#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 0.00 0.01 -0.41 0.00 -1.26 -2.26 117.12 113.19 2kmd n MET 29 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 57.70 57.50 2kmd n MET 29 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 33.22 33.08 2kmd n MET 29 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 175.97 177.02 2kmd h GLU 30 N 0.00 0.26 -7.04 2.12 4.11 -1.91 -3.45 114.58 108.66 2kmd h GLU 30 Ca 0.00 -0.44 -0.51 0.00 0.07 0.00 0.00 59.36 58.48 2kmd h GLU 30 Cb 0.00 0.16 0.07 0.00 0.50 0.00 0.00 28.75 29.48 2kmd h GLU 30 CO 0.00 1.17 0.47 0.00 0.07 0.00 0.00 179.01 180.72 2kmd n ALA 32 N -0.85 6.19 -2.56 0.00 0.00 -1.26 -1.51 120.51 120.52 2kmd n ALA 32 Ca 0.09 -3.88 -0.12 0.00 0.00 0.00 0.00 53.44 49.53 2kmd n ALA 32 Cb 0.49 -3.33 -0.08 0.00 0.00 0.00 0.00 19.45 16.53 2kmd n ALA 32 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2kmd s ASP 33 N 2.26 0.36 -0.12 0.00 1.01 -1.26 -4.86 116.67 114.05 2kmd s ASP 33 Ca 0.53 -1.32 -0.29 0.00 0.71 0.00 0.00 52.55 52.17 2kmd s ASP 33 Cb 0.15 0.49 -0.03 0.00 1.01 0.00 0.00 42.92 44.54 2kmd s ASP 33 CO -0.07 -1.01 1.35 -0.69 0.21 0.00 0.00 175.17 174.97 2kmd s VAL 34 N -3.89 4.09 -0.38 -1.27 1.01 -1.26 -1.24 120.40 117.45 2kmd s VAL 34 Ca 0.34 1.34 -0.29 0.00 0.00 0.00 0.00 61.98 63.37 2kmd s VAL 34 Cb 0.03 -3.86 -0.08 0.00 0.00 0.00 0.00 36.38 32.47 2kmd s VAL 34 CO 0.14 -0.10 2.31 -2.65 0.00 0.00 0.00 175.10 174.80 2kmd n PRO 35 N 6.55 1.35 0.15 2.72 -0.02 -1.26 -4.40 135.00 140.09 2kmd n PRO 35 Ca 0.14 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2kmd n PRO 35 Cb 0.44 -3.06 0.00 0.00 -0.02 0.00 0.00 33.50 30.87 2kmd n PRO 35 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2kmd n LEU 36 N 12.74 -2.31 -4.75 2.45 7.94 -1.26 -5.02 117.00 126.79 2kmd n LEU 36 Ca 0.37 0.56 -0.37 0.00 -1.11 0.00 0.00 56.01 55.47 2kmd n LEU 36 Cb 0.41 2.30 -0.07 0.00 0.53 0.00 0.00 43.42 46.60 2kmd n LEU 36 CO 0.71 -0.11 -0.02 -0.22 -1.11 0.00 0.00 177.39 176.64 2kmd s LEU 37 N -6.31 4.27 0.00 -1.96 2.96 -1.26 -5.17 118.68 111.21 2kmd s LEU 37 Ca 0.00 0.54 0.00 0.00 -0.22 0.00 0.00 54.13 54.45 2kmd s LEU 37 Cb 0.00 -2.36 0.00 0.00 0.50 0.00 0.00 46.19 44.33 2kmd s LEU 37 CO 0.00 0.14 0.00 -0.81 -1.32 0.00 0.00 176.35 174.36 2kmd n PRO 39 N 3.30 -3.75 0.00 0.98 -0.04 -1.26 -4.96 135.00 129.27 2kmd n PRO 39 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 2kmd n PRO 39 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 2kmd n PRO 39 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2kmd n SER 40 N 2.37 0.00 0.00 3.54 2.88 -1.26 -1.59 113.62 119.56 2kmd n SER 40 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2kmd n SER 40 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2kmd n SER 40 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2kmd n LYS 42 N 0.81 0.00 -0.13 -1.46 3.00 -1.26 -0.44 118.16 118.68 2kmd n LYS 42 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.18 2kmd n LYS 42 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.01 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 0.93 0.00 1.64 5.08 -1.71 -3.11 114.58 117.41 2kmd h GLU 43 Ca 0.00 -0.46 -0.14 0.00 -1.00 0.00 0.00 59.36 57.77 2kmd h GLU 43 Cb 0.00 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2kmd h GLU 43 CO 0.00 1.12 -0.65 0.00 -1.00 0.00 0.00 179.01 178.47 2kmd h MET 44 N 0.76 0.00 -1.00 2.33 -0.00 -1.02 -2.85 114.93 113.15 2kmd h MET 44 Ca 0.08 0.00 0.04 0.00 -0.00 0.00 0.00 59.70 59.82 2kmd h MET 44 Cb 0.90 0.00 -0.06 0.00 -0.00 0.00 0.00 31.60 32.44 2kmd h MET 44 CO 0.08 0.65 0.65 1.98 -0.00 0.00 0.00 176.91 180.28 2kmd h MET 45 N 0.00 1.22 0.00 -0.10 -1.53 -1.77 -2.66 114.93 110.10 2kmd h MET 45 Ca -0.01 -0.07 -0.20 0.00 -3.44 0.00 0.00 59.70 55.98 2kmd h MET 45 Cb 1.24 -0.28 -0.03 0.00 -0.55 0.00 0.00 31.60 31.98 2kmd h MET 45 CO 0.08 0.81 -1.21 0.66 0.14 0.00 0.00 176.91 177.39 2kmd h SER 46 N 1.26 0.00 -0.30 1.39 4.64 -1.56 -3.33 113.55 115.66 2kmd h SER 46 Ca 0.40 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.79 2kmd h SER 46 Cb 0.01 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.03 2kmd h SER 46 CO -0.13 0.79 -0.19 1.56 -0.87 0.00 0.00 176.83 177.99 2kmd h GLN 47 N 0.00 -0.15 -0.36 4.77 4.20 -1.22 -1.60 115.11 120.75 2kmd h GLN 47 Ca -0.13 0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.52 2kmd h GLN 47 Cb 1.71 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 29.51 2kmd h GLN 47 CO 0.08 -0.10 -0.06 0.00 -0.67 0.00 0.00 178.83 178.07 2kmd h ALA 48 N 1.02 1.22 -0.88 3.87 0.00 -1.69 -2.87 119.26 119.93 2kmd h ALA 48 Ca 0.16 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2kmd h ALA 48 Cb 0.40 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 2kmd h ALA 48 CO -0.40 0.51 0.58 -0.07 0.00 0.00 0.00 179.25 179.87 2kmd h LEU 49 N 0.56 0.97 -0.65 0.00 3.38 -1.42 0.47 115.31 118.63 2kmd h LEU 49 Ca 0.11 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 2kmd h LEU 49 Cb 0.45 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2kmd h LEU 49 CO 0.02 0.69 -0.35 0.11 0.09 0.00 0.00 178.44 179.00 2kmd h LYS 50 N 1.14 0.67 0.02 1.13 1.57 -1.18 -3.04 116.57 116.89 2kmd h LYS 50 Ca 0.34 -0.32 -0.27 0.00 -1.87 0.00 0.00 60.65 58.53 2kmd h LYS 50 Cb -0.05 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.22 2kmd h LYS 50 CO -0.09 0.92 -1.47 0.00 -0.57 0.00 0.00 179.45 178.24 2kmd h ALA 51 N 1.05 0.56 0.00 3.86 0.00 -1.37 -3.35 119.26 120.01 2kmd h ALA 51 Ca 0.06 -1.24 -0.08 0.00 0.00 0.00 0.00 54.91 53.65 2kmd h ALA 51 Cb 0.86 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2kmd h ALA 51 CO 0.07 1.41 -0.36 0.00 0.00 0.00 0.00 179.25 180.38 2kmd h THR 52 N 0.01 1.20 -2.11 0.00 1.03 -0.11 -3.18 112.91 109.76 2kmd h THR 52 Ca -0.20 -1.25 -0.76 0.00 -0.01 0.00 0.00 66.41 64.19 2kmd h THR 52 Cb 1.94 1.69 -0.29 0.00 -1.07 0.00 0.00 68.15 70.41 2kmd h THR 52 CO 0.11 0.35 0.81 0.49 -0.01 0.00 0.00 175.52 177.27 2kmd n PHE 53 N -4.02 2.99 0.18 0.00 3.72 -1.15 -4.68 117.46 114.51 2kmd n PHE 53 Ca -0.02 -2.61 0.06 0.00 -0.05 0.00 0.00 57.45 54.84 2kmd n PHE 53 Cb 0.40 -1.07 0.24 0.00 -0.94 0.00 0.00 39.48 38.11 2kmd n PHE 53 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2kmd h SER 54 N 3.54 0.00 1.64 4.37 0.87 -1.75 -3.06 113.55 119.15 2kmd h SER 54 Ca 0.51 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.07 2kmd h SER 54 Cb 0.25 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 2kmd h SER 54 CO 1.24 0.35 0.00 1.23 -0.53 0.00 0.00 176.83 179.11 2kmd h GLY 55 N 2.79 0.00 0.09 5.77 0.00 -1.90 -3.11 103.07 106.70 2kmd h GLY 55 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 2kmd h GLY 55 CO 0.05 0.00 -0.24 -2.75 0.00 0.00 0.00 176.54 173.59 2kmd h PHE 56 N 0.00 0.07 -0.67 5.60 3.57 -1.92 -3.28 116.94 120.32 2kmd h PHE 56 Ca 0.00 -0.05 0.12 0.00 3.53 0.00 0.00 57.97 61.56 2kmd h PHE 56 Cb 0.82 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.51 2kmd h PHE 56 CO 0.00 1.09 0.45 1.15 -2.23 0.00 0.00 178.31 178.77 2kmd h THR 57 N -0.91 0.86 -0.14 4.41 2.02 -1.62 0.17 112.91 117.70 2kmd h THR 57 Ca -0.06 -0.15 -0.04 0.00 0.77 0.00 0.00 66.41 66.93 2kmd h THR 57 Cb 1.12 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 2kmd h THR 57 CO -0.00 0.08 -0.12 0.11 0.37 0.00 0.00 175.52 175.96 2kmd h LYS 58 N 0.43 0.21 0.20 6.66 1.57 -1.64 -1.62 116.57 122.38 2kmd h LYS 58 Ca 0.32 -0.04 -0.29 0.00 -1.87 0.00 0.00 60.65 58.77 2kmd h LYS 58 Cb 0.66 -0.03 0.03 0.00 0.08 0.00 0.00 32.23 32.97 2kmd h LYS 58 CO -0.09 0.34 -1.30 1.49 -0.57 0.00 0.00 179.45 179.31 2kmd h GLU 59 N 0.20 0.43 -0.01 3.15 4.22 -0.84 -3.27 114.58 118.47 2kmd h GLU 59 Ca 0.04 -0.73 0.00 0.00 0.08 0.00 0.00 59.36 58.75 2kmd h GLU 59 Cb 0.34 0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2kmd h GLU 59 CO 0.02 1.35 0.01 1.96 -2.18 0.00 0.00 179.01 180.16 2kmd h GLN 60 N -0.06 0.00 0.00 1.92 4.20 -0.67 -1.00 115.11 119.50 2kmd h GLN 60 Ca -0.24 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.47 2kmd h GLN 60 Cb 1.97 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.75 2kmd h GLN 60 CO 0.21 0.00 -0.21 0.00 -0.67 0.00 0.00 178.83 178.16 2kmd n GLN 61 N -4.48 0.20 0.06 1.46 10.64 -0.63 -0.16 117.38 124.48 2kmd n GLN 61 Ca -0.03 0.13 -0.19 0.00 -1.83 0.00 0.00 57.00 55.08 2kmd n GLN 61 Cb 0.10 -1.70 -0.14 0.00 -0.86 0.00 0.00 30.24 27.63 2kmd n GLN 61 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2kmd h ARG 62 N 0.00 0.30 0.00 2.61 3.08 -1.23 -3.39 114.38 115.75 2kmd h ARG 62 Ca 0.00 -0.52 -0.20 0.00 0.07 0.00 0.00 59.98 59.33 2kmd h ARG 62 Cb 0.68 0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.88 2kmd h ARG 62 CO 0.00 1.18 -1.95 1.28 -1.07 0.00 0.00 179.97 179.41 2kmd n LEU 63 N -3.50 0.00 0.00 3.04 4.32 -1.06 -5.02 117.00 114.78 2kmd n LEU 63 Ca -0.20 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.79 2kmd n LEU 63 Cb 1.06 0.27 0.00 0.00 -1.62 0.00 0.00 43.42 43.13 2kmd n LEU 63 CO 0.50 0.27 0.00 0.61 -1.22 0.00 0.00 177.39 177.56 2kmd n GLY 64 N 1.95 0.88 3.68 -0.72 0.00 0.78 -5.06 105.19 106.69 2kmd n GLY 64 Ca -0.19 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.53 0.32 -1.51 -0.61 5.41 -0.87 -4.97 119.36 115.60 2kmd n ILE 65 Ca 0.00 -0.06 -0.29 0.00 1.00 0.00 0.00 62.75 63.40 2kmd n ILE 65 Cb 0.00 -1.88 0.14 0.00 -0.71 0.00 0.00 39.64 37.19 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 2.57 1.01 0.11 0.38 0.04 -1.26 -4.69 135.00 133.16 2kmd s PRO 66 Ca 0.84 0.27 -0.07 0.00 0.04 0.00 0.00 61.00 62.08 2kmd s PRO 66 Cb -0.60 -1.83 -0.13 0.00 0.04 0.00 0.00 34.50 31.99 2kmd s PRO 66 CO 0.41 -2.28 1.28 0.87 0.04 0.00 0.00 177.00 177.32 2kmd h LYS 67 N -1.56 0.49 -6.33 4.56 1.57 -1.96 -3.44 116.57 109.90 2kmd h LYS 67 Ca -0.50 -0.53 -0.55 0.00 -1.87 0.00 0.00 60.65 57.20 2kmd h LYS 67 Cb 1.33 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.77 2kmd h LYS 67 CO 0.60 1.17 0.74 0.34 -0.57 0.00 0.00 179.45 181.72 2kmd s ASP 68 N -7.14 7.00 0.19 0.86 -1.08 -1.26 -4.64 116.67 110.59 2kmd s ASP 68 Ca -0.07 1.89 0.03 0.00 -0.52 0.00 0.00 52.55 53.88 2kmd s ASP 68 Cb 0.08 -2.56 0.08 0.00 -1.46 0.00 0.00 42.92 39.07 2kmd s ASP 68 CO 0.88 -0.62 1.44 1.55 0.52 0.00 0.00 175.17 178.94 2kmd h PRO 69 N 7.55 0.23 0.00 4.34 0.13 -1.86 -3.16 132.00 139.24 2kmd h PRO 69 Ca -0.35 -0.21 -0.02 0.00 -0.87 0.00 0.00 66.00 64.55 2kmd h PRO 69 Cb 1.17 0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2kmd h PRO 69 CO 0.89 0.89 -0.12 0.00 -0.23 0.00 0.00 178.00 179.43 2kmd h ARG 70 N 0.14 0.00 -1.21 0.86 -0.00 -1.85 -2.28 114.38 110.05 2kmd h ARG 70 Ca -0.03 0.00 -0.57 0.00 -0.50 0.00 0.00 59.98 58.88 2kmd h ARG 70 Cb 1.36 0.00 -0.24 0.00 0.00 0.00 0.00 29.97 31.09 2kmd h ARG 70 CO 0.12 0.12 0.73 1.04 0.00 0.00 0.00 179.97 181.98 2kmd n GLN 71 N -4.26 2.41 -4.00 0.04 6.02 -1.19 -2.76 117.38 113.64 2kmd n GLN 71 Ca -0.03 -2.74 -0.24 0.00 -0.01 0.00 0.00 57.00 53.99 2kmd n GLN 71 Cb 0.19 -2.08 -0.06 0.00 1.02 0.00 0.00 30.24 29.32 2kmd n GLN 71 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2kmd s TRP 72 N -3.17 2.64 0.38 1.08 0.52 -0.86 -4.83 118.94 114.70 2kmd s TRP 72 Ca 0.54 -0.55 0.03 0.00 0.02 0.00 0.00 56.10 56.14 2kmd s TRP 72 Cb 0.42 -1.98 -0.01 0.00 -1.15 0.00 0.00 33.47 30.75 2kmd s TRP 72 CO -0.02 0.13 0.10 0.25 0.02 0.00 0.00 176.95 177.43 2kmd n THR 73 N -1.30 0.00 -0.34 2.01 -2.24 -1.26 -1.87 114.28 109.28 2kmd n THR 73 Ca -0.00 -2.10 0.11 0.00 -2.27 0.00 0.00 64.05 59.79 2kmd n THR 73 Cb 0.64 0.69 0.31 0.00 -2.10 0.00 0.00 70.33 69.87 2kmd n THR 73 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2kmd h GLU 74 N 0.00 0.79 -0.04 -0.78 5.08 -1.88 0.30 114.58 118.06 2kmd h GLU 74 Ca -0.30 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.01 2kmd h GLU 74 Cb 1.08 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 2kmd h GLU 74 CO 0.48 0.52 -0.00 1.15 -1.00 0.00 0.00 179.01 180.15 2kmd h THR 75 N 0.81 1.27 -0.67 1.13 2.02 -1.95 -1.47 112.91 114.05 2kmd h THR 75 Ca 0.53 -0.83 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 2kmd h THR 75 Cb 0.76 1.76 -0.03 0.00 -1.74 0.00 0.00 68.15 68.89 2kmd h THR 75 CO -0.31 0.22 0.38 0.45 0.37 0.00 0.00 175.52 176.63 2kmd h HIS 76 N -0.26 0.92 0.26 3.16 3.86 -1.76 0.40 115.15 121.73 2kmd h HIS 76 Ca 0.01 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 2kmd h HIS 76 Cb 0.36 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.54 2kmd h HIS 76 CO 0.04 0.65 -0.12 0.28 0.86 0.00 0.00 177.93 179.64 2kmd h VAL 77 N 0.92 0.76 -0.19 2.45 2.07 -0.96 -0.63 116.25 120.67 2kmd h VAL 77 Ca 0.24 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.65 2kmd h VAL 77 Cb 0.03 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2kmd h VAL 77 CO -0.04 0.02 -0.03 -0.09 0.02 0.00 0.00 177.57 177.45 2kmd h ARG 78 N -0.38 0.35 -0.94 1.57 2.43 -1.13 -1.72 114.38 114.55 2kmd h ARG 78 Ca -0.04 -0.12 0.02 0.00 -0.81 0.00 0.00 59.98 59.03 2kmd h ARG 78 Cb 0.29 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.77 2kmd h ARG 78 CO 0.06 0.59 0.62 0.22 -1.51 0.00 0.00 179.97 179.94 2kmd h ASP 79 N 0.08 1.06 0.62 -3.80 3.58 -0.21 0.11 116.42 117.86 2kmd h ASP 79 Ca 0.05 -0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.45 2kmd h ASP 79 Cb 0.45 -0.26 0.01 0.00 1.72 0.00 0.00 39.33 41.24 2kmd h ASP 79 CO 0.01 0.76 -0.30 -0.25 -2.88 0.00 0.00 179.24 176.59 2kmd h TRP 80 N 1.25 -0.77 -0.94 0.28 7.01 -1.04 -0.98 115.95 120.76 2kmd h TRP 80 Ca 0.35 -0.02 0.19 0.00 2.11 0.00 0.00 58.89 61.53 2kmd h TRP 80 Cb -0.11 0.25 -0.18 0.00 -2.10 0.00 0.00 29.16 27.02 2kmd h TRP 80 CO -0.01 -0.48 -0.21 0.28 -2.79 0.00 0.00 178.44 175.23 2kmd h VAL 81 N -0.95 0.06 -0.16 2.65 2.07 -1.20 0.22 116.25 118.94 2kmd h VAL 81 Ca -0.08 -0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.47 2kmd h VAL 81 Cb 0.64 0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 2kmd h VAL 81 CO 0.14 0.00 -0.09 -0.03 0.02 0.00 0.00 177.57 177.61 2kmd h MET 82 N 0.00 -0.08 -1.00 1.57 1.85 -0.89 0.12 114.93 116.51 2kmd h MET 82 Ca 0.46 0.01 0.11 0.00 -0.61 0.00 0.00 59.70 59.67 2kmd h MET 82 Cb 0.73 0.02 -0.08 0.00 0.43 0.00 0.00 31.60 32.70 2kmd h MET 82 CO -0.96 -0.05 0.64 2.35 -0.40 0.00 0.00 176.91 178.48 2kmd h TRP 83 N -0.08 1.15 -0.05 1.39 7.01 0.77 -1.40 115.95 124.75 2kmd h TRP 83 Ca 0.09 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.10 2kmd h TRP 83 Cb 0.21 -0.37 -0.00 0.00 -2.10 0.00 0.00 29.16 26.90 2kmd h TRP 83 CO -0.23 0.49 -0.08 0.00 -2.79 0.00 0.00 178.44 175.83 2kmd h ALA 84 N 1.52 0.08 -0.73 2.65 0.00 -0.43 -1.84 119.26 120.51 2kmd h ALA 84 Ca 0.48 -0.31 0.21 0.00 0.00 0.00 0.00 54.91 55.29 2kmd h ALA 84 Cb 0.42 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2kmd h ALA 84 CO -0.24 -0.09 0.52 0.28 0.00 0.00 0.00 179.25 179.72 2kmd h VAL 85 N -0.35 0.65 0.07 0.00 2.07 -0.28 0.30 116.25 118.71 2kmd h VAL 85 Ca 0.00 -0.01 -0.15 0.00 0.82 0.00 0.00 66.70 67.37 2kmd h VAL 85 Cb 0.63 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 2kmd h VAL 85 CO 0.02 0.01 -0.71 0.78 0.02 0.00 0.00 177.57 177.69 2kmd h ASN 86 N 0.04 0.23 0.12 0.57 2.35 -1.17 0.11 115.58 117.83 2kmd h ASN 86 Ca 0.35 -0.90 -0.07 0.00 -0.55 0.00 0.00 56.30 55.13 2kmd h ASN 86 Cb 1.34 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.62 2kmd h ASN 86 CO -0.02 1.31 -0.25 -0.33 -1.65 0.00 0.00 177.43 176.49 2kmd h GLU 87 N -0.65 0.24 -0.15 0.81 4.39 -0.65 -2.90 114.58 115.67 2kmd h GLU 87 Ca -0.15 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.47 2kmd h GLU 87 Cb 1.40 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.03 2kmd h GLU 87 CO 0.04 0.48 0.00 1.19 -1.16 0.00 0.00 179.01 179.56 2kmd n PHE 88 N -4.16 0.18 -3.89 4.33 3.01 0.10 -5.01 117.46 112.02 2kmd n PHE 88 Ca -0.01 -0.13 -0.39 0.00 1.01 0.00 0.00 57.45 57.93 2kmd n PHE 88 Cb 0.36 -0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.86 2kmd n PHE 88 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2kmd n SER 89 N 1.02 -4.58 -4.87 4.37 7.64 -0.06 -4.94 113.62 112.20 2kmd n SER 89 Ca 0.12 -1.17 -0.31 0.00 1.01 0.00 0.00 58.87 58.53 2kmd n SER 89 Cb 0.46 -2.49 -0.04 0.00 -1.01 0.00 0.00 64.21 61.13 2kmd n SER 89 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2kmd s LEU 90 N -7.00 3.94 0.10 -3.43 1.43 0.19 -5.01 118.68 108.90 2kmd s LEU 90 Ca 0.47 1.12 0.04 0.00 -1.03 0.00 0.00 54.13 54.73 2kmd s LEU 90 Cb -0.22 -3.97 -0.04 0.00 0.03 0.00 0.00 46.19 42.00 2kmd s LEU 90 CO 0.92 -0.30 -0.10 -1.59 0.23 0.00 0.00 176.35 175.51 2kmd s LYS 91 N -3.51 0.85 0.00 1.70 0.00 -1.26 -4.80 119.74 112.72 2kmd s LYS 91 Ca 0.51 -1.17 0.00 0.00 0.00 0.00 0.00 55.97 55.32 2kmd s LYS 91 Cb -0.10 -0.52 0.00 0.00 0.00 0.00 0.00 37.83 37.21 2kmd s LYS 91 CO 0.27 0.08 0.00 0.41 0.00 0.00 0.00 175.35 176.10 2kmd n GLY 92 N 0.53 2.37 3.72 0.59 0.00 -1.26 -4.81 105.19 106.34 2kmd n GLY 92 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.21 3.98 -0.16 1.61 0.11 -1.26 -4.44 120.40 117.03 2kmd s VAL 93 Ca 0.00 1.51 -0.06 0.00 -2.93 0.00 0.00 61.98 60.50 2kmd s VAL 93 Cb 0.00 -3.97 -0.04 0.00 -1.53 0.00 0.00 36.38 30.85 2kmd s VAL 93 CO 0.00 0.17 0.04 -1.81 -3.33 0.00 0.00 175.10 170.17 2kmd s ASP 94 N 0.65 5.46 0.13 3.54 1.01 -1.26 -4.99 116.67 121.21 2kmd s ASP 94 Ca 0.55 0.08 0.16 0.00 0.71 0.00 0.00 52.55 54.05 2kmd s ASP 94 Cb -0.29 -1.86 -0.08 0.00 1.01 0.00 0.00 42.92 41.70 2kmd s ASP 94 CO 0.31 0.22 1.01 -0.26 0.21 0.00 0.00 175.17 176.67 2kmd h PHE 95 N 6.33 0.00 -0.36 4.23 0.04 -1.95 -3.29 116.94 121.93 2kmd h PHE 95 Ca -0.39 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.36 2kmd h PHE 95 Cb 1.18 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.31 2kmd h PHE 95 CO 0.58 0.55 0.12 0.37 -0.60 0.00 0.00 178.31 179.33 2kmd h GLN 96 N 0.00 0.51 -0.29 1.51 5.75 -1.98 -1.65 115.11 118.96 2kmd h GLN 96 Ca -0.11 -0.07 -0.09 0.00 -0.15 0.00 0.00 58.65 58.24 2kmd h GLN 96 Cb 1.52 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 29.96 2kmd h GLN 96 CO 0.05 0.44 -0.18 0.87 -2.65 0.00 0.00 178.83 177.36 2kmd h LYS 97 N 0.51 0.53 -1.03 1.69 1.79 -1.88 -2.88 116.57 115.29 2kmd h LYS 97 Ca 0.12 -0.18 -0.51 0.00 -2.18 0.00 0.00 60.65 57.91 2kmd h LYS 97 Cb 0.13 -0.04 -0.27 0.00 -1.58 0.00 0.00 32.23 30.47 2kmd h LYS 97 CO -0.01 0.69 0.65 1.19 -1.08 0.00 0.00 179.45 180.89 2kmd n PHE 98 N -4.16 2.81 -1.88 -1.35 3.72 -0.65 -4.77 117.46 111.18 2kmd n PHE 98 Ca 0.00 -2.04 -0.41 0.00 -0.05 0.00 0.00 57.45 54.95 2kmd n PHE 98 Cb 0.37 -1.02 -0.01 0.00 -0.94 0.00 0.00 39.48 37.88 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 1.00 1.75 0.72 0.00 0.23 -1.26 -5.01 119.30 116.73 2kmd s MET 100 Ca 0.52 -1.02 -0.11 0.00 -1.03 0.00 0.00 55.69 54.05 2kmd s MET 100 Cb 0.15 0.59 0.02 0.00 -1.53 0.00 0.00 34.83 34.06 2kmd s MET 100 CO -0.06 -0.79 1.07 -1.12 -2.03 0.00 0.00 175.02 172.09 2kmd s SER 101 N -2.93 5.16 0.30 -1.18 0.01 -1.26 -3.37 113.70 110.44 2kmd s SER 101 Ca 0.12 1.50 -0.00 0.00 1.31 0.00 0.00 55.95 58.88 2kmd s SER 101 Cb -0.05 -2.34 0.50 0.00 0.21 0.00 0.00 66.02 64.34 2kmd s SER 101 CO 0.07 -1.57 1.94 1.23 0.41 0.00 0.00 173.24 175.32 2kmd h GLY 102 N -0.81 1.24 0.62 3.44 0.00 -1.52 -1.54 103.07 104.52 2kmd h GLY 102 Ca -0.45 -0.42 0.10 0.00 0.00 0.00 0.00 47.33 46.57 2kmd h GLY 102 CO 0.58 0.35 0.61 0.00 0.00 0.00 0.00 176.54 178.08 2kmd h ALA 103 N 1.50 1.57 -0.08 3.60 0.00 -1.58 0.48 119.26 124.75 2kmd h ALA 103 Ca 0.35 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.15 2kmd h ALA 103 Cb 0.07 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.64 2kmd h ALA 103 CO -0.11 0.23 -0.39 0.00 0.00 0.00 0.00 179.25 178.97 2kmd h ALA 104 N 1.54 0.15 -0.45 0.00 0.00 -1.67 -2.40 119.26 116.43 2kmd h ALA 104 Ca 0.45 -0.47 0.06 0.00 0.00 0.00 0.00 54.91 54.94 2kmd h ALA 104 Cb 0.41 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 2kmd h ALA 104 CO -0.21 0.26 0.17 1.25 0.00 0.00 0.00 179.25 180.72 2kmd h LEU 105 N -0.06 0.18 -0.68 0.00 5.85 -0.62 -0.08 115.31 119.90 2kmd h LEU 105 Ca -0.03 0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.64 2kmd h LEU 105 Cb 1.05 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 2kmd h LEU 105 CO 0.08 0.14 -0.09 0.00 -0.34 0.00 0.00 178.44 178.23 2kmd h ALA 107 N 1.05 1.50 -0.19 0.00 0.00 -0.85 -2.66 119.26 118.11 2kmd h ALA 107 Ca 0.14 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2kmd h ALA 107 Cb 0.62 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2kmd h ALA 107 CO 0.04 0.27 -0.19 -0.07 0.00 0.00 0.00 179.25 179.30 2kmd h LEU 108 N 0.00 0.32 0.00 0.00 3.38 -0.72 -3.49 115.31 114.79 2kmd h LEU 108 Ca -0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2kmd h LEU 108 Cb 0.41 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2kmd h LEU 108 CO 0.03 0.52 0.00 0.61 0.09 0.00 0.00 178.44 179.69 2kmd n GLY 109 N -0.65 -1.54 0.28 0.83 0.00 -1.00 -3.47 105.19 99.64 2kmd n GLY 109 Ca -0.00 -1.53 -0.07 0.00 0.00 0.00 0.00 46.02 44.42 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 0.96 0.24 1.61 3.64 -1.91 -1.10 116.57 120.01 2kmd h LYS 110 Ca 0.00 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2kmd h LYS 110 Cb 0.00 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 2kmd h LYS 110 CO 0.00 0.78 -0.35 1.49 -2.27 0.00 0.00 179.45 179.10 2kmd h GLU 111 N 0.92 -0.59 -0.77 1.90 4.57 -1.99 0.40 114.58 119.02 2kmd h GLU 111 Ca 0.22 0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.44 2kmd h GLU 111 Cb 0.15 0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.84 2kmd h GLU 111 CO -0.02 -0.40 0.46 0.00 -1.18 0.00 0.00 179.01 177.87 2kmd h PHE 113 N 1.06 0.58 0.00 0.00 3.57 -0.92 -2.17 116.94 119.07 2kmd h PHE 113 Ca 0.27 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.70 2kmd h PHE 113 Cb -0.03 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 38.53 2kmd h PHE 113 CO 0.00 0.53 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.39 2kmd h LEU 114 N 0.47 0.00 -0.68 0.59 3.38 0.16 -0.98 115.31 118.26 2kmd h LEU 114 Ca 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2kmd h LEU 114 Cb 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2kmd h LEU 114 CO -0.01 0.15 -0.14 -0.33 0.09 0.00 0.00 178.44 178.20 2kmd h GLU 115 N 0.00 0.00 0.09 1.13 5.08 -0.75 -3.25 114.58 116.88 2kmd h GLU 115 Ca -0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.04 2kmd h GLU 115 Cb 0.37 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 2kmd h GLU 115 CO 0.02 0.14 -1.68 -0.07 -1.00 0.00 0.00 179.01 176.42 2kmd h LEU 116 N 0.00 0.29 -9.16 1.33 3.38 -0.70 -3.47 115.31 106.98 2kmd h LEU 116 Ca -0.00 -0.49 -0.66 0.00 0.09 0.00 0.00 57.88 56.81 2kmd h LEU 116 Cb 0.87 -0.09 -0.17 0.00 0.09 0.00 0.00 40.66 41.35 2kmd h LEU 116 CO 0.02 1.43 -0.78 0.00 0.09 0.00 0.00 178.44 179.20 2kmd s ALA 117 N -2.60 2.75 1.00 1.53 0.00 -0.75 -4.38 121.76 119.32 2kmd s ALA 117 Ca -0.11 -1.39 -0.19 0.00 0.00 0.00 0.00 51.96 50.27 2kmd s ALA 117 Cb 0.07 -0.67 -0.11 0.00 0.00 0.00 0.00 23.12 22.41 2kmd s ALA 117 CO 0.82 0.56 -0.73 -2.30 0.00 0.00 0.00 175.76 174.11 2kmd n PRO 118 N 0.59 -0.18 0.33 0.00 -0.02 -1.26 -4.41 135.00 130.03 2kmd n PRO 118 Ca -0.14 -0.05 0.21 0.00 -2.02 0.00 0.00 63.50 61.50 2kmd n PRO 118 Cb 0.53 -1.20 1.13 0.00 -0.02 0.00 0.00 33.50 33.94 2kmd n PRO 118 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2kmd h ASP 119 N -1.18 0.00 0.00 2.55 2.03 -1.97 -1.53 116.42 116.32 2kmd h ASP 119 Ca -0.44 0.00 -0.21 0.00 -0.73 0.00 0.00 57.03 55.66 2kmd h ASP 119 Cb 1.33 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.80 2kmd h ASP 119 CO 0.26 0.00 -1.58 0.49 -1.03 0.00 0.00 179.24 177.38 2kmd n PHE 120 N -3.27 0.00 -0.18 4.15 3.72 -1.26 -4.51 117.46 116.12 2kmd n PHE 120 Ca -0.03 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.37 2kmd n PHE 120 Cb 0.09 -0.52 0.23 0.00 -0.94 0.00 0.00 39.48 38.33 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 -0.61 1.20 -0.73 -4.37 -1.51 -1.87 -2.41 116.25 105.95 2kmd h VAL 121 Ca -0.31 -0.50 0.07 0.00 -1.23 0.00 0.00 66.70 64.73 2kmd h VAL 121 Cb 1.16 0.29 -0.05 0.00 -2.13 0.00 0.00 31.29 30.57 2kmd h VAL 121 CO -0.19 0.22 0.48 1.23 -1.23 0.00 0.00 177.57 178.08 2kmd h GLY 122 N 0.99 0.95 0.87 5.19 0.00 -1.48 -2.24 103.07 107.35 2kmd h GLY 122 Ca 0.24 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.27 2kmd h GLY 122 CO -0.04 0.21 -0.00 -1.80 0.00 0.00 0.00 176.54 174.91 2kmd h ASP 123 N 0.73 -0.00 0.33 0.19 3.58 -1.64 -1.87 116.42 117.74 2kmd h ASP 123 Ca 0.32 -0.13 -0.00 0.00 0.42 0.00 0.00 57.03 57.63 2kmd h ASP 123 Cb 0.30 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.33 2kmd h ASP 123 CO -0.11 0.13 -0.30 0.40 -2.88 0.00 0.00 179.24 176.48 2kmd h ILE 124 N -0.13 0.36 0.09 2.25 2.04 -1.45 0.24 117.51 120.92 2kmd h ILE 124 Ca -0.00 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.88 2kmd h ILE 124 Cb 0.13 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 2kmd h ILE 124 CO 0.00 0.00 -0.36 -0.07 0.00 0.00 0.00 178.15 177.72 2kmd h LEU 125 N -0.65 -1.07 -1.81 1.44 3.38 -1.43 -1.31 115.31 113.86 2kmd h LEU 125 Ca -0.02 0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2kmd h LEU 125 Cb 0.59 0.41 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 2kmd h LEU 125 CO -0.05 -0.44 -0.14 -0.25 0.09 0.00 0.00 178.44 177.65 2kmd h TRP 126 N -0.58 0.00 0.45 1.13 7.01 -1.27 0.41 115.95 123.10 2kmd h TRP 126 Ca 0.03 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.01 2kmd h TRP 126 Cb 0.62 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.69 2kmd h TRP 126 CO -0.33 0.14 -0.22 1.49 -2.79 0.00 0.00 178.44 176.73 2kmd h GLU 127 N 0.00 -0.59 -0.11 2.65 4.57 0.59 0.24 114.58 121.93 2kmd h GLU 127 Ca -0.00 0.04 -0.19 0.00 -1.18 0.00 0.00 59.36 58.03 2kmd h GLU 127 Cb 0.29 0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.01 2kmd h GLU 127 CO 0.02 -0.37 -0.70 1.25 -1.18 0.00 0.00 179.01 178.02 2kmd h HIS 128 N -0.64 0.66 -0.68 0.92 2.76 -1.11 -2.78 115.15 114.28 2kmd h HIS 128 Ca -0.06 -0.28 0.02 0.00 -2.20 0.00 0.00 60.37 57.85 2kmd h HIS 128 Cb 0.48 -0.11 -0.04 0.00 1.55 0.00 0.00 27.41 29.30 2kmd h HIS 128 CO -0.04 1.04 0.43 1.25 -1.30 0.00 0.00 177.93 179.32 2kmd h LEU 129 N 0.35 0.72 -0.98 0.26 5.85 -0.06 -1.09 115.31 120.36 2kmd h LEU 129 Ca -0.03 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.59 2kmd h LEU 129 Cb 1.28 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 2kmd h LEU 129 CO 0.13 0.51 -0.36 -0.08 -0.34 0.00 0.00 178.44 178.30 2kmd h GLU 130 N 0.86 0.29 -0.53 1.25 4.57 -0.51 -2.74 114.58 117.77 2kmd h GLU 130 Ca 0.27 -0.12 -0.07 0.00 -1.18 0.00 0.00 59.36 58.25 2kmd h GLU 130 Cb -0.02 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.54 2kmd h GLU 130 CO -0.09 0.61 0.04 0.82 -1.18 0.00 0.00 179.01 179.21 2kmd h ILE 131 N 0.25 1.25 0.34 2.32 2.04 -1.04 -2.14 117.51 120.52 2kmd h ILE 131 Ca 0.03 -0.99 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 2kmd h ILE 131 Cb 0.75 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 2kmd h ILE 131 CO 0.06 0.36 -0.16 -0.07 0.00 0.00 0.00 178.15 178.33 2kmd h LEU 132 N 0.82 -0.38 -1.15 1.44 3.38 -0.93 0.09 115.31 118.58 2kmd h LEU 132 Ca 0.16 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.10 2kmd h LEU 132 Cb 0.43 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2kmd h LEU 132 CO 0.02 -0.21 0.56 0.06 0.09 0.00 0.00 178.44 178.95 2kmd h GLN 133 N -0.53 1.13 0.00 1.13 3.07 -1.49 -1.96 115.11 116.46 2kmd h GLN 133 Ca -0.05 -0.07 -0.10 0.00 0.09 0.00 0.00 58.65 58.52 2kmd h GLN 133 Cb 0.40 -0.25 -0.01 0.00 0.08 0.00 0.00 27.48 27.69 2kmd h GLN 133 CO 0.08 0.75 -0.49 0.87 0.09 0.00 0.00 178.83 180.13 2kmd h LYS 134 N 1.16 0.00 -0.75 0.06 1.79 -1.26 -3.03 116.57 114.53 2kmd h LYS 134 Ca 0.31 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 58.59 2kmd h LYS 134 Cb -0.12 0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 30.41 2kmd h LYS 134 CO -0.07 0.49 0.24 -1.91 -1.08 0.00 0.00 179.45 177.13 2kmd n GLU 135 N -3.62 3.79 -3.63 3.15 2.13 0.01 -2.09 120.64 120.37 2kmd n GLU 135 Ca -0.00 -2.98 -0.13 0.00 0.66 0.00 0.00 57.16 54.70 2kmd n GLU 135 Cb 0.57 -2.20 -0.06 0.00 0.27 0.00 0.00 31.44 30.02 2kmd n GLU 135 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2kmd s ASP 136 N -0.92 -0.33 0.38 4.31 1.01 -0.90 -4.91 116.67 115.30 2kmd s ASP 136 Ca 0.53 0.05 0.08 0.00 0.71 0.00 0.00 52.55 53.92 2kmd s ASP 136 Cb 0.42 0.45 -0.05 0.00 1.01 0.00 0.00 42.92 44.76 2kmd s ASP 136 CO 0.13 -0.69 0.16 0.68 0.21 0.00 0.00 175.17 175.67 2kmd s VAL 137 N -2.49 2.64 0.00 -1.27 -7.23 -1.21 -4.43 120.40 106.41 2kmd s VAL 137 Ca -0.05 -1.71 0.00 0.00 -1.81 0.00 0.00 61.98 58.41 2kmd s VAL 137 Cb -0.01 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 33.97 2kmd s VAL 137 CO -0.02 -0.09 0.00 1.17 -0.31 0.00 0.00 175.10 175.84