#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kzi h ASP 27 N 0.00 0.16 -1.16 0.55 2.03 -2.05 -3.36 116.42 112.58 3kzi h ASP 27 Ca 0.00 0.09 0.13 0.00 -0.73 0.00 0.00 57.03 56.52 3kzi h ASP 27 Cb 0.00 0.09 -0.21 0.00 -0.83 0.00 0.00 39.33 38.38 3kzi h ASP 27 CO 0.00 -0.13 -0.08 -1.10 -1.03 0.00 0.00 179.24 176.89 3kzi s GLN 28 N -5.16 0.46 0.00 4.15 -1.52 -1.26 -5.12 119.66 111.22 3kzi s GLN 28 Ca -0.07 0.97 0.00 0.00 -1.95 0.00 0.00 55.36 54.31 3kzi s GLN 28 Cb 0.29 0.56 0.00 0.00 -0.22 0.00 0.00 33.01 33.64 3kzi s GLN 28 CO 0.84 -0.35 0.00 -0.85 -0.25 0.00 0.00 175.29 174.68 3kzi n GLU 29 N 5.36 0.00 0.04 2.91 -0.00 -1.26 -5.02 120.64 122.67 3kzi n GLU 29 Ca -0.06 0.00 0.21 0.00 -0.00 0.00 0.00 57.16 57.31 3kzi n GLU 29 Cb 0.51 0.00 0.73 0.00 -0.00 0.00 0.00 31.44 32.68 3kzi n GLU 29 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 3kzi h SER 30 N 0.00 0.00 -0.91 -1.84 0.87 -1.96 -1.94 113.55 107.77 3kzi h SER 30 Ca 0.00 0.00 -0.55 0.00 -1.23 0.00 0.00 61.79 60.01 3kzi h SER 30 Cb 0.00 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 61.82 3kzi h SER 30 CO 0.00 0.00 1.13 -1.20 -0.53 0.00 0.00 176.83 176.23 3kzi n SER 31 N -4.01 6.95 0.00 6.23 7.64 -1.26 -3.54 113.62 125.63 3kzi n SER 31 Ca 0.09 -3.06 0.00 0.00 1.01 0.00 0.00 58.87 56.91 3kzi n SER 31 Cb 0.64 -1.31 0.00 0.00 -1.01 0.00 0.00 64.21 62.52 3kzi n SER 31 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3kzi n GLY 32 N 1.49 -0.92 3.36 0.23 0.00 -0.73 -5.06 105.19 103.55 3kzi n GLY 32 Ca 0.54 0.24 -0.18 0.00 0.00 0.00 0.00 46.02 46.63 3kzi n GLY 32 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kzi s PHE 33 N -0.23 1.49 0.65 1.61 0.08 -1.23 -5.03 117.98 115.32 3kzi s PHE 33 Ca 0.00 -1.53 -0.11 0.00 0.12 0.00 0.00 56.93 55.41 3kzi s PHE 33 Cb 0.00 -0.48 -0.02 0.00 -0.57 0.00 0.00 43.02 41.95 3kzi s PHE 33 CO 0.00 -0.97 1.04 0.00 -0.10 0.00 0.00 175.22 175.19 3kzi s ALA 34 N -3.30 2.95 0.15 5.36 0.00 -1.26 -4.11 121.76 121.55 3kzi s ALA 34 Ca 0.37 -0.06 -0.21 0.00 0.00 0.00 0.00 51.96 52.06 3kzi s ALA 34 Cb 0.01 -3.10 0.03 0.00 0.00 0.00 0.00 23.12 20.06 3kzi s ALA 34 CO 0.25 -0.88 1.65 0.11 0.00 0.00 0.00 175.76 176.88 3kzi h TRP 35 N -0.47 -0.45 0.00 0.00 5.08 -1.94 -1.63 115.95 116.55 3kzi h TRP 35 Ca -0.44 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.56 3kzi h TRP 35 Cb 1.20 0.24 0.00 0.00 -3.00 0.00 0.00 29.16 27.60 3kzi h TRP 35 CO 0.64 -0.25 0.00 -2.67 -1.28 0.00 0.00 178.44 174.88 3kzi n TRP 36 N -5.33 0.00 -1.23 0.12 4.27 -1.26 0.19 117.44 114.19 3kzi n TRP 36 Ca -0.01 0.00 0.05 0.00 -3.89 0.00 0.00 57.50 53.65 3kzi n TRP 36 Cb 0.25 0.00 0.07 0.00 -1.36 0.00 0.00 31.31 30.27 3kzi n TRP 36 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3kzi n ALA 37 N -0.80 2.04 -0.37 -1.67 0.00 -0.64 -4.90 120.51 114.17 3kzi n ALA 37 Ca 0.05 -1.73 -0.00 0.00 0.00 0.00 0.00 53.44 51.75 3kzi n ALA 37 Cb 0.02 -0.34 0.05 0.00 0.00 0.00 0.00 19.45 19.18 3kzi n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kzi n GLY 38 N -0.75 -1.95 0.01 0.00 0.00 0.13 -0.79 105.19 101.85 3kzi n GLY 38 Ca 0.08 1.07 0.01 0.00 0.00 0.00 0.00 46.02 47.18 3kzi n GLY 38 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3kzi n ASN 39 N -5.42 0.05 -0.03 1.61 3.02 -1.26 -0.45 115.26 112.77 3kzi n ASN 39 Ca 0.10 0.50 0.14 0.00 -0.03 0.00 0.00 54.58 55.29 3kzi n ASN 39 Cb 0.39 -0.51 0.55 0.00 -0.61 0.00 0.00 39.78 39.61 3kzi n ASN 39 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kzi n ALA 40 N -1.50 2.71 1.07 5.41 0.00 0.03 -2.81 120.51 125.43 3kzi n ALA 40 Ca -0.00 -0.20 0.12 0.00 0.00 0.00 0.00 53.44 53.37 3kzi n ALA 40 Cb 0.03 -1.36 0.60 0.00 0.00 0.00 0.00 19.45 18.71 3kzi n ALA 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3kzi n ARG 41 N -1.36 0.22 -0.20 0.00 1.74 0.40 -2.45 116.66 115.01 3kzi n ARG 41 Ca 0.09 0.06 0.11 0.00 -0.77 0.00 0.00 57.85 57.34 3kzi n ARG 41 Cb 0.31 -1.50 0.21 0.00 -1.02 0.00 0.00 32.46 30.47 3kzi n ARG 41 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3kzi n LEU 42 N -1.37 3.41 0.08 0.55 4.77 -1.12 -4.43 117.00 118.88 3kzi n LEU 42 Ca 0.10 -1.59 0.17 0.00 -0.03 0.00 0.00 56.01 54.66 3kzi n LEU 42 Cb 0.24 -0.27 0.69 0.00 -2.33 0.00 0.00 43.42 41.75 3kzi n LEU 42 CO 0.21 0.76 1.15 0.40 -1.33 0.00 0.00 177.39 178.58 3kzi h ILE 43 N 4.09 0.76 -1.27 -0.08 2.04 -1.65 -3.03 117.51 118.36 3kzi h ILE 43 Ca 0.00 0.00 -0.52 0.00 1.00 0.00 0.00 64.86 65.34 3kzi h ILE 43 Cb 0.93 0.80 -0.42 0.00 -0.74 0.00 0.00 36.82 37.40 3kzi h ILE 43 CO 0.00 0.00 -0.86 0.59 0.00 0.00 0.00 178.15 177.88 3kzi n ASN 44 N -4.34 3.88 -2.85 1.72 3.02 -1.26 -4.77 115.26 110.66 3kzi n ASN 44 Ca 0.06 -3.43 -0.12 0.00 -0.03 0.00 0.00 54.58 51.06 3kzi n ASN 44 Cb 0.46 -0.46 0.02 0.00 -0.61 0.00 0.00 39.78 39.19 3kzi n ASN 44 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3kzi n LEU 45 N -0.42 0.81 0.00 3.41 4.32 -1.15 -5.01 117.00 118.96 3kzi n LEU 45 Ca 0.32 -4.14 0.00 0.00 -0.02 0.00 0.00 56.01 52.17 3kzi n LEU 45 Cb 0.74 0.52 0.00 0.00 -1.62 0.00 0.00 43.42 43.06 3kzi n LEU 45 CO 0.31 1.86 0.00 -1.54 -1.22 0.00 0.00 177.39 176.80 3kzi n SER 46 N 0.04 0.00 0.14 -1.43 3.41 -1.26 -0.29 113.62 114.23 3kzi n SER 46 Ca 0.13 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.60 3kzi n SER 46 Cb 0.76 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.63 3kzi n SER 46 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3kzi h GLY 47 N 0.00 -1.18 1.21 5.00 0.00 -1.77 -1.39 103.07 104.94 3kzi h GLY 47 Ca 0.00 0.60 -0.00 0.00 0.00 0.00 0.00 47.33 47.93 3kzi h GLY 47 CO 0.00 -0.32 0.48 0.50 0.00 0.00 0.00 176.54 177.20 3kzi h LYS 48 N -0.69 1.05 0.00 4.80 1.57 -0.67 0.94 116.57 123.58 3kzi h LYS 48 Ca -0.02 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3kzi h LYS 48 Cb 0.66 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3kzi h LYS 48 CO -0.18 0.73 0.00 -0.11 -0.57 0.00 0.00 179.45 179.33 3kzi n LEU 49 N -4.38 0.00 -0.03 2.94 7.94 -0.77 -0.93 117.00 121.76 3kzi n LEU 49 Ca 0.08 0.40 -0.19 0.00 -1.11 0.00 0.00 56.01 55.20 3kzi n LEU 49 Cb 0.06 -0.40 -0.14 0.00 0.53 0.00 0.00 43.42 43.47 3kzi n LEU 49 CO 0.37 -0.30 -0.90 -0.11 -1.11 0.00 0.00 177.39 175.34 3kzi n LEU 50 N -1.40 2.39 -0.09 -1.96 7.94 0.29 -3.63 117.00 120.55 3kzi n LEU 50 Ca 0.03 0.16 -0.07 0.00 -1.11 0.00 0.00 56.01 55.02 3kzi n LEU 50 Cb 0.08 -0.86 0.00 0.00 0.53 0.00 0.00 43.42 43.17 3kzi n LEU 50 CO 0.07 0.80 0.89 1.23 -1.11 0.00 0.00 177.39 179.27 3kzi h GLY 51 N 1.69 0.35 -0.04 -3.96 0.00 -0.66 0.91 103.07 101.35 3kzi h GLY 51 Ca -0.44 -0.01 0.02 0.00 0.00 0.00 0.00 47.33 46.89 3kzi h GLY 51 CO 0.05 -0.02 -0.42 0.00 0.00 0.00 0.00 176.54 176.14 3kzi h ALA 52 N 1.24 -0.83 -0.13 3.60 0.00 -1.59 1.11 119.26 122.66 3kzi h ALA 52 Ca 0.15 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.03 3kzi h ALA 52 Cb 0.16 0.88 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 3kzi h ALA 52 CO -0.20 -0.97 0.11 0.45 0.00 0.00 0.00 179.25 178.64 3kzi h HIS 53 N -0.50 0.00 0.00 0.00 -0.00 -1.55 0.69 115.15 113.80 3kzi h HIS 53 Ca 0.02 0.00 -0.23 0.00 -0.00 0.00 0.00 60.37 60.16 3kzi h HIS 53 Cb 0.55 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 27.92 3kzi h HIS 53 CO -0.51 0.00 -1.37 0.28 -0.00 0.00 0.00 177.93 176.32 3kzi h VAL 54 N 0.00 0.93 0.16 2.45 2.07 0.35 -2.50 116.25 119.70 3kzi h VAL 54 Ca 0.06 -2.62 -0.31 0.00 0.82 0.00 0.00 66.70 64.65 3kzi h VAL 54 Cb 0.28 2.41 0.03 0.00 -1.52 0.00 0.00 31.29 32.49 3kzi h VAL 54 CO -0.00 0.53 -1.30 0.00 0.02 0.00 0.00 177.57 176.82 3kzi h ALA 55 N 1.16 -0.05 0.52 1.67 0.00 0.23 -3.16 119.26 119.62 3kzi h ALA 55 Ca -0.17 -0.79 -0.03 0.00 0.00 0.00 0.00 54.91 53.92 3kzi h ALA 55 Cb 1.79 0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.72 3kzi h ALA 55 CO 0.08 0.68 -0.25 1.25 0.00 0.00 0.00 179.25 181.01 3kzi h HIS 56 N 0.23 -0.65 0.00 0.00 6.17 0.25 -1.51 115.15 119.65 3kzi h HIS 56 Ca -0.21 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 60.86 3kzi h HIS 56 Cb 1.98 0.21 0.00 0.00 2.52 0.00 0.00 27.41 32.12 3kzi h HIS 56 CO 0.12 -0.33 0.42 0.00 0.71 0.00 0.00 177.93 178.85 3kzi h ALA 57 N -0.56 1.34 0.01 5.26 0.00 -1.57 1.04 119.26 124.79 3kzi h ALA 57 Ca -0.07 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.66 3kzi h ALA 57 Cb 0.61 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.42 3kzi h ALA 57 CO 0.12 -0.34 -0.71 0.78 0.00 0.00 0.00 179.25 179.10 3kzi h GLY 58 N 0.00 0.51 1.40 0.00 0.00 -1.24 -3.08 103.07 100.66 3kzi h GLY 58 Ca 0.00 -0.92 0.04 0.00 0.00 0.00 0.00 47.33 46.46 3kzi h GLY 58 CO 0.00 0.81 0.30 1.41 0.00 0.00 0.00 176.54 179.06 3kzi h LEU 59 N -0.03 0.38 -0.17 3.11 3.38 0.14 0.28 115.31 122.39 3kzi h LEU 59 Ca -0.09 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.71 3kzi h LEU 59 Cb 1.42 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 42.09 3kzi h LEU 59 CO 0.14 0.25 -0.56 0.40 0.09 0.00 0.00 178.44 178.77 3kzi h ILE 60 N 0.43 1.32 -0.31 1.22 2.04 -1.54 -0.93 117.51 119.75 3kzi h ILE 60 Ca 0.19 -1.80 -0.07 0.00 1.00 0.00 0.00 64.86 64.18 3kzi h ILE 60 Cb 0.21 1.97 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 3kzi h ILE 60 CO -0.05 0.56 -0.09 0.58 0.00 0.00 0.00 178.15 179.15 3kzi h VAL 61 N 0.36 1.28 -0.25 1.67 2.07 -1.32 -0.98 116.25 119.09 3kzi h VAL 61 Ca -0.02 -1.15 0.06 0.00 0.82 0.00 0.00 66.70 66.41 3kzi h VAL 61 Cb 1.18 1.40 -0.07 0.00 -1.52 0.00 0.00 31.29 32.28 3kzi h VAL 61 CO 0.12 0.37 -0.26 0.15 0.02 0.00 0.00 177.57 177.96 3kzi h PHE 62 N 0.37 -0.71 0.30 1.57 3.57 -0.43 0.23 116.94 121.83 3kzi h PHE 62 Ca 0.08 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 3kzi h PHE 62 Cb 0.59 0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.68 3kzi h PHE 62 CO 0.05 -0.34 -0.24 2.35 -2.23 0.00 0.00 178.31 177.91 3kzi h TRP 63 N -0.27 -0.64 -0.96 0.41 7.01 -1.03 0.90 115.95 121.37 3kzi h TRP 63 Ca 0.14 0.00 0.20 0.00 2.11 0.00 0.00 58.89 61.34 3kzi h TRP 63 Cb 0.48 0.24 -0.18 0.00 -2.10 0.00 0.00 29.16 27.60 3kzi h TRP 63 CO -0.42 -0.33 -0.21 0.00 -2.79 0.00 0.00 178.44 174.69 3kzi h ALA 64 N -1.44 0.69 0.59 2.65 0.00 -0.88 0.54 119.26 121.41 3kzi h ALA 64 Ca -0.04 0.37 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 3kzi h ALA 64 Cb 0.43 0.71 0.01 0.00 0.00 0.00 0.00 17.79 18.94 3kzi h ALA 64 CO 0.00 -0.40 -0.28 0.78 0.00 0.00 0.00 179.25 179.35 3kzi h GLY 65 N 0.00 -0.82 1.14 0.00 0.00 -0.24 -2.75 103.07 100.40 3kzi h GLY 65 Ca 0.47 0.31 0.12 0.00 0.00 0.00 0.00 47.33 48.23 3kzi h GLY 65 CO -0.98 -0.30 0.32 0.00 0.00 0.00 0.00 176.54 175.58 3kzi h ALA 66 N -1.17 2.32 0.14 3.60 0.00 0.19 -2.46 119.26 121.87 3kzi h ALA 66 Ca -0.08 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.57 3kzi h ALA 66 Cb 0.62 0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.46 3kzi h ALA 66 CO 0.13 -0.53 -1.04 1.98 0.00 0.00 0.00 179.25 179.79 3kzi h MET 67 N 0.00 0.47 -0.43 0.00 -1.53 -0.00 -2.98 114.93 110.46 3kzi h MET 67 Ca 0.19 -0.68 0.08 0.00 -3.44 0.00 0.00 59.70 55.85 3kzi h MET 67 Cb 0.82 0.24 -0.07 0.00 -0.55 0.00 0.00 31.60 32.05 3kzi h MET 67 CO -0.00 1.30 0.02 1.15 0.14 0.00 0.00 176.91 179.52 3kzi h THR 68 N -0.03 0.69 -0.24 -0.77 2.02 -1.13 0.51 112.91 113.96 3kzi h THR 68 Ca -0.17 -0.04 -0.05 0.00 0.77 0.00 0.00 66.41 66.92 3kzi h THR 68 Cb 1.78 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 3kzi h THR 68 CO 0.20 0.02 -0.06 -0.07 0.37 0.00 0.00 175.52 175.98 3kzi h LEU 69 N 0.13 0.35 -0.24 2.58 3.38 -1.62 0.18 115.31 120.07 3kzi h LEU 69 Ca 0.21 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 3kzi h LEU 69 Cb 0.30 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3kzi h LEU 69 CO -0.34 0.46 -0.01 0.15 0.09 0.00 0.00 178.44 178.79 3kzi h PHE 70 N 0.36 0.47 0.57 1.13 3.57 -0.74 0.13 116.94 122.43 3kzi h PHE 70 Ca 0.08 -0.09 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 3kzi h PHE 70 Cb 0.34 -0.12 0.01 0.00 2.79 0.00 0.00 35.95 38.97 3kzi h PHE 70 CO 0.01 0.61 -0.27 0.93 -2.23 0.00 0.00 178.31 177.36 3kzi h GLU 71 N 0.19 -0.74 -0.95 1.11 5.08 0.55 -2.83 114.58 116.98 3kzi h GLU 71 Ca 0.07 0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.58 3kzi h GLU 71 Cb 0.43 0.17 -0.08 0.00 0.50 0.00 0.00 28.75 29.77 3kzi h GLU 71 CO 0.01 -0.48 0.59 1.25 -1.00 0.00 0.00 179.01 179.38 3kzi h LEU 72 N -0.79 0.87 -2.11 1.33 5.85 -0.64 0.63 115.31 120.44 3kzi h LEU 72 Ca -0.08 0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.76 3kzi h LEU 72 Cb 0.60 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 3kzi h LEU 72 CO 0.13 0.48 0.22 0.00 -0.34 0.00 0.00 178.44 178.93 3kzi h ALA 73 N 1.50 2.06 0.00 1.25 0.00 -0.53 -1.82 119.26 121.71 3kzi h ALA 73 Ca 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.36 3kzi h ALA 73 Cb 0.41 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3kzi h ALA 73 CO -0.25 -0.34 -1.63 0.72 0.00 0.00 0.00 179.25 177.75 3kzi n HIS 74 N -4.13 0.00 -1.66 0.00 8.25 0.14 -5.01 115.22 112.82 3kzi n HIS 74 Ca 0.03 0.00 -0.48 0.00 -0.26 0.00 0.00 57.72 57.01 3kzi n HIS 74 Cb 0.36 -0.33 -0.05 0.00 1.12 0.00 0.00 29.99 31.10 3kzi n HIS 74 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3kzi n PHE 75 N -1.98 2.14 -3.78 4.41 7.35 0.20 -4.98 117.46 120.81 3kzi n PHE 75 Ca -0.02 0.31 -0.37 0.00 -0.76 0.00 0.00 57.45 56.61 3kzi n PHE 75 Cb 0.42 -2.52 -0.12 0.00 0.35 0.00 0.00 39.48 37.61 3kzi n PHE 75 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 3kzi s ILE 76 N 1.40 3.40 0.16 -2.13 1.01 -1.26 -4.99 121.20 118.80 3kzi s ILE 76 Ca 0.83 -1.66 -0.25 0.00 0.00 0.00 0.00 60.65 59.56 3kzi s ILE 76 Cb -0.75 -3.15 0.01 0.00 0.01 0.00 0.00 42.46 38.59 3kzi s ILE 76 CO 0.43 -0.44 1.42 -0.81 0.00 0.00 0.00 174.94 175.53 3kzi n PRO 77 N 4.68 -0.35 -1.26 2.79 -0.04 -1.26 -2.64 135.00 136.91 3kzi n PRO 77 Ca -0.08 1.39 -0.33 0.00 -0.04 0.00 0.00 63.50 64.45 3kzi n PRO 77 Cb 0.42 -2.06 -0.06 0.00 -0.04 0.00 0.00 33.50 31.77 3kzi n PRO 77 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3kzi n GLU 78 N -5.20 3.34 -3.64 0.54 0.00 -1.26 -4.74 120.64 109.68 3kzi n GLU 78 Ca 0.04 -1.97 -0.05 0.00 0.00 0.00 0.00 57.16 55.18 3kzi n GLU 78 Cb 0.27 -2.61 -0.07 0.00 0.00 0.00 0.00 31.44 29.04 3kzi n GLU 78 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.13 177.34 3kzi s LYS 79 N 1.78 0.37 0.34 3.44 2.20 -1.08 -5.15 119.74 121.62 3kzi s LYS 79 Ca 0.69 0.51 -0.25 0.00 -0.36 0.00 0.00 55.97 56.56 3kzi s LYS 79 Cb 0.21 0.14 -0.14 0.00 -1.51 0.00 0.00 37.83 36.53 3kzi s LYS 79 CO -0.05 -0.06 0.58 -2.30 -0.36 0.00 0.00 175.35 173.17 3kzi n PRO 80 N 2.70 0.52 -0.09 4.03 -0.02 -1.26 -4.86 135.00 136.02 3kzi n PRO 80 Ca -0.15 0.19 -0.13 0.00 -2.02 0.00 0.00 63.50 61.39 3kzi n PRO 80 Cb 0.57 -1.39 -0.04 0.00 -0.02 0.00 0.00 33.50 32.62 3kzi n PRO 80 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 3kzi h MET 81 N 1.04 0.73 -0.00 -0.52 2.86 -1.80 -2.87 114.93 114.37 3kzi h MET 81 Ca -0.37 -0.39 0.00 0.00 -2.06 0.00 0.00 59.70 56.88 3kzi h MET 81 Cb 1.40 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 33.08 3kzi h MET 81 CO 0.54 1.01 0.03 0.10 1.06 0.00 0.00 176.91 179.65 3kzi h TYR 82 N 0.48 0.00 -0.36 -0.22 -0.00 -1.64 0.14 116.97 115.37 3kzi h TYR 82 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.77 3kzi h TYR 82 Cb 0.89 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.62 3kzi h TYR 82 CO 0.07 0.00 0.00 0.39 -0.00 0.00 0.00 178.16 178.62 3kzi n GLU 83 N -3.10 2.94 0.00 0.10 1.02 -1.08 -3.98 120.64 116.53 3kzi n GLU 83 Ca -0.03 -1.77 0.00 0.00 -0.02 0.00 0.00 57.16 55.34 3kzi n GLU 83 Cb 0.10 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 3kzi n GLU 83 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3kzi n GLN 84 N 0.48 0.98 -3.07 3.49 6.02 0.48 -4.99 117.38 120.77 3kzi n GLN 84 Ca 0.16 -0.82 -0.17 0.00 -0.01 0.00 0.00 57.00 56.16 3kzi n GLN 84 Cb 0.69 -0.67 0.04 0.00 1.02 0.00 0.00 30.24 31.31 3kzi n GLN 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kzi n GLY 85 N -0.17 -0.19 3.89 1.08 0.00 -1.24 -4.99 105.19 103.58 3kzi n GLY 85 Ca 0.00 -0.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 3kzi n GLY 85 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kzi s LEU 86 N -5.40 4.35 0.00 0.99 1.02 -1.25 -4.97 118.68 113.42 3kzi s LEU 86 Ca 0.33 0.57 0.00 0.00 0.02 0.00 0.00 54.13 55.06 3kzi s LEU 86 Cb -0.15 -2.84 0.00 0.00 0.02 0.00 0.00 46.19 43.22 3kzi s LEU 86 CO 0.41 0.20 0.00 2.30 0.02 0.00 0.00 176.35 179.29 3kzi n ILE 87 N 0.86 0.00 -0.05 -0.59 -5.35 -1.26 -4.83 119.36 108.14 3kzi n ILE 87 Ca -0.09 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.29 3kzi n ILE 87 Cb 0.52 1.37 -0.04 0.00 -1.74 0.00 0.00 39.64 39.75 3kzi n ILE 87 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3kzi n LEU 88 N 0.00 1.37 -0.35 7.28 4.77 -1.26 -4.32 117.00 124.49 3kzi n LEU 88 Ca 0.00 0.08 0.07 0.00 -0.03 0.00 0.00 56.01 56.13 3kzi n LEU 88 Cb 0.18 -0.32 0.25 0.00 -2.33 0.00 0.00 43.42 41.21 3kzi n LEU 88 CO 0.00 0.34 1.24 0.40 -1.33 0.00 0.00 177.39 178.04 3kzi h ILE 89 N -0.27 0.94 0.00 -0.08 2.04 -1.93 0.35 117.51 118.57 3kzi h ILE 89 Ca -0.25 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.27 3kzi h ILE 89 Cb 1.26 -0.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.22 3kzi h ILE 89 CO -0.12 0.18 0.00 1.55 0.00 0.00 0.00 178.15 179.75 3kzi h PRO 90 N 0.98 0.00 0.06 2.37 0.13 -1.88 0.38 132.00 134.04 3kzi h PRO 90 Ca 0.47 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 65.37 3kzi h PRO 90 Cb 0.45 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.58 3kzi h PRO 90 CO -0.24 0.00 -1.07 0.45 -0.23 0.00 0.00 178.00 176.92 3kzi h HIS 91 N 0.00 0.38 0.01 1.56 3.86 -0.52 -2.80 115.15 117.64 3kzi h HIS 91 Ca 0.00 -0.25 -0.08 0.00 -1.16 0.00 0.00 60.37 58.88 3kzi h HIS 91 Cb 0.37 -0.03 0.01 0.00 1.06 0.00 0.00 27.41 28.82 3kzi h HIS 91 CO 0.00 1.14 -0.33 0.82 0.86 0.00 0.00 177.93 180.42 3kzi h ILE 92 N 0.09 1.54 -0.86 2.45 2.04 -0.81 -3.24 117.51 118.71 3kzi h ILE 92 Ca -0.08 -2.02 0.18 0.00 1.00 0.00 0.00 64.86 63.93 3kzi h ILE 92 Cb 1.76 2.80 -0.11 0.00 -0.74 0.00 0.00 36.82 40.53 3kzi h ILE 92 CO 0.17 0.56 0.41 0.00 0.00 0.00 0.00 178.15 179.29 3kzi h ALA 93 N 0.24 1.33 -0.53 1.87 0.00 -0.99 0.86 119.26 122.04 3kzi h ALA 93 Ca -0.04 0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.00 3kzi h ALA 93 Cb 1.09 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 3kzi h ALA 93 CO 0.06 -0.20 0.35 1.79 0.00 0.00 0.00 179.25 181.25 3kzi h THR 94 N 0.52 1.10 0.00 0.00 1.35 -1.52 -0.25 112.91 114.11 3kzi h THR 94 Ca 0.50 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 66.13 3kzi h THR 94 Cb 0.82 0.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 3kzi h THR 94 CO -0.43 0.12 0.00 0.18 -0.25 0.00 0.00 175.52 175.14 3kzi n LEU 95 N -4.46 0.45 -2.41 3.87 4.77 0.29 0.93 117.00 120.44 3kzi n LEU 95 Ca 0.05 -0.22 -0.00 0.00 -0.03 0.00 0.00 56.01 55.81 3kzi n LEU 95 Cb 0.09 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 3kzi n LEU 95 CO 0.35 0.11 0.20 0.61 -1.33 0.00 0.00 177.39 177.33 3kzi n GLY 96 N 0.23 -0.86 2.83 -0.72 0.00 -0.11 -4.35 105.19 102.21 3kzi n GLY 96 Ca 0.00 0.22 -0.15 0.00 0.00 0.00 0.00 46.02 46.09 3kzi n GLY 96 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3kzi s TRP 97 N -2.95 -0.48 0.00 1.61 0.51 -1.22 -4.85 118.94 111.55 3kzi s TRP 97 Ca 0.01 0.49 0.00 0.00 -2.12 0.00 0.00 56.10 54.48 3kzi s TRP 97 Cb -0.00 -0.20 0.00 0.00 -0.81 0.00 0.00 33.47 32.46 3kzi s TRP 97 CO 0.44 -0.63 0.00 0.41 -0.51 0.00 0.00 176.95 176.66 3kzi n GLY 98 N 5.34 0.53 3.35 0.98 0.00 -1.26 -4.27 105.19 109.87 3kzi n GLY 98 Ca -0.05 -0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.72 3kzi n GLY 98 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kzi s VAL 99 N -2.00 1.07 0.00 1.61 -7.23 -1.26 0.91 120.40 113.50 3kzi s VAL 99 Ca 0.00 -2.03 0.00 0.00 -1.81 0.00 0.00 61.98 58.14 3kzi s VAL 99 Cb 0.00 -2.44 0.00 0.00 0.56 0.00 0.00 36.38 34.50 3kzi s VAL 99 CO 0.00 -0.25 0.00 0.61 -0.31 0.00 0.00 175.10 175.15 3kzi n GLY 100 N -0.48 4.83 3.61 2.32 0.00 0.69 -4.75 105.19 111.41 3kzi n GLY 100 Ca -0.04 -0.62 -0.62 0.00 0.00 0.00 0.00 46.02 44.74 3kzi n GLY 100 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3kzi n PRO 101 N 0.00 0.15 -1.47 1.61 -0.02 -1.26 -1.23 135.00 132.78 3kzi n PRO 101 Ca 0.00 0.06 -0.16 0.00 -2.02 0.00 0.00 63.50 61.37 3kzi n PRO 101 Cb 0.00 -1.58 -0.07 0.00 -0.02 0.00 0.00 33.50 31.83 3kzi n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kzi n GLY 102 N 2.67 1.55 1.68 -1.23 0.00 0.11 -1.43 105.19 108.54 3kzi n GLY 102 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 3kzi n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzi n GLY 103 N -0.29 0.50 3.72 -0.02 0.00 -0.37 -4.97 105.19 103.76 3kzi n GLY 103 Ca -0.16 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 3kzi n GLY 103 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3kzi s GLU 104 N -1.89 4.42 -0.33 1.61 -6.30 -0.51 -4.76 118.70 110.93 3kzi s GLU 104 Ca 0.00 1.89 -0.29 0.00 -2.50 0.00 0.00 54.97 54.07 3kzi s GLU 104 Cb 0.00 -3.29 0.02 0.00 0.00 0.00 0.00 34.13 30.86 3kzi s GLU 104 CO 0.00 -0.26 1.07 0.08 0.02 0.00 0.00 175.26 176.17 3kzi s VAL 105 N 0.74 4.49 -0.16 3.70 1.01 -1.26 -0.22 120.40 128.70 3kzi s VAL 105 Ca 0.59 1.68 -0.13 0.00 0.00 0.00 0.00 61.98 64.12 3kzi s VAL 105 Cb -0.32 -4.43 -0.06 0.00 0.00 0.00 0.00 36.38 31.57 3kzi s VAL 105 CO 0.32 -0.52 -0.19 0.52 0.00 0.00 0.00 175.10 175.22 3kzi n VAL 106 N 5.95 1.46 -4.01 2.92 0.31 0.26 -4.95 118.33 120.27 3kzi n VAL 106 Ca 0.12 0.15 -0.27 0.00 -0.01 0.00 0.00 64.34 64.32 3kzi n VAL 106 Cb 0.47 -2.32 -0.17 0.00 -0.91 0.00 0.00 33.84 30.91 3kzi n VAL 106 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3kzi s ASP 107 N -5.97 2.28 0.00 4.52 2.15 -1.12 -5.00 116.67 113.52 3kzi s ASP 107 Ca -0.21 -0.35 0.29 0.00 0.43 0.00 0.00 52.55 52.71 3kzi s ASP 107 Cb 0.04 -0.93 1.59 0.00 -0.30 0.00 0.00 42.92 43.31 3kzi s ASP 107 CO 0.32 -0.09 2.04 0.35 -0.17 0.00 0.00 175.17 177.63 3kzi n THR 108 N 4.78 0.01 0.13 1.71 -2.24 -1.26 -4.08 114.28 113.32 3kzi n THR 108 Ca -0.15 -0.07 -0.14 0.00 -2.27 0.00 0.00 64.05 61.43 3kzi n THR 108 Cb 0.50 -0.22 -0.08 0.00 -2.10 0.00 0.00 70.33 68.44 3kzi n THR 108 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3kzi h PHE 109 N 0.62 -0.25 -0.73 4.78 3.57 -1.96 -2.24 116.94 120.73 3kzi h PHE 109 Ca 0.00 -0.01 0.20 0.00 3.53 0.00 0.00 57.97 61.70 3kzi h PHE 109 Cb 0.13 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.92 3kzi h PHE 109 CO 0.00 -0.09 0.52 -1.35 -2.23 0.00 0.00 178.31 175.16 3kzi h PRO 110 N -0.34 0.05 0.28 6.41 0.11 -1.92 0.12 132.00 136.71 3kzi h PRO 110 Ca -0.03 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 3kzi h PRO 110 Cb 0.26 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.36 3kzi h PRO 110 CO 0.04 0.04 -0.14 0.74 -0.21 0.00 0.00 178.00 178.47 3kzi h PHE 111 N 0.06 -0.35 -0.73 0.65 0.04 -1.71 -2.06 116.94 112.84 3kzi h PHE 111 Ca 0.35 -0.01 0.11 0.00 2.80 0.00 0.00 57.97 61.23 3kzi h PHE 111 Cb 1.31 0.12 -0.08 0.00 2.20 0.00 0.00 35.95 39.50 3kzi h PHE 111 CO -0.00 -0.00 0.33 0.35 -0.60 0.00 0.00 178.31 178.39 3kzi h PHE 112 N -0.79 0.58 0.13 -0.55 3.57 -0.66 -1.28 116.94 117.95 3kzi h PHE 112 Ca -0.04 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 3kzi h PHE 112 Cb 0.51 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.10 3kzi h PHE 112 CO 0.04 0.16 -0.09 0.28 -2.23 0.00 0.00 178.31 176.46 3kzi h VAL 113 N 0.53 0.00 -1.10 1.41 2.07 -0.80 -0.62 116.25 117.75 3kzi h VAL 113 Ca 0.38 0.00 0.34 0.00 0.82 0.00 0.00 66.70 68.24 3kzi h VAL 113 Cb 0.48 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.12 3kzi h VAL 113 CO -0.32 0.00 0.67 0.58 0.02 0.00 0.00 177.57 178.52 3kzi h VAL 114 N -0.21 0.31 0.27 2.57 2.07 -1.22 -0.17 116.25 119.87 3kzi h VAL 114 Ca -0.02 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 3kzi h VAL 114 Cb 0.17 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.95 3kzi h VAL 114 CO 0.01 0.05 -0.13 1.23 0.02 0.00 0.00 177.57 178.75 3kzi h GLY 115 N 0.28 -0.38 0.96 2.17 0.00 -0.97 -3.02 103.07 102.10 3kzi h GLY 115 Ca 0.72 0.14 -0.03 0.00 0.00 0.00 0.00 47.33 48.16 3kzi h GLY 115 CO -0.48 -0.14 0.16 -0.39 0.00 0.00 0.00 176.54 175.69 3kzi h VAL 116 N -0.73 1.22 -0.02 4.60 -1.51 0.20 -2.30 116.25 117.71 3kzi h VAL 116 Ca -0.04 -0.70 0.03 0.00 -1.23 0.00 0.00 66.70 64.77 3kzi h VAL 116 Cb 0.49 0.82 -0.06 0.00 -2.13 0.00 0.00 31.29 30.41 3kzi h VAL 116 CO 0.06 0.25 -0.40 0.58 -1.23 0.00 0.00 177.57 176.84 3kzi h VAL 117 N 0.59 0.18 0.10 7.19 2.07 -1.18 -0.53 116.25 124.67 3kzi h VAL 117 Ca 0.15 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.69 3kzi h VAL 117 Cb 0.24 0.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.14 3kzi h VAL 117 CO -0.01 0.00 -0.40 0.45 0.02 0.00 0.00 177.57 177.64 3kzi h HIS 118 N -0.54 -1.11 -1.17 1.57 3.86 -1.50 -1.20 115.15 115.06 3kzi h HIS 118 Ca 0.06 0.03 0.37 0.00 -1.16 0.00 0.00 60.37 59.67 3kzi h HIS 118 Cb 0.63 0.47 -0.13 0.00 1.06 0.00 0.00 27.41 29.45 3kzi h HIS 118 CO -0.42 -0.49 0.74 1.25 0.86 0.00 0.00 177.93 179.86 3kzi h LEU 119 N -0.61 0.35 0.30 2.43 5.85 -0.81 -0.25 115.31 122.56 3kzi h LEU 119 Ca 0.03 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.88 3kzi h LEU 119 Cb 0.65 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.80 3kzi h LEU 119 CO -0.25 -0.13 -0.14 0.40 -0.34 0.00 0.00 178.44 177.98 3kzi h ILE 120 N 0.20 0.33 -0.16 4.05 1.08 0.01 -3.18 117.51 119.85 3kzi h ILE 120 Ca 0.75 -0.81 0.05 0.00 -0.39 0.00 0.00 64.86 64.46 3kzi h ILE 120 Cb 2.13 0.56 -0.01 0.00 -3.07 0.00 0.00 36.82 36.43 3kzi h ILE 120 CO -0.45 0.08 0.53 0.28 -0.69 0.00 0.00 178.15 177.91 3kzi h SER 121 N -1.02 0.00 -0.08 1.72 0.02 -0.09 0.79 113.55 114.89 3kzi h SER 121 Ca -0.04 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.80 3kzi h SER 121 Cb 0.45 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 3kzi h SER 121 CO 0.07 0.00 -0.28 0.77 -1.14 0.00 0.00 176.83 176.25 3kzi h SER 122 N 0.00 0.54 -0.23 3.07 4.64 -1.18 -1.00 113.55 119.39 3kzi h SER 122 Ca 0.08 -0.20 -0.10 0.00 -0.47 0.00 0.00 61.79 61.10 3kzi h SER 122 Cb 1.13 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3kzi h SER 122 CO -0.00 0.81 -0.25 0.00 -0.87 0.00 0.00 176.83 176.51 3kzi h ALA 123 N 1.23 0.34 0.39 5.18 0.00 0.51 0.53 119.26 127.45 3kzi h ALA 123 Ca 0.06 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 3kzi h ALA 123 Cb 0.73 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3kzi h ALA 123 CO 0.06 0.32 -0.25 0.28 0.00 0.00 0.00 179.25 179.66 3kzi h VAL 124 N 0.27 0.49 0.06 0.00 2.07 -1.33 -0.52 116.25 117.29 3kzi h VAL 124 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 3kzi h VAL 124 Cb 0.82 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 3kzi h VAL 124 CO 0.06 0.00 -0.06 -0.07 0.02 0.00 0.00 177.57 177.52 3kzi h LEU 125 N -0.61 -0.17 -1.31 2.57 3.38 -1.23 -2.35 115.31 115.59 3kzi h LEU 125 Ca -0.04 0.02 0.23 0.00 0.09 0.00 0.00 57.88 58.17 3kzi h LEU 125 Cb 0.51 0.06 -0.09 0.00 0.09 0.00 0.00 40.66 41.23 3kzi h LEU 125 CO 0.04 -0.10 0.63 1.23 0.09 0.00 0.00 178.44 180.33 3kzi h GLY 126 N -0.14 1.26 0.52 0.83 0.00 -0.74 0.55 103.07 105.34 3kzi h GLY 126 Ca 0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 3kzi h GLY 126 CO -0.02 -0.08 -0.31 -2.75 0.00 0.00 0.00 176.54 173.38 3kzi h PHE 127 N 0.50 -0.83 -0.84 5.60 3.57 -0.55 -1.30 116.94 123.09 3kzi h PHE 127 Ca 0.55 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 62.23 3kzi h PHE 127 Cb 1.25 0.29 -0.11 0.00 2.79 0.00 0.00 35.95 40.16 3kzi h PHE 127 CO -0.00 -0.47 0.34 0.78 -2.23 0.00 0.00 178.31 176.73 3kzi h GLY 128 N -0.77 1.35 0.30 2.40 0.00 -0.88 0.14 103.07 105.61 3kzi h GLY 128 Ca -0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 3kzi h GLY 128 CO 0.08 -0.19 -0.24 -1.33 0.00 0.00 0.00 176.54 174.85 3kzi h GLY 129 N 0.41 -0.89 -0.21 4.60 0.00 -0.80 0.66 103.07 106.85 3kzi h GLY 129 Ca 0.49 0.39 0.17 0.00 0.00 0.00 0.00 47.33 48.38 3kzi h GLY 129 CO -0.48 -0.30 0.13 -2.08 0.00 0.00 0.00 176.54 173.81 3kzi h VAL 130 N -0.52 0.43 0.39 4.60 2.07 -0.54 -1.66 116.25 121.03 3kzi h VAL 130 Ca -0.04 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 3kzi h VAL 130 Cb 0.44 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 3kzi h VAL 130 CO 0.01 0.04 -0.36 0.22 0.02 0.00 0.00 177.57 177.50 3kzi h TYR 131 N 0.20 -0.98 0.00 1.57 3.20 -0.47 -2.13 116.97 118.36 3kzi h TYR 131 Ca 0.43 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.30 3kzi h TYR 131 Cb 0.76 0.38 0.00 0.00 1.54 0.00 0.00 36.73 39.41 3kzi h TYR 131 CO -0.31 -0.48 0.09 0.45 -1.64 0.00 0.00 178.16 176.26 3kzi h HIS 132 N -0.74 0.00 0.00 -3.82 3.86 -0.22 -0.88 115.15 113.35 3kzi h HIS 132 Ca -0.05 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 3kzi h HIS 132 Cb 0.63 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.10 3kzi h HIS 132 CO -0.17 0.00 -1.18 0.00 0.86 0.00 0.00 177.93 177.44 3kzi n ALA 133 N -1.83 4.16 -0.41 2.45 0.00 -0.68 -3.73 120.51 120.46 3kzi n ALA 133 Ca -0.02 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.88 3kzi n ALA 133 Cb 0.13 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 18.86 3kzi n ALA 133 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3kzi n ILE 134 N -1.65 0.00 0.02 0.00 -5.35 -0.83 -4.97 119.36 106.59 3kzi n ILE 134 Ca 0.02 -0.04 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 3kzi n ILE 134 Cb 0.36 1.41 0.00 0.00 -1.74 0.00 0.00 39.64 39.68 3kzi n ILE 134 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 3kzi n ARG 135 N -0.05 0.00 -0.56 6.28 0.00 -0.38 -5.07 116.66 116.88 3kzi n ARG 135 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 57.72 3kzi n ARG 135 Cb 0.10 -0.09 0.11 0.00 0.00 0.00 0.00 32.46 32.59 3kzi n ARG 135 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3kzi n GLY 136 N 2.91 -2.16 3.64 5.14 0.00 -1.02 -4.82 105.19 108.88 3kzi n GLY 136 Ca 0.00 -0.65 -0.46 0.00 0.00 0.00 0.00 46.02 44.91 3kzi n GLY 136 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3kzi n PRO 137 N -0.98 1.74 0.14 1.61 -0.04 -1.26 -4.88 135.00 131.33 3kzi n PRO 137 Ca 0.05 0.62 0.13 0.00 -0.04 0.00 0.00 63.50 64.26 3kzi n PRO 137 Cb 0.25 -2.22 0.41 0.00 -0.04 0.00 0.00 33.50 31.90 3kzi n PRO 137 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3kzi h GLU 138 N 3.87 0.00 -4.51 0.54 4.81 -1.88 -3.35 114.58 114.07 3kzi h GLU 138 Ca -0.44 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.59 3kzi h GLU 138 Cb 1.30 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.53 3kzi h GLU 138 CO 0.73 0.00 -0.68 -0.08 -0.73 0.00 0.00 179.01 178.25 3kzi s THR 139 N -3.21 0.46 -0.12 0.32 -1.32 -1.26 -3.41 115.64 107.11 3kzi s THR 139 Ca 0.08 -1.90 -0.02 0.00 -1.21 0.00 0.00 61.69 58.65 3kzi s THR 139 Cb 0.10 -1.73 -0.07 0.00 -1.51 0.00 0.00 72.50 69.29 3kzi s THR 139 CO 0.56 -0.81 -0.12 0.18 -2.21 0.00 0.00 174.62 172.21 3kzi n LEU 140 N -0.02 2.27 -0.13 9.08 4.77 -1.26 -4.43 117.00 127.28 3kzi n LEU 140 Ca -0.11 0.01 0.10 0.00 -0.03 0.00 0.00 56.01 55.98 3kzi n LEU 140 Cb 0.62 -0.40 0.18 0.00 -2.33 0.00 0.00 43.42 41.49 3kzi n LEU 140 CO 0.30 0.55 0.37 -0.62 -1.33 0.00 0.00 177.39 176.66 3kzi n GLU 141 N -3.09 -0.03 -0.00 3.23 4.71 -1.26 -0.50 120.64 123.70 3kzi n GLU 141 Ca -0.22 0.54 -0.22 0.00 -0.01 0.00 0.00 57.16 57.25 3kzi n GLU 141 Cb 0.71 -0.93 -0.14 0.00 -1.01 0.00 0.00 31.44 30.07 3kzi n GLU 141 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 3kzi h GLU 142 N 0.00 0.24 -0.14 3.49 4.81 -1.97 -3.19 114.58 117.82 3kzi h GLU 142 Ca 0.29 -0.41 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 3kzi h GLU 142 Cb 0.71 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.25 3kzi h GLU 142 CO -0.32 1.20 0.00 0.66 -0.73 0.00 0.00 179.01 179.82 3kzi n TYR 143 N -3.68 0.00 0.00 0.92 0.53 0.34 -4.54 117.16 110.73 3kzi n TYR 143 Ca -0.31 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.57 3kzi n TYR 143 Cb 0.98 -0.01 0.00 0.00 -1.03 0.00 0.00 39.34 39.28 3kzi n TYR 143 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 3kzi n SER 144 N -0.31 0.00 0.14 7.72 2.88 -1.03 -5.03 113.62 117.98 3kzi n SER 144 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 3kzi n SER 144 Cb 0.03 0.00 0.48 0.00 -0.75 0.00 0.00 64.21 63.97 3kzi n SER 144 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 3kzi h SER 145 N 0.00 0.00 -0.20 -3.46 0.87 -1.78 -1.98 113.55 107.00 3kzi h SER 145 Ca 0.00 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.45 3kzi h SER 145 Cb 0.00 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 61.96 3kzi h SER 145 CO 0.00 0.00 -0.32 0.15 -0.53 0.00 0.00 176.83 176.13 3kzi h PHE 146 N 0.00 0.72 0.13 2.24 3.57 -1.93 -3.35 116.94 118.31 3kzi h PHE 146 Ca 0.00 -0.24 -0.32 0.00 3.53 0.00 0.00 57.97 60.94 3kzi h PHE 146 Cb 0.49 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 3kzi h PHE 146 CO 0.00 0.97 -1.66 0.74 -2.23 0.00 0.00 178.31 176.14 3kzi h PHE 147 N 0.25 0.49 -3.41 0.41 0.04 -1.91 -3.46 116.94 109.35 3kzi h PHE 147 Ca 0.02 -0.36 -0.55 0.00 2.80 0.00 0.00 57.97 59.88 3kzi h PHE 147 Cb 0.91 -0.02 0.19 0.00 2.20 0.00 0.00 35.95 39.22 3kzi h PHE 147 CO 0.09 1.65 -0.27 0.41 -0.60 0.00 0.00 178.31 179.59 3kzi n GLY 148 N 1.82 -1.26 3.38 -1.45 0.00 -0.75 -4.87 105.19 102.06 3kzi n GLY 148 Ca -0.28 -0.42 -0.10 0.00 0.00 0.00 0.00 46.02 45.23 3kzi n GLY 148 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kzi s TYR 149 N -1.96 0.10 -0.17 1.61 1.13 -1.26 -4.75 117.35 112.05 3kzi s TYR 149 Ca 0.67 -0.46 0.01 0.00 -1.41 0.00 0.00 57.07 55.88 3kzi s TYR 149 Cb -0.33 0.14 0.03 0.00 -1.10 0.00 0.00 41.96 40.70 3kzi s TYR 149 CO 0.57 -0.76 -0.13 0.34 -2.51 0.00 0.00 175.55 173.05 3kzi s ASP 150 N -2.90 3.02 0.22 -0.18 -1.08 -1.26 -4.91 116.67 109.59 3kzi s ASP 150 Ca 0.11 -0.66 -0.14 0.00 -0.52 0.00 0.00 52.55 51.33 3kzi s ASP 150 Cb 0.02 -1.24 0.27 0.00 -1.46 0.00 0.00 42.92 40.50 3kzi s ASP 150 CO -0.04 -0.08 1.59 -0.50 0.52 0.00 0.00 175.17 176.66 3kzi h TRP 151 N 8.01 -0.60 0.00 -5.34 -0.00 -1.97 0.85 115.95 116.90 3kzi h TRP 151 Ca -0.35 0.07 0.00 0.00 -0.00 0.00 0.00 58.89 58.61 3kzi h TRP 151 Cb 1.12 0.38 0.00 0.00 -0.00 0.00 0.00 29.16 30.66 3kzi h TRP 151 CO 0.49 -0.35 0.00 1.63 -0.00 0.00 0.00 178.44 180.21 3kzi n LYS 152 N -5.49 0.57 -2.22 0.49 5.02 -1.26 -4.45 118.16 110.82 3kzi n LYS 152 Ca 0.09 0.02 -0.40 0.00 -2.02 0.00 0.00 58.31 56.00 3kzi n LYS 152 Cb 0.39 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.88 3kzi n LYS 152 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3kzi n ASP 153 N -1.05 4.23 -0.44 4.39 -0.08 0.30 -4.80 116.55 119.08 3kzi n ASP 153 Ca 0.14 -2.85 0.39 0.00 -1.51 0.00 0.00 54.79 50.97 3kzi n ASP 153 Cb 0.09 -1.69 0.60 0.00 2.34 0.00 0.00 41.12 42.46 3kzi n ASP 153 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 3kzi n LYS 154 N 7.81 0.01 -0.03 -0.67 5.02 -1.26 -0.79 118.16 128.25 3kzi n LYS 154 Ca 0.49 1.03 -0.20 0.00 -2.02 0.00 0.00 58.31 57.61 3kzi n LYS 154 Cb 0.44 -2.47 -0.13 0.00 -0.02 0.00 0.00 35.03 32.85 3kzi n LYS 154 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 3kzi h ASN 155 N 0.00 0.22 -0.58 4.39 -0.26 -1.87 -2.00 115.58 115.48 3kzi h ASN 155 Ca 0.69 -0.81 0.04 0.00 -0.56 0.00 0.00 56.30 55.67 3kzi h ASN 155 Cb 3.28 -0.07 -0.05 0.00 -1.06 0.00 0.00 38.32 40.42 3kzi h ASN 155 CO -0.01 1.44 0.32 0.11 -1.06 0.00 0.00 177.43 178.23 3kzi h LYS 156 N -0.62 0.59 0.88 0.81 1.57 -1.30 0.20 116.57 118.70 3kzi h LYS 156 Ca -0.24 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.46 3kzi h LYS 156 Cb 1.48 -0.13 0.01 0.00 0.08 0.00 0.00 32.23 33.66 3kzi h LYS 156 CO -0.01 0.39 -0.46 0.52 -0.57 0.00 0.00 179.45 179.33 3kzi h MET 157 N 0.61 -1.18 -0.60 3.15 2.86 -1.47 0.29 114.93 118.60 3kzi h MET 157 Ca 0.25 0.08 0.17 0.00 -2.06 0.00 0.00 59.70 58.14 3kzi h MET 157 Cb 0.12 0.27 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 3kzi h MET 157 CO -0.15 -0.79 0.52 0.00 1.06 0.00 0.00 176.91 177.55 3kzi h THR 158 N -1.22 0.48 0.00 2.22 1.03 -0.98 -0.46 112.91 113.97 3kzi h THR 158 Ca -0.12 0.00 -0.05 0.00 -0.01 0.00 0.00 66.41 66.23 3kzi h THR 158 Cb 0.95 0.61 -0.01 0.00 -1.07 0.00 0.00 68.15 68.64 3kzi h THR 158 CO 0.18 0.00 -0.30 0.74 -0.01 0.00 0.00 175.52 176.12 3kzi h THR 159 N 0.00 1.48 -0.71 0.00 2.02 0.10 -2.08 112.91 113.72 3kzi h THR 159 Ca 0.28 -2.22 0.05 0.00 0.77 0.00 0.00 66.41 65.29 3kzi h THR 159 Cb 1.32 2.91 -0.05 0.00 -1.74 0.00 0.00 68.15 70.58 3kzi h THR 159 CO -0.00 0.50 0.42 0.40 0.37 0.00 0.00 175.52 177.21 3kzi h ILE 160 N -1.00 1.02 -0.87 3.11 2.04 0.05 0.31 117.51 122.17 3kzi h ILE 160 Ca -0.08 -0.27 0.09 0.00 1.00 0.00 0.00 64.86 65.60 3kzi h ILE 160 Cb 1.02 0.16 -0.07 0.00 -0.74 0.00 0.00 36.82 37.19 3kzi h ILE 160 CO -0.05 0.14 0.51 0.25 0.00 0.00 0.00 178.15 179.01 3kzi h LEU 161 N 0.78 0.75 -1.05 1.44 5.85 -1.21 -0.94 115.31 120.93 3kzi h LEU 161 Ca 0.31 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 59.03 3kzi h LEU 161 Cb 0.14 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 3kzi h LEU 161 CO -0.16 0.43 0.22 1.23 -0.34 0.00 0.00 178.44 179.83 3kzi h GLY 162 N 0.87 0.96 0.87 3.75 0.00 0.23 0.28 103.07 110.03 3kzi h GLY 162 Ca 0.41 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 47.22 3kzi h GLY 162 CO -0.24 0.48 -0.16 0.74 0.00 0.00 0.00 176.54 177.36 3kzi h PHE 163 N 0.88 -0.43 -0.51 5.60 0.04 0.55 -2.99 116.94 120.08 3kzi h PHE 163 Ca 0.20 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.96 3kzi h PHE 163 Cb 0.21 0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.47 3kzi h PHE 163 CO 0.01 -0.18 0.32 0.45 -0.60 0.00 0.00 178.31 178.31 3kzi h HIS 164 N -0.60 0.65 0.00 -0.55 3.86 -1.19 -0.88 115.15 116.45 3kzi h HIS 164 Ca -0.05 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 3kzi h HIS 164 Cb 0.44 -0.22 0.00 0.00 1.06 0.00 0.00 27.41 28.69 3kzi h HIS 164 CO -0.02 0.43 0.00 -0.07 0.86 0.00 0.00 177.93 179.13 3kzi h LEU 165 N 0.69 0.00 0.05 2.43 3.38 -0.83 -1.13 115.31 119.91 3kzi h LEU 165 Ca 0.18 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.81 3kzi h LEU 165 Cb -0.05 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 3kzi h LEU 165 CO -0.04 0.00 -1.96 -0.38 0.09 0.00 0.00 178.44 176.16 3kzi n ILE 166 N -2.79 1.63 -0.27 1.22 5.41 -0.40 -3.10 119.36 121.05 3kzi n ILE 166 Ca -0.01 -0.44 -0.00 0.00 1.00 0.00 0.00 62.75 63.29 3kzi n ILE 166 Cb 0.13 -1.78 0.12 0.00 -0.71 0.00 0.00 39.64 37.40 3kzi n ILE 166 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3kzi h VAL 167 N -0.36 1.00 -0.24 1.39 2.07 -1.02 0.22 116.25 119.31 3kzi h VAL 167 Ca -0.47 -0.28 -0.12 0.00 0.82 0.00 0.00 66.70 66.65 3kzi h VAL 167 Cb 1.76 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 3kzi h VAL 167 CO -0.09 0.15 -0.38 -0.07 0.02 0.00 0.00 177.57 177.20 3kzi h LEU 168 N 0.82 0.56 -0.55 2.57 3.38 -1.39 -2.53 115.31 118.17 3kzi h LEU 168 Ca 0.34 -0.24 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 3kzi h LEU 168 Cb 0.18 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3kzi h LEU 168 CO -0.18 0.88 -0.01 1.23 0.09 0.00 0.00 178.44 180.46 3kzi h GLY 169 N 1.07 1.05 0.97 0.83 0.00 -1.08 -1.57 103.07 104.32 3kzi h GLY 169 Ca 0.04 -0.77 -0.00 0.00 0.00 0.00 0.00 47.33 46.59 3kzi h GLY 169 CO 0.07 0.71 0.20 -2.22 0.00 0.00 0.00 176.54 175.30 3kzi h ILE 170 N 0.85 1.13 -0.58 2.60 2.04 -0.56 -2.59 117.51 120.40 3kzi h ILE 170 Ca 0.15 -0.32 0.11 0.00 1.00 0.00 0.00 64.86 65.80 3kzi h ILE 170 Cb 0.54 0.72 -0.09 0.00 -0.74 0.00 0.00 36.82 37.26 3kzi h ILE 170 CO 0.03 0.13 0.09 1.23 0.00 0.00 0.00 178.15 179.63 3kzi h GLY 171 N 0.44 0.70 1.37 5.37 0.00 -1.12 0.21 103.07 110.04 3kzi h GLY 171 Ca 0.12 -0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.54 3kzi h GLY 171 CO -0.02 -0.12 0.23 0.00 0.00 0.00 0.00 176.54 176.63 3kzi h ALA 172 N 1.47 2.24 0.00 3.60 0.00 -0.91 0.93 119.26 126.59 3kzi h ALA 172 Ca 0.30 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 55.03 3kzi h ALA 172 Cb 0.45 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 3kzi h ALA 172 CO -0.41 -0.39 -1.12 -0.07 0.00 0.00 0.00 179.25 177.27 3kzi h LEU 173 N 0.00 0.00 -2.62 0.00 3.38 -0.51 -3.14 115.31 112.43 3kzi h LEU 173 Ca 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3kzi h LEU 173 Cb 0.60 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 3kzi h LEU 173 CO -0.00 0.68 -0.00 0.25 0.09 0.00 0.00 178.44 179.45 3kzi h LEU 174 N 0.00 0.00 0.00 1.67 6.46 0.17 0.88 115.31 124.49 3kzi h LEU 174 Ca -0.11 0.00 -0.08 0.00 -0.12 0.00 0.00 57.88 57.57 3kzi h LEU 174 Cb 1.61 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.53 3kzi h LEU 174 CO 0.07 0.00 -0.48 0.25 -0.62 0.00 0.00 178.44 177.66 3kzi h LEU 175 N 0.00 0.00 -1.85 2.25 5.85 -1.49 -3.15 115.31 116.92 3kzi h LEU 175 Ca -0.00 -0.68 0.31 0.00 0.84 0.00 0.00 57.88 58.35 3kzi h LEU 175 Cb 0.01 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 40.99 3kzi h LEU 175 CO 0.00 1.12 0.77 0.58 -0.34 0.00 0.00 178.44 180.57 3kzi h VAL 176 N -1.00 0.46 0.12 1.05 2.07 -1.23 -1.19 116.25 116.53 3kzi h VAL 176 Ca -0.13 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 3kzi h VAL 176 Cb 1.00 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 3kzi h VAL 176 CO -0.08 0.02 -0.06 0.00 0.02 0.00 0.00 177.57 177.47 3kzi h ALA 177 N 1.49 -0.16 -0.97 1.67 0.00 -0.97 -2.26 119.26 118.06 3kzi h ALA 177 Ca 0.54 -0.25 0.19 0.00 0.00 0.00 0.00 54.91 55.39 3kzi h ALA 177 Cb 1.98 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 19.74 3kzi h ALA 177 CO -0.08 -0.26 0.61 -0.22 0.00 0.00 0.00 179.25 179.30 3kzi h LYS 178 N -0.81 0.62 0.05 0.00 1.63 -1.19 0.38 116.57 117.25 3kzi h LYS 178 Ca -0.02 -0.04 -0.19 0.00 -0.85 0.00 0.00 60.65 59.55 3kzi h LYS 178 Cb 0.56 -0.14 0.02 0.00 -0.60 0.00 0.00 32.23 32.07 3kzi h LYS 178 CO 0.03 0.41 -0.78 0.00 -3.45 0.00 0.00 179.45 175.65 3kzi h ALA 179 N 1.62 0.02 0.05 5.00 0.00 -1.47 -0.71 119.26 123.78 3kzi h ALA 179 Ca 0.53 -0.64 -0.29 0.00 0.00 0.00 0.00 54.91 54.51 3kzi h ALA 179 Cb 0.99 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 3kzi h ALA 179 CO -0.29 0.43 -1.57 0.52 0.00 0.00 0.00 179.25 178.34 3kzi h MET 180 N -0.07 0.11 0.00 0.00 2.86 -1.00 -2.65 114.93 114.18 3kzi h MET 180 Ca -0.11 -0.19 -0.08 0.00 -2.06 0.00 0.00 59.70 57.26 3kzi h MET 180 Cb 1.51 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 33.23 3kzi h MET 180 CO 0.15 0.86 -0.95 1.19 1.06 0.00 0.00 176.91 179.22 3kzi n PHE 181 N -3.28 0.00 1.54 -0.22 3.72 0.13 -4.79 117.46 114.56 3kzi n PHE 181 Ca -0.16 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.32 3kzi n PHE 181 Cb 1.03 -0.24 0.48 0.00 -0.94 0.00 0.00 39.48 39.81 3kzi n PHE 181 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 3kzi n PHE 182 N -3.58 0.00 0.00 1.38 3.72 -0.84 -4.84 117.46 113.30 3kzi n PHE 182 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 3kzi n PHE 182 Cb 0.41 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.95 3kzi n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3kzi n GLY 183 N 0.45 2.49 0.00 1.37 0.00 -0.65 -4.97 105.19 103.87 3kzi n GLY 183 Ca 0.12 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3kzi n GLY 183 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzi n GLY 184 N 0.00 0.35 3.37 -0.02 0.00 -0.36 -4.30 105.19 104.22 3kzi n GLY 184 Ca 0.00 -2.21 -0.10 0.00 0.00 0.00 0.00 46.02 43.72 3kzi n GLY 184 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kzi s LEU 185 N 0.00 0.86 -0.37 0.99 1.43 -0.93 -4.21 118.68 116.46 3kzi s LEU 185 Ca 0.00 -0.93 -0.28 0.00 -1.03 0.00 0.00 54.13 51.89 3kzi s LEU 185 Cb 0.00 1.22 0.02 0.00 0.03 0.00 0.00 46.19 47.46 3kzi s LEU 185 CO 0.00 -0.93 1.05 -0.47 0.23 0.00 0.00 176.35 176.23 3kzi s TYR 186 N -3.99 3.05 -0.33 0.29 5.04 0.26 -1.22 117.35 120.45 3kzi s TYR 186 Ca 0.20 0.97 -0.09 0.00 -2.44 0.00 0.00 57.07 55.70 3kzi s TYR 186 Cb 0.03 -3.86 0.01 0.00 0.35 0.00 0.00 41.96 38.49 3kzi s TYR 186 CO 0.03 -0.91 0.15 0.34 -1.34 0.00 0.00 175.55 173.82 3kzi s ASP 187 N 1.91 5.51 0.38 4.32 2.15 -0.80 -4.93 116.67 125.21 3kzi s ASP 187 Ca 0.44 -0.76 0.20 0.00 0.43 0.00 0.00 52.55 52.86 3kzi s ASP 187 Cb -0.11 -1.97 0.52 0.00 -0.30 0.00 0.00 42.92 41.05 3kzi s ASP 187 CO 0.20 -0.27 1.65 0.71 -0.17 0.00 0.00 175.17 177.30 3kzi h THR 188 N 5.81 0.61 -0.00 1.71 1.35 -1.87 -0.79 112.91 119.73 3kzi h THR 188 Ca -0.29 -1.54 0.00 0.00 -0.55 0.00 0.00 66.41 64.03 3kzi h THR 188 Cb 1.12 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 69.60 3kzi h THR 188 CO 0.63 0.30 0.00 0.79 -0.25 0.00 0.00 175.52 176.99 3kzi n TRP 189 N -3.29 0.00 -1.08 4.73 7.02 -1.26 -2.74 117.44 120.82 3kzi n TRP 189 Ca 0.01 -0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.07 3kzi n TRP 189 Cb 0.56 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.39 3kzi n TRP 189 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3kzi n ALA 190 N -0.82 -2.40 -0.17 6.99 0.00 -1.08 -4.77 120.51 118.25 3kzi n ALA 190 Ca 0.22 0.41 -0.03 0.00 0.00 0.00 0.00 53.44 54.03 3kzi n ALA 190 Cb 0.14 -1.25 0.03 0.00 0.00 0.00 0.00 19.45 18.37 3kzi n ALA 190 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3kzi h PRO 191 N 2.34 -0.08 0.00 0.00 0.11 -1.92 0.58 132.00 133.03 3kzi h PRO 191 Ca -0.35 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3kzi h PRO 191 Cb 0.99 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.12 3kzi h PRO 191 CO 0.49 -0.06 0.00 0.41 -0.21 0.00 0.00 178.00 178.64 3kzi n GLY 192 N -1.41 -0.95 0.00 -0.55 0.00 -1.26 -4.93 105.19 96.08 3kzi n GLY 192 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3kzi n GLY 192 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzi n GLY 193 N 0.61 2.31 0.00 -0.02 0.00 0.20 -5.02 105.19 103.28 3kzi n GLY 193 Ca 0.08 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.64 3kzi n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzi n GLY 194 N 1.97 0.00 3.62 -0.02 0.00 -1.11 -4.51 105.19 105.14 3kzi n GLY 194 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 3kzi n GLY 194 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3kzi s ASP 195 N 0.00 -0.08 -0.00 1.61 2.15 -0.32 0.04 116.67 120.07 3kzi s ASP 195 Ca 0.00 0.02 -0.30 0.00 0.43 0.00 0.00 52.55 52.70 3kzi s ASP 195 Cb 0.00 0.08 -0.06 0.00 -0.30 0.00 0.00 42.92 42.64 3kzi s ASP 195 CO 0.00 -0.13 1.57 -0.69 -0.17 0.00 0.00 175.17 175.75 3kzi s VAL 196 N -2.03 3.46 0.00 1.11 1.01 -1.26 -1.90 120.40 120.79 3kzi s VAL 196 Ca 0.10 0.77 0.03 0.00 0.00 0.00 0.00 61.98 62.88 3kzi s VAL 196 Cb -0.01 -3.50 -0.01 0.00 0.00 0.00 0.00 36.38 32.86 3kzi s VAL 196 CO -0.04 -0.03 -0.11 -0.60 0.00 0.00 0.00 175.10 174.33 3kzi s ARG 197 N 3.11 0.82 -0.33 2.72 3.52 -0.35 -4.92 118.95 123.52 3kzi s ARG 197 Ca 0.70 -0.44 -0.24 0.00 -0.13 0.00 0.00 55.73 55.63 3kzi s ARG 197 Cb -0.34 -0.79 0.00 0.00 -1.56 0.00 0.00 34.95 32.26 3kzi s ARG 197 CO 0.29 0.21 0.80 0.08 -0.81 0.00 0.00 175.30 175.87 3kzi s VAL 198 N -0.39 4.76 -0.31 7.11 1.01 -1.26 -2.18 120.40 129.15 3kzi s VAL 198 Ca 0.03 1.10 -0.28 0.00 0.00 0.00 0.00 61.98 62.82 3kzi s VAL 198 Cb -0.05 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 32.16 3kzi s VAL 198 CO -0.00 -0.33 1.02 -0.63 0.00 0.00 0.00 175.10 175.16 3kzi s ILE 199 N 3.04 4.58 -0.38 2.22 1.09 -1.00 -4.90 121.20 125.85 3kzi s ILE 199 Ca 0.33 1.67 0.11 0.00 -1.10 0.00 0.00 60.65 61.66 3kzi s ILE 199 Cb -0.14 -4.36 0.44 0.00 -1.06 0.00 0.00 42.46 37.34 3kzi s ILE 199 CO 0.14 -0.41 1.03 0.35 -0.10 0.00 0.00 174.94 175.96 3kzi n THR 200 N 5.75 1.73 -2.66 2.92 -2.24 -1.26 -3.90 114.28 114.61 3kzi n THR 200 Ca 0.11 -4.07 -0.03 0.00 -2.27 0.00 0.00 64.05 57.79 3kzi n THR 200 Cb 0.47 -0.37 0.02 0.00 -2.10 0.00 0.00 70.33 68.35 3kzi n THR 200 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3kzi n ASN 201 N -0.28 -1.12 -4.72 3.42 2.85 -1.26 -5.14 115.26 109.01 3kzi n ASN 201 Ca 0.25 -1.65 -0.42 0.00 -0.11 0.00 0.00 54.58 52.65 3kzi n ASN 201 Cb 0.73 1.03 -0.03 0.00 1.24 0.00 0.00 39.78 42.75 3kzi n ASN 201 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3kzi n PRO 202 N -0.24 2.78 -1.72 1.20 -0.04 -1.26 -4.86 135.00 130.85 3kzi n PRO 202 Ca -0.23 1.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.81 3kzi n PRO 202 Cb 0.67 -2.85 -0.03 0.00 -0.04 0.00 0.00 33.50 31.25 3kzi n PRO 202 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3kzi s THR 203 N 1.30 3.12 -0.38 0.52 2.01 -1.07 -4.76 115.64 116.38 3kzi s THR 203 Ca 0.76 0.14 0.08 0.00 0.31 0.00 0.00 61.69 62.97 3kzi s THR 203 Cb -0.50 -3.11 -0.08 0.00 0.01 0.00 0.00 72.50 68.82 3kzi s THR 203 CO 0.33 -0.04 0.34 0.18 -0.69 0.00 0.00 174.62 174.73 3kzi n LEU 204 N 8.83 0.40 -4.55 4.42 4.77 -1.26 -3.90 117.00 125.71 3kzi n LEU 204 Ca 0.23 -0.52 -0.43 0.00 -0.03 0.00 0.00 56.01 55.26 3kzi n LEU 204 Cb 0.43 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.47 3kzi n LEU 204 CO 0.67 0.10 1.91 -0.67 -1.33 0.00 0.00 177.39 178.07 3kzi n ASP 205 N -1.13 2.59 -0.29 -1.43 -0.08 -1.26 -4.84 116.55 110.12 3kzi n ASP 205 Ca 0.02 0.04 0.03 0.00 -1.51 0.00 0.00 54.79 53.37 3kzi n ASP 205 Cb 0.12 -1.47 0.17 0.00 2.34 0.00 0.00 41.12 42.28 3kzi n ASP 205 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3kzi h PRO 206 N 15.67 0.73 -0.98 -0.67 0.13 -1.98 -0.45 132.00 144.46 3kzi h PRO 206 Ca -0.31 -0.04 0.28 0.00 -0.87 0.00 0.00 66.00 65.05 3kzi h PRO 206 Cb 1.27 -0.17 -0.14 0.00 0.13 0.00 0.00 31.00 32.10 3kzi h PRO 206 CO 1.05 0.48 0.52 -0.09 -0.23 0.00 0.00 178.00 179.73 3kzi h ARG 207 N 0.75 0.39 0.00 0.86 2.43 -1.97 -0.96 114.38 115.88 3kzi h ARG 207 Ca 0.40 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 3kzi h ARG 207 Cb 0.40 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 3kzi h ARG 207 CO -0.26 0.26 -0.09 0.28 -1.51 0.00 0.00 179.97 178.64 3kzi h VAL 208 N 0.40 0.00 0.00 0.20 2.07 -1.61 -3.05 116.25 114.27 3kzi h VAL 208 Ca 0.67 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 67.45 3kzi h VAL 208 Cb 1.40 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 3kzi h VAL 208 CO -0.56 0.00 0.00 -0.38 0.02 0.00 0.00 177.57 176.65 3kzi n ILE 209 N -4.03 0.00 0.11 4.57 2.08 -0.30 0.82 119.36 122.62 3kzi n ILE 209 Ca -0.01 1.20 0.02 0.00 0.56 0.00 0.00 62.75 64.51 3kzi n ILE 209 Cb 0.05 -1.65 0.07 0.00 -0.75 0.00 0.00 39.64 37.36 3kzi n ILE 209 CO 0.00 0.00 0.00 0.49 0.56 0.00 0.00 176.55 177.60 3kzi n PHE 210 N -2.20 0.00 -0.31 1.39 3.72 -0.39 -2.40 117.46 117.27 3kzi n PHE 210 Ca 0.00 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.41 3kzi n PHE 210 Cb 0.00 -0.50 0.14 0.00 -0.94 0.00 0.00 39.48 38.19 3kzi n PHE 210 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3kzi h GLY 211 N 0.57 1.28 -0.12 1.37 0.00 0.54 -1.77 103.07 104.94 3kzi h GLY 211 Ca 0.00 -0.38 0.21 0.00 0.00 0.00 0.00 47.33 47.17 3kzi h GLY 211 CO 0.00 0.25 0.43 -0.97 0.00 0.00 0.00 176.54 176.24 3kzi h TYR 212 N 0.95 0.72 0.00 5.60 0.05 -1.43 0.19 116.97 123.05 3kzi h TYR 212 Ca 0.37 0.04 -0.01 0.00 0.05 0.00 0.00 58.73 59.19 3kzi h TYR 212 Cb 0.19 -0.18 -0.00 0.00 1.01 0.00 0.00 36.73 37.75 3kzi h TYR 212 CO -0.04 0.01 -0.03 -0.07 -1.05 0.00 0.00 178.16 176.98 3kzi h LEU 213 N 0.46 0.00 -2.08 3.88 4.07 -1.53 -1.75 115.31 118.36 3kzi h LEU 213 Ca 0.55 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.51 3kzi h LEU 213 Cb 1.01 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.75 3kzi h LEU 213 CO -0.49 0.03 0.00 0.18 -1.08 0.00 0.00 178.44 177.07 3kzi n LEU 214 N -3.19 3.04 -4.79 1.67 4.32 0.67 -4.93 117.00 113.79 3kzi n LEU 214 Ca -0.01 -1.47 -0.38 0.00 -0.02 0.00 0.00 56.01 54.13 3kzi n LEU 214 Cb 0.21 -0.34 -0.06 0.00 -1.62 0.00 0.00 43.42 41.61 3kzi n LEU 214 CO 0.25 0.73 0.46 -0.75 -1.22 0.00 0.00 177.39 176.87 3kzi s LYS 215 N -1.32 4.45 0.72 3.23 2.20 -0.66 -5.05 119.74 123.31 3kzi s LYS 215 Ca 0.38 1.05 -0.15 0.00 -0.36 0.00 0.00 55.97 56.89 3kzi s LYS 215 Cb 0.20 -3.11 0.03 0.00 -1.51 0.00 0.00 37.83 33.45 3kzi s LYS 215 CO 0.27 0.50 1.20 0.45 -0.36 0.00 0.00 175.35 177.41 3kzi s SER 216 N -1.34 4.33 0.00 1.43 0.15 -1.26 -4.20 113.70 112.81 3kzi s SER 216 Ca 0.39 2.33 0.22 0.00 0.70 0.00 0.00 55.95 59.59 3kzi s SER 216 Cb -0.21 -2.59 0.54 0.00 -1.71 0.00 0.00 66.02 62.06 3kzi s SER 216 CO 0.24 -2.17 1.47 -0.81 1.20 0.00 0.00 173.24 173.16 3kzi n PRO 217 N -2.62 2.49 -0.75 5.44 -0.04 -1.26 -0.64 135.00 137.62 3kzi n PRO 217 Ca 0.13 -2.28 -0.02 0.00 -0.04 0.00 0.00 63.50 61.29 3kzi n PRO 217 Cb 0.50 -1.51 0.01 0.00 -0.04 0.00 0.00 33.50 32.46 3kzi n PRO 217 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3kzi n PHE 218 N 1.40 -3.39 -1.67 0.54 3.72 -1.16 -4.85 117.46 112.05 3kzi n PHE 218 Ca 0.21 -0.16 -0.45 0.00 -0.05 0.00 0.00 57.45 57.00 3kzi n PHE 218 Cb 0.57 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 39.01 3kzi n PHE 218 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3kzi n GLY 219 N 4.27 0.71 3.53 1.37 0.00 -1.26 -3.80 105.19 110.01 3kzi n GLY 219 Ca 0.02 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.52 3kzi n GLY 219 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzi n GLY 220 N 2.02 1.50 3.61 -0.02 0.00 -1.26 -4.82 105.19 106.21 3kzi n GLY 220 Ca 0.11 -0.38 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 3kzi n GLY 220 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kzi s GLU 221 N 0.00 3.31 0.00 1.61 0.41 -1.25 -4.82 118.70 117.96 3kzi s GLU 221 Ca 0.00 1.95 0.16 0.00 -0.41 0.00 0.00 54.97 56.67 3kzi s GLU 221 Cb 0.00 -4.30 0.38 0.00 -1.78 0.00 0.00 34.13 28.43 3kzi s GLU 221 CO 0.00 -1.90 1.30 0.41 -0.49 0.00 0.00 175.26 174.58 3kzi n GLY 222 N 5.51 2.07 7.00 -1.39 0.00 -1.19 -2.97 105.19 114.21 3kzi n GLY 222 Ca 0.27 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.75 3kzi n GLY 222 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3kzi n TRP 223 N 1.00 0.00 -0.31 1.61 -0.00 0.18 -3.68 117.44 116.24 3kzi n TRP 223 Ca 0.16 0.00 0.15 0.00 -0.00 0.00 0.00 57.50 57.81 3kzi n TRP 223 Cb 0.49 0.05 0.34 0.00 -0.00 0.00 0.00 31.31 32.19 3kzi n TRP 223 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 177.69 178.51 3kzi h ILE 224 N 0.00 0.42 0.00 5.87 2.04 -1.89 0.70 117.51 124.65 3kzi h ILE 224 Ca 0.00 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.73 3kzi h ILE 224 Cb 0.00 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.10 3kzi h ILE 224 CO 0.00 0.07 0.00 0.52 0.00 0.00 0.00 178.15 178.74 3kzi n VAL 225 N -5.06 1.37 1.87 1.67 0.31 -1.24 -2.17 118.33 115.08 3kzi n VAL 225 Ca 0.24 0.34 0.14 0.00 -0.01 0.00 0.00 64.34 65.05 3kzi n VAL 225 Cb 0.72 -1.21 0.78 0.00 -0.91 0.00 0.00 33.84 33.22 3kzi n VAL 225 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3kzi n SER 226 N -1.47 0.36 -4.66 4.52 3.41 0.24 -4.55 113.62 111.47 3kzi n SER 226 Ca 0.02 -1.20 -0.47 0.00 -0.26 0.00 0.00 58.87 56.97 3kzi n SER 226 Cb 0.09 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 63.99 3kzi n SER 226 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3kzi n VAL 227 N -0.68 0.06 -1.89 -3.33 0.31 -0.92 -4.88 118.33 106.99 3kzi n VAL 227 Ca 0.21 -0.01 0.03 0.00 -0.01 0.00 0.00 64.34 64.56 3kzi n VAL 227 Cb 0.16 -1.48 0.05 0.00 -0.91 0.00 0.00 33.84 31.65 3kzi n VAL 227 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3kzi n ASN 228 N 3.62 0.81 -3.56 4.52 0.23 -1.26 -4.68 115.26 114.94 3kzi n ASN 228 Ca 0.18 -2.37 -0.16 0.00 -0.53 0.00 0.00 54.58 51.70 3kzi n ASN 228 Cb 0.28 -0.29 -0.06 0.00 -2.08 0.00 0.00 39.78 37.62 3kzi n ASN 228 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3kzi s ASN 229 N -1.76 -0.62 0.45 0.53 4.22 -1.26 -4.95 114.94 111.55 3kzi s ASN 229 Ca 0.17 0.81 0.20 0.00 -2.14 0.00 0.00 52.86 51.90 3kzi s ASN 229 Cb 0.17 0.69 1.08 0.00 1.28 0.00 0.00 41.25 44.47 3kzi s ASN 229 CO -0.04 -0.48 1.95 -0.07 -2.04 0.00 0.00 177.10 176.43 3kzi h LEU 230 N 3.35 0.00 -0.23 3.54 3.38 -1.97 -3.10 115.31 120.27 3kzi h LEU 230 Ca -0.26 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.76 3kzi h LEU 230 Cb 1.15 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.86 3kzi h LEU 230 CO 0.30 0.23 -0.05 -0.33 0.09 0.00 0.00 178.44 178.68 3kzi h GLU 231 N 0.00 0.01 -0.38 1.13 3.07 -1.97 0.22 114.58 116.66 3kzi h GLU 231 Ca -0.00 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.84 3kzi h GLU 231 Cb 0.49 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.38 3kzi h GLU 231 CO 0.03 0.01 0.19 -0.44 -1.40 0.00 0.00 179.01 177.39 3kzi h ASP 232 N 0.01 0.49 0.30 1.42 5.19 -1.86 1.27 116.42 123.24 3kzi h ASP 232 Ca 0.11 -0.12 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 3kzi h ASP 232 Cb 0.17 -0.13 -0.04 0.00 0.18 0.00 0.00 39.33 39.51 3kzi h ASP 232 CO -0.23 0.47 -0.49 0.58 -3.12 0.00 0.00 179.24 176.45 3kzi h VAL 233 N 0.47 0.05 0.14 -1.35 2.07 -1.34 1.17 116.25 117.46 3kzi h VAL 233 Ca 0.13 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.64 3kzi h VAL 233 Cb 0.11 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 3kzi h VAL 233 CO -0.02 0.00 -0.07 0.58 0.02 0.00 0.00 177.57 178.09 3kzi h VAL 234 N -0.85 0.87 0.06 2.57 2.07 -0.44 -1.19 116.25 119.35 3kzi h VAL 234 Ca -0.03 -0.02 0.02 0.00 0.82 0.00 0.00 66.70 67.50 3kzi h VAL 234 Cb 0.79 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.40 3kzi h VAL 234 CO -0.17 0.00 -0.42 1.23 0.02 0.00 0.00 177.57 178.23 3kzi h GLY 235 N -0.19 -0.82 0.38 2.17 0.00 0.19 -1.31 103.07 103.48 3kzi h GLY 235 Ca -0.02 0.51 0.15 0.00 0.00 0.00 0.00 47.33 47.97 3kzi h GLY 235 CO 0.03 -0.26 0.62 -1.33 0.00 0.00 0.00 176.54 175.60 3kzi h GLY 236 N -0.62 1.57 1.94 4.60 0.00 0.15 0.10 103.07 110.82 3kzi h GLY 236 Ca 0.03 -0.37 -0.07 0.00 0.00 0.00 0.00 47.33 46.92 3kzi h GLY 236 CO -0.28 0.08 -0.31 0.45 0.00 0.00 0.00 176.54 176.48 3kzi h HIS 237 N 0.85 0.08 0.10 5.60 3.86 -0.35 -1.23 115.15 124.07 3kzi h HIS 237 Ca 0.51 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.70 3kzi h HIS 237 Cb 0.68 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.13 3kzi h HIS 237 CO -0.00 0.38 -0.05 0.82 0.86 0.00 0.00 177.93 179.93 3kzi h ILE 238 N 0.07 0.89 -0.55 2.45 2.04 0.28 -0.02 117.51 122.66 3kzi h ILE 238 Ca 0.01 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.91 3kzi h ILE 238 Cb 0.58 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 37.51 3kzi h ILE 238 CO 0.04 0.00 0.30 -0.50 0.00 0.00 0.00 178.15 178.00 3kzi h TRP 239 N -0.15 0.56 -0.35 1.37 4.06 -0.97 -2.51 115.95 117.97 3kzi h TRP 239 Ca -0.01 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.95 3kzi h TRP 239 Cb 0.11 -0.17 -0.02 0.00 -1.00 0.00 0.00 29.16 28.09 3kzi h TRP 239 CO -0.07 0.29 0.17 0.82 -3.56 0.00 0.00 178.44 176.08 3kzi h ILE 240 N 0.59 1.16 -0.38 1.49 1.08 -0.95 0.65 117.51 121.15 3kzi h ILE 240 Ca 0.24 -0.44 0.07 0.00 -0.39 0.00 0.00 64.86 64.34 3kzi h ILE 240 Cb 0.11 0.82 -0.07 0.00 -3.07 0.00 0.00 36.82 34.61 3kzi h ILE 240 CO -0.14 0.17 -0.04 1.23 -0.69 0.00 0.00 178.15 178.67 3kzi h GLY 241 N 0.42 0.33 0.10 5.37 0.00 -0.74 0.50 103.07 109.05 3kzi h GLY 241 Ca 0.12 0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.52 3kzi h GLY 241 CO -0.02 -0.11 -0.05 1.41 0.00 0.00 0.00 176.54 177.77 3kzi h LEU 242 N 0.06 -0.11 -1.14 3.11 3.38 -1.30 -1.62 115.31 117.69 3kzi h LEU 242 Ca 0.18 0.00 0.42 0.00 0.09 0.00 0.00 57.88 58.58 3kzi h LEU 242 Cb 0.27 0.03 -0.14 0.00 0.09 0.00 0.00 40.66 40.90 3kzi h LEU 242 CO -0.34 -0.05 0.70 -0.38 0.09 0.00 0.00 178.44 178.46 3kzi n ILE 243 N -2.54 -0.30 0.03 1.22 5.41 0.21 -0.44 119.36 122.96 3kzi n ILE 243 Ca -0.02 1.76 -0.13 0.00 1.00 0.00 0.00 62.75 65.37 3kzi n ILE 243 Cb 0.05 -2.88 -0.09 0.00 -0.71 0.00 0.00 39.64 36.01 3kzi n ILE 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3kzi h ILE 245 N -0.62 1.21 -0.38 0.00 2.04 0.27 -1.85 117.51 118.17 3kzi h ILE 245 Ca -0.01 -0.88 0.05 0.00 1.00 0.00 0.00 64.86 65.01 3kzi h ILE 245 Cb 0.50 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.63 3kzi h ILE 245 CO 0.02 0.29 0.11 0.00 0.00 0.00 0.00 178.15 178.57 3kzi h ALA 246 N 1.50 0.43 0.00 1.87 0.00 -0.96 0.91 119.26 123.01 3kzi h ALA 246 Ca 0.08 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3kzi h ALA 246 Cb 0.41 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3kzi h ALA 246 CO 0.02 -0.28 -0.07 0.78 0.00 0.00 0.00 179.25 179.69 3kzi h GLY 247 N 0.26 0.00 1.11 0.00 0.00 -1.15 -1.43 103.07 101.86 3kzi h GLY 247 Ca 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.35 3kzi h GLY 247 CO -0.20 0.00 -0.35 -1.33 0.00 0.00 0.00 176.54 174.66 3kzi h GLY 248 N 1.90 1.01 0.41 4.60 0.00 -0.05 -2.25 103.07 108.69 3kzi h GLY 248 Ca -0.00 -1.02 -0.00 0.00 0.00 0.00 0.00 47.33 46.31 3kzi h GLY 248 CO 0.01 0.92 -0.02 -2.22 0.00 0.00 0.00 176.54 175.23 3kzi h ILE 249 N 0.75 1.31 -1.02 2.60 1.08 -0.92 -2.81 117.51 118.51 3kzi h ILE 249 Ca 0.07 -1.30 0.27 0.00 -0.39 0.00 0.00 64.86 63.51 3kzi h ILE 249 Cb 0.95 2.16 -0.13 0.00 -3.07 0.00 0.00 36.82 36.73 3kzi h ILE 249 CO 0.09 0.32 0.61 -0.25 -0.69 0.00 0.00 178.15 178.23 3kzi h TRP 250 N -0.65 0.93 0.00 1.37 2.91 -1.26 0.11 115.95 119.37 3kzi h TRP 250 Ca -0.01 0.03 -0.20 0.00 1.13 0.00 0.00 58.89 59.85 3kzi h TRP 250 Cb 0.57 -0.26 -0.03 0.00 -0.51 0.00 0.00 29.16 28.94 3kzi h TRP 250 CO 0.12 -0.01 -0.94 0.45 -1.03 0.00 0.00 178.44 177.04 3kzi h HIS 251 N 0.47 0.02 -0.46 2.65 3.86 -1.43 -3.01 115.15 117.26 3kzi h HIS 251 Ca 0.67 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.85 3kzi h HIS 251 Cb 1.42 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.87 3kzi h HIS 251 CO -0.01 0.94 0.22 0.82 0.86 0.00 0.00 177.93 180.77 3kzi h ILE 252 N 0.00 1.18 -0.61 2.45 1.08 -0.60 -2.91 117.51 118.10 3kzi h ILE 252 Ca -0.01 -0.51 -0.35 0.00 -0.39 0.00 0.00 64.86 63.59 3kzi h ILE 252 Cb 1.65 0.68 -0.19 0.00 -3.07 0.00 0.00 36.82 35.89 3kzi h ILE 252 CO 0.12 0.20 0.45 0.18 -0.69 0.00 0.00 178.15 178.41 3kzi n LEU 253 N -4.65 5.80 0.00 1.44 4.77 0.03 -4.83 117.00 119.56 3kzi n LEU 253 Ca 0.01 -3.05 -0.04 0.00 -0.03 0.00 0.00 56.01 52.90 3kzi n LEU 253 Cb 0.11 -0.82 0.02 0.00 -2.33 0.00 0.00 43.42 40.40 3kzi n LEU 253 CO 0.37 0.99 0.43 0.41 -1.33 0.00 0.00 177.39 178.26 3kzi n THR 254 N -0.33 0.00 -4.02 -5.08 -1.04 -1.10 -4.97 114.28 97.74 3kzi n THR 254 Ca 0.37 -0.55 -0.11 0.00 -2.04 0.00 0.00 64.05 61.73 3kzi n THR 254 Cb 1.01 0.60 -0.11 0.00 -1.82 0.00 0.00 70.33 70.01 3kzi n THR 254 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3kzi s THR 255 N -2.33 0.30 0.38 12.58 -1.32 -1.26 -4.78 115.64 119.21 3kzi s THR 255 Ca 0.12 -1.02 -0.27 0.00 -1.21 0.00 0.00 61.69 59.31 3kzi s THR 255 Cb -0.03 -0.46 -0.11 0.00 -1.51 0.00 0.00 72.50 70.40 3kzi s THR 255 CO 0.06 -0.47 1.38 -2.65 -2.21 0.00 0.00 174.62 170.73 3kzi n PRO 256 N 1.48 2.31 0.00 7.08 -0.02 -1.26 -4.98 135.00 139.62 3kzi n PRO 256 Ca -0.23 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 3kzi n PRO 256 Cb 0.55 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 3kzi n PRO 256 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3kzi n PHE 257 N 0.21 0.00 -0.07 6.00 3.01 -1.26 -4.80 117.46 120.54 3kzi n PHE 257 Ca 0.04 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.44 3kzi n PHE 257 Cb 0.38 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.84 3kzi n PHE 257 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3kzi n GLY 258 N 0.13 -0.82 0.09 1.37 0.00 -1.26 -3.99 105.19 100.71 3kzi n GLY 258 Ca 0.00 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 45.73 3kzi n GLY 258 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 3kzi h TRP 259 N -0.94 -0.08 -1.18 1.61 5.08 -1.95 0.28 115.95 118.76 3kzi h TRP 259 Ca 0.00 0.02 0.34 0.00 1.08 0.00 0.00 58.89 60.33 3kzi h TRP 259 Cb 0.60 0.06 -0.05 0.00 -3.00 0.00 0.00 29.16 26.78 3kzi h TRP 259 CO -0.26 -0.07 1.07 0.00 -1.28 0.00 0.00 178.44 177.90 3kzi h ALA 260 N 1.17 3.07 0.06 0.11 0.00 -1.93 0.44 119.26 122.17 3kzi h ALA 260 Ca 0.08 -0.04 -0.38 0.00 0.00 0.00 0.00 54.91 54.57 3kzi h ALA 260 Cb 0.12 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 3kzi h ALA 260 CO -0.17 -1.67 -2.24 0.54 0.00 0.00 0.00 179.25 175.70 3kzi n ARG 261 N -3.65 0.70 0.00 0.00 1.74 0.71 -3.60 116.66 112.55 3kzi n ARG 261 Ca 0.26 0.21 0.13 0.00 -0.77 0.00 0.00 57.85 57.68 3kzi n ARG 261 Cb 1.44 -1.61 0.79 0.00 -1.02 0.00 0.00 32.46 32.06 3kzi n ARG 261 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3kzi n ARG 262 N -3.41 0.91 -0.11 5.56 1.74 0.47 -3.77 116.66 118.04 3kzi n ARG 262 Ca -0.40 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.44 3kzi n ARG 262 Cb 1.01 -1.46 -0.08 0.00 -1.02 0.00 0.00 32.46 30.91 3kzi n ARG 262 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3kzi n ALA 263 N -0.96 1.53 -1.94 7.54 0.00 0.12 -5.03 120.51 121.77 3kzi n ALA 263 Ca 0.20 -0.91 -0.26 0.00 0.00 0.00 0.00 53.44 52.47 3kzi n ALA 263 Cb 0.09 0.20 0.09 0.00 0.00 0.00 0.00 19.45 19.83 3kzi n ALA 263 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3kzi s PHE 264 N -2.42 2.46 -0.13 0.00 0.08 -1.24 -5.09 117.98 111.65 3kzi s PHE 264 Ca -0.32 0.27 -0.03 0.00 0.12 0.00 0.00 56.93 56.97 3kzi s PHE 264 Cb 0.12 -3.29 -0.03 0.00 -0.57 0.00 0.00 43.02 39.25 3kzi s PHE 264 CO 0.41 -1.64 -0.03 0.42 -0.10 0.00 0.00 175.22 174.28 3kzi s ILE 265 N -3.31 4.01 -0.50 0.64 -1.09 -1.26 -4.93 121.20 114.75 3kzi s ILE 265 Ca 0.63 -0.33 -0.06 0.00 -2.23 0.00 0.00 60.65 58.66 3kzi s ILE 265 Cb -0.09 -2.73 0.13 0.00 -1.58 0.00 0.00 42.46 38.20 3kzi s ILE 265 CO 0.46 0.53 0.34 0.26 -1.23 0.00 0.00 174.94 175.30 3kzi s TRP 266 N -0.08 3.50 0.20 3.97 0.52 -1.26 -4.68 118.94 121.10 3kzi s TRP 266 Ca 0.02 -2.24 -0.23 0.00 0.02 0.00 0.00 56.10 53.67 3kzi s TRP 266 Cb -0.13 -3.37 0.05 0.00 -1.15 0.00 0.00 33.47 28.87 3kzi s TRP 266 CO 0.02 -0.96 0.73 -1.54 0.02 0.00 0.00 176.95 175.23 3kzi s SER 267 N 1.94 -0.36 0.29 2.95 1.04 -1.26 -4.63 113.70 113.68 3kzi s SER 267 Ca 0.10 -0.33 -0.03 0.00 0.48 0.00 0.00 55.95 56.17 3kzi s SER 267 Cb -0.23 0.62 0.40 0.00 0.10 0.00 0.00 66.02 66.91 3kzi s SER 267 CO -0.03 -1.09 1.95 1.23 0.98 0.00 0.00 173.24 176.27 3kzi h GLY 268 N 2.00 1.18 0.21 7.32 0.00 -1.94 -1.97 103.07 109.88 3kzi h GLY 268 Ca -0.25 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.61 3kzi h GLY 268 CO 0.29 0.45 -0.08 -2.09 0.00 0.00 0.00 176.54 175.11 3kzi h GLU 269 N 1.13 -0.21 -0.96 4.80 4.81 -1.97 -3.11 114.58 119.07 3kzi h GLU 269 Ca 0.30 0.01 0.30 0.00 -0.13 0.00 0.00 59.36 59.85 3kzi h GLU 269 Cb -0.09 0.05 -0.17 0.00 0.63 0.00 0.00 28.75 29.17 3kzi h GLU 269 CO -0.06 0.05 0.25 0.00 -0.73 0.00 0.00 179.01 178.52 3kzi h ALA 270 N -0.77 1.51 -0.40 2.92 0.00 -1.78 0.60 119.26 121.34 3kzi h ALA 270 Ca -0.02 0.28 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 3kzi h ALA 270 Cb 0.36 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3kzi h ALA 270 CO 0.04 -0.64 0.13 1.88 0.00 0.00 0.00 179.25 180.65 3kzi h TYR 271 N 0.09 0.64 0.09 0.00 0.05 -1.44 -2.41 116.97 113.98 3kzi h TYR 271 Ca 0.66 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 59.38 3kzi h TYR 271 Cb 1.49 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 39.02 3kzi h TYR 271 CO -0.27 0.60 -0.23 1.25 -1.05 0.00 0.00 178.16 178.45 3kzi h LEU 272 N 0.50 -0.69 -0.81 3.88 5.85 0.21 -2.55 115.31 121.69 3kzi h LEU 272 Ca 0.13 0.07 0.10 0.00 0.84 0.00 0.00 57.88 59.02 3kzi h LEU 272 Cb 0.25 0.25 -0.12 0.00 0.37 0.00 0.00 40.66 41.42 3kzi h LEU 272 CO -0.00 -0.26 -0.39 -1.54 -0.34 0.00 0.00 178.44 175.91 3kzi n SER 273 N -3.77 -0.68 -0.35 1.25 3.41 -0.27 0.12 113.62 113.34 3kzi n SER 273 Ca -0.04 1.43 0.13 0.00 -0.26 0.00 0.00 58.87 60.13 3kzi n SER 273 Cb 0.19 -0.26 0.33 0.00 -0.26 0.00 0.00 64.21 64.20 3kzi n SER 273 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 3kzi h TYR 274 N 0.00 1.06 0.00 7.33 0.05 -1.10 0.54 116.97 124.85 3kzi h TYR 274 Ca 0.21 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 59.01 3kzi h TYR 274 Cb 0.42 -0.32 -0.00 0.00 1.01 0.00 0.00 36.73 37.84 3kzi h TYR 274 CO -0.77 0.21 -0.09 0.77 -1.05 0.00 0.00 178.16 177.23 3kzi h SER 275 N 0.74 0.00 -0.01 3.88 0.02 0.13 -2.72 113.55 115.59 3kzi h SER 275 Ca 0.59 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.53 3kzi h SER 275 Cb 0.94 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.48 3kzi h SER 275 CO -0.40 0.09 -0.04 -0.07 -1.14 0.00 0.00 176.83 175.27 3kzi h LEU 276 N 0.00 0.05 -1.77 5.07 3.38 0.19 -2.44 115.31 119.78 3kzi h LEU 276 Ca -0.00 -0.65 -0.02 0.00 0.09 0.00 0.00 57.88 57.30 3kzi h LEU 276 Cb 0.93 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 3kzi h LEU 276 CO 0.01 0.69 -0.11 1.23 0.09 0.00 0.00 178.44 180.35 3kzi h GLY 277 N -0.59 0.01 0.85 0.83 0.00 -1.10 -1.97 103.07 101.10 3kzi h GLY 277 Ca -0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.28 3kzi h GLY 277 CO 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.54 3kzi h ALA 278 N 1.89 0.34 -0.29 3.60 0.00 -1.41 -2.61 119.26 120.78 3kzi h ALA 278 Ca 0.00 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 3kzi h ALA 278 Cb 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3kzi h ALA 278 CO 0.01 0.08 -0.02 -0.07 0.00 0.00 0.00 179.25 179.26 3kzi h LEU 279 N 0.22 0.51 -0.40 0.00 3.38 -1.08 -2.29 115.31 115.65 3kzi h LEU 279 Ca 0.07 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.76 3kzi h LEU 279 Cb 0.43 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 40.97 3kzi h LEU 279 CO 0.01 0.72 -0.53 -1.28 0.09 0.00 0.00 178.44 177.45 3kzi h SER 280 N 0.30 -1.78 -0.92 -0.43 0.87 -1.36 0.70 113.55 110.92 3kzi h SER 280 Ca 0.08 0.23 0.14 0.00 -1.23 0.00 0.00 61.79 61.01 3kzi h SER 280 Cb 0.47 0.73 -0.09 0.00 -0.44 0.00 0.00 62.40 63.07 3kzi h SER 280 CO 0.02 -0.38 0.54 -0.03 -0.53 0.00 0.00 176.83 176.44 3kzi h MET 281 N -0.37 0.77 0.00 2.24 1.85 -1.41 0.26 114.93 118.27 3kzi h MET 281 Ca 0.07 -0.05 -0.08 0.00 -0.61 0.00 0.00 59.70 59.03 3kzi h MET 281 Cb 0.56 -0.17 -0.01 0.00 0.43 0.00 0.00 31.60 32.41 3kzi h MET 281 CO -0.57 0.51 -0.39 0.52 -0.40 0.00 0.00 176.91 176.58 3kzi h MET 282 N 0.79 0.00 -0.38 0.39 2.07 -0.35 -1.97 114.93 115.48 3kzi h MET 282 Ca 0.49 0.00 -0.12 0.00 -2.07 0.00 0.00 59.70 58.00 3kzi h MET 282 Cb 0.61 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.32 3kzi h MET 282 CO -0.32 0.39 -0.25 0.78 1.07 0.00 0.00 176.91 178.57 3kzi h GLY 283 N 1.67 0.84 0.89 8.32 0.00 0.38 -0.60 103.07 114.57 3kzi h GLY 283 Ca -0.00 -0.73 -0.13 0.00 0.00 0.00 0.00 47.33 46.46 3kzi h GLY 283 CO 0.05 0.67 -0.42 0.74 0.00 0.00 0.00 176.54 177.57 3kzi h PHE 284 N 0.67 0.71 -0.50 5.60 0.04 -1.08 -2.39 116.94 119.99 3kzi h PHE 284 Ca 0.09 -0.28 -0.01 0.00 2.80 0.00 0.00 57.97 60.57 3kzi h PHE 284 Cb 0.77 -0.12 -0.02 0.00 2.20 0.00 0.00 35.95 38.77 3kzi h PHE 284 CO 0.04 1.04 0.28 0.82 -0.60 0.00 0.00 178.31 179.89 3kzi h ILE 285 N 0.18 1.15 -0.41 -0.55 2.04 -1.21 -2.07 117.51 116.64 3kzi h ILE 285 Ca -0.01 -0.37 -0.14 0.00 1.00 0.00 0.00 64.86 65.34 3kzi h ILE 285 Cb 1.04 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 3kzi h ILE 285 CO 0.09 0.16 -0.30 0.00 0.00 0.00 0.00 178.15 178.10 3kzi h ALA 286 N 1.62 0.70 -0.59 1.87 0.00 -1.03 -2.18 119.26 119.65 3kzi h ALA 286 Ca 0.18 -0.42 0.06 0.00 0.00 0.00 0.00 54.91 54.73 3kzi h ALA 286 Cb 0.01 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 3kzi h ALA 286 CO -0.03 0.67 0.30 1.15 0.00 0.00 0.00 179.25 181.33 3kzi h THR 287 N 0.75 0.92 0.00 0.00 2.02 -0.85 -2.03 112.91 113.72 3kzi h THR 287 Ca 0.08 -0.19 -0.11 0.00 0.77 0.00 0.00 66.41 66.96 3kzi h THR 287 Cb 0.87 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.58 3kzi h THR 287 CO 0.08 0.10 -0.52 0.00 0.37 0.00 0.00 175.52 175.55 3kzi h PHE 289 N 0.00 0.20 0.00 0.00 -1.00 -0.73 -0.35 116.94 115.06 3kzi h PHE 289 Ca -0.01 -0.05 -0.02 0.00 2.81 0.00 0.00 57.97 60.70 3kzi h PHE 289 Cb 1.04 -0.04 -0.00 0.00 3.61 0.00 0.00 35.95 40.55 3kzi h PHE 289 CO 0.00 0.55 -0.11 -0.24 -1.61 0.00 0.00 178.31 176.90 3kzi h VAL 290 N -0.21 0.25 0.14 -0.55 3.04 -1.44 0.15 116.25 117.63 3kzi h VAL 290 Ca 0.02 -0.85 -0.33 0.00 -1.01 0.00 0.00 66.70 64.52 3kzi h VAL 290 Cb 0.50 1.68 -0.00 0.00 -2.01 0.00 0.00 31.29 31.46 3kzi h VAL 290 CO 0.01 0.10 -1.71 -0.25 -1.01 0.00 0.00 177.57 174.72 3kzi h TRP 291 N 0.00 0.54 0.00 3.17 2.91 -1.40 -3.43 115.95 117.74 3kzi h TRP 291 Ca -0.00 -0.39 -0.37 0.00 1.13 0.00 0.00 58.89 59.25 3kzi h TRP 291 Cb 0.68 -0.02 -0.06 0.00 -0.51 0.00 0.00 29.16 29.24 3kzi h TRP 291 CO 0.00 1.54 -2.30 1.19 -1.03 0.00 0.00 178.44 177.84 3kzi n PHE 292 N -3.49 0.00 -1.92 2.65 3.72 -0.15 -4.11 117.46 114.16 3kzi n PHE 292 Ca -0.22 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.77 3kzi n PHE 292 Cb 1.06 -0.85 -0.01 0.00 -0.94 0.00 0.00 39.48 38.73 3kzi n PHE 292 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3kzi s ASN 293 N -6.70 6.53 -0.21 4.37 3.84 0.52 -4.94 114.94 118.35 3kzi s ASN 293 Ca -0.32 2.86 0.10 0.00 0.21 0.00 0.00 52.86 55.71 3kzi s ASN 293 Cb 0.11 -2.65 -0.20 0.00 -0.55 0.00 0.00 41.25 37.96 3kzi s ASN 293 CO 0.46 -0.76 -0.05 -3.20 -2.79 0.00 0.00 177.10 170.76 3kzi n ASN 294 N 1.25 1.11 0.08 -4.21 2.85 -1.26 -4.46 115.26 110.61 3kzi n ASN 294 Ca 0.03 -0.06 -0.03 0.00 -0.11 0.00 0.00 54.58 54.41 3kzi n ASN 294 Cb 0.40 0.39 -0.02 0.00 1.24 0.00 0.00 39.78 41.79 3kzi n ASN 294 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 3kzi h THR 295 N 0.00 0.00 0.00 -0.44 2.02 -1.92 -3.17 112.91 109.40 3kzi h THR 295 Ca -0.52 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.48 3kzi h THR 295 Cb 2.02 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 3kzi h THR 295 CO -0.02 0.00 0.00 1.33 0.37 0.00 0.00 175.52 177.20 3kzi n VAL 296 N -3.11 0.05 -3.48 3.16 0.24 -1.26 -3.81 118.33 110.13 3kzi n VAL 296 Ca -0.03 0.01 -0.28 0.00 -2.04 0.00 0.00 64.34 62.01 3kzi n VAL 296 Cb 0.09 -0.59 -0.11 0.00 -1.47 0.00 0.00 33.84 31.76 3kzi n VAL 296 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 3kzi s TYR 297 N -2.15 1.28 0.08 6.34 2.02 -1.25 -5.03 117.35 118.64 3kzi s TYR 297 Ca 0.36 -2.26 -0.31 0.00 -0.37 0.00 0.00 57.07 54.49 3kzi s TYR 297 Cb 0.18 -1.14 -0.09 0.00 -0.40 0.00 0.00 41.96 40.51 3kzi s TYR 297 CO 0.33 -0.80 1.76 -2.14 -1.57 0.00 0.00 175.55 173.12 3kzi s PRO 298 N 0.18 4.17 0.12 -1.71 0.02 -1.20 -4.28 135.00 132.29 3kzi s PRO 298 Ca 0.28 2.45 0.08 0.00 0.02 0.00 0.00 61.00 63.83 3kzi s PRO 298 Cb -0.05 -3.69 0.43 0.00 0.02 0.00 0.00 34.50 31.21 3kzi s PRO 298 CO -0.13 -0.81 1.23 0.43 -0.33 0.00 0.00 177.00 177.38 3kzi n SER 299 N 5.97 0.21 0.08 2.53 7.64 -1.26 -1.02 113.62 127.77 3kzi n SER 299 Ca 0.17 0.58 -0.08 0.00 1.01 0.00 0.00 58.87 60.55 3kzi n SER 299 Cb 0.40 -0.60 0.01 0.00 -1.01 0.00 0.00 64.21 63.00 3kzi n SER 299 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 3kzi h GLU 300 N 0.00 0.21 0.00 1.43 3.07 -1.89 -3.37 114.58 114.03 3kzi h GLU 300 Ca 0.00 -0.22 -0.42 0.00 -0.50 0.00 0.00 59.36 58.22 3kzi h GLU 300 Cb 0.05 0.06 -0.07 0.00 -0.84 0.00 0.00 28.75 27.95 3kzi h GLU 300 CO 0.00 0.93 -2.48 1.19 -1.40 0.00 0.00 179.01 177.25 3kzi n PHE 301 N -3.69 0.00 -0.94 4.33 3.72 -0.19 -4.53 117.46 116.16 3kzi n PHE 301 Ca -0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 3kzi n PHE 301 Cb 0.78 -0.97 0.00 0.00 -0.94 0.00 0.00 39.48 38.34 3kzi n PHE 301 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3kzi n TYR 302 N -3.75 -1.12 -2.89 1.38 4.01 -0.30 -2.08 117.16 112.41 3kzi n TYR 302 Ca -0.49 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.22 3kzi n TYR 302 Cb 0.93 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.97 3kzi n TYR 302 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3kzi n GLY 303 N 5.00 1.74 3.80 2.72 0.00 -1.26 -4.47 105.19 112.72 3kzi n GLY 303 Ca 0.00 -2.11 -0.35 0.00 0.00 0.00 0.00 46.02 43.56 3kzi n GLY 303 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kzi s PRO 304 N -2.43 4.10 0.93 1.61 0.04 -1.26 -4.32 135.00 133.67 3kzi s PRO 304 Ca 0.09 1.33 -0.11 0.00 0.04 0.00 0.00 61.00 62.35 3kzi s PRO 304 Cb -0.01 -2.31 0.15 0.00 0.04 0.00 0.00 34.50 32.37 3kzi s PRO 304 CO 0.05 -0.16 1.10 -0.08 0.04 0.00 0.00 177.00 177.95 3kzi s THR 305 N -1.91 2.45 0.10 1.26 -1.32 -1.26 -4.54 115.64 110.42 3kzi s THR 305 Ca 0.61 0.15 -0.33 0.00 -1.21 0.00 0.00 61.69 60.91 3kzi s THR 305 Cb -0.16 -2.37 -0.13 0.00 -1.51 0.00 0.00 72.50 68.33 3kzi s THR 305 CO 0.20 -0.19 1.58 1.23 -2.21 0.00 0.00 174.62 175.23 3kzi h GLY 306 N -1.78 -0.99 1.13 6.08 0.00 -1.95 -0.88 103.07 104.68 3kzi h GLY 306 Ca -0.48 0.54 -0.02 0.00 0.00 0.00 0.00 47.33 47.36 3kzi h GLY 306 CO 0.48 -0.30 0.41 -2.55 0.00 0.00 0.00 176.54 174.59 3kzi h PRO 307 N -0.76 1.14 -0.80 4.80 0.11 -1.92 -2.73 132.00 131.83 3kzi h PRO 307 Ca -0.01 -0.15 0.07 0.00 0.11 0.00 0.00 66.00 66.03 3kzi h PRO 307 Cb 0.74 -0.22 -0.05 0.00 0.11 0.00 0.00 31.00 31.58 3kzi h PRO 307 CO -0.19 0.85 0.52 1.49 -0.21 0.00 0.00 178.00 180.47 3kzi h GLU 308 N 1.13 0.81 -0.11 1.05 4.81 -1.80 0.00 114.58 120.48 3kzi h GLU 308 Ca 0.28 -0.05 -0.23 0.00 -0.13 0.00 0.00 59.36 59.23 3kzi h GLU 308 Cb 0.07 -0.18 0.01 0.00 0.63 0.00 0.00 28.75 29.28 3kzi h GLU 308 CO -0.04 0.54 -0.84 0.00 -0.73 0.00 0.00 179.01 177.93 3kzi h ALA 309 N 1.57 0.29 -0.14 2.92 0.00 -0.88 -1.87 119.26 121.16 3kzi h ALA 309 Ca 0.35 -0.63 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 3kzi h ALA 309 Cb 0.29 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3kzi h ALA 309 CO -0.13 0.69 -0.36 1.03 0.00 0.00 0.00 179.25 180.49 3kzi h SER 310 N 0.48 0.29 -0.02 0.00 0.87 -1.22 -2.71 113.55 111.24 3kzi h SER 310 Ca -0.07 -0.11 -0.00 0.00 -1.23 0.00 0.00 61.79 60.38 3kzi h SER 310 Cb 1.48 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 63.35 3kzi h SER 310 CO 0.17 0.64 0.01 1.56 -0.53 0.00 0.00 176.83 178.67 3kzi h GLN 311 N 0.24 0.03 -0.71 2.24 1.08 -0.95 -2.99 115.11 114.05 3kzi h GLN 311 Ca 0.03 -0.01 0.16 0.00 -1.45 0.00 0.00 58.65 57.38 3kzi h GLN 311 Cb 0.75 -0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.14 3kzi h GLN 311 CO 0.06 0.24 0.48 0.00 -0.95 0.00 0.00 178.83 178.66 3kzi h ALA 312 N 0.80 2.28 -0.19 3.87 0.00 -1.05 -0.75 119.26 124.22 3kzi h ALA 312 Ca 0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3kzi h ALA 312 Cb 0.22 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3kzi h ALA 312 CO -0.00 -0.47 0.06 0.37 0.00 0.00 0.00 179.25 179.20 3kzi h GLN 313 N 0.27 0.30 -0.37 0.00 4.15 -1.34 0.22 115.11 118.34 3kzi h GLN 313 Ca 0.35 -0.07 0.03 0.00 0.77 0.00 0.00 58.65 59.73 3kzi h GLN 313 Cb 0.97 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.58 3kzi h GLN 313 CO -0.08 0.41 0.17 0.00 -1.93 0.00 0.00 178.83 177.40 3kzi h ALA 314 N 0.87 0.45 0.14 3.38 0.00 -1.17 -1.36 119.26 121.58 3kzi h ALA 314 Ca 0.06 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.01 3kzi h ALA 314 Cb 0.24 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 3kzi h ALA 314 CO -0.00 -0.20 -0.40 1.98 0.00 0.00 0.00 179.25 180.63 3kzi h MET 315 N 0.36 -0.62 -0.48 0.00 1.85 -0.88 0.15 114.93 115.30 3kzi h MET 315 Ca 0.16 0.04 0.09 0.00 -0.61 0.00 0.00 59.70 59.39 3kzi h MET 315 Cb 0.08 0.14 -0.10 0.00 0.43 0.00 0.00 31.60 32.15 3kzi h MET 315 CO -0.12 -0.41 -0.28 1.15 -0.40 0.00 0.00 176.91 176.84 3kzi h THR 316 N -0.65 0.26 0.00 -0.77 2.02 -0.12 0.16 112.91 113.83 3kzi h THR 316 Ca 0.02 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.05 3kzi h THR 316 Cb 0.66 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 3kzi h THR 316 CO -0.22 0.00 -0.72 -0.26 0.37 0.00 0.00 175.52 174.70 3kzi h PHE 317 N -0.17 0.00 -0.53 3.16 0.04 -1.04 0.13 116.94 118.52 3kzi h PHE 317 Ca 0.21 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.86 3kzi h PHE 317 Cb 0.52 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.65 3kzi h PHE 317 CO -0.54 0.72 -0.14 1.25 -0.60 0.00 0.00 178.31 178.99 3kzi h LEU 318 N 0.00 1.04 -0.19 1.54 6.46 -0.30 -2.03 115.31 121.84 3kzi h LEU 318 Ca -0.01 -0.36 -0.01 0.00 -0.12 0.00 0.00 57.88 57.38 3kzi h LEU 318 Cb 1.42 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 41.06 3kzi h LEU 318 CO 0.09 1.17 0.08 0.40 -0.62 0.00 0.00 178.44 179.56 3kzi h ILE 319 N 0.91 1.15 0.00 4.05 2.04 -0.45 -2.25 117.51 122.96 3kzi h ILE 319 Ca 0.13 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.54 3kzi h ILE 319 Cb 0.72 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.91 3kzi h ILE 319 CO 0.06 0.15 0.00 -1.14 0.00 0.00 0.00 178.15 177.21 3kzi n ARG 320 N -4.85 0.00 -0.39 2.37 0.63 0.43 -2.89 116.66 111.97 3kzi n ARG 320 Ca -0.04 0.31 0.33 0.00 -0.92 0.00 0.00 57.85 57.53 3kzi n ARG 320 Cb 0.11 -1.27 0.65 0.00 0.45 0.00 0.00 32.46 32.40 3kzi n ARG 320 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3kzi h ASP 321 N 0.00 0.20 -0.25 6.15 3.32 -1.50 0.86 116.42 125.20 3kzi h ASP 321 Ca 0.00 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 3kzi h ASP 321 Cb 0.00 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 3kzi h ASP 321 CO 0.00 -0.01 0.10 -0.61 -1.72 0.00 0.00 179.24 177.00 3kzi h GLN 322 N 0.15 0.44 0.00 3.56 4.15 -1.38 -0.03 115.11 122.01 3kzi h GLN 322 Ca 0.67 -0.06 -0.08 0.00 0.77 0.00 0.00 58.65 59.96 3kzi h GLN 322 Cb 2.23 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 29.83 3kzi h GLN 322 CO -0.20 0.39 -0.36 0.87 -1.93 0.00 0.00 178.83 177.60 3kzi h LYS 323 N 0.44 0.00 -0.02 1.69 1.57 0.88 -2.43 116.57 118.70 3kzi h LYS 323 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3kzi h LYS 323 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 3kzi h LYS 323 CO -0.01 0.36 0.00 1.28 -0.57 0.00 0.00 179.45 180.51 3kzi n LEU 324 N -3.48 0.23 0.00 2.94 7.99 -0.07 -4.86 117.00 119.75 3kzi n LEU 324 Ca 0.00 -0.10 0.00 0.00 -0.01 0.00 0.00 56.01 55.90 3kzi n LEU 324 Cb 0.52 -0.01 0.00 0.00 -0.11 0.00 0.00 43.42 43.81 3kzi n LEU 324 CO 0.36 0.05 0.00 0.61 -1.51 0.00 0.00 177.39 176.90 3kzi n GLY 325 N 0.86 0.93 3.81 -0.72 0.00 -0.92 -5.08 105.19 104.08 3kzi n GLY 325 Ca 0.15 -0.09 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 3kzi n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kzi s ALA 326 N -2.00 3.62 -0.88 4.61 0.00 -0.94 -5.01 121.76 121.15 3kzi s ALA 326 Ca 0.00 -0.06 -0.19 0.00 0.00 0.00 0.00 51.96 51.71 3kzi s ALA 326 Cb 0.00 -2.56 0.13 0.00 0.00 0.00 0.00 23.12 20.69 3kzi s ALA 326 CO 0.00 0.40 1.07 -0.80 0.00 0.00 0.00 175.76 176.43 3kzi s ASN 327 N -0.99 6.56 0.28 0.00 0.01 -1.26 -4.42 114.94 115.13 3kzi s ASN 327 Ca 0.27 -1.92 0.02 0.00 -0.71 0.00 0.00 52.86 50.52 3kzi s ASN 327 Cb -0.18 -2.39 0.68 0.00 0.41 0.00 0.00 41.25 39.77 3kzi s ASN 327 CO 0.17 -1.09 1.67 -0.37 -1.51 0.00 0.00 177.10 175.97 3kzi h VAL 328 N 5.81 0.40 -0.94 1.60 -1.51 -1.95 -1.87 116.25 117.78 3kzi h VAL 328 Ca 0.08 -0.10 0.16 0.00 -1.23 0.00 0.00 66.70 65.62 3kzi h VAL 328 Cb 1.03 0.09 -0.08 0.00 -2.13 0.00 0.00 31.29 30.21 3kzi h VAL 328 CO 1.10 0.05 0.60 1.23 -1.23 0.00 0.00 177.57 179.32 3kzi h GLY 329 N 0.28 1.34 -1.34 5.19 0.00 -1.95 -2.96 103.07 103.63 3kzi h GLY 329 Ca 0.54 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.56 3kzi h GLY 329 CO -0.59 0.04 0.00 -1.14 0.00 0.00 0.00 176.54 174.85 3kzi n SER 330 N -4.61 3.16 -4.70 0.19 3.41 -0.73 -4.91 113.62 105.43 3kzi n SER 330 Ca 0.19 -2.26 -0.42 0.00 -0.26 0.00 0.00 58.87 56.12 3kzi n SER 330 Cb 0.53 -0.31 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 3kzi n SER 330 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kzi s ALA 331 N -1.48 3.60 -0.25 7.33 0.00 -1.07 -5.00 121.76 124.89 3kzi s ALA 331 Ca 0.28 1.06 -0.08 0.00 0.00 0.00 0.00 51.96 53.22 3kzi s ALA 331 Cb 0.18 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 3kzi s ALA 331 CO 0.14 -0.75 0.08 -1.14 0.00 0.00 0.00 175.76 174.09 3kzi s GLN 332 N 1.63 3.71 0.62 0.00 0.74 -1.26 -2.55 119.66 122.55 3kzi s GLN 332 Ca 0.65 -0.45 -0.06 0.00 0.05 0.00 0.00 55.36 55.55 3kzi s GLN 332 Cb -0.36 -3.35 0.02 0.00 1.10 0.00 0.00 33.01 30.43 3kzi s GLN 332 CO 0.29 -0.15 0.93 0.20 -0.55 0.00 0.00 175.29 176.01 3kzi s GLY 333 N 1.54 1.64 0.17 2.59 0.00 -1.26 -4.64 107.32 107.36 3kzi s GLY 333 Ca 0.06 -0.77 0.01 0.00 0.00 0.00 0.00 44.72 44.02 3kzi s GLY 333 CO 0.04 -0.46 0.86 -1.05 0.00 0.00 0.00 173.10 172.50 3kzi n PRO 334 N -2.68 -0.04 0.04 2.90 -0.02 -1.26 0.76 135.00 134.70 3kzi n PRO 334 Ca 0.06 0.82 0.13 0.00 -2.02 0.00 0.00 63.50 62.49 3kzi n PRO 334 Cb 0.58 -1.31 0.43 0.00 -0.02 0.00 0.00 33.50 33.19 3kzi n PRO 334 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3kzi n THR 335 N -4.67 0.23 -1.51 3.45 -2.24 -1.26 -4.92 114.28 103.36 3kzi n THR 335 Ca 0.13 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 3kzi n THR 335 Cb 0.43 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 3kzi n THR 335 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kzi n GLY 336 N 1.42 0.94 0.03 3.38 0.00 0.23 -4.99 105.19 106.19 3kzi n GLY 336 Ca 0.06 -0.53 -0.03 0.00 0.00 0.00 0.00 46.02 45.51 3kzi n GLY 336 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3kzi n LEU 337 N -0.16 0.11 0.00 0.99 7.94 -1.26 -4.89 117.00 119.72 3kzi n LEU 337 Ca 0.00 -0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3kzi n LEU 337 Cb 0.34 0.15 0.00 0.00 0.53 0.00 0.00 43.42 44.43 3kzi n LEU 337 CO 0.00 0.18 0.00 0.61 -1.11 0.00 0.00 177.39 177.07 3kzi n GLY 338 N 2.61 0.94 0.22 -3.96 0.00 -1.26 -4.66 105.19 99.09 3kzi n GLY 338 Ca -0.11 -0.34 -0.02 0.00 0.00 0.00 0.00 46.02 45.55 3kzi n GLY 338 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3kzi n LYS 339 N 0.00 -0.17 -0.13 1.61 4.81 -1.06 -3.19 118.16 120.04 3kzi n LYS 339 Ca 0.00 0.86 -0.21 0.00 -0.87 0.00 0.00 58.31 58.09 3kzi n LYS 339 Cb 0.00 -1.28 -0.10 0.00 0.02 0.00 0.00 35.03 33.67 3kzi n LYS 339 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3kzi n TYR 340 N -4.79 0.00 -4.83 5.64 4.01 -1.26 -4.31 117.16 111.62 3kzi n TYR 340 Ca 0.04 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.53 3kzi n TYR 340 Cb 0.20 -0.93 -0.16 0.00 -0.31 0.00 0.00 39.34 38.14 3kzi n TYR 340 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3kzi s LEU 341 N -6.82 1.99 0.00 7.72 1.43 -1.19 0.11 118.68 121.91 3kzi s LEU 341 Ca -0.34 -0.33 0.00 0.00 -1.03 0.00 0.00 54.13 52.43 3kzi s LEU 341 Cb 0.11 -0.92 -0.00 0.00 0.03 0.00 0.00 46.19 45.40 3kzi s LEU 341 CO 0.52 0.19 0.02 1.15 0.23 0.00 0.00 176.35 178.46 3kzi n MET 342 N 2.84 0.03 -4.42 1.70 0.00 -0.41 -4.57 117.12 112.29 3kzi n MET 342 Ca -0.16 -0.19 -0.30 0.00 0.00 0.00 0.00 57.70 57.05 3kzi n MET 342 Cb 0.54 0.16 -0.11 0.00 0.00 0.00 0.00 33.22 33.80 3kzi n MET 342 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 3kzi s ARG 343 N -2.08 2.01 0.87 3.17 0.52 -1.26 -0.97 118.95 121.22 3kzi s ARG 343 Ca 0.02 -1.04 -0.12 0.00 -0.52 0.00 0.00 55.73 54.07 3kzi s ARG 343 Cb 0.00 -2.21 0.16 0.00 0.52 0.00 0.00 34.95 33.42 3kzi s ARG 343 CO 0.02 0.52 1.21 -1.54 0.02 0.00 0.00 175.30 175.52 3kzi s SER 344 N -1.87 3.69 0.58 0.23 1.04 0.05 -4.90 113.70 112.52 3kzi s SER 344 Ca 0.18 0.24 0.31 0.00 0.48 0.00 0.00 55.95 57.15 3kzi s SER 344 Cb -0.11 -0.46 1.77 0.00 0.10 0.00 0.00 66.02 67.32 3kzi s SER 344 CO 0.09 -2.35 2.21 -0.65 0.98 0.00 0.00 173.24 173.52 3kzi h PRO 345 N -1.26 0.00 -0.49 4.02 0.11 -1.98 -2.53 132.00 129.88 3kzi h PRO 345 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3kzi h PRO 345 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3kzi h PRO 345 CO 0.44 0.04 0.00 0.25 -0.21 0.00 0.00 178.00 178.52 3kzi n THR 346 N -3.68 2.17 0.00 -1.15 -2.24 -1.26 -4.98 114.28 103.14 3kzi n THR 346 Ca -0.03 -1.44 0.00 0.00 -2.27 0.00 0.00 64.05 60.31 3kzi n THR 346 Cb 0.13 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 3kzi n THR 346 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kzi n GLY 347 N 0.45 2.03 3.78 3.38 0.00 -0.95 -5.08 105.19 108.79 3kzi n GLY 347 Ca 0.24 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.89 3kzi n GLY 347 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kzi s GLU 348 N -0.86 3.94 -0.18 1.61 8.01 -1.26 -4.64 118.70 125.32 3kzi s GLU 348 Ca 0.00 1.66 -0.29 0.00 0.01 0.00 0.00 54.97 56.35 3kzi s GLU 348 Cb 0.00 -2.47 -0.00 0.00 -4.31 0.00 0.00 34.13 27.35 3kzi s GLU 348 CO 0.00 -0.37 1.01 0.42 0.01 0.00 0.00 175.26 176.34 3kzi s ILE 349 N -1.60 4.73 0.39 -1.63 -1.09 -0.70 -0.77 121.20 120.54 3kzi s ILE 349 Ca 0.61 2.01 0.04 0.00 -2.23 0.00 0.00 60.65 61.08 3kzi s ILE 349 Cb -0.26 -4.30 -0.03 0.00 -1.58 0.00 0.00 42.46 36.29 3kzi s ILE 349 CO 0.32 -0.10 0.11 0.27 -1.23 0.00 0.00 174.94 174.31 3kzi s ILE 350 N 2.67 0.72 0.45 2.92 -4.36 -0.14 -2.64 121.20 120.82 3kzi s ILE 350 Ca 0.45 -2.00 -0.21 0.00 -0.26 0.00 0.00 60.65 58.63 3kzi s ILE 350 Cb -0.16 -2.44 -0.09 0.00 1.25 0.00 0.00 42.46 41.02 3kzi s ILE 350 CO 0.11 0.00 1.02 -0.36 0.24 0.00 0.00 174.94 175.96 3kzi s PHE 351 N -3.24 3.12 0.63 1.37 0.08 -1.26 -1.29 117.98 117.40 3kzi s PHE 351 Ca 0.26 1.60 0.04 0.00 0.12 0.00 0.00 56.93 58.95 3kzi s PHE 351 Cb 0.04 -3.04 0.09 0.00 -0.57 0.00 0.00 43.02 39.54 3kzi s PHE 351 CO 0.14 -0.64 0.87 0.20 -0.10 0.00 0.00 175.22 175.69 3kzi s GLY 352 N -1.91 1.77 0.00 4.36 0.00 0.12 -4.20 107.32 107.46 3kzi s GLY 352 Ca 0.64 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 43.54 3kzi s GLY 352 CO 0.21 -1.34 0.00 0.61 0.00 0.00 0.00 173.10 172.57 3kzi n GLY 353 N -2.51 -2.35 0.25 0.20 0.00 -1.26 -4.16 105.19 95.35 3kzi n GLY 353 Ca 0.14 -1.93 0.13 0.00 0.00 0.00 0.00 46.02 44.36 3kzi n GLY 353 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3kzi h GLU 354 N 0.00 0.00 0.00 1.61 5.08 -1.98 -0.78 114.58 118.52 3kzi h GLU 354 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3kzi h GLU 354 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3kzi h GLU 354 CO 0.00 0.00 0.00 2.41 -1.00 0.00 0.00 179.01 180.42 3kzi n THR 355 N -2.53 0.00 0.33 1.13 -1.04 -1.26 -2.76 114.28 108.16 3kzi n THR 355 Ca -0.02 0.00 0.14 0.00 -2.04 0.00 0.00 64.05 62.13 3kzi n THR 355 Cb 0.21 -0.61 0.61 0.00 -1.82 0.00 0.00 70.33 68.72 3kzi n THR 355 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3kzi h MET 356 N 0.00 0.00 0.00 -2.82 -0.00 -1.30 -2.27 114.93 108.54 3kzi h MET 356 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 3kzi h MET 356 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 3kzi h MET 356 CO 0.00 0.00 -0.06 0.07 -0.00 0.00 0.00 176.91 176.92 3kzi h ARG 357 N 0.00 0.00 -0.41 -0.10 0.11 -1.79 -3.27 114.38 108.92 3kzi h ARG 357 Ca 0.00 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.98 3kzi h ARG 357 Cb 0.35 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.37 3kzi h ARG 357 CO 0.00 0.00 0.06 1.19 0.10 0.00 0.00 179.97 181.32 3kzi n PHE 358 N -2.39 1.39 0.52 4.08 3.72 -0.85 -4.65 117.46 119.28 3kzi n PHE 358 Ca 0.05 -1.15 0.03 0.00 -0.05 0.00 0.00 57.45 56.33 3kzi n PHE 358 Cb 0.45 -0.46 0.19 0.00 -0.94 0.00 0.00 39.48 38.71 3kzi n PHE 358 CO 0.00 0.00 0.00 -2.67 -0.05 0.00 0.00 176.76 174.04 3kzi n TRP 359 N -0.57 0.00 0.23 1.38 4.27 -1.23 -0.90 117.44 120.62 3kzi n TRP 359 Ca 0.30 0.00 0.11 0.00 -3.89 0.00 0.00 57.50 54.02 3kzi n TRP 359 Cb 1.07 0.00 0.26 0.00 -1.36 0.00 0.00 31.31 31.28 3kzi n TRP 359 CO 0.00 0.00 0.00 -0.25 -2.29 0.00 0.00 177.69 175.15 3kzi n ASP 360 N -0.87 3.33 -4.72 -0.67 8.00 -1.26 -4.94 116.55 115.41 3kzi n ASP 360 Ca 0.05 -1.97 -0.41 0.00 0.71 0.00 0.00 54.79 53.16 3kzi n ASP 360 Cb 0.02 -0.31 -0.04 0.00 -0.02 0.00 0.00 41.12 40.77 3kzi n ASP 360 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3kzi s PHE 361 N -1.37 3.73 0.02 1.24 5.36 -0.08 -4.98 117.98 121.90 3kzi s PHE 361 Ca 0.40 1.71 0.06 0.00 -0.96 0.00 0.00 56.93 58.15 3kzi s PHE 361 Cb 0.22 -3.06 -0.02 0.00 -0.34 0.00 0.00 43.02 39.82 3kzi s PHE 361 CO 0.31 0.10 -0.19 1.03 -1.46 0.00 0.00 175.22 175.02 3kzi s ARG 362 N 0.50 1.32 -0.23 10.12 1.81 -1.26 -5.05 118.95 126.17 3kzi s ARG 362 Ca 0.48 -0.81 -0.27 0.00 -1.72 0.00 0.00 55.73 53.42 3kzi s ARG 362 Cb -0.22 -1.37 0.11 0.00 -0.45 0.00 0.00 34.95 33.02 3kzi s ARG 362 CO 0.28 0.36 0.92 0.20 -0.68 0.00 0.00 175.30 176.38 3kzi s GLY 363 N -0.92 -0.30 0.18 -3.53 0.00 -1.26 -4.98 107.32 96.50 3kzi s GLY 363 Ca 0.06 2.26 -0.28 0.00 0.00 0.00 0.00 44.72 46.76 3kzi s GLY 363 CO 0.01 1.55 1.54 -1.55 0.00 0.00 0.00 173.10 174.65 3kzi n PRO 364 N 1.86 -0.39 -0.08 2.90 -0.04 -1.26 -0.65 135.00 137.34 3kzi n PRO 364 Ca -0.13 1.51 0.16 0.00 -0.04 0.00 0.00 63.50 65.00 3kzi n PRO 364 Cb 0.56 -2.23 0.56 0.00 -0.04 0.00 0.00 33.50 32.35 3kzi n PRO 364 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 3kzi h TRP 365 N 0.00 0.31 0.00 0.54 5.08 -1.97 -3.06 115.95 116.85 3kzi h TRP 365 Ca 0.20 0.01 -0.11 0.00 1.08 0.00 0.00 58.89 60.07 3kzi h TRP 365 Cb 0.45 -0.10 -0.02 0.00 -3.00 0.00 0.00 29.16 26.49 3kzi h TRP 365 CO -0.99 0.13 -1.80 -0.11 -1.28 0.00 0.00 178.44 174.39 3kzi n LEU 366 N -4.45 0.32 -0.15 0.11 7.94 0.18 -4.60 117.00 116.35 3kzi n LEU 366 Ca 0.11 0.13 -0.03 0.00 -1.11 0.00 0.00 56.01 55.12 3kzi n LEU 366 Cb 0.50 0.11 0.06 0.00 0.53 0.00 0.00 43.42 44.62 3kzi n LEU 366 CO 0.34 0.11 0.94 -0.33 -1.11 0.00 0.00 177.39 177.34 3kzi h GLU 367 N 0.00 0.30 0.00 1.96 4.39 -1.04 -2.44 114.58 117.75 3kzi h GLU 367 Ca -0.15 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.53 3kzi h GLU 367 Cb 1.39 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 3kzi h GLU 367 CO 0.02 0.20 0.13 -2.30 -1.16 0.00 0.00 179.01 175.89 3kzi n PRO 368 N -5.04 0.00 -0.00 2.33 -0.02 -1.26 0.74 135.00 131.74 3kzi n PRO 368 Ca 0.05 0.28 0.10 0.00 -2.02 0.00 0.00 63.50 61.92 3kzi n PRO 368 Cb 0.21 -1.63 -0.14 0.00 -0.02 0.00 0.00 33.50 31.92 3kzi n PRO 368 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3kzi n LEU 369 N -1.26 0.57 -4.77 2.45 4.77 -0.92 -4.95 117.00 112.90 3kzi n LEU 369 Ca 0.00 -0.29 -0.38 0.00 -0.03 0.00 0.00 56.01 55.31 3kzi n LEU 369 Cb 0.13 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.15 3kzi n LEU 369 CO 0.00 0.14 0.66 -0.60 -1.33 0.00 0.00 177.39 176.26 3kzi s ARG 370 N -3.18 4.64 0.00 3.23 3.52 0.23 -1.37 118.95 126.02 3kzi s ARG 370 Ca 0.01 1.39 0.00 0.00 -0.13 0.00 0.00 55.73 57.00 3kzi s ARG 370 Cb 0.15 -2.92 0.00 0.00 -1.56 0.00 0.00 34.95 30.62 3kzi s ARG 370 CO 0.87 0.32 0.00 0.41 -0.81 0.00 0.00 175.30 176.09 3kzi n GLY 371 N 0.80 5.30 0.04 8.12 0.00 -1.14 -4.76 105.19 113.54 3kzi n GLY 371 Ca 0.01 -2.07 0.12 0.00 0.00 0.00 0.00 46.02 44.08 3kzi n GLY 371 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3kzi n PRO 372 N -0.08 0.08 -0.08 1.61 -0.04 -1.26 -2.97 135.00 132.26 3kzi n PRO 372 Ca 0.00 0.13 0.04 0.00 -0.04 0.00 0.00 63.50 63.63 3kzi n PRO 372 Cb 0.00 -1.60 0.08 0.00 -0.04 0.00 0.00 33.50 31.93 3kzi n PRO 372 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3kzi n ASN 373 N -1.74 2.37 0.00 3.54 4.13 -1.26 -5.10 115.26 117.20 3kzi n ASN 373 Ca 0.06 -2.35 0.00 0.00 1.68 0.00 0.00 54.58 53.96 3kzi n ASN 373 Cb 0.32 -0.19 0.00 0.00 -1.54 0.00 0.00 39.78 38.38 3kzi n ASN 373 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3kzi n GLY 374 N -0.58 0.98 0.00 7.41 0.00 -1.16 -1.72 105.19 110.12 3kzi n GLY 374 Ca 0.07 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.14 3kzi n GLY 374 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kzi n LEU 375 N -0.23 0.00 -4.63 0.99 4.77 -1.08 -2.88 117.00 113.93 3kzi n LEU 375 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.58 3kzi n LEU 375 Cb 0.00 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.02 3kzi n LEU 375 CO 0.00 0.00 0.23 -0.62 -1.33 0.00 0.00 177.39 175.67 3kzi s ASP 376 N 0.00 6.45 0.46 -1.43 2.15 -0.47 -4.72 116.67 119.11 3kzi s ASP 376 Ca 0.00 0.54 0.30 0.00 0.43 0.00 0.00 52.55 53.82 3kzi s ASP 376 Cb 0.00 -2.28 1.64 0.00 -0.30 0.00 0.00 42.92 41.98 3kzi s ASP 376 CO 0.00 -0.25 1.92 0.25 -0.17 0.00 0.00 175.17 176.92 3kzi h LEU 377 N 8.55 0.00 0.16 -1.34 5.85 -1.89 -1.61 115.31 125.04 3kzi h LEU 377 Ca -0.30 0.00 -0.34 0.00 0.84 0.00 0.00 57.88 58.08 3kzi h LEU 377 Cb 1.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.18 3kzi h LEU 377 CO 0.72 0.00 -1.71 0.78 -0.34 0.00 0.00 178.44 177.89 3kzi h ASN 378 N 0.00 0.54 -0.23 1.25 2.35 -1.96 -2.68 115.58 114.85 3kzi h ASN 378 Ca 0.00 -0.92 -0.08 0.00 -0.55 0.00 0.00 56.30 54.75 3kzi h ASN 378 Cb 0.03 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.22 3kzi h ASN 378 CO 0.00 1.76 -0.17 0.11 -1.65 0.00 0.00 177.43 177.48 3kzi h LYS 379 N 0.01 0.52 -0.37 0.81 1.57 -1.78 -1.98 116.57 115.36 3kzi h LYS 379 Ca -0.35 -0.26 0.04 0.00 -1.87 0.00 0.00 60.65 58.21 3kzi h LYS 379 Cb 2.01 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.30 3kzi h LYS 379 CO 0.14 0.83 0.25 0.82 -0.57 0.00 0.00 179.45 180.91 3kzi h ILE 380 N 0.22 1.01 0.00 1.86 2.04 -1.45 0.82 117.51 122.01 3kzi h ILE 380 Ca 0.04 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3kzi h ILE 380 Cb 0.71 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 3kzi h ILE 380 CO 0.05 0.07 0.00 0.50 0.00 0.00 0.00 178.15 178.76 3kzi h LYS 381 N 0.36 0.00 0.00 2.37 3.64 -1.07 -3.42 116.57 118.45 3kzi h LYS 381 Ca 0.15 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 3kzi h LYS 381 Cb 0.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 3kzi h LYS 381 CO -0.03 0.00 0.00 0.27 -2.27 0.00 0.00 179.45 177.42 3kzi n ASN 382 N -2.87 0.00 -0.07 4.20 6.94 -0.79 -4.95 115.26 117.71 3kzi n ASN 382 Ca 0.04 -0.82 0.01 0.00 -0.02 0.00 0.00 54.58 53.78 3kzi n ASN 382 Cb 0.46 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 37.90 3kzi n ASN 382 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 3kzi n ASP 383 N 0.00 1.58 -4.71 0.53 8.00 0.28 -5.00 116.55 117.22 3kzi n ASP 383 Ca 0.00 -1.48 -0.42 0.00 0.71 0.00 0.00 54.79 53.60 3kzi n ASP 383 Cb 0.41 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.47 3kzi n ASP 383 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3kzi s ILE 384 N -0.52 3.08 0.07 0.53 -1.09 -1.16 -4.97 121.20 117.14 3kzi s ILE 384 Ca 0.02 0.73 0.01 0.00 -2.23 0.00 0.00 60.65 59.19 3kzi s ILE 384 Cb 0.01 -3.47 -0.04 0.00 -1.58 0.00 0.00 42.46 37.38 3kzi s ILE 384 CO 0.02 0.04 0.16 -1.10 -1.23 0.00 0.00 174.94 172.83 3kzi s GLN 385 N 1.43 3.20 0.25 2.79 -1.52 -1.26 -5.01 119.66 119.54 3kzi s GLN 385 Ca 0.67 -0.55 -0.04 0.00 -1.95 0.00 0.00 55.36 53.49 3kzi s GLN 385 Cb -0.39 -2.90 0.45 0.00 -0.22 0.00 0.00 33.01 29.95 3kzi s GLN 385 CO 0.30 0.59 1.75 -1.35 -0.25 0.00 0.00 175.29 176.34 3kzi h PRO 386 N 3.14 0.54 -0.00 2.91 0.11 -1.99 0.17 132.00 136.87 3kzi h PRO 386 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3kzi h PRO 386 Cb 1.16 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 3kzi h PRO 386 CO 0.71 0.35 0.01 0.11 -0.21 0.00 0.00 178.00 178.97 3kzi h TRP 387 N 0.55 0.00 0.20 0.65 5.08 -1.99 0.30 115.95 120.75 3kzi h TRP 387 Ca 0.42 0.00 -0.28 0.00 1.08 0.00 0.00 58.89 60.11 3kzi h TRP 387 Cb 0.57 0.00 0.03 0.00 -3.00 0.00 0.00 29.16 26.76 3kzi h TRP 387 CO -0.12 0.00 -1.24 1.96 -1.28 0.00 0.00 178.44 177.75 3kzi h GLN 388 N 0.00 0.42 -0.67 0.12 4.20 -1.08 -1.88 115.11 116.22 3kzi h GLN 388 Ca 0.00 -0.71 0.05 0.00 0.06 0.00 0.00 58.65 58.05 3kzi h GLN 388 Cb 0.01 0.27 -0.05 0.00 0.30 0.00 0.00 27.48 28.01 3kzi h GLN 388 CO -0.00 1.34 0.39 1.49 -0.67 0.00 0.00 178.83 181.38 3kzi h GLU 389 N -0.09 0.72 0.00 1.46 4.81 0.09 0.12 114.58 121.70 3kzi h GLU 389 Ca -0.22 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.95 3kzi h GLU 389 Cb 1.93 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 31.15 3kzi h GLU 389 CO 0.20 0.48 -0.06 0.07 -0.73 0.00 0.00 179.01 178.97 3kzi h ARG 390 N 0.75 0.00 0.03 1.92 0.11 -1.19 -1.57 114.38 114.42 3kzi h ARG 390 Ca 0.29 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.37 3kzi h ARG 390 Cb 0.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.20 3kzi h ARG 390 CO -0.15 0.06 -0.02 -0.09 0.10 0.00 0.00 179.97 179.88 3kzi h ARG 391 N 0.00 -0.04 -1.00 0.08 9.65 -0.41 0.67 114.38 123.33 3kzi h ARG 391 Ca -0.00 0.00 0.07 0.00 -1.10 0.00 0.00 59.98 58.95 3kzi h ARG 391 Cb 0.97 0.01 -0.07 0.00 -1.39 0.00 0.00 29.97 29.49 3kzi h ARG 391 CO 0.01 0.46 0.64 0.00 2.80 0.00 0.00 179.97 183.88 3kzi h ALA 392 N 0.35 1.40 -0.13 2.80 0.00 -0.75 0.64 119.26 123.56 3kzi h ALA 392 Ca -0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3kzi h ALA 392 Cb 0.53 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3kzi h ALA 392 CO 0.01 0.41 -0.03 0.00 0.00 0.00 0.00 179.25 179.65 3kzi h ALA 393 N 1.46 0.18 0.47 0.00 0.00 -1.22 -0.46 119.26 119.69 3kzi h ALA 393 Ca 0.44 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3kzi h ALA 393 Cb 0.20 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3kzi h ALA 393 CO -0.18 -0.08 -0.45 1.49 0.00 0.00 0.00 179.25 180.03 3kzi h GLU 394 N -0.05 -0.87 -0.13 0.00 4.57 -0.13 -1.88 114.58 116.10 3kzi h GLU 394 Ca 0.03 0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.31 3kzi h GLU 394 Cb 0.44 0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 29.22 3kzi h GLU 394 CO 0.01 -0.58 0.10 1.88 -1.18 0.00 0.00 179.01 179.23 3kzi h TYR 395 N -0.91 0.00 -0.46 0.92 0.05 -0.95 -1.72 116.97 113.90 3kzi h TYR 395 Ca -0.06 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.66 3kzi h TYR 395 Cb 0.78 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.50 3kzi h TYR 395 CO -0.22 0.00 0.05 1.98 -1.05 0.00 0.00 178.16 178.93 3kzi h MET 396 N 0.00 0.77 -0.71 4.88 4.05 -0.57 -2.83 114.93 120.53 3kzi h MET 396 Ca 0.06 -0.22 0.00 0.00 -0.28 0.00 0.00 59.70 59.26 3kzi h MET 396 Cb 0.25 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 30.97 3kzi h MET 396 CO -0.00 0.80 0.00 0.25 0.23 0.00 0.00 176.91 178.19 3kzi n THR 397 N -4.43 1.00 -2.52 -0.77 -2.24 -0.68 -3.71 114.28 100.93 3kzi n THR 397 Ca 0.00 -0.55 0.03 0.00 -2.27 0.00 0.00 64.05 61.26 3kzi n THR 397 Cb 0.26 -0.26 0.02 0.00 -2.10 0.00 0.00 70.33 68.25 3kzi n THR 397 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3kzi n HIS 398 N 0.30 0.12 -1.01 4.78 -0.00 -1.02 -5.05 115.22 113.33 3kzi n HIS 398 Ca 0.11 -0.67 -0.33 0.00 -0.00 0.00 0.00 57.72 56.84 3kzi n HIS 398 Cb 0.56 -0.13 0.14 0.00 -0.00 0.00 0.00 29.99 30.56 3kzi n HIS 398 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3kzi s ALA 399 N -0.38 1.75 -1.56 -1.41 0.00 -1.19 -4.38 121.76 114.59 3kzi s ALA 399 Ca 0.32 0.77 -0.11 0.00 0.00 0.00 0.00 51.96 52.94 3kzi s ALA 399 Cb 0.37 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 3kzi s ALA 399 CO -0.15 -2.40 2.69 -0.35 0.00 0.00 0.00 175.76 175.55 3kzi n PRO 400 N -3.54 3.47 -4.75 0.00 -0.04 -1.26 -4.73 135.00 124.15 3kzi n PRO 400 Ca 0.13 -2.40 -0.28 0.00 -0.04 0.00 0.00 63.50 60.91 3kzi n PRO 400 Cb 0.51 -2.95 -0.17 0.00 -0.04 0.00 0.00 33.50 30.85 3kzi n PRO 400 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3kzi s LEU 401 N 0.71 1.81 0.05 1.53 2.01 -1.26 -4.89 118.68 118.63 3kzi s LEU 401 Ca 0.62 -0.41 -0.28 0.00 0.01 0.00 0.00 54.13 54.06 3kzi s LEU 401 Cb 0.17 -1.08 0.10 0.00 0.01 0.00 0.00 46.19 45.39 3kzi s LEU 401 CO -0.07 0.07 1.18 -0.83 1.01 0.00 0.00 176.35 177.70 3kzi s GLY 402 N 0.65 -0.26 0.34 -3.19 0.00 -1.18 -0.77 107.32 102.90 3kzi s GLY 402 Ca -0.14 0.32 0.08 0.00 0.00 0.00 0.00 44.72 44.98 3kzi s GLY 402 CO 0.04 1.17 0.24 -1.35 0.00 0.00 0.00 173.10 173.20 3kzi s SER 403 N -3.15 5.08 0.23 1.64 1.04 -1.15 -4.90 113.70 112.49 3kzi s SER 403 Ca 0.17 -0.59 -0.06 0.00 0.48 0.00 0.00 55.95 55.95 3kzi s SER 403 Cb 0.02 -0.89 0.40 0.00 0.10 0.00 0.00 66.02 65.65 3kzi s SER 403 CO -0.01 -0.33 1.73 0.25 0.98 0.00 0.00 173.24 175.87 3kzi h LEU 404 N 1.36 0.26 -0.58 2.42 5.85 -2.00 0.38 115.31 122.99 3kzi h LEU 404 Ca -0.44 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.38 3kzi h LEU 404 Cb 1.25 0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.36 3kzi h LEU 404 CO 0.60 0.11 0.00 -0.46 -0.34 0.00 0.00 178.44 178.35 3kzi n ASN 405 N -5.00 0.53 -3.21 1.25 6.94 -1.26 -4.88 115.26 109.62 3kzi n ASN 405 Ca 0.13 -1.83 -0.10 0.00 -0.02 0.00 0.00 54.58 52.75 3kzi n ASN 405 Cb 0.37 -0.26 0.04 0.00 -2.36 0.00 0.00 39.78 37.56 3kzi n ASN 405 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 3kzi n SER 406 N -0.19 -7.00 -3.94 0.53 7.64 0.13 -5.00 113.62 105.80 3kzi n SER 406 Ca 0.00 -0.48 -0.30 0.00 1.01 0.00 0.00 58.87 59.10 3kzi n SER 406 Cb 0.13 -5.06 -0.14 0.00 -1.01 0.00 0.00 64.21 58.13 3kzi n SER 406 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3kzi s VAL 407 N -3.23 2.22 0.24 0.44 1.01 -1.25 -2.95 120.40 116.89 3kzi s VAL 407 Ca 0.26 -2.73 -0.31 0.00 0.00 0.00 0.00 61.98 59.21 3kzi s VAL 407 Cb -0.04 -2.59 -0.14 0.00 0.00 0.00 0.00 36.38 33.61 3kzi s VAL 407 CO 0.76 -0.72 1.33 0.61 0.00 0.00 0.00 175.10 177.08 3kzi n GLY 408 N 3.72 0.58 0.00 4.51 0.00 -0.54 -2.94 105.19 110.52 3kzi n GLY 408 Ca 0.04 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.54 3kzi n GLY 408 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzi n GLY 409 N 1.94 0.56 3.84 -0.02 0.00 0.05 -4.83 105.19 106.74 3kzi n GLY 409 Ca 0.11 -2.20 -0.33 0.00 0.00 0.00 0.00 46.02 43.60 3kzi n GLY 409 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kzi s VAL 410 N -0.61 4.66 0.64 1.61 1.01 -1.26 -3.11 120.40 123.34 3kzi s VAL 410 Ca 0.00 0.99 0.13 0.00 0.00 0.00 0.00 61.98 63.10 3kzi s VAL 410 Cb 0.00 -3.63 0.13 0.00 0.00 0.00 0.00 36.38 32.88 3kzi s VAL 410 CO 0.00 -0.15 1.39 0.00 0.00 0.00 0.00 175.10 176.34 3kzi h ALA 411 N 2.35 1.68 -0.06 5.51 0.00 -1.94 0.49 119.26 127.30 3kzi h ALA 411 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3kzi h ALA 411 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3kzi h ALA 411 CO 0.65 -0.68 0.00 0.25 0.00 0.00 0.00 179.25 179.47 3kzi n THR 412 N -2.64 0.04 -0.80 0.00 -2.24 -1.26 -4.99 114.28 102.40 3kzi n THR 412 Ca -0.01 -0.51 -0.29 0.00 -2.27 0.00 0.00 64.05 60.97 3kzi n THR 412 Cb 0.71 1.41 0.24 0.00 -2.10 0.00 0.00 70.33 70.59 3kzi n THR 412 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3kzi s GLU 413 N -1.96 -1.02 0.21 -0.78 2.56 0.17 -5.06 118.70 112.83 3kzi s GLU 413 Ca 0.29 0.42 0.06 0.00 0.00 0.00 0.00 54.97 55.74 3kzi s GLU 413 Cb 0.20 -1.58 -0.04 0.00 2.00 0.00 0.00 34.13 34.72 3kzi s GLU 413 CO 0.30 -3.68 0.19 0.42 -0.56 0.00 0.00 175.26 171.93 3kzi s ILE 414 N -2.68 4.58 0.46 -3.70 -1.09 -1.26 -5.02 121.20 112.48 3kzi s ILE 414 Ca 0.68 -1.19 -0.23 0.00 -2.23 0.00 0.00 60.65 57.68 3kzi s ILE 414 Cb -0.18 -3.41 -0.07 0.00 -1.58 0.00 0.00 42.46 37.21 3kzi s ILE 414 CO 0.60 -0.23 1.18 0.20 -1.23 0.00 0.00 174.94 175.45 3kzi s ASN 415 N -3.50 6.15 0.00 3.58 0.01 -1.26 -4.60 114.94 115.32 3kzi s ASN 415 Ca 0.32 2.34 0.00 0.00 -0.71 0.00 0.00 52.86 54.81 3kzi s ASN 415 Cb -0.09 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 38.96 3kzi s ASN 415 CO 0.25 -0.93 0.00 -1.54 -1.51 0.00 0.00 177.10 173.36 3kzi n SER 416 N -0.47 0.00 -4.39 -1.22 3.41 -1.26 -5.06 113.62 104.62 3kzi n SER 416 Ca 0.07 0.00 -0.45 0.00 -0.26 0.00 0.00 58.87 58.24 3kzi n SER 416 Cb 0.48 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.39 3kzi n SER 416 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3kzi s VAL 417 N 0.00 4.84 -0.72 -3.33 0.11 -1.26 -4.99 120.40 115.04 3kzi s VAL 417 Ca 0.00 -1.23 -0.27 0.00 -2.93 0.00 0.00 61.98 57.55 3kzi s VAL 417 Cb 0.00 -4.58 0.02 0.00 -1.53 0.00 0.00 36.38 30.30 3kzi s VAL 417 CO 0.00 -1.24 1.36 0.21 -3.33 0.00 0.00 175.10 172.10 3kzi s ASN 418 N 3.45 6.04 -0.28 3.54 2.47 -1.26 -1.46 114.94 127.44 3kzi s ASN 418 Ca 0.18 -0.33 -0.25 0.00 0.42 0.00 0.00 52.86 52.88 3kzi s ASN 418 Cb -0.17 -2.56 0.11 0.00 -1.45 0.00 0.00 41.25 37.18 3kzi s ASN 418 CO 0.01 -1.91 0.94 0.12 -3.72 0.00 0.00 177.10 172.54 3kzi s PHE 419 N 6.21 -0.56 -0.18 0.43 5.36 -1.15 -4.85 117.98 123.23 3kzi s PHE 419 Ca 0.40 1.36 -0.04 0.00 -0.96 0.00 0.00 56.93 57.69 3kzi s PHE 419 Cb -0.09 0.34 0.09 0.00 -0.34 0.00 0.00 43.02 43.02 3kzi s PHE 419 CO 0.16 -0.27 0.26 0.08 -1.46 0.00 0.00 175.22 173.99 3kzi s VAL 420 N 0.24 -0.41 0.06 3.12 1.01 -1.26 -1.47 120.40 121.69 3kzi s VAL 420 Ca 0.02 0.03 -0.37 0.00 0.00 0.00 0.00 61.98 61.66 3kzi s VAL 420 Cb -0.05 -0.62 -0.18 0.00 0.00 0.00 0.00 36.38 35.53 3kzi s VAL 420 CO -0.04 -0.08 1.13 -0.24 0.00 0.00 0.00 175.10 175.87 3kzi n SER 421 N 5.34 0.59 -0.09 3.32 2.88 -1.26 -4.78 113.62 119.62 3kzi n SER 421 Ca -0.05 1.14 0.19 0.00 -1.33 0.00 0.00 58.87 58.82 3kzi n SER 421 Cb 0.50 -1.04 0.61 0.00 -0.75 0.00 0.00 64.21 63.53 3kzi n SER 421 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3kzi h PRO 422 N 3.41 0.18 -0.02 -1.46 0.11 -1.89 0.39 132.00 132.72 3kzi h PRO 422 Ca -0.48 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 3kzi h PRO 422 Cb 1.39 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.45 3kzi h PRO 422 CO 0.69 0.12 -0.27 0.00 -0.21 0.00 0.00 178.00 178.32 3kzi h ARG 423 N 0.18 0.03 -0.02 1.05 3.08 -1.88 -0.62 114.38 116.20 3kzi h ARG 423 Ca 0.32 -0.01 -0.12 0.00 0.07 0.00 0.00 59.98 60.24 3kzi h ARG 423 Cb 1.01 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.06 3kzi h ARG 423 CO -0.06 0.31 -0.45 0.77 -1.07 0.00 0.00 179.97 179.47 3kzi h SER 424 N 0.03 0.43 0.73 7.04 0.02 -0.58 -2.57 113.55 118.66 3kzi h SER 424 Ca 0.00 -0.74 -0.03 0.00 -0.84 0.00 0.00 61.79 60.18 3kzi h SER 424 Cb 0.50 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.91 3kzi h SER 424 CO 0.04 1.11 -0.45 -0.50 -1.14 0.00 0.00 176.83 175.88 3kzi h TRP 425 N -0.20 -1.20 -0.12 3.45 4.06 -1.15 -1.88 115.95 118.90 3kzi h TRP 425 Ca -0.05 -0.01 0.03 0.00 2.06 0.00 0.00 58.89 60.91 3kzi h TRP 425 Cb 1.16 0.43 -0.06 0.00 -1.00 0.00 0.00 29.16 29.69 3kzi h TRP 425 CO 0.15 -0.67 -0.52 -0.07 -3.56 0.00 0.00 178.44 173.77 3kzi h LEU 426 N -1.11 -1.65 -0.93 -4.49 3.38 -1.24 -1.95 115.31 107.32 3kzi h LEU 426 Ca -0.10 0.19 0.21 0.00 0.09 0.00 0.00 57.88 58.27 3kzi h LEU 426 Cb 0.89 0.64 -0.12 0.00 0.09 0.00 0.00 40.66 42.16 3kzi h LEU 426 CO 0.10 -0.47 0.49 0.00 0.09 0.00 0.00 178.44 178.65 3kzi h ALA 427 N -0.37 1.53 0.06 1.53 0.00 -1.43 -1.61 119.26 118.97 3kzi h ALA 427 Ca 0.03 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3kzi h ALA 427 Cb 0.66 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3kzi h ALA 427 CO -0.41 -0.23 -0.03 1.79 0.00 0.00 0.00 179.25 180.37 3kzi h THR 428 N 0.55 1.24 -0.63 0.00 1.35 -0.97 -2.58 112.91 111.87 3kzi h THR 428 Ca 0.56 -1.45 0.13 0.00 -0.55 0.00 0.00 66.41 65.11 3kzi h THR 428 Cb 0.99 2.13 -0.11 0.00 -1.73 0.00 0.00 68.15 69.44 3kzi h THR 428 CO -0.46 0.34 -0.02 0.77 -0.25 0.00 0.00 175.52 175.90 3kzi h SER 429 N -0.78 -0.32 1.14 5.36 4.64 -1.12 -0.47 113.55 122.00 3kzi h SER 429 Ca -0.01 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3kzi h SER 429 Cb 0.62 0.29 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3kzi h SER 429 CO 0.01 -0.13 0.00 0.45 -0.87 0.00 0.00 176.83 176.29 3kzi h HIS 430 N 0.10 0.00 0.22 4.77 -0.00 -1.37 -1.87 115.15 117.00 3kzi h HIS 430 Ca 0.33 0.00 -0.32 0.00 -0.00 0.00 0.00 60.37 60.38 3kzi h HIS 430 Cb 0.53 0.00 0.03 0.00 -0.00 0.00 0.00 27.41 27.97 3kzi h HIS 430 CO -0.39 0.00 -1.44 0.35 -0.00 0.00 0.00 177.93 176.45 3kzi h PHE 431 N 0.00 0.83 0.33 2.45 3.57 -0.69 -0.61 116.94 122.82 3kzi h PHE 431 Ca 0.00 -0.61 -0.02 0.00 3.53 0.00 0.00 57.97 60.88 3kzi h PHE 431 Cb 0.57 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.28 3kzi h PHE 431 CO 0.00 1.49 -0.16 0.28 -2.23 0.00 0.00 178.31 177.70 3kzi h VAL 432 N 0.12 0.69 0.33 1.41 2.07 -1.13 0.15 116.25 119.90 3kzi h VAL 432 Ca -0.23 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 3kzi h VAL 432 Cb 2.12 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.65 3kzi h VAL 432 CO 0.25 0.03 -0.21 -0.07 0.02 0.00 0.00 177.57 177.59 3kzi h LEU 433 N -0.52 -0.52 -0.77 2.57 3.38 -1.44 -0.92 115.31 117.09 3kzi h LEU 433 Ca -0.05 0.03 0.18 0.00 0.09 0.00 0.00 57.88 58.13 3kzi h LEU 433 Cb 0.39 0.16 -0.12 0.00 0.09 0.00 0.00 40.66 41.18 3kzi h LEU 433 CO 0.07 -0.33 0.19 0.00 0.09 0.00 0.00 178.44 178.46 3kzi h ALA 434 N 0.13 1.02 0.03 1.53 0.00 -0.98 -1.61 119.26 119.37 3kzi h ALA 434 Ca -0.03 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3kzi h ALA 434 Cb 0.43 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3kzi h ALA 434 CO 0.03 -0.36 -0.02 0.35 0.00 0.00 0.00 179.25 179.25 3kzi h PHE 435 N 0.26 -0.04 -1.50 0.00 3.57 -0.08 -2.76 116.94 116.39 3kzi h PHE 435 Ca 0.45 -0.00 0.45 0.00 3.53 0.00 0.00 57.97 62.40 3kzi h PHE 435 Cb 0.79 0.01 -0.09 0.00 2.79 0.00 0.00 35.95 39.45 3kzi h PHE 435 CO -0.27 -0.03 1.04 0.74 -2.23 0.00 0.00 178.31 177.56 3kzi h PHE 436 N -0.05 0.25 -0.12 0.41 0.04 -1.05 1.54 116.94 117.96 3kzi h PHE 436 Ca -0.00 0.01 -0.10 0.00 2.80 0.00 0.00 57.97 60.68 3kzi h PHE 436 Cb 0.03 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.11 3kzi h PHE 436 CO 0.20 -0.08 -0.37 0.74 -0.60 0.00 0.00 178.31 178.21 3kzi h PHE 437 N 0.06 0.30 0.00 -0.55 0.05 -1.15 0.30 116.94 115.94 3kzi h PHE 437 Ca 0.80 -0.07 -0.07 0.00 3.82 0.00 0.00 57.97 62.44 3kzi h PHE 437 Cb 2.85 -0.07 -0.01 0.00 2.00 0.00 0.00 35.95 40.73 3kzi h PHE 437 CO -0.00 0.60 -0.33 1.25 -0.18 0.00 0.00 178.31 179.64 3kzi h LEU 438 N 0.22 0.00 -0.01 1.54 5.85 0.25 0.39 115.31 123.55 3kzi h LEU 438 Ca 0.02 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 3kzi h LEU 438 Cb 0.75 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.79 3kzi h LEU 438 CO 0.06 0.33 -0.28 0.58 -0.34 0.00 0.00 178.44 178.79 3kzi h VAL 439 N 0.00 1.51 -0.75 1.05 2.07 -0.93 -2.28 116.25 116.92 3kzi h VAL 439 Ca -0.00 -1.90 0.15 0.00 0.82 0.00 0.00 66.70 65.77 3kzi h VAL 439 Cb 0.73 2.67 -0.10 0.00 -1.52 0.00 0.00 31.29 33.07 3kzi h VAL 439 CO 0.04 0.53 0.26 1.23 0.02 0.00 0.00 177.57 179.65 3kzi h GLY 440 N -0.41 1.12 0.12 2.17 0.00 0.32 0.22 103.07 106.61 3kzi h GLY 440 Ca -0.03 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 3kzi h GLY 440 CO 0.06 -0.14 -0.09 0.84 0.00 0.00 0.00 176.54 177.21 3kzi h HIS 441 N 0.38 -0.24 -0.97 5.60 6.17 -0.17 0.05 115.15 125.97 3kzi h HIS 441 Ca 0.42 -0.00 0.18 0.00 0.71 0.00 0.00 60.37 61.68 3kzi h HIS 441 Cb 0.68 0.09 -0.18 0.00 2.52 0.00 0.00 27.41 30.52 3kzi h HIS 441 CO -0.20 -0.13 -0.28 -0.07 0.71 0.00 0.00 177.93 177.97 3kzi h LEU 442 N -0.20 -1.04 0.34 0.26 3.38 -0.78 0.65 115.31 117.92 3kzi h LEU 442 Ca -0.02 0.30 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 3kzi h LEU 442 Cb 0.17 0.64 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 3kzi h LEU 442 CO 0.01 -0.31 -0.19 -0.25 0.09 0.00 0.00 178.44 177.78 3kzi h TRP 443 N -0.00 -0.50 0.00 1.13 2.91 -0.37 0.87 115.95 119.98 3kzi h TRP 443 Ca 0.43 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 60.40 3kzi h TRP 443 Cb 0.68 0.17 -0.01 0.00 -0.51 0.00 0.00 29.16 29.50 3kzi h TRP 443 CO -0.78 -0.30 -0.20 0.45 -1.03 0.00 0.00 178.44 176.58 3kzi h HIS 444 N -0.50 0.00 0.16 2.65 3.86 -0.23 -2.09 115.15 118.99 3kzi h HIS 444 Ca -0.04 0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 58.88 3kzi h HIS 444 Cb 0.40 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.89 3kzi h HIS 444 CO -0.08 0.20 -1.29 0.00 0.86 0.00 0.00 177.93 177.62 3kzi h ALA 445 N 1.80 0.04 -0.30 2.45 0.00 -0.72 -2.30 119.26 120.23 3kzi h ALA 445 Ca -0.00 -0.87 -0.10 0.00 0.00 0.00 0.00 54.91 53.94 3kzi h ALA 445 Cb 0.67 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3kzi h ALA 445 CO 0.03 0.89 -0.22 0.78 0.00 0.00 0.00 179.25 180.72 3kzi h GLY 446 N 1.18 0.62 0.90 0.00 0.00 -0.64 -2.22 103.07 102.92 3kzi h GLY 446 Ca -0.16 -0.50 -0.11 0.00 0.00 0.00 0.00 47.33 46.56 3kzi h GLY 446 CO 0.22 0.46 -0.29 -0.09 0.00 0.00 0.00 176.54 176.84 3kzi h ARG 447 N 0.51 0.59 -0.70 4.80 9.65 -1.41 -3.01 114.38 124.81 3kzi h ARG 447 Ca 0.08 -0.34 -0.01 0.00 -1.10 0.00 0.00 59.98 58.61 3kzi h ARG 447 Cb 0.66 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 29.23 3kzi h ARG 447 CO 0.05 0.94 0.39 0.00 2.80 0.00 0.00 179.97 184.15 3kzi h ALA 448 N 0.65 0.90 -0.05 2.80 0.00 -1.24 0.22 119.26 122.53 3kzi h ALA 448 Ca 0.03 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 3kzi h ALA 448 Cb 0.86 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3kzi h ALA 448 CO 0.07 0.41 -0.36 0.00 0.00 0.00 0.00 179.25 179.37 3kzi h ARG 449 N 0.97 0.11 0.08 0.00 2.47 -1.43 0.28 114.38 116.85 3kzi h ARG 449 Ca 0.25 -0.04 -0.28 0.00 -1.26 0.00 0.00 59.98 58.65 3kzi h ARG 449 Cb 0.03 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.33 3kzi h ARG 449 CO -0.04 0.45 -1.39 0.00 0.56 0.00 0.00 179.97 179.55 3kzi h ALA 450 N 1.55 0.31 0.47 0.04 0.00 -1.35 -3.07 119.26 117.21 3kzi h ALA 450 Ca 0.01 -1.07 -0.02 0.00 0.00 0.00 0.00 54.91 53.83 3kzi h ALA 450 Cb 0.68 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3kzi h ALA 450 CO 0.05 1.18 -0.23 0.00 0.00 0.00 0.00 179.25 180.25 3kzi h ALA 451 N 0.67 -0.64 -3.00 0.00 0.00 -0.37 0.71 119.26 116.63 3kzi h ALA 451 Ca -0.18 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3kzi h ALA 451 Cb 1.96 0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.99 3kzi h ALA 451 CO 0.15 -0.79 0.00 0.00 0.00 0.00 0.00 179.25 178.62 3kzi n ALA 452 N -2.45 0.00 -0.22 0.00 0.00 0.07 -0.65 120.51 117.25 3kzi n ALA 452 Ca -0.11 0.00 0.29 0.00 0.00 0.00 0.00 53.44 53.61 3kzi n ALA 452 Cb 0.29 0.05 0.45 0.00 0.00 0.00 0.00 19.45 20.25 3kzi n ALA 452 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kzi h ALA 453 N -2.35 2.99 -2.52 0.00 0.00 -1.65 -3.44 119.26 112.28 3kzi h ALA 453 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3kzi h ALA 453 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3kzi h ALA 453 CO 0.00 -1.76 0.00 0.41 0.00 0.00 0.00 179.25 177.90 3kzi n GLY 454 N -1.72 0.87 0.03 0.00 0.00 0.18 -5.04 105.19 99.51 3kzi n GLY 454 Ca 0.24 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3kzi n GLY 454 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3kzi n PHE 455 N -1.24 0.00 0.25 1.61 -1.74 0.19 -4.92 117.46 111.60 3kzi n PHE 455 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 3kzi n PHE 455 Cb 0.42 0.04 0.00 0.00 1.52 0.00 0.00 39.48 41.46 3kzi n PHE 455 CO 0.00 0.00 0.00 -0.85 -0.56 0.00 0.00 176.76 175.35 3kzi n GLU 456 N 0.00 0.19 0.00 3.97 0.00 -1.18 -1.04 120.64 122.58 3kzi n GLU 456 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 3kzi n GLU 456 Cb 0.51 -1.07 0.00 0.00 0.00 0.00 0.00 31.44 30.88 3kzi n GLU 456 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3kzi n LYS 457 N 0.15 0.32 0.00 3.44 5.02 -1.26 -4.99 118.16 120.85 3kzi n LYS 457 Ca 0.00 -0.49 0.00 0.00 -2.02 0.00 0.00 58.31 55.80 3kzi n LYS 457 Cb 0.03 -0.60 0.00 0.00 -0.02 0.00 0.00 35.03 34.44 3kzi n LYS 457 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kzi n GLY 458 N -0.07 3.82 3.73 0.72 0.00 -0.21 -5.06 105.19 108.12 3kzi n GLY 458 Ca 0.00 -1.72 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 3kzi n GLY 458 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kzi s ILE 459 N -2.37 4.64 -0.34 -0.61 1.01 -1.26 -4.80 121.20 117.47 3kzi s ILE 459 Ca 0.00 1.96 -0.27 0.00 0.00 0.00 0.00 60.65 62.34 3kzi s ILE 459 Cb 0.00 -4.27 -0.05 0.00 0.01 0.00 0.00 42.46 38.14 3kzi s ILE 459 CO 0.00 0.29 2.25 -0.62 0.00 0.00 0.00 174.94 176.86 3kzi s ASP 460 N 0.24 5.10 0.28 3.58 -1.08 -1.26 -4.81 116.67 118.72 3kzi s ASP 460 Ca 0.46 1.49 -0.06 0.00 -0.52 0.00 0.00 52.55 53.93 3kzi s ASP 460 Cb -0.22 -2.51 0.53 0.00 -1.46 0.00 0.00 42.92 39.26 3kzi s ASP 460 CO 0.28 -2.30 1.57 0.03 0.52 0.00 0.00 175.17 175.26 3kzi h ARG 461 N 16.58 0.00 0.00 4.34 2.47 -2.01 -2.65 114.38 133.10 3kzi h ARG 461 Ca -0.34 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.38 3kzi h ARG 461 Cb 1.24 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.56 3kzi h ARG 461 CO 1.05 0.00 0.00 0.39 0.56 0.00 0.00 179.97 181.97 3kzi n GLU 462 N -5.59 0.00 -2.69 0.04 -0.58 -1.26 -4.20 120.64 106.36 3kzi n GLU 462 Ca 0.17 0.06 -0.43 0.00 -0.42 0.00 0.00 57.16 56.54 3kzi n GLU 462 Cb 0.56 -0.99 -0.01 0.00 -0.57 0.00 0.00 31.44 30.42 3kzi n GLU 462 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3kzi s SER 463 N -1.91 6.80 -0.75 1.62 1.04 -1.02 -4.94 113.70 114.55 3kzi s SER 463 Ca 0.00 -2.31 -0.21 0.00 0.48 0.00 0.00 55.95 53.91 3kzi s SER 463 Cb 0.00 -2.52 0.09 0.00 0.10 0.00 0.00 66.02 63.69 3kzi s SER 463 CO 0.00 -1.14 1.00 -0.70 0.98 0.00 0.00 173.24 173.39 3kzi s GLU 464 N 3.64 3.27 0.11 4.02 2.12 -1.10 -4.28 118.70 126.48 3kzi s GLU 464 Ca 0.48 -1.18 -0.13 0.00 0.36 0.00 0.00 54.97 54.50 3kzi s GLU 464 Cb 0.01 -4.47 0.07 0.00 0.26 0.00 0.00 34.13 29.99 3kzi s GLU 464 CO 0.00 -1.79 0.86 -0.35 -0.54 0.00 0.00 175.26 173.45 3kzi n PRO 465 N 7.25 -0.17 -0.33 4.30 -0.04 -1.26 0.89 135.00 145.64 3kzi n PRO 465 Ca 0.05 0.85 0.19 0.00 -0.04 0.00 0.00 63.50 64.55 3kzi n PRO 465 Cb 0.46 -1.26 0.44 0.00 -0.04 0.00 0.00 33.50 33.11 3kzi n PRO 465 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3kzi h VAL 466 N 0.00 0.58 0.00 0.52 2.07 -1.96 0.68 116.25 118.15 3kzi h VAL 466 Ca 0.15 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.49 3kzi h VAL 466 Cb 0.29 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.08 3kzi h VAL 466 CO -0.54 0.10 0.00 0.18 0.02 0.00 0.00 177.57 177.32 3kzi n LEU 467 N -4.71 0.00 -0.69 2.57 4.77 0.26 -1.92 117.00 117.28 3kzi n LEU 467 Ca 0.25 0.35 0.07 0.00 -0.03 0.00 0.00 56.01 56.65 3kzi n LEU 467 Cb 0.76 -0.35 0.12 0.00 -2.33 0.00 0.00 43.42 41.61 3kzi n LEU 467 CO 0.23 -0.22 0.56 -1.20 -1.33 0.00 0.00 177.39 175.43 3kzi n SER 468 N -1.35 2.63 -4.79 -1.43 7.64 0.23 -4.97 113.62 111.58 3kzi n SER 468 Ca 0.04 -1.77 -0.35 0.00 1.01 0.00 0.00 58.87 57.81 3kzi n SER 468 Cb 0.10 -0.12 -0.07 0.00 -1.01 0.00 0.00 64.21 63.11 3kzi n SER 468 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 3kzi s MET 469 N -1.13 3.16 0.61 1.43 -1.94 -0.81 -5.08 119.30 115.55 3kzi s MET 469 Ca 0.23 -0.35 -0.19 0.00 -1.71 0.00 0.00 55.69 53.66 3kzi s MET 469 Cb 0.14 -2.94 -0.03 0.00 2.01 0.00 0.00 34.83 34.00 3kzi s MET 469 CO 0.19 0.70 1.20 -0.35 -0.01 0.00 0.00 175.02 176.76 3kzi n PRO 470 N 1.68 1.16 -2.48 2.03 -0.04 -1.26 -4.93 135.00 131.15 3kzi n PRO 470 Ca -0.16 0.44 -0.42 0.00 -0.04 0.00 0.00 63.50 63.32 3kzi n PRO 470 Cb 0.54 -2.42 -0.03 0.00 -0.04 0.00 0.00 33.50 31.54 3kzi n PRO 470 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3kzi s SER 471 N -1.25 7.11 -0.04 3.54 0.15 -1.26 -4.91 113.70 117.05 3kzi s SER 471 Ca 0.78 1.89 -0.06 0.00 0.70 0.00 0.00 55.95 59.26 3kzi s SER 471 Cb -0.40 -2.57 -0.28 0.00 -1.71 0.00 0.00 66.02 61.06 3kzi s SER 471 CO 0.44 -0.48 0.69 0.17 1.20 0.00 0.00 173.24 175.26 3kzi h LEU 472 N 7.33 0.47 0.00 3.45 8.10 -2.03 -3.57 115.31 129.06 3kzi h LEU 472 Ca -0.39 -0.74 0.00 0.00 0.11 0.00 0.00 57.88 56.87 3kzi h LEU 472 Cb 1.19 -0.15 0.00 0.00 -0.44 0.00 0.00 40.66 41.26 3kzi h LEU 472 CO 0.83 1.63 0.00 -0.90 -4.11 0.00 0.00 178.44 175.89