#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 -2.75 -0.41 2.00 -1.26 -4.84 117.12 109.85 2kmd n MET 29 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 57.70 57.39 2kmd n MET 29 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.18 2kmd n MET 29 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 2kmd s GLU 30 N 0.00 3.89 -0.64 0.03 2.02 -1.26 -4.96 118.70 117.78 2kmd s GLU 30 Ca 0.00 0.68 -0.26 0.00 0.02 0.00 0.00 54.97 55.41 2kmd s GLU 30 Cb 0.00 -2.31 -0.05 0.00 0.10 0.00 0.00 34.13 31.87 2kmd s GLU 30 CO 0.00 -0.08 2.12 0.00 0.02 0.00 0.00 175.26 177.32 2kmd n ALA 32 N 14.68 0.00 -2.70 0.00 0.00 -1.26 -5.01 120.51 126.22 2kmd n ALA 32 Ca 0.32 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.70 2kmd n ALA 32 Cb 0.51 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.07 2kmd n ALA 32 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2kmd n ASP 33 N -2.67 -1.07 -4.63 0.00 5.68 -1.26 -4.93 116.55 107.68 2kmd n ASP 33 Ca 0.00 -2.40 -0.43 0.00 -0.50 0.00 0.00 54.79 51.46 2kmd n ASP 33 Cb 0.00 0.61 -0.03 0.00 -1.14 0.00 0.00 41.12 40.56 2kmd n ASP 33 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2kmd s VAL 34 N -0.58 3.55 0.34 2.12 1.01 -1.26 -1.98 120.40 123.60 2kmd s VAL 34 Ca 0.20 0.61 -0.13 0.00 0.00 0.00 0.00 61.98 62.66 2kmd s VAL 34 Cb 0.42 -3.57 -0.08 0.00 0.00 0.00 0.00 36.38 33.14 2kmd s VAL 34 CO -0.08 -0.25 0.72 -2.16 0.00 0.00 0.00 175.10 173.33 2kmd s PRO 35 N 4.92 3.90 0.54 2.72 0.04 -1.26 -4.81 135.00 141.04 2kmd s PRO 35 Ca 0.77 0.54 -0.19 0.00 0.04 0.00 0.00 61.00 62.16 2kmd s PRO 35 Cb -0.27 -2.45 -0.06 0.00 0.04 0.00 0.00 34.50 31.76 2kmd s PRO 35 CO 0.31 0.11 1.08 -0.48 0.04 0.00 0.00 177.00 178.07 2kmd s LEU 36 N -3.27 3.71 -0.51 -3.56 0.05 -1.26 -5.02 118.68 108.83 2kmd s LEU 36 Ca 0.52 2.01 -0.20 0.00 0.05 0.00 0.00 54.13 56.51 2kmd s LEU 36 Cb -0.10 -4.56 0.05 0.00 -2.05 0.00 0.00 46.19 39.52 2kmd s LEU 36 CO 0.23 -1.08 0.70 -0.22 -0.55 0.00 0.00 176.35 175.42 2kmd s LEU 37 N -3.89 4.70 -0.73 1.48 1.98 -1.26 -4.69 118.68 116.26 2kmd s LEU 37 Ca 0.69 -0.70 -0.20 0.00 -2.89 0.00 0.00 54.13 51.03 2kmd s LEU 37 Cb -0.19 -2.57 0.11 0.00 0.66 0.00 0.00 46.19 44.19 2kmd s LEU 37 CO 0.27 -0.95 0.92 -2.84 -1.89 0.00 0.00 176.35 171.86 2kmd s PRO 39 N 2.94 3.27 0.00 0.98 0.02 -1.26 -5.18 135.00 135.78 2kmd s PRO 39 Ca 0.20 -1.39 0.00 0.00 0.02 0.00 0.00 61.00 59.82 2kmd s PRO 39 Cb -0.17 -4.47 0.00 0.00 0.02 0.00 0.00 34.50 29.88 2kmd s PRO 39 CO 0.15 -1.68 0.00 0.43 -0.33 0.00 0.00 177.00 175.57 2kmd n SER 40 N 6.65 0.00 0.00 2.53 7.64 -1.26 -5.00 113.62 124.17 2kmd n SER 40 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.92 2kmd n SER 40 Cb 0.46 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.66 2kmd n SER 40 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2kmd n LYS 42 N 0.00 0.00 0.19 1.43 3.00 -1.26 -2.60 118.16 118.92 2kmd n LYS 42 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 58.31 58.38 2kmd n LYS 42 Cb 0.00 0.00 0.27 0.00 0.00 0.00 0.00 35.03 35.30 2kmd n LYS 42 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 2kmd h GLU 43 N 0.00 0.00 -0.89 1.64 4.57 -1.95 -3.27 114.58 114.69 2kmd h GLU 43 Ca 0.00 0.00 0.07 0.00 -1.18 0.00 0.00 59.36 58.25 2kmd h GLU 43 Cb 0.00 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 28.52 2kmd h GLU 43 CO 0.00 0.32 0.55 0.52 -1.18 0.00 0.00 179.01 179.22 2kmd h MET 44 N 0.00 0.95 -0.45 1.92 2.86 -1.92 -1.53 114.93 116.77 2kmd h MET 44 Ca -0.00 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 2kmd h MET 44 Cb 1.01 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.43 2kmd h MET 44 CO 0.04 0.63 0.13 0.00 1.06 0.00 0.00 176.91 178.77 2kmd h MET 45 N 0.98 0.66 -0.44 1.72 -0.00 -1.90 -2.34 114.93 113.60 2kmd h MET 45 Ca 0.39 -0.11 -0.02 0.00 -0.00 0.00 0.00 59.70 59.97 2kmd h MET 45 Cb 0.22 -0.11 -0.02 0.00 -0.00 0.00 0.00 31.60 31.68 2kmd h MET 45 CO -0.19 0.59 0.21 1.03 -0.00 0.00 0.00 176.91 178.55 2kmd h SER 46 N 0.64 0.55 -0.76 -0.10 0.87 -1.44 -3.08 113.55 110.23 2kmd h SER 46 Ca 0.15 -0.04 0.14 0.00 -1.23 0.00 0.00 61.79 60.80 2kmd h SER 46 Cb 0.21 -0.14 -0.14 0.00 -0.44 0.00 0.00 62.40 61.89 2kmd h SER 46 CO -0.01 0.47 -0.29 -0.61 -0.53 0.00 0.00 176.83 175.86 2kmd h GLN 47 N 0.62 -0.06 -0.76 2.24 5.75 -1.22 0.55 115.11 122.23 2kmd h GLN 47 Ca 0.16 0.00 0.12 0.00 -0.15 0.00 0.00 58.65 58.78 2kmd h GLN 47 Cb 0.07 0.01 -0.09 0.00 1.07 0.00 0.00 27.48 28.55 2kmd h GLN 47 CO -0.02 -0.04 0.35 0.00 -2.65 0.00 0.00 178.83 176.47 2kmd h ALA 48 N 1.41 1.08 0.12 3.38 0.00 -1.69 0.16 119.26 123.71 2kmd h ALA 48 Ca 0.32 0.08 -0.29 0.00 0.00 0.00 0.00 54.91 55.02 2kmd h ALA 48 Cb 0.58 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2kmd h ALA 48 CO -0.81 -0.12 -1.43 -0.07 0.00 0.00 0.00 179.25 176.83 2kmd h LEU 49 N 0.55 0.38 -0.15 0.00 4.07 -1.31 -3.23 115.31 115.62 2kmd h LEU 49 Ca 0.40 -0.48 -0.02 0.00 0.08 0.00 0.00 57.88 57.85 2kmd h LEU 49 Cb 0.53 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 2kmd h LEU 49 CO -0.34 1.39 0.00 0.50 -1.08 0.00 0.00 178.44 178.92 2kmd h LYS 50 N 0.07 0.27 -0.95 1.13 1.63 0.45 -3.11 116.57 116.05 2kmd h LYS 50 Ca -0.20 -0.08 0.01 0.00 -0.85 0.00 0.00 60.65 59.52 2kmd h LYS 50 Cb 2.00 -0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 33.55 2kmd h LYS 50 CO 0.17 0.49 0.63 0.00 -3.45 0.00 0.00 179.45 177.29 2kmd h ALA 51 N 0.77 1.21 -0.57 5.00 0.00 -0.85 -2.71 119.26 122.11 2kmd h ALA 51 Ca 0.04 -0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.00 2kmd h ALA 51 Cb 0.37 -0.39 -0.09 0.00 0.00 0.00 0.00 17.79 17.68 2kmd h ALA 51 CO 0.01 0.60 0.04 1.15 0.00 0.00 0.00 179.25 181.05 2kmd h THR 52 N 1.29 0.57 -0.57 0.00 2.02 -1.56 -1.74 112.91 112.92 2kmd h THR 52 Ca 0.35 -0.05 0.10 0.00 0.77 0.00 0.00 66.41 67.58 2kmd h THR 52 Cb -0.15 0.40 -0.11 0.00 -1.74 0.00 0.00 68.15 66.55 2kmd h THR 52 CO -0.08 0.03 -0.32 -0.26 0.37 0.00 0.00 175.52 175.27 2kmd h PHE 53 N 0.15 -0.86 -0.08 3.16 0.04 -1.45 0.24 116.94 118.15 2kmd h PHE 53 Ca 0.30 0.07 -0.03 0.00 2.80 0.00 0.00 57.97 61.11 2kmd h PHE 53 Cb 0.46 0.46 -0.01 0.00 2.20 0.00 0.00 35.95 39.07 2kmd h PHE 53 CO -0.32 -0.37 -0.09 0.77 -0.60 0.00 0.00 178.31 177.71 2kmd h SER 54 N -0.16 0.10 0.06 2.17 0.02 -1.44 -1.21 113.55 113.10 2kmd h SER 54 Ca 0.23 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2kmd h SER 54 Cb 0.54 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.06 2kmd h SER 54 CO -0.66 0.21 0.00 0.61 -1.14 0.00 0.00 176.83 175.85 2kmd n GLY 55 N -1.14 -0.82 0.13 -3.77 0.00 0.78 -3.35 105.19 97.02 2kmd n GLY 55 Ca -0.02 -0.15 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 2kmd n GLY 55 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2kmd n PHE 56 N -1.04 0.61 -0.21 1.61 7.35 -0.46 -4.05 117.46 121.26 2kmd n PHE 56 Ca 0.18 0.19 0.04 0.00 -0.76 0.00 0.00 57.45 57.10 2kmd n PHE 56 Cb 0.10 -1.07 0.30 0.00 0.35 0.00 0.00 39.48 39.16 2kmd n PHE 56 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 2kmd h THR 57 N -0.53 1.08 -0.05 -2.13 2.02 -1.55 0.23 112.91 111.98 2kmd h THR 57 Ca -0.51 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 66.33 2kmd h THR 57 Cb 1.69 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 2kmd h THR 57 CO -0.17 0.16 -0.13 0.07 0.37 0.00 0.00 175.52 175.83 2kmd h LYS 58 N 0.88 0.08 0.24 6.66 2.10 -1.75 -2.34 116.57 122.44 2kmd h LYS 58 Ca 0.31 -0.01 -0.34 0.00 -2.00 0.00 0.00 60.65 58.61 2kmd h LYS 58 Cb 0.13 -0.01 0.03 0.00 -0.90 0.00 0.00 32.23 31.48 2kmd h LYS 58 CO -0.10 0.21 -1.55 1.49 -2.00 0.00 0.00 179.45 177.50 2kmd h GLU 59 N 0.08 0.50 -0.34 0.07 4.81 -1.17 -2.96 114.58 115.57 2kmd h GLU 59 Ca 0.02 -0.86 0.10 0.00 -0.13 0.00 0.00 59.36 58.48 2kmd h GLU 59 Cb 0.27 0.32 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 2kmd h GLU 59 CO 0.02 1.41 0.27 1.96 -0.73 0.00 0.00 179.01 181.94 2kmd h GLN 60 N 0.12 0.00 0.11 1.92 4.20 -0.21 0.18 115.11 121.44 2kmd h GLN 60 Ca -0.28 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.09 2kmd h GLN 60 Cb 2.15 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.91 2kmd h GLN 60 CO 0.25 0.00 -1.83 -0.56 -0.67 0.00 0.00 178.83 176.02 2kmd h GLN 61 N 0.00 0.24 -0.54 1.46 3.07 -1.52 0.36 115.11 118.18 2kmd h GLN 61 Ca 0.16 -0.41 -0.12 0.00 0.09 0.00 0.00 58.65 58.38 2kmd h GLN 61 Cb 0.69 0.15 -0.02 0.00 0.08 0.00 0.00 27.48 28.39 2kmd h GLN 61 CO -0.00 1.09 -0.12 -0.09 0.09 0.00 0.00 178.83 179.80 2kmd h ARG 62 N 0.07 1.03 0.00 0.06 2.43 -1.17 -3.30 114.38 113.50 2kmd h ARG 62 Ca -0.36 -0.39 -0.34 0.00 -0.81 0.00 0.00 59.98 58.08 2kmd h ARG 62 Cb 2.04 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 31.46 2kmd h ARG 62 CO 0.11 1.08 -2.29 1.28 -1.51 0.00 0.00 179.97 178.64 2kmd n LEU 63 N -4.14 0.11 0.00 3.80 4.77 0.55 -5.01 117.00 117.08 2kmd n LEU 63 Ca 0.01 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2kmd n LEU 63 Cb 0.41 0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.94 2kmd n LEU 63 CO 0.46 0.46 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 2kmd n GLY 64 N 1.71 0.53 3.67 -0.72 0.00 0.05 -5.05 105.19 105.37 2kmd n GLY 64 Ca -0.30 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.74 0.31 -1.31 -0.61 5.41 -0.77 -4.91 119.36 115.74 2kmd n ILE 65 Ca 0.00 -0.06 -0.29 0.00 1.00 0.00 0.00 62.75 63.41 2kmd n ILE 65 Cb 0.00 -1.50 0.15 0.00 -0.71 0.00 0.00 39.64 37.59 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 2.79 0.82 -0.57 0.38 0.04 -1.26 -4.55 135.00 132.64 2kmd s PRO 66 Ca 0.90 0.48 -0.02 0.00 0.04 0.00 0.00 61.00 62.40 2kmd s PRO 66 Cb -0.82 -1.79 0.39 0.00 0.04 0.00 0.00 34.50 32.33 2kmd s PRO 66 CO 0.52 -2.46 2.03 0.36 0.04 0.00 0.00 177.00 177.49 2kmd n LYS 67 N -3.98 2.44 -3.58 4.56 2.85 -1.26 -4.84 118.16 114.36 2kmd n LYS 67 Ca 0.06 -2.83 -0.18 0.00 -1.05 0.00 0.00 58.31 54.31 2kmd n LYS 67 Cb 0.58 -2.11 -0.14 0.00 -0.65 0.00 0.00 35.03 32.70 2kmd n LYS 67 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2kmd s ASP 68 N -1.29 1.20 0.51 -5.58 -1.08 -1.26 -4.38 116.67 104.79 2kmd s ASP 68 Ca 0.56 -0.01 0.27 0.00 -0.52 0.00 0.00 52.55 52.84 2kmd s ASP 68 Cb 0.44 0.30 1.39 0.00 -1.46 0.00 0.00 42.92 43.58 2kmd s ASP 68 CO -0.01 -0.29 2.04 1.55 0.52 0.00 0.00 175.17 178.98 2kmd h PRO 69 N 8.34 0.00 0.01 4.34 0.13 -1.80 -2.48 132.00 140.54 2kmd h PRO 69 Ca -0.15 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.78 2kmd h PRO 69 Cb 1.14 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 2kmd h PRO 69 CO 0.22 0.13 -0.93 0.00 -0.23 0.00 0.00 178.00 177.19 2kmd h ARG 70 N 0.00 0.08 -1.08 0.86 -0.00 -1.87 -3.19 114.38 109.18 2kmd h ARG 70 Ca -0.00 -0.10 -0.50 0.00 -0.50 0.00 0.00 59.98 58.87 2kmd h ARG 70 Cb 0.39 0.03 -0.25 0.00 0.00 0.00 0.00 29.97 30.14 2kmd h ARG 70 CO 0.02 0.95 0.64 1.04 0.00 0.00 0.00 179.97 182.62 2kmd n GLN 71 N -3.52 2.23 -3.65 0.04 1.13 -0.94 -3.40 117.38 109.27 2kmd n GLN 71 Ca -0.02 -2.64 -0.21 0.00 -1.94 0.00 0.00 57.00 52.19 2kmd n GLN 71 Cb 0.86 -2.03 -0.04 0.00 0.11 0.00 0.00 30.24 29.14 2kmd n GLN 71 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 2kmd s TRP 72 N -2.99 2.65 0.29 1.08 0.52 -1.19 -4.90 118.94 114.41 2kmd s TRP 72 Ca 0.51 -0.52 0.05 0.00 0.02 0.00 0.00 56.10 56.16 2kmd s TRP 72 Cb 0.41 -2.14 -0.02 0.00 -1.15 0.00 0.00 33.47 30.58 2kmd s TRP 72 CO 0.04 -0.10 0.17 -2.37 0.02 0.00 0.00 176.95 174.72 2kmd n THR 73 N -1.52 0.00 -0.30 2.01 5.66 -1.26 -1.65 114.28 117.22 2kmd n THR 73 Ca 0.03 -1.89 0.10 0.00 -3.05 0.00 0.00 64.05 59.24 2kmd n THR 73 Cb 0.62 0.82 0.26 0.00 -1.55 0.00 0.00 70.33 70.49 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 0.48 0.13 1.09 5.08 -1.85 0.94 114.58 120.45 2kmd h GLU 74 Ca -0.21 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 2kmd h GLU 74 Cb 0.95 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.09 2kmd h GLU 74 CO 0.33 0.32 -0.06 1.15 -1.00 0.00 0.00 179.01 179.74 2kmd h THR 75 N 0.49 0.98 -0.80 1.13 2.02 -1.94 -1.44 112.91 113.35 2kmd h THR 75 Ca 0.50 -0.46 0.01 0.00 0.77 0.00 0.00 66.41 67.23 2kmd h THR 75 Cb 0.85 1.26 -0.04 0.00 -1.74 0.00 0.00 68.15 68.49 2kmd h THR 75 CO -0.45 0.11 0.52 0.45 0.37 0.00 0.00 175.52 176.52 2kmd h HIS 76 N -0.40 1.01 0.34 3.16 3.86 -1.74 0.44 115.15 121.82 2kmd h HIS 76 Ca -0.02 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 2kmd h HIS 76 Cb 0.32 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.45 2kmd h HIS 76 CO -0.00 0.65 -0.16 0.28 0.86 0.00 0.00 177.93 179.55 2kmd h VAL 77 N 1.09 0.67 -0.16 2.45 2.07 -0.80 -1.18 116.25 120.38 2kmd h VAL 77 Ca 0.29 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.74 2kmd h VAL 77 Cb -0.11 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2kmd h VAL 77 CO -0.06 0.01 -0.06 -0.09 0.02 0.00 0.00 177.57 177.38 2kmd h ARG 78 N -0.47 0.33 -0.90 1.57 2.43 -1.09 -1.67 114.38 114.59 2kmd h ARG 78 Ca -0.05 -0.14 0.08 0.00 -0.81 0.00 0.00 59.98 59.06 2kmd h ARG 78 Cb 0.36 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.83 2kmd h ARG 78 CO 0.08 0.63 0.56 0.22 -1.51 0.00 0.00 179.97 179.95 2kmd h ASP 79 N 0.02 0.86 0.63 -3.80 1.82 -0.14 0.12 116.42 115.92 2kmd h ASP 79 Ca 0.04 0.02 -0.03 0.00 -0.39 0.00 0.00 57.03 56.67 2kmd h ASP 79 Cb 0.52 -0.15 0.01 0.00 0.68 0.00 0.00 39.33 40.39 2kmd h ASP 79 CO 0.02 0.53 -0.30 -0.25 -1.61 0.00 0.00 179.24 177.63 2kmd h TRP 80 N 0.98 -0.78 -0.92 0.28 7.01 -1.14 0.68 115.95 122.05 2kmd h TRP 80 Ca 0.41 -0.02 0.15 0.00 2.11 0.00 0.00 58.89 61.54 2kmd h TRP 80 Cb 0.24 0.26 -0.16 0.00 -2.10 0.00 0.00 29.16 27.41 2kmd h TRP 80 CO -0.03 -0.48 -0.35 0.28 -2.79 0.00 0.00 178.44 175.07 2kmd h VAL 81 N -1.03 0.04 -0.26 2.65 2.07 -1.07 0.33 116.25 118.99 2kmd h VAL 81 Ca -0.09 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.46 2kmd h VAL 81 Cb 0.64 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 2kmd h VAL 81 CO 0.14 0.00 0.10 -0.03 0.02 0.00 0.00 177.57 177.80 2kmd h MET 82 N -0.03 0.22 -0.90 1.57 1.85 -0.75 -1.02 114.93 115.88 2kmd h MET 82 Ca 0.35 -0.01 0.07 0.00 -0.61 0.00 0.00 59.70 59.50 2kmd h MET 82 Cb 0.61 -0.05 -0.06 0.00 0.43 0.00 0.00 31.60 32.53 2kmd h MET 82 CO -0.94 0.15 0.58 2.35 -0.40 0.00 0.00 176.91 178.65 2kmd h TRP 83 N 0.23 1.01 -0.35 1.39 7.01 0.17 -1.75 115.95 123.66 2kmd h TRP 83 Ca 0.11 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.08 2kmd h TRP 83 Cb 0.06 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 26.78 2kmd h TRP 83 CO -0.12 0.51 -0.02 0.00 -2.79 0.00 0.00 178.44 176.03 2kmd h ALA 84 N 1.53 0.47 -0.83 2.65 0.00 0.17 -1.12 119.26 122.13 2kmd h ALA 84 Ca 0.40 -0.26 0.18 0.00 0.00 0.00 0.00 54.91 55.23 2kmd h ALA 84 Cb 0.27 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 2kmd h ALA 84 CO -0.16 0.26 0.55 0.28 0.00 0.00 0.00 179.25 180.19 2kmd h VAL 85 N 0.44 0.73 0.15 0.00 2.07 -0.35 0.13 116.25 119.42 2kmd h VAL 85 Ca 0.10 -0.14 -0.29 0.00 0.82 0.00 0.00 66.70 67.19 2kmd h VAL 85 Cb 0.49 0.29 0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2kmd h VAL 85 CO 0.02 0.07 -1.27 -1.13 0.02 0.00 0.00 177.57 175.28 2kmd h ASN 86 N 0.40 0.54 -0.44 0.57 -1.24 -1.01 0.24 115.58 114.64 2kmd h ASN 86 Ca 0.42 -0.56 -0.13 0.00 0.71 0.00 0.00 56.30 56.74 2kmd h ASN 86 Cb 1.03 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.89 2kmd h ASN 86 CO -0.15 1.43 -0.23 -0.33 -1.29 0.00 0.00 177.43 176.87 2kmd h GLU 87 N 0.11 0.95 -0.40 6.67 4.39 0.15 -3.18 114.58 123.27 2kmd h GLU 87 Ca -0.16 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.13 2kmd h GLU 87 Cb 1.99 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 30.60 2kmd h GLU 87 CO 0.22 1.07 0.00 1.19 -1.16 0.00 0.00 179.01 180.33 2kmd n PHE 88 N -4.11 0.53 -4.03 4.33 3.72 0.32 -4.99 117.46 113.23 2kmd n PHE 88 Ca -0.00 -0.43 -0.28 0.00 -0.05 0.00 0.00 57.45 56.70 2kmd n PHE 88 Cb 0.46 -0.02 -0.04 0.00 -0.94 0.00 0.00 39.48 38.95 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 0.84 -0.34 -4.12 4.37 2.88 0.50 -4.95 113.62 112.80 2kmd n SER 89 Ca 0.14 -1.08 -0.30 0.00 -1.33 0.00 0.00 58.87 56.30 2kmd n SER 89 Cb 0.47 -2.67 0.19 0.00 -0.75 0.00 0.00 64.21 61.45 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 -7.06 2.46 -0.03 2.46 1.43 0.54 -5.00 118.68 113.48 2kmd s LEU 90 Ca 0.04 0.33 -0.29 0.00 -1.03 0.00 0.00 54.13 53.18 2kmd s LEU 90 Cb -0.02 -2.35 0.08 0.00 0.03 0.00 0.00 46.19 43.93 2kmd s LEU 90 CO 0.92 -2.87 0.74 -1.59 0.23 0.00 0.00 176.35 173.78 2kmd s LYS 91 N -5.82 0.99 0.00 1.70 0.00 -1.26 -4.92 119.74 110.43 2kmd s LYS 91 Ca 0.73 0.05 0.00 0.00 0.00 0.00 0.00 55.97 56.75 2kmd s LYS 91 Cb -0.05 0.46 0.00 0.00 0.00 0.00 0.00 37.83 38.25 2kmd s LYS 91 CO 0.53 -0.35 0.00 0.41 0.00 0.00 0.00 175.35 175.94 2kmd n GLY 92 N 0.52 1.68 3.72 0.59 0.00 -1.26 -4.84 105.19 105.61 2kmd n GLY 92 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.53 4.02 -0.16 1.61 0.11 -1.26 -4.57 120.40 117.63 2kmd s VAL 93 Ca 0.00 1.55 -0.10 0.00 -2.93 0.00 0.00 61.98 60.50 2kmd s VAL 93 Cb 0.00 -3.99 -0.05 0.00 -1.53 0.00 0.00 36.38 30.81 2kmd s VAL 93 CO 0.00 0.17 0.17 -1.81 -3.33 0.00 0.00 175.10 170.30 2kmd s ASP 94 N 0.65 6.33 0.17 3.54 1.11 -1.26 -4.98 116.67 122.23 2kmd s ASP 94 Ca 0.55 0.39 0.18 0.00 0.18 0.00 0.00 52.55 53.85 2kmd s ASP 94 Cb -0.29 -2.10 -0.02 0.00 1.07 0.00 0.00 42.92 41.57 2kmd s ASP 94 CO 0.31 0.25 1.07 -0.26 1.18 0.00 0.00 175.17 177.73 2kmd h PHE 95 N 5.99 0.00 -0.26 4.23 0.04 -1.95 -3.30 116.94 121.69 2kmd h PHE 95 Ca -0.46 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.27 2kmd h PHE 95 Cb 1.18 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.32 2kmd h PHE 95 CO 0.65 0.38 -0.01 -0.56 -0.60 0.00 0.00 178.31 178.17 2kmd h GLN 96 N 0.00 0.39 -0.26 1.51 3.07 -1.98 -2.12 115.11 115.71 2kmd h GLN 96 Ca -0.08 -0.07 -0.10 0.00 0.09 0.00 0.00 58.65 58.49 2kmd h GLN 96 Cb 1.36 -0.06 -0.01 0.00 0.08 0.00 0.00 27.48 28.84 2kmd h GLN 96 CO 0.04 0.42 -0.26 0.87 0.09 0.00 0.00 178.83 179.99 2kmd h LYS 97 N 0.38 0.51 -0.98 0.06 6.56 -1.89 -3.01 116.57 118.20 2kmd h LYS 97 Ca 0.09 -0.20 -0.59 0.00 -1.06 0.00 0.00 60.65 58.89 2kmd h LYS 97 Cb 0.26 -0.03 -0.30 0.00 -0.57 0.00 0.00 32.23 31.60 2kmd h LYS 97 CO 0.01 0.73 0.72 1.19 -2.06 0.00 0.00 179.45 180.04 2kmd n PHE 98 N -4.11 3.10 -2.01 -1.35 3.72 -0.82 -4.78 117.46 111.20 2kmd n PHE 98 Ca -0.00 -2.41 -0.41 0.00 -0.05 0.00 0.00 57.45 54.58 2kmd n PHE 98 Cb 0.41 -1.17 -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 0.21 1.55 0.71 0.00 0.23 -1.26 -4.99 119.30 115.74 2kmd s MET 100 Ca 0.50 -1.03 -0.11 0.00 -1.03 0.00 0.00 55.69 54.02 2kmd s MET 100 Cb 0.15 0.53 0.02 0.00 -1.53 0.00 0.00 34.83 33.99 2kmd s MET 100 CO -0.05 -0.67 1.07 -1.12 -2.03 0.00 0.00 175.02 172.21 2kmd s SER 101 N -2.93 5.21 0.23 -1.18 0.01 -1.26 -3.05 113.70 110.72 2kmd s SER 101 Ca 0.14 1.68 -0.07 0.00 1.31 0.00 0.00 55.95 59.01 2kmd s SER 101 Cb -0.02 -2.50 0.33 0.00 0.21 0.00 0.00 66.02 64.04 2kmd s SER 101 CO 0.04 -1.56 1.79 1.23 0.41 0.00 0.00 173.24 175.15 2kmd h GLY 102 N -0.74 1.11 0.31 3.44 0.00 -1.46 -1.30 103.07 104.42 2kmd h GLY 102 Ca -0.44 -0.26 0.17 0.00 0.00 0.00 0.00 47.33 46.80 2kmd h GLY 102 CO 0.56 0.10 0.61 0.00 0.00 0.00 0.00 176.54 177.81 2kmd h ALA 103 N 1.42 1.76 -0.10 3.60 0.00 -1.56 0.01 119.26 124.39 2kmd h ALA 103 Ca 0.35 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.23 2kmd h ALA 103 Cb 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2kmd h ALA 103 CO -0.24 -0.07 -0.25 0.00 0.00 0.00 0.00 179.25 178.70 2kmd h ALA 104 N 1.61 0.16 -0.63 0.00 0.00 -1.61 -2.40 119.26 116.38 2kmd h ALA 104 Ca 0.52 -0.40 0.07 0.00 0.00 0.00 0.00 54.91 55.10 2kmd h ALA 104 Cb 0.82 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 2kmd h ALA 104 CO -0.29 0.15 0.31 1.25 0.00 0.00 0.00 179.25 180.68 2kmd h LEU 105 N -0.11 0.43 -0.53 0.00 5.85 -0.51 -0.07 115.31 120.37 2kmd h LEU 105 Ca -0.00 0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.69 2kmd h LEU 105 Cb 0.85 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 2kmd h LEU 105 CO 0.05 0.27 0.04 0.00 -0.34 0.00 0.00 178.44 178.46 2kmd h ALA 107 N 0.96 1.65 -0.64 0.00 0.00 -0.84 -2.68 119.26 117.71 2kmd h ALA 107 Ca 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2kmd h ALA 107 Cb 0.48 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2kmd h ALA 107 CO 0.02 0.26 0.34 -0.07 0.00 0.00 0.00 179.25 179.81 2kmd h LEU 108 N 0.15 0.80 0.00 0.00 3.38 -0.76 -3.49 115.31 115.38 2kmd h LEU 108 Ca 0.03 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2kmd h LEU 108 Cb 0.28 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2kmd h LEU 108 CO 0.02 0.65 0.00 0.61 0.09 0.00 0.00 178.44 179.81 2kmd n GLY 109 N -1.22 -1.18 0.10 0.83 0.00 -1.01 -3.68 105.19 99.03 2kmd n GLY 109 Ca 0.06 -1.61 -0.13 0.00 0.00 0.00 0.00 46.02 44.34 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 -0.35 1.61 3.64 -1.91 -1.34 116.57 118.06 2kmd h LYS 110 Ca 0.00 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.47 2kmd h LYS 110 Cb 0.00 0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 31.77 2kmd h LYS 110 CO 0.00 -0.05 -0.22 1.05 -2.27 0.00 0.00 179.45 177.97 2kmd h GLU 111 N -0.23 -0.16 -0.44 1.90 4.11 -1.99 0.42 114.58 118.19 2kmd h GLU 111 Ca -0.02 0.01 -0.08 0.00 0.07 0.00 0.00 59.36 59.35 2kmd h GLU 111 Cb 0.19 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2kmd h GLU 111 CO 0.03 -0.11 -0.03 0.00 0.07 0.00 0.00 179.01 178.97 2kmd h PHE 113 N 0.62 0.96 0.00 0.00 3.57 -0.70 -2.35 116.94 119.05 2kmd h PHE 113 Ca 0.12 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 2kmd h PHE 113 Cb 0.53 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2kmd h PHE 113 CO 0.04 0.78 -0.24 1.25 -2.23 0.00 0.00 178.31 177.91 2kmd h LEU 114 N 0.86 0.00 -0.91 0.59 5.85 -0.09 -1.23 115.31 120.38 2kmd h LEU 114 Ca 0.20 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 2kmd h LEU 114 Cb 0.26 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 2kmd h LEU 114 CO -0.01 0.24 -0.09 -0.33 -0.34 0.00 0.00 178.44 177.92 2kmd h GLU 115 N 0.00 0.00 0.05 1.25 5.08 -0.91 -3.18 114.58 116.87 2kmd h GLU 115 Ca -0.00 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.08 2kmd h GLU 115 Cb 0.43 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 2kmd h GLU 115 CO 0.03 0.09 -1.50 -0.07 -1.00 0.00 0.00 179.01 176.56 2kmd h LEU 116 N 0.00 0.16 -9.32 1.33 3.38 -0.83 -3.47 115.31 106.56 2kmd h LEU 116 Ca -0.00 -0.24 -0.65 0.00 0.09 0.00 0.00 57.88 57.07 2kmd h LEU 116 Cb 0.75 -0.05 -0.15 0.00 0.09 0.00 0.00 40.66 41.30 2kmd h LEU 116 CO 0.01 1.21 -0.72 0.00 0.09 0.00 0.00 178.44 179.03 2kmd s ALA 117 N -2.63 3.02 1.03 1.53 0.00 -0.83 -4.44 121.76 119.44 2kmd s ALA 117 Ca -0.06 -1.27 -0.23 0.00 0.00 0.00 0.00 51.96 50.41 2kmd s ALA 117 Cb 0.08 -0.92 -0.09 0.00 0.00 0.00 0.00 23.12 22.19 2kmd s ALA 117 CO 0.83 0.61 -0.88 -2.30 0.00 0.00 0.00 175.76 174.02 2kmd n PRO 118 N 0.53 -0.47 0.29 0.00 -0.02 -1.26 -4.45 135.00 129.61 2kmd n PRO 118 Ca -0.12 -0.13 0.15 0.00 -2.02 0.00 0.00 63.50 61.38 2kmd n PRO 118 Cb 0.53 -1.25 0.85 0.00 -0.02 0.00 0.00 33.50 33.61 2kmd n PRO 118 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2kmd h ASP 119 N -1.34 0.00 0.00 2.55 3.32 -1.97 -1.90 116.42 117.08 2kmd h ASP 119 Ca -0.44 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.33 2kmd h ASP 119 Cb 1.37 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.87 2kmd h ASP 119 CO 0.27 0.06 -1.93 2.22 -1.72 0.00 0.00 179.24 178.14 2kmd n PHE 120 N -3.60 0.00 -0.00 4.55 -1.74 -1.26 -4.52 117.46 110.89 2kmd n PHE 120 Ca -0.02 0.00 0.01 0.00 -0.56 0.00 0.00 57.45 56.88 2kmd n PHE 120 Cb 0.17 -0.60 0.32 0.00 1.52 0.00 0.00 39.48 40.90 2kmd n PHE 120 CO 0.00 0.00 0.00 -0.39 -0.56 0.00 0.00 176.76 175.81 2kmd h VAL 121 N -0.55 1.18 -0.91 1.97 -1.51 -1.89 -2.77 116.25 111.77 2kmd h VAL 121 Ca -0.42 -0.66 0.09 0.00 -1.23 0.00 0.00 66.70 64.48 2kmd h VAL 121 Cb 1.38 0.85 -0.07 0.00 -2.13 0.00 0.00 31.29 31.32 2kmd h VAL 121 CO -0.24 0.23 0.56 1.23 -1.23 0.00 0.00 177.57 178.12 2kmd h GLY 122 N 0.78 1.42 0.98 5.19 0.00 -1.56 -1.37 103.07 108.51 2kmd h GLY 122 Ca 0.12 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 2kmd h GLY 122 CO 0.00 0.21 0.24 -1.80 0.00 0.00 0.00 176.54 175.20 2kmd h ASP 123 N 0.96 0.53 0.64 0.19 1.82 -1.71 -0.97 116.42 117.88 2kmd h ASP 123 Ca 0.42 -0.08 -0.03 0.00 -0.39 0.00 0.00 57.03 56.96 2kmd h ASP 123 Cb 0.31 -0.13 0.01 0.00 0.68 0.00 0.00 39.33 40.19 2kmd h ASP 123 CO -0.22 0.45 -0.31 0.40 -1.61 0.00 0.00 179.24 177.96 2kmd h ILE 124 N 0.56 0.33 0.32 2.25 2.04 -1.43 0.45 117.51 122.03 2kmd h ILE 124 Ca 0.15 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.87 2kmd h ILE 124 Cb 0.03 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.46 2kmd h ILE 124 CO -0.03 0.02 -0.39 -0.07 0.00 0.00 0.00 178.15 177.68 2kmd h LEU 125 N -0.95 -1.10 -1.30 1.44 3.38 -1.25 -1.84 115.31 113.69 2kmd h LEU 125 Ca -0.09 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2kmd h LEU 125 Cb 0.69 0.38 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 2kmd h LEU 125 CO 0.14 -0.52 0.30 -0.25 0.09 0.00 0.00 178.44 178.20 2kmd h TRP 126 N -0.76 0.76 0.23 1.13 7.01 -1.24 0.65 115.95 123.73 2kmd h TRP 126 Ca -0.02 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 60.98 2kmd h TRP 126 Cb 0.70 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 27.49 2kmd h TRP 126 CO -0.25 0.54 -0.27 1.49 -2.79 0.00 0.00 178.44 177.16 2kmd h GLU 127 N 0.79 -0.53 -0.01 2.65 4.81 -0.47 0.20 114.58 122.02 2kmd h GLU 127 Ca 0.20 0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.33 2kmd h GLU 127 Cb 0.04 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 2kmd h GLU 127 CO -0.03 -0.35 -0.63 1.25 -0.73 0.00 0.00 179.01 178.52 2kmd h HIS 128 N -0.55 0.03 -0.03 0.92 2.76 -1.09 -2.91 115.15 114.28 2kmd h HIS 128 Ca 0.00 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2kmd h HIS 128 Cb 0.52 -0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.47 2kmd h HIS 128 CO -0.19 0.64 0.00 1.25 -1.30 0.00 0.00 177.93 178.34 2kmd h LEU 129 N 0.02 -0.00 -1.00 0.26 5.85 0.77 -1.68 115.31 119.52 2kmd h LEU 129 Ca -0.01 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 2kmd h LEU 129 Cb 1.11 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 2kmd h LEU 129 CO 0.08 0.01 -0.27 -0.33 -0.34 0.00 0.00 178.44 177.59 2kmd h GLU 130 N 0.02 0.39 -0.99 1.25 4.39 -0.99 -2.69 114.58 115.95 2kmd h GLU 130 Ca 0.02 -0.15 0.04 0.00 0.34 0.00 0.00 59.36 59.61 2kmd h GLU 130 Cb 0.01 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.58 2kmd h GLU 130 CO -0.02 0.63 0.65 0.82 -1.16 0.00 0.00 179.01 179.93 2kmd h ILE 131 N 0.34 1.17 -0.78 3.13 2.04 -1.24 -1.22 117.51 120.95 2kmd h ILE 131 Ca 0.05 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 2kmd h ILE 131 Cb 0.66 -0.20 -0.04 0.00 -0.74 0.00 0.00 36.82 36.51 2kmd h ILE 131 CO 0.05 0.23 0.36 -0.07 0.00 0.00 0.00 178.15 178.72 2kmd h LEU 132 N 1.26 1.02 0.09 1.44 3.38 -0.98 0.16 115.31 121.67 2kmd h LEU 132 Ca 0.40 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 2kmd h LEU 132 Cb 0.00 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.49 2kmd h LEU 132 CO -0.13 0.87 -0.04 1.56 0.09 0.00 0.00 178.44 180.79 2kmd h GLN 133 N 1.11 -0.11 -0.33 1.13 4.20 -1.15 -1.83 115.11 118.13 2kmd h GLN 133 Ca 0.27 0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.91 2kmd h GLN 133 Cb 0.13 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 2kmd h GLN 133 CO -0.03 0.04 -0.13 0.87 -0.67 0.00 0.00 178.83 178.92 2kmd h LYS 134 N -0.24 0.57 -0.33 1.46 1.57 -1.11 -2.97 116.57 115.51 2kmd h LYS 134 Ca -0.01 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 2kmd h LYS 134 Cb 0.21 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 2kmd h LYS 134 CO 0.02 0.68 0.21 1.49 -0.57 0.00 0.00 179.45 181.28 2kmd h GLU 135 N 0.52 0.44 -2.28 3.15 4.81 -0.50 -3.41 114.58 117.30 2kmd h GLU 135 Ca 0.09 -0.03 -0.23 0.00 -0.13 0.00 0.00 59.36 59.06 2kmd h GLU 135 Cb 0.53 -0.09 -0.33 0.00 0.63 0.00 0.00 28.75 29.48 2kmd h GLU 135 CO 0.03 0.31 -0.54 0.34 -0.73 0.00 0.00 179.01 178.42 2kmd s ASP 136 N -5.52 0.73 0.08 1.04 2.15 -0.70 -5.03 116.67 109.42 2kmd s ASP 136 Ca -0.13 0.09 -0.07 0.00 0.43 0.00 0.00 52.55 52.87 2kmd s ASP 136 Cb 0.10 0.77 -0.24 0.00 -0.30 0.00 0.00 42.92 43.25 2kmd s ASP 136 CO 0.71 -0.30 1.17 -0.37 -0.17 0.00 0.00 175.17 176.21 2kmd h VAL 137 N 6.25 1.42 0.00 1.11 -1.51 -1.78 -3.41 116.25 118.32 2kmd h VAL 137 Ca -0.18 -2.76 0.00 0.00 -1.23 0.00 0.00 66.70 62.53 2kmd h VAL 137 Cb 1.15 2.77 0.00 0.00 -2.13 0.00 0.00 31.29 33.08 2kmd h VAL 137 CO 0.26 0.82 0.00 1.17 -1.23 0.00 0.00 177.57 178.59