 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.25 2kmd h GLU 130 Cb 0.08 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 2kmd h GLU 130 CO -0.02 0.29 -0.27 0.82 -0.73 0.00 0.00 179.01 179.10 2kmd h ILE 131 N 0.00 1.28 -0.11 2.32 2.04 -1.17 -3.02 117.51 118.86 2kmd h ILE 131 Ca -0.00 -1.40 -0.01 0.00 1.00 0.00 0.00 64.86 64.45 2kmd h ILE 131 Cb 0.60 1.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.96 2kmd h ILE 131 CO 0.04 0.46 0.02 -0.07 0.00 0.00 0.00 178.15 178.61 2kmd h LEU 132 N 0.66 0.16 -1.19 1.44 3.38 -0.94 -2.47 115.31 116.35 2kmd h LEU 132 Ca 0.08 -0.23 0.07 0.00 0.09 0.00 0.00 57.88 57.89 2kmd h LEU 132 Cb 0.79 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.44 2kmd h LEU 132 CO 0.07 0.35 0.57 0.06 0.09 0.00 0.00 178.44 179.58 2kmd h GLN 133 N -0.04 0.93 -0.39 1.13 3.07 -1.52 -1.91 115.11 116.38 2kmd h GLN 133 Ca 0.03 -0.06 -0.13 0.00 0.09 0.00 0.00 58.65 58.58 2kmd h GLN 133 Cb 0.26 -0.21 -0.01 0.00 0.08 0.00 0.00 27.48 27.59 2kmd h GLN 133 CO 0.00 0.62 -0.29 0.87 0.09 0.00 0.00 178.83 180.12 2kmd h LYS 134 N 0.96 0.84 -6.45 0.06 1.57 -1.39 -3.40 116.57 108.76 2kmd h LYS 134 Ca 0.38 -0.38 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 2kmd h LYS 134 Cb 0.25 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 2kmd h LYS 134 CO -0.15 1.02 0.45 -2.00 -0.57 0.00 0.00 179.45 178.20 2kmd s GLU 135 N -4.51 4.52 -0.38 3.15 -6.30 -0.72 -4.96 118.70 109.50 2kmd s GLU 135 Ca -0.10 1.56 0.01 0.00 -2.50 0.00 0.00 54.97 53.94 2kmd s GLU 135 Cb 0.12 -3.41 0.14 0.00 0.00 0.00 0.00 34.13 30.98 2kmd s GLU 135 CO 0.85 -0.12 0.21 -0.51 0.02 0.00 0.00 175.26 175.72 2kmd s ASP 136 N 0.97 3.27 0.08 -1.70 1.11 -1.26 -4.65 116.67 114.49 2kmd s ASP 136 Ca 0.54 -2.30 0.09 0.00 0.18 0.00 0.00 52.55 51.06 2kmd s ASP 136 Cb -0.25 -0.65 -0.03 0.00 1.07 0.00 0.00 42.92 43.07 2kmd s ASP 136 CO 0.29 -0.30 -0.24 0.68 1.18 0.00 0.00 175.17 176.77 2kmd s VAL 137 N 0.86 1.99 -2.37 -1.27 -7.23 -1.26 -5.18 120.40 105.93 2kmd s VAL 137 Ca 0.17 -1.48 0.29 0.00 -1.81 0.00 0.00 61.98 59.15 2kmd s VAL 137 Cb -0.23 -1.74 0.64 0.00 0.56 0.00 0.00 36.38 35.61 2kmd s VAL 137 CO -0.01 0.17 1.87 1.17 -0.31 0.00 0.00 175.10 177.99