#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z4k s ALA 35 N 0.00 3.53 0.24 5.13 0.00 -1.26 -4.92 121.76 124.48 1z4k s ALA 35 Ca 0.00 1.36 -0.30 0.00 0.00 0.00 0.00 51.96 53.02 1z4k s ALA 35 Cb 0.00 -3.52 -0.09 0.00 0.00 0.00 0.00 23.12 19.51 1z4k s ALA 35 CO 0.00 -0.77 1.16 -1.17 0.00 0.00 0.00 175.76 174.98 1z4k s LEU 36 N -1.74 4.50 -0.15 0.00 2.96 -0.26 -4.87 118.68 119.12 1z4k s LEU 36 Ca 0.51 2.27 0.02 0.00 -0.22 0.00 0.00 54.13 56.71 1z4k s LEU 36 Cb -0.42 -3.62 0.01 0.00 0.50 0.00 0.00 46.19 42.66 1z4k s LEU 36 CO 0.55 -0.27 -0.20 -0.60 -1.32 0.00 0.00 176.35 174.50 1z4k s ARG 37 N -0.90 3.06 -0.13 1.98 3.52 -1.26 -0.82 118.95 124.40 1z4k s ARG 37 Ca 0.49 -0.83 0.02 0.00 -0.13 0.00 0.00 55.73 55.27 1z4k s ARG 37 Cb -0.33 -2.48 0.02 0.00 -1.56 0.00 0.00 34.95 30.60 1z4k s ARG 37 CO 0.40 -0.02 -0.16 0.08 -0.81 0.00 0.00 175.30 174.79 1z4k s VAL 38 N 0.84 1.63 -0.19 7.11 1.01 -0.34 -0.89 120.40 129.58 1z4k s VAL 38 Ca -0.06 -0.71 -0.18 0.00 0.00 0.00 0.00 61.98 61.03 1z4k s VAL 38 Cb -0.15 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 1z4k s VAL 38 CO -0.02 0.47 0.48 -0.76 0.00 0.00 0.00 175.10 175.27 1z4k s LEU 39 N 1.08 4.16 -0.23 3.92 1.43 0.43 -1.52 118.68 127.96 1z4k s LEU 39 Ca -0.04 0.65 -0.03 0.00 -1.03 0.00 0.00 54.13 53.68 1z4k s LEU 39 Cb -0.14 -2.66 0.00 0.00 0.03 0.00 0.00 46.19 43.42 1z4k s LEU 39 CO -0.04 -0.13 -0.05 -0.69 0.23 0.00 0.00 176.35 175.66 1z4k s VAL 40 N 1.43 3.19 0.73 -1.59 1.01 0.33 -0.71 120.40 124.79 1z4k s VAL 40 Ca 0.23 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 1z4k s VAL 40 Cb -0.15 -2.48 0.04 0.00 0.00 0.00 0.00 36.38 33.78 1z4k s VAL 40 CO 0.09 0.38 1.11 0.21 0.00 0.00 0.00 175.10 176.89 1z4k s ASN 41 N 1.44 4.64 0.00 3.32 3.04 -0.22 -0.95 114.94 126.21 1z4k s ASN 41 Ca 0.05 1.94 0.00 0.00 0.04 0.00 0.00 52.86 54.89 1z4k s ASN 41 Cb -0.15 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 37.02 1z4k s ASN 41 CO -0.04 -1.95 0.00 0.80 -3.04 0.00 0.00 177.10 172.87 1z4k n MET 42 N -3.08 0.00 -2.10 0.43 0.00 -1.26 -3.78 117.12 107.34 1z4k n MET 42 Ca 0.10 0.05 -0.41 0.00 -0.00 0.00 0.00 57.70 57.44 1z4k n MET 42 Cb 0.52 -0.32 -0.02 0.00 0.00 0.00 0.00 33.22 33.40 1z4k n MET 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1z4k s ASP 43 N -1.99 6.75 0.00 6.12 1.01 -1.26 -0.21 116.67 127.09 1z4k s ASP 43 Ca 0.00 2.60 0.00 0.00 0.71 0.00 0.00 52.55 55.86 1z4k s ASP 43 Cb 0.00 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.30 1z4k s ASP 43 CO 0.00 -0.61 0.00 0.61 0.21 0.00 0.00 175.17 175.38 1z4k n GLY 44 N 1.83 1.59 1.61 0.21 0.00 0.12 -4.71 105.19 105.85 1z4k n GLY 44 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1z4k n GLY 44 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1z4k n VAL 45 N -2.00 0.11 -0.09 1.61 0.31 -0.74 -4.71 118.33 112.83 1z4k n VAL 45 Ca 0.00 0.03 -0.19 0.00 -0.01 0.00 0.00 64.34 64.17 1z4k n VAL 45 Cb 0.00 -0.90 -0.13 0.00 -0.91 0.00 0.00 33.84 31.90 1z4k n VAL 45 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1z4k n LEU 46 N -2.87 2.84 -4.36 7.52 4.77 0.70 -4.70 117.00 120.90 1z4k n LEU 46 Ca 0.00 -0.01 -0.32 0.00 -0.03 0.00 0.00 56.01 55.65 1z4k n LEU 46 Cb 0.15 -0.98 -0.15 0.00 -2.33 0.00 0.00 43.42 40.12 1z4k n LEU 46 CO 0.00 0.90 -0.51 0.00 -1.33 0.00 0.00 177.39 176.45 1z4k s ALA 47 N -2.53 2.40 -1.23 -1.18 0.00 -0.52 -0.97 121.76 117.73 1z4k s ALA 47 Ca -0.31 -1.01 -0.15 0.00 0.00 0.00 0.00 51.96 50.49 1z4k s ALA 47 Cb 0.08 -0.84 0.14 0.00 0.00 0.00 0.00 23.12 22.50 1z4k s ALA 47 CO 0.65 0.45 1.52 0.34 0.00 0.00 0.00 175.76 178.72 1z4k s ASP 48 N -0.32 6.99 0.10 0.00 2.15 0.08 -0.70 116.67 124.97 1z4k s ASP 48 Ca 0.02 -2.80 -0.17 0.00 0.43 0.00 0.00 52.55 50.03 1z4k s ASP 48 Cb -0.13 -2.46 -0.07 0.00 -0.30 0.00 0.00 42.92 39.97 1z4k s ASP 48 CO 0.02 -0.89 1.51 0.15 -0.17 0.00 0.00 175.17 175.79 1z4k h PHE 49 N 7.34 0.62 -0.16 -5.34 3.04 -1.93 -1.91 116.94 118.59 1z4k h PHE 49 Ca 0.35 -0.12 0.00 0.00 3.98 0.00 0.00 57.97 62.18 1z4k h PHE 49 Cb 0.88 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 39.22 1z4k h PHE 49 CO 1.21 0.73 0.11 0.93 -2.02 0.00 0.00 178.31 179.26 1z4k h GLU 50 N 0.33 0.21 -0.57 1.11 4.39 -1.99 0.14 114.58 118.19 1z4k h GLU 50 Ca 0.08 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.69 1z4k h GLU 50 Cb 0.51 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.10 1z4k h GLU 50 CO 0.02 0.14 0.05 0.78 -1.16 0.00 0.00 179.01 178.84 1z4k h GLY 51 N 0.22 1.06 0.97 -3.84 0.00 -1.97 -1.54 103.07 97.96 1z4k h GLY 51 Ca 0.06 -0.74 -0.07 0.00 0.00 0.00 0.00 47.33 46.58 1z4k h GLY 51 CO -0.01 0.68 -0.02 -1.33 0.00 0.00 0.00 176.54 175.86 1z4k h GLY 52 N 0.87 0.82 0.96 4.60 0.00 -1.18 -1.88 103.07 107.26 1z4k h GLY 52 Ca 0.17 -0.62 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 1z4k h GLY 52 CO 0.02 0.57 -0.02 -2.75 0.00 0.00 0.00 176.54 174.35 1z4k h PHE 53 N 0.59 -0.06 -0.38 5.60 3.57 -0.61 -2.11 116.94 123.54 1z4k h PHE 53 Ca 0.12 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.63 1z4k h PHE 53 Cb 0.51 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 1z4k h PHE 53 CO 0.04 -0.00 0.23 1.25 -2.23 0.00 0.00 178.31 177.60 1z4k h LEU 54 N -0.10 0.39 -0.26 0.59 5.85 -1.15 0.33 115.31 120.96 1z4k h LEU 54 Ca -0.01 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.73 1z4k h LEU 54 Cb 0.08 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1z4k h LEU 54 CO 0.01 0.28 0.13 -0.09 -0.34 0.00 0.00 178.44 178.43 1z4k h ARG 55 N 0.48 0.26 0.00 1.25 2.43 -1.26 -1.54 114.38 116.00 1z4k h ARG 55 Ca 0.14 -0.02 -0.19 0.00 -0.81 0.00 0.00 59.98 59.11 1z4k h ARG 55 Cb -0.02 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1z4k h ARG 55 CO -0.05 0.18 -0.86 0.87 -1.51 0.00 0.00 179.97 178.59 1z4k h LYS 56 N 0.27 0.15 -0.04 0.20 1.57 -1.04 -1.92 116.57 115.76 1z4k h LYS 56 Ca 0.11 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1z4k h LYS 56 Cb 0.03 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 1z4k h LYS 56 CO -0.08 0.92 0.02 0.35 -0.57 0.00 0.00 179.45 180.09 1z4k h PHE 57 N 0.08 0.05 -0.43 -1.35 3.04 -0.20 -1.03 116.94 117.11 1z4k h PHE 57 Ca -0.04 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.86 1z4k h PHE 57 Cb 1.49 -0.02 -0.02 0.00 2.56 0.00 0.00 35.95 39.97 1z4k h PHE 57 CO 0.02 0.11 0.04 0.00 -2.02 0.00 0.00 178.31 176.47 1z4k h ARG 58 N -0.03 0.67 -0.38 1.11 3.08 -1.20 0.21 114.38 117.84 1z4k h ARG 58 Ca 0.01 -0.15 -0.12 0.00 0.07 0.00 0.00 59.98 59.80 1z4k h ARG 58 Cb 0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1z4k h ARG 58 CO -0.00 0.66 -0.22 0.00 -1.07 0.00 0.00 179.97 179.34 1z4k h ALA 59 N 1.41 0.54 0.03 0.04 0.00 -1.21 -2.83 119.26 117.24 1z4k h ALA 59 Ca 0.14 -0.38 -0.25 0.00 0.00 0.00 0.00 54.91 54.42 1z4k h ALA 59 Cb 0.34 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1z4k h ALA 59 CO 0.01 0.51 -1.23 -0.09 0.00 0.00 0.00 179.25 178.45 1z4k h ARG 60 N 0.62 0.07 -2.20 0.00 2.43 -0.84 -3.38 114.38 111.08 1z4k h ARG 60 Ca 0.08 -0.12 -0.56 0.00 -0.81 0.00 0.00 59.98 58.57 1z4k h ARG 60 Cb 0.78 0.05 -0.41 0.00 -0.42 0.00 0.00 29.97 29.96 1z4k h ARG 60 CO 0.06 0.96 -0.81 1.19 -1.51 0.00 0.00 179.97 179.86 1z4k n PHE 61 N -3.34 2.89 0.31 2.20 3.72 0.71 -4.94 117.46 119.02 1z4k n PHE 61 Ca -0.06 -3.95 0.16 0.00 -0.05 0.00 0.00 57.45 53.55 1z4k n PHE 61 Cb 0.98 -0.47 0.72 0.00 -0.94 0.00 0.00 39.48 39.77 1z4k n PHE 61 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1z4k h PRO 62 N 2.99 0.00 -0.12 -1.08 0.13 -1.69 -2.09 132.00 130.14 1z4k h PRO 62 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1z4k h PRO 62 Cb 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 1z4k h PRO 62 CO 0.72 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.24 1z4k n ASP 63 N -2.68 2.36 -4.93 1.44 10.43 -1.26 -4.91 116.55 117.01 1z4k n ASP 63 Ca -0.00 -1.79 -0.28 0.00 2.57 0.00 0.00 54.79 55.29 1z4k n ASP 63 Cb 0.19 -0.07 -0.03 0.00 1.84 0.00 0.00 41.12 43.05 1z4k n ASP 63 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 1z4k s GLN 64 N -1.86 3.49 0.73 -1.24 -1.52 -0.79 -5.10 119.66 113.36 1z4k s GLN 64 Ca 0.34 -0.43 -0.11 0.00 -1.95 0.00 0.00 55.36 53.21 1z4k s GLN 64 Cb 0.20 -2.91 0.03 0.00 -0.22 0.00 0.00 33.01 30.11 1z4k s GLN 64 CO 0.31 0.48 1.07 -1.25 -0.25 0.00 0.00 175.29 175.64 1z4k s PRO 65 N -3.14 2.67 0.24 2.91 0.04 -1.26 -5.05 135.00 131.40 1z4k s PRO 65 Ca 0.37 0.88 -0.01 0.00 0.04 0.00 0.00 61.00 62.28 1z4k s PRO 65 Cb -0.11 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 1z4k s PRO 65 CO 0.28 -1.27 0.22 -0.59 0.04 0.00 0.00 177.00 175.68 1z4k s PHE 66 N -3.07 1.18 -0.30 0.56 -0.12 -1.26 -5.09 117.98 109.89 1z4k s PHE 66 Ca 0.59 -1.36 -0.06 0.00 -0.05 0.00 0.00 56.93 56.06 1z4k s PHE 66 Cb -0.14 -0.48 0.02 0.00 -0.63 0.00 0.00 43.02 41.79 1z4k s PHE 66 CO 0.55 -0.75 0.06 0.42 -0.05 0.00 0.00 175.22 175.44 1z4k s ILE 67 N -3.94 3.68 0.52 -4.49 1.01 -1.26 -5.09 121.20 111.63 1z4k s ILE 67 Ca 0.37 -0.88 -0.23 0.00 0.00 0.00 0.00 60.65 59.92 1z4k s ILE 67 Cb 0.05 -2.94 -0.06 0.00 0.01 0.00 0.00 42.46 39.52 1z4k s ILE 67 CO 0.15 0.04 1.38 0.00 0.00 0.00 0.00 174.94 176.51 1z4k s ALA 68 N 1.44 2.93 0.31 9.38 0.00 -1.26 -4.83 121.76 129.73 1z4k s ALA 68 Ca 0.01 1.37 0.04 0.00 0.00 0.00 0.00 51.96 53.38 1z4k s ALA 68 Cb -0.18 -3.57 0.64 0.00 0.00 0.00 0.00 23.12 20.01 1z4k s ALA 68 CO 0.01 -1.33 1.87 -0.07 0.00 0.00 0.00 175.76 176.24 1z4k h LEU 69 N 1.69 0.82 -2.22 0.00 3.38 -1.98 0.11 115.31 117.12 1z4k h LEU 69 Ca -0.51 0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.52 1z4k h LEU 69 Cb 1.29 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 1z4k h LEU 69 CO 0.58 0.46 0.09 -0.33 0.09 0.00 0.00 178.44 179.33 1z4k h GLU 70 N 0.90 0.00 -0.02 1.13 3.07 -1.93 -1.72 114.58 116.00 1z4k h GLU 70 Ca 0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.31 1z4k h GLU 70 Cb 0.49 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 1z4k h GLU 70 CO -0.21 0.00 -0.03 -0.25 -1.40 0.00 0.00 179.01 177.12 1z4k n ASP 71 N -4.11 2.44 -4.74 1.42 8.00 0.37 -4.96 116.55 114.97 1z4k n ASP 71 Ca -0.01 -1.80 -0.41 0.00 0.71 0.00 0.00 54.79 53.28 1z4k n ASP 71 Cb 0.19 0.03 -0.02 0.00 -0.02 0.00 0.00 41.12 41.30 1z4k n ASP 71 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1z4k s ARG 72 N -2.03 4.26 -0.03 -1.24 1.81 -0.65 -4.94 118.95 116.12 1z4k s ARG 72 Ca 0.31 2.31 -0.03 0.00 -1.72 0.00 0.00 55.73 56.60 1z4k s ARG 72 Cb 0.20 -3.11 0.01 0.00 -0.45 0.00 0.00 34.95 31.60 1z4k s ARG 72 CO 0.33 -0.44 0.08 1.03 -0.68 0.00 0.00 175.30 175.62 1z4k s ARG 73 N -0.25 0.08 0.00 3.54 1.81 -1.26 -4.32 118.95 118.55 1z4k s ARG 73 Ca 0.60 0.15 0.00 0.00 -1.72 0.00 0.00 55.73 54.76 1z4k s ARG 73 Cb -0.42 -0.00 0.00 0.00 -0.45 0.00 0.00 34.95 34.07 1z4k s ARG 73 CO 0.42 -0.04 0.00 0.41 -0.68 0.00 0.00 175.30 175.41 1z4k n GLY 74 N 3.27 -0.99 0.23 -3.53 0.00 -1.14 -4.80 105.19 98.23 1z4k n GLY 74 Ca -0.15 -1.32 -0.04 0.00 0.00 0.00 0.00 46.02 44.51 1z4k n GLY 74 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1z4k h PHE 75 N 0.00 0.60 -3.31 1.61 3.57 -1.98 -3.41 116.94 114.03 1z4k h PHE 75 Ca 0.00 0.02 -0.58 0.00 3.53 0.00 0.00 57.97 60.94 1z4k h PHE 75 Cb 0.00 -0.19 -0.09 0.00 2.79 0.00 0.00 35.95 38.46 1z4k h PHE 75 CO 0.00 0.32 0.79 -1.58 -2.23 0.00 0.00 178.31 175.60 1z4k s TRP 76 N -6.12 2.73 0.21 0.41 0.52 -1.26 -4.90 118.94 110.52 1z4k s TRP 76 Ca -0.13 0.30 -0.09 0.00 0.02 0.00 0.00 56.10 56.20 1z4k s TRP 76 Cb 0.14 -4.30 0.31 0.00 -1.15 0.00 0.00 33.47 28.47 1z4k s TRP 76 CO 0.75 -1.42 1.71 0.28 0.02 0.00 0.00 176.95 178.28 1z4k h VAL 77 N 6.11 0.64 -0.72 4.03 2.07 -1.94 -2.53 116.25 123.91 1z4k h VAL 77 Ca -0.25 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 1z4k h VAL 77 Cb 1.06 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 1z4k h VAL 77 CO 1.13 0.05 0.37 0.77 0.02 0.00 0.00 177.57 179.91 1z4k h SER 78 N 0.27 0.91 -0.53 0.57 4.64 -1.90 -1.54 113.55 115.96 1z4k h SER 78 Ca 0.32 -0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.55 1z4k h SER 78 Cb 0.48 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.31 1z4k h SER 78 CO -0.40 0.75 0.31 -0.33 -0.87 0.00 0.00 176.83 176.29 1z4k h GLU 79 N 1.01 0.73 -0.20 4.77 5.08 -1.84 0.09 114.58 124.23 1z4k h GLU 79 Ca 0.25 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 58.44 1z4k h GLU 79 Cb 0.06 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1z4k h GLU 79 CO -0.04 0.55 -0.32 0.37 -1.00 0.00 0.00 179.01 178.57 1z4k h GLN 80 N 0.72 0.40 -0.19 2.33 4.15 -1.35 -2.69 115.11 118.48 1z4k h GLN 80 Ca 0.19 -0.17 -0.13 0.00 0.77 0.00 0.00 58.65 59.31 1z4k h GLN 80 Cb 0.01 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 1z4k h GLN 80 CO -0.03 0.68 -0.43 1.88 -1.93 0.00 0.00 178.83 179.00 1z4k h TYR 81 N 0.35 0.56 -0.42 3.99 0.05 -0.95 -2.70 116.97 117.84 1z4k h TYR 81 Ca 0.04 -0.16 -0.10 0.00 0.05 0.00 0.00 58.73 58.56 1z4k h TYR 81 Cb 0.73 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 38.34 1z4k h TYR 81 CO 0.02 0.82 -0.16 0.78 -1.05 0.00 0.00 178.16 178.57 1z4k h GLY 82 N 1.12 0.86 2.00 3.88 0.00 -0.83 -1.90 103.07 108.20 1z4k h GLY 82 Ca 0.03 -0.69 -0.05 0.00 0.00 0.00 0.00 47.33 46.62 1z4k h GLY 82 CO 0.08 0.63 -0.23 -0.09 0.00 0.00 0.00 176.54 176.93 1z4k h ARG 83 N 0.71 0.00 0.03 4.80 2.43 -1.35 -3.20 114.38 117.80 1z4k h ARG 83 Ca 0.11 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 59.02 1z4k h ARG 83 Cb 0.66 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.17 1z4k h ARG 83 CO 0.05 0.23 -1.39 1.25 -1.51 0.00 0.00 179.97 178.60 1z4k h LEU 84 N 0.00 0.09 -7.00 3.80 5.85 -1.02 -3.47 115.31 113.56 1z4k h LEU 84 Ca -0.00 -0.13 0.12 0.00 0.84 0.00 0.00 57.88 58.70 1z4k h LEU 84 Cb 0.50 -0.03 -0.19 0.00 0.37 0.00 0.00 40.66 41.31 1z4k h LEU 84 CO 0.03 1.11 0.56 0.00 -0.34 0.00 0.00 178.44 179.80 1z4k s ARG 85 N -2.65 0.65 0.46 1.25 1.70 -1.03 -5.10 118.95 114.25 1z4k s ARG 85 Ca -0.04 -0.08 -0.24 0.00 -0.47 0.00 0.00 55.73 54.90 1z4k s ARG 85 Cb 0.09 0.30 -0.08 0.00 -0.57 0.00 0.00 34.95 34.69 1z4k s ARG 85 CO 0.83 -0.25 1.26 -2.30 -1.08 0.00 0.00 175.30 173.75 1z4k n PRO 86 N 0.21 1.78 0.00 3.89 -0.02 -1.26 -2.43 135.00 137.17 1z4k n PRO 86 Ca -0.08 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1z4k n PRO 86 Cb 0.60 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1z4k n PRO 86 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1z4k n GLY 87 N 0.85 2.61 0.14 -1.23 0.00 -1.26 -4.86 105.19 101.44 1z4k n GLY 87 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.04 1z4k n GLY 87 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1z4k h LEU 88 N 0.00 0.21 -0.36 0.99 5.85 -1.73 -2.55 115.31 117.72 1z4k h LEU 88 Ca 0.00 -0.15 0.07 0.00 0.84 0.00 0.00 57.88 58.65 1z4k h LEU 88 Cb 0.00 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 40.90 1z4k h LEU 88 CO 0.00 0.88 -0.11 -1.28 -0.34 0.00 0.00 178.44 177.59 1z4k h SER 89 N 0.11 -0.40 -0.63 1.25 0.87 -1.76 0.11 113.55 113.10 1z4k h SER 89 Ca -0.02 0.12 -0.06 0.00 -1.23 0.00 0.00 61.79 60.59 1z4k h SER 89 Cb 1.31 0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 63.49 1z4k h SER 89 CO 0.11 -0.14 0.16 -0.33 -0.53 0.00 0.00 176.83 176.10 1z4k h GLU 90 N -0.03 1.01 -0.80 2.24 3.07 -1.88 -0.44 114.58 117.74 1z4k h GLU 90 Ca 0.17 -0.24 -0.03 0.00 -0.50 0.00 0.00 59.36 58.77 1z4k h GLU 90 Cb 0.30 -0.13 -0.04 0.00 -0.84 0.00 0.00 28.75 28.04 1z4k h GLU 90 CO -0.39 0.91 0.39 0.87 -1.40 0.00 0.00 179.01 179.39 1z4k h LYS 91 N 0.93 1.15 -0.08 2.33 1.57 -1.23 -1.89 116.57 119.36 1z4k h LYS 91 Ca 0.20 -0.17 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1z4k h LYS 91 Cb 0.35 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1z4k h LYS 91 CO 0.00 0.89 0.02 0.00 -0.57 0.00 0.00 179.45 179.79 1z4k h ALA 92 N 1.20 0.08 -0.70 3.86 0.00 -0.34 -2.74 119.26 120.62 1z4k h ALA 92 Ca 0.28 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.25 1z4k h ALA 92 Cb 0.11 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1z4k h ALA 92 CO -0.04 -0.45 0.46 0.82 0.00 0.00 0.00 179.25 180.05 1z4k h ILE 93 N 0.05 1.05 0.00 0.00 2.04 -0.89 -1.28 117.51 118.48 1z4k h ILE 93 Ca 0.03 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 1z4k h ILE 93 Cb 0.02 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 36.31 1z4k h ILE 93 CO -0.04 0.14 -0.06 0.77 0.00 0.00 0.00 178.15 178.96 1z4k h SER 94 N 0.77 0.00 0.02 1.72 4.64 -1.03 -1.65 113.55 118.01 1z4k h SER 94 Ca 0.29 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.61 1z4k h SER 94 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1z4k h SER 94 CO -0.09 0.06 -0.01 0.40 -0.87 0.00 0.00 176.83 176.32 1z4k h ILE 95 N 0.00 1.24 0.00 0.95 1.08 -1.17 -2.94 117.51 116.67 1z4k h ILE 95 Ca -0.00 -0.77 0.00 0.00 -0.39 0.00 0.00 64.86 63.70 1z4k h ILE 95 Cb 0.18 1.76 0.00 0.00 -3.07 0.00 0.00 36.82 35.69 1z4k h ILE 95 CO 0.01 0.20 -0.07 4.11 -0.69 0.00 0.00 178.15 181.70 1z4k h TRP 96 N -0.35 0.00 0.00 1.37 0.09 -1.53 -2.91 115.95 112.62 1z4k h TRP 96 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 1z4k h TRP 96 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.58 1z4k h TRP 96 CO 0.04 0.00 -0.01 0.39 0.09 0.00 0.00 178.44 178.95 1z4k n GLU 97 N -2.31 0.03 -2.65 0.12 1.02 -0.66 -4.79 120.64 111.40 1z4k n GLU 97 Ca 0.05 0.03 -0.35 0.00 -0.02 0.00 0.00 57.16 56.87 1z4k n GLU 97 Cb 0.44 -1.54 -0.05 0.00 -0.02 0.00 0.00 31.44 30.27 1z4k n GLU 97 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1z4k s SER 98 N -3.19 6.74 0.35 1.62 0.01 -1.10 -4.91 113.70 113.21 1z4k s SER 98 Ca 0.13 1.88 -0.27 0.00 1.31 0.00 0.00 55.95 59.00 1z4k s SER 98 Cb 0.18 -2.56 -0.12 0.00 0.21 0.00 0.00 66.02 63.73 1z4k s SER 98 CO 0.54 -0.50 1.24 1.17 0.41 0.00 0.00 173.24 176.10 1z4k n LYS 99 N -0.47 1.96 -0.87 12.44 4.81 -1.26 -2.26 118.16 132.52 1z4k n LYS 99 Ca 0.07 0.69 0.00 0.00 -0.87 0.00 0.00 58.31 58.20 1z4k n LYS 99 Cb 0.52 -2.26 0.00 0.00 0.02 0.00 0.00 35.03 33.31 1z4k n LYS 99 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1z4k n ASN 100 N 0.72 -1.22 0.26 3.14 3.02 -1.26 -4.90 115.26 115.03 1z4k n ASN 100 Ca 0.06 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.45 1z4k n ASN 100 Cb 0.36 -1.13 -0.08 0.00 -0.61 0.00 0.00 39.78 38.32 1z4k n ASN 100 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1z4k h PHE 101 N 0.00 -0.60 -0.27 3.10 3.57 -1.75 -1.59 116.94 119.41 1z4k h PHE 101 Ca 0.00 -0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.34 1z4k h PHE 101 Cb 0.11 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1z4k h PHE 101 CO 0.07 -0.32 -0.42 0.74 -2.23 0.00 0.00 178.31 176.15 1z4k h PHE 102 N -0.74 0.79 -0.50 0.41 0.04 -1.87 -3.13 116.94 111.95 1z4k h PHE 102 Ca -0.07 -0.24 -0.05 0.00 2.80 0.00 0.00 57.97 60.42 1z4k h PHE 102 Cb 0.54 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.50 1z4k h PHE 102 CO -0.02 0.97 0.10 0.35 -0.60 0.00 0.00 178.31 179.11 1z4k h PHE 103 N 0.54 0.79 -0.01 -0.55 3.57 -1.77 -2.97 116.94 116.53 1z4k h PHE 103 Ca 0.04 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1z4k h PHE 103 Cb 0.95 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.46 1z4k h PHE 103 CO 0.04 0.68 -0.02 0.39 -2.23 0.00 0.00 178.31 177.17 1z4k n GLU 104 N -4.28 1.39 -1.76 1.11 1.02 -0.60 -4.88 120.64 112.64 1z4k n GLU 104 Ca 0.03 -0.65 -0.41 0.00 -0.02 0.00 0.00 57.16 56.11 1z4k n GLU 104 Cb 0.23 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.16 1z4k n GLU 104 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1z4k n LEU 105 N -0.23 4.61 -4.77 -4.62 4.77 -1.12 -4.97 117.00 110.66 1z4k n LEU 105 Ca 0.20 1.19 -0.39 0.00 -0.03 0.00 0.00 56.01 56.98 1z4k n LEU 105 Cb 0.29 -1.61 -0.06 0.00 -2.33 0.00 0.00 43.42 39.71 1z4k n LEU 105 CO 0.18 0.17 0.63 -1.61 -1.33 0.00 0.00 177.39 175.43 1z4k s GLU 106 N -1.34 4.71 0.51 3.23 0.41 -1.26 -4.81 118.70 120.15 1z4k s GLU 106 Ca 0.58 1.38 -0.22 0.00 -0.41 0.00 0.00 54.97 56.30 1z4k s GLU 106 Cb -0.48 -3.08 -0.06 0.00 -1.78 0.00 0.00 34.13 28.72 1z4k s GLU 106 CO 0.57 0.43 1.28 -2.14 -0.49 0.00 0.00 175.26 174.90 1z4k s PRO 107 N -1.53 3.40 0.61 0.39 0.02 -1.26 -0.74 135.00 135.88 1z4k s PRO 107 Ca 0.44 2.05 -0.17 0.00 0.02 0.00 0.00 61.00 63.33 1z4k s PRO 107 Cb -0.23 -2.32 -0.03 0.00 0.02 0.00 0.00 34.50 31.95 1z4k s PRO 107 CO 0.28 -0.93 1.13 -0.51 -0.33 0.00 0.00 177.00 176.65 1z4k s LEU 108 N -3.32 3.57 0.23 -5.54 1.43 -0.14 -4.76 118.68 110.15 1z4k s LEU 108 Ca 0.68 2.13 -0.32 0.00 -1.03 0.00 0.00 54.13 55.60 1z4k s LEU 108 Cb -0.36 -4.57 -0.13 0.00 0.03 0.00 0.00 46.19 41.17 1z4k s LEU 108 CO 0.42 -1.48 1.59 -2.65 0.23 0.00 0.00 176.35 174.46 1z4k n PRO 109 N -1.87 2.48 -0.27 1.29 -0.02 -1.26 -2.09 135.00 133.26 1z4k n PRO 109 Ca 0.11 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 1z4k n PRO 109 Cb 0.51 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1z4k n PRO 109 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1z4k n GLY 110 N 2.87 2.31 0.10 -1.23 0.00 -1.26 -4.45 105.19 103.53 1z4k n GLY 110 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 1z4k n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z4k h ALA 111 N 0.00 0.12 -0.28 4.61 0.00 -1.75 -1.09 119.26 120.87 1z4k h ALA 111 Ca 0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1z4k h ALA 111 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1z4k h ALA 111 CO 0.00 -0.04 0.02 0.28 0.00 0.00 0.00 179.25 179.51 1z4k h VAL 112 N -0.22 1.25 -0.88 0.00 2.07 -1.89 -1.58 116.25 115.00 1z4k h VAL 112 Ca 0.01 -0.88 0.01 0.00 0.82 0.00 0.00 66.70 66.66 1z4k h VAL 112 Cb 0.62 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 1z4k h VAL 112 CO 0.02 0.28 0.57 -0.08 0.02 0.00 0.00 177.57 178.39 1z4k h GLU 113 N 0.28 1.16 -0.33 1.57 4.81 -1.94 -1.51 114.58 118.61 1z4k h GLU 113 Ca 0.08 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 59.14 1z4k h GLU 113 Cb 0.40 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1z4k h GLU 113 CO 0.01 0.77 -0.15 0.00 -0.73 0.00 0.00 179.01 178.91 1z4k h ALA 114 N 1.32 0.47 -0.35 2.92 0.00 -0.99 -0.80 119.26 121.83 1z4k h ALA 114 Ca 0.32 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 1z4k h ALA 114 Cb -0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1z4k h ALA 114 CO -0.07 0.37 -0.40 0.28 0.00 0.00 0.00 179.25 179.44 1z4k h VAL 115 N 0.47 1.28 -0.19 0.00 2.07 -1.16 0.12 116.25 118.83 1z4k h VAL 115 Ca 0.08 -1.57 0.01 0.00 0.82 0.00 0.00 66.70 66.03 1z4k h VAL 115 Cb 0.68 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1z4k h VAL 115 CO 0.05 0.52 0.10 0.11 0.02 0.00 0.00 177.57 178.37 1z4k h LYS 116 N 0.69 0.21 -0.45 1.57 1.57 -1.24 -0.52 116.57 118.39 1z4k h LYS 116 Ca 0.05 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1z4k h LYS 116 Cb 0.97 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.21 1z4k h LYS 116 CO 0.09 0.14 0.28 1.49 -0.57 0.00 0.00 179.45 180.88 1z4k h GLU 117 N 0.22 0.60 -0.70 3.15 4.81 -0.80 -2.40 114.58 119.46 1z4k h GLU 117 Ca 0.08 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1z4k h GLU 117 Cb 0.01 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 1z4k h GLU 117 CO -0.05 0.43 0.45 1.98 -0.73 0.00 0.00 179.01 181.10 1z4k h MET 118 N 0.60 0.93 -0.10 1.92 4.05 -0.48 -2.31 114.93 119.55 1z4k h MET 118 Ca 0.16 -0.06 -0.11 0.00 -0.28 0.00 0.00 59.70 59.41 1z4k h MET 118 Cb -0.03 -0.21 -0.01 0.00 -0.80 0.00 0.00 31.60 30.55 1z4k h MET 118 CO -0.03 0.63 -0.42 0.00 0.23 0.00 0.00 176.91 177.31 1z4k h ALA 119 N 1.25 1.11 0.00 0.39 0.00 -0.93 -2.63 119.26 118.44 1z4k h ALA 119 Ca 0.26 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1z4k h ALA 119 Cb -0.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1z4k h ALA 119 CO -0.05 0.59 0.00 -1.13 0.00 0.00 0.00 179.25 178.66 1z4k n SER 120 N -4.02 0.21 -4.77 0.00 3.41 -0.89 -4.84 113.62 102.73 1z4k n SER 120 Ca -0.02 0.53 -0.39 0.00 -0.26 0.00 0.00 58.87 58.74 1z4k n SER 120 Cb 0.48 -0.58 -0.02 0.00 -0.26 0.00 0.00 64.21 63.83 1z4k n SER 120 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1z4k s LEU 121 N -3.42 4.28 0.52 1.04 1.43 -0.99 -4.97 118.68 116.57 1z4k s LEU 121 Ca 0.09 2.47 -0.22 0.00 -1.03 0.00 0.00 54.13 55.44 1z4k s LEU 121 Cb 0.13 -3.89 -0.06 0.00 0.03 0.00 0.00 46.19 42.41 1z4k s LEU 121 CO 0.42 -0.63 1.30 -1.10 0.23 0.00 0.00 176.35 176.56 1z4k s GLN 122 N -2.10 3.32 -1.45 1.70 -1.52 -1.26 -2.89 119.66 115.46 1z4k s GLN 122 Ca 0.54 2.09 -0.09 0.00 -1.95 0.00 0.00 55.36 55.95 1z4k s GLN 122 Cb -0.34 -2.30 0.03 0.00 -0.22 0.00 0.00 33.01 30.19 1z4k s GLN 122 CO 0.44 -1.00 0.95 0.09 -0.25 0.00 0.00 175.29 175.52 1z4k n ASN 123 N -0.87 -5.77 -3.60 5.90 3.02 -1.26 -4.96 115.26 107.73 1z4k n ASN 123 Ca 0.09 -0.53 -0.18 0.00 -0.03 0.00 0.00 54.58 53.93 1z4k n ASN 123 Cb 0.46 -4.59 -0.15 0.00 -0.61 0.00 0.00 39.78 34.89 1z4k n ASN 123 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1z4k s THR 124 N -3.25 -0.26 -0.18 3.41 2.01 -1.14 -1.10 115.64 115.12 1z4k s THR 124 Ca 0.53 0.12 -0.04 0.00 0.31 0.00 0.00 61.69 62.60 1z4k s THR 124 Cb -0.24 -0.47 -0.02 0.00 0.01 0.00 0.00 72.50 71.77 1z4k s THR 124 CO 0.65 -0.04 -0.02 -1.81 -0.69 0.00 0.00 174.62 172.72 1z4k s ASP 125 N 2.29 4.77 -0.12 3.53 1.01 -0.00 -4.70 116.67 123.45 1z4k s ASP 125 Ca 0.04 -0.19 0.01 0.00 0.71 0.00 0.00 52.55 53.12 1z4k s ASP 125 Cb -0.14 -1.80 -0.01 0.00 1.01 0.00 0.00 42.92 41.98 1z4k s ASP 125 CO -0.08 0.10 -0.16 -0.69 0.21 0.00 0.00 175.17 174.55 1z4k s VAL 126 N 0.79 2.83 0.07 -1.27 1.01 -1.26 -1.20 120.40 121.37 1z4k s VAL 126 Ca -0.00 -0.75 0.09 0.00 0.00 0.00 0.00 61.98 61.32 1z4k s VAL 126 Cb -0.14 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 1z4k s VAL 126 CO 0.02 0.54 -0.25 -0.36 0.00 0.00 0.00 175.10 175.05 1z4k s PHE 127 N 0.24 2.16 -0.33 5.22 0.40 -0.58 -4.85 117.98 120.25 1z4k s PHE 127 Ca -0.10 -0.40 -0.16 0.00 -0.60 0.00 0.00 56.93 55.67 1z4k s PHE 127 Cb -0.16 -1.25 -0.01 0.00 0.51 0.00 0.00 43.02 42.11 1z4k s PHE 127 CO 0.06 0.18 0.41 0.42 0.70 0.00 0.00 175.22 176.98 1z4k s ILE 128 N -0.90 5.13 -0.27 0.64 1.01 -0.03 -0.51 121.20 126.27 1z4k s ILE 128 Ca 0.11 0.23 -0.01 0.00 0.00 0.00 0.00 60.65 60.97 1z4k s ILE 128 Cb -0.10 -3.84 0.04 0.00 0.01 0.00 0.00 42.46 38.57 1z4k s ILE 128 CO 0.03 -0.08 -0.04 0.00 0.00 0.00 0.00 174.94 174.85 1z4k s THR 130 N 1.29 0.07 -0.11 0.00 -1.32 -0.63 -3.91 115.64 111.03 1z4k s THR 130 Ca -0.02 -0.58 -0.05 0.00 -1.21 0.00 0.00 61.69 59.83 1z4k s THR 130 Cb -0.18 -0.32 -0.04 0.00 -1.51 0.00 0.00 72.50 70.46 1z4k s THR 130 CO -0.03 -0.32 0.08 -0.44 -2.21 0.00 0.00 174.62 171.70 1z4k s SER 131 N -1.04 5.84 0.52 8.08 0.01 -1.23 -1.24 113.70 124.64 1z4k s SER 131 Ca -0.11 0.30 -0.17 0.00 1.31 0.00 0.00 55.95 57.27 1z4k s SER 131 Cb -0.07 -1.82 -0.07 0.00 0.21 0.00 0.00 66.02 64.28 1z4k s SER 131 CO 0.01 0.37 1.01 -2.16 0.41 0.00 0.00 173.24 172.88 1z4k s PRO 132 N -0.82 3.78 1.07 12.44 0.04 -1.26 -4.97 135.00 145.28 1z4k s PRO 132 Ca 0.13 1.10 -0.14 0.00 0.04 0.00 0.00 61.00 62.13 1z4k s PRO 132 Cb -0.12 -2.11 0.23 0.00 0.04 0.00 0.00 34.50 32.54 1z4k s PRO 132 CO 0.03 -0.42 1.08 0.96 0.04 0.00 0.00 177.00 178.69 1z4k s ILE 133 N -2.45 1.93 0.24 0.56 -4.36 -1.26 -4.94 121.20 110.92 1z4k s ILE 133 Ca 0.62 0.00 0.02 0.00 -0.26 0.00 0.00 60.65 61.02 1z4k s ILE 133 Cb -0.12 -2.42 -0.02 0.00 1.25 0.00 0.00 42.46 41.15 1z4k s ILE 133 CO 0.29 0.00 1.59 0.11 0.24 0.00 0.00 174.94 177.17 1z4k h LYS 134 N -2.17 0.40 -5.98 0.37 1.57 -2.01 -3.40 116.57 105.35 1z4k h LYS 134 Ca -0.55 -0.23 -0.59 0.00 -1.87 0.00 0.00 60.65 57.42 1z4k h LYS 134 Cb 1.33 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 33.58 1z4k h LYS 134 CO 0.53 0.80 0.61 1.41 -0.57 0.00 0.00 179.45 182.23 1z4k s MET 135 N -4.04 4.09 0.00 3.15 1.75 -1.26 -4.91 119.30 118.07 1z4k s MET 135 Ca -0.06 0.93 0.14 0.00 -1.25 0.00 0.00 55.69 55.45 1z4k s MET 135 Cb 0.12 -3.70 0.33 0.00 2.84 0.00 0.00 34.83 34.43 1z4k s MET 135 CO 0.81 -0.70 1.24 1.97 -0.65 0.00 0.00 175.02 177.69 1z4k n PHE 136 N 6.37 0.46 -0.14 4.11 -1.74 -1.26 -4.47 117.46 120.79 1z4k n PHE 136 Ca 0.08 -0.38 -0.06 0.00 -0.56 0.00 0.00 57.45 56.54 1z4k n PHE 136 Cb 0.47 -0.01 0.03 0.00 1.52 0.00 0.00 39.48 41.49 1z4k n PHE 136 CO 0.00 0.00 0.00 -0.22 -0.56 0.00 0.00 176.76 175.98 1z4k h LYS 137 N 2.71 0.40 0.00 3.97 1.63 -1.96 -3.37 116.57 119.96 1z4k h LYS 137 Ca 0.00 -0.02 -0.15 0.00 -0.85 0.00 0.00 60.65 59.63 1z4k h LYS 137 Cb 0.76 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 32.27 1z4k h LYS 137 CO 0.00 0.27 -1.55 0.66 -3.45 0.00 0.00 179.45 175.37 1z4k n TYR 138 N -4.93 0.00 0.18 1.91 4.01 -1.26 -4.82 117.16 112.24 1z4k n TYR 138 Ca 0.03 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.62 1z4k n TYR 138 Cb 0.12 -0.39 -0.08 0.00 -0.31 0.00 0.00 39.34 38.68 1z4k n TYR 138 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1z4k h PRO 140 N -0.60 -0.18 -0.24 0.00 0.11 -1.90 -0.49 132.00 128.69 1z4k h PRO 140 Ca -0.04 0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.10 1z4k h PRO 140 Cb 0.43 0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.56 1z4k h PRO 140 CO 0.07 -0.12 0.09 -0.92 -0.21 0.00 0.00 178.00 176.91 1z4k h TYR 141 N -0.19 0.17 -0.04 0.65 3.20 -1.81 -2.19 116.97 116.76 1z4k h TYR 141 Ca 0.20 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.98 1z4k h TYR 141 Cb 0.52 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 1z4k h TYR 141 CO -0.54 0.09 -0.45 0.93 -1.64 0.00 0.00 178.16 176.55 1z4k h GLU 142 N 0.21 0.10 -0.35 1.82 5.08 -0.69 -0.19 114.58 120.56 1z4k h GLU 142 Ca 0.10 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1z4k h GLU 142 Cb 0.06 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1z4k h GLU 142 CO -0.10 0.53 0.01 0.87 -1.00 0.00 0.00 179.01 179.33 1z4k h LYS 143 N 0.08 0.60 -0.58 2.33 1.57 -0.79 0.12 116.57 119.91 1z4k h LYS 143 Ca 0.00 -0.18 0.02 0.00 -1.87 0.00 0.00 60.65 58.62 1z4k h LYS 143 Cb 0.83 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.04 1z4k h LYS 143 CO 0.06 0.71 0.36 1.88 -0.57 0.00 0.00 179.45 181.90 1z4k h TYR 144 N 0.42 0.69 -1.00 -1.35 -1.99 -1.11 -1.84 116.97 110.78 1z4k h TYR 144 Ca 0.10 0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.86 1z4k h TYR 144 Cb 0.43 -0.23 -0.05 0.00 2.00 0.00 0.00 36.73 38.88 1z4k h TYR 144 CO 0.03 0.41 0.66 0.00 -0.00 0.00 0.00 178.16 179.26 1z4k h ALA 145 N 1.24 1.28 -0.31 3.88 0.00 -0.78 -0.29 119.26 124.28 1z4k h ALA 145 Ca 0.22 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1z4k h ALA 145 Cb -0.03 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.36 1z4k h ALA 145 CO -0.08 0.63 -0.08 2.35 0.00 0.00 0.00 179.25 182.07 1z4k h TRP 146 N 1.33 0.68 -0.64 0.00 7.01 -0.70 -1.75 115.95 121.87 1z4k h TRP 146 Ca 0.37 -0.15 -0.04 0.00 2.11 0.00 0.00 58.89 61.18 1z4k h TRP 146 Cb -0.12 -0.16 -0.03 0.00 -2.10 0.00 0.00 29.16 26.75 1z4k h TRP 146 CO -0.00 0.79 0.24 0.28 -2.79 0.00 0.00 178.44 176.96 1z4k h VAL 147 N 0.37 1.24 -0.56 2.65 2.07 -1.00 -1.80 116.25 119.21 1z4k h VAL 147 Ca 0.08 -0.78 0.04 0.00 0.82 0.00 0.00 66.70 66.86 1z4k h VAL 147 Cb 0.57 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1z4k h VAL 147 CO 0.03 0.30 0.32 -0.08 0.02 0.00 0.00 177.57 178.17 1z4k h GLU 148 N 0.91 0.61 -0.16 1.57 4.81 -0.86 0.23 114.58 121.70 1z4k h GLU 148 Ca 0.21 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1z4k h GLU 148 Cb 0.23 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 1z4k h GLU 148 CO -0.01 0.41 0.07 -0.22 -0.73 0.00 0.00 179.01 178.52 1z4k h LYS 149 N 0.63 0.15 0.00 1.92 3.64 -0.92 -0.56 116.57 121.43 1z4k h LYS 149 Ca 0.24 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.53 1z4k h LYS 149 Cb 0.08 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1z4k h LYS 149 CO -0.13 0.10 -1.47 0.66 -2.27 0.00 0.00 179.45 176.34 1z4k n TYR 150 N -5.03 0.66 0.00 1.91 4.01 -0.71 -4.58 117.16 113.42 1z4k n TYR 150 Ca -0.04 0.21 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 1z4k n TYR 150 Cb 0.05 -0.89 0.00 0.00 -0.31 0.00 0.00 39.34 38.19 1z4k n TYR 150 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1z4k n PHE 151 N -2.64 0.00 0.00 -0.72 3.72 0.81 -5.04 117.46 113.58 1z4k n PHE 151 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 1z4k n PHE 151 Cb 0.69 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.23 1z4k n PHE 151 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1z4k n GLY 152 N 1.64 2.14 0.34 1.37 0.00 -0.22 -4.39 105.19 106.08 1z4k n GLY 152 Ca 0.00 -1.91 0.11 0.00 0.00 0.00 0.00 46.02 44.22 1z4k n GLY 152 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1z4k h PRO 153 N 0.00 0.72 0.00 1.61 0.11 -1.89 -2.18 132.00 130.37 1z4k h PRO 153 Ca 0.00 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.04 1z4k h PRO 153 Cb 0.00 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 30.94 1z4k h PRO 153 CO 0.00 0.47 -0.11 -0.44 -0.21 0.00 0.00 178.00 177.72 1z4k h ASP 154 N 0.74 0.00 0.91 -2.05 3.32 -1.96 -2.37 116.42 115.01 1z4k h ASP 154 Ca 0.53 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.58 1z4k h ASP 154 Cb 0.78 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.33 1z4k h ASP 154 CO -0.37 0.11 0.00 0.33 -1.72 0.00 0.00 179.24 177.59 1z4k n PHE 155 N -3.81 0.08 0.19 4.55 -0.00 -0.82 -2.91 117.46 114.73 1z4k n PHE 155 Ca -0.02 0.02 0.05 0.00 -0.00 0.00 0.00 57.45 57.51 1z4k n PHE 155 Cb 0.21 -0.54 0.52 0.00 -0.00 0.00 0.00 39.48 39.67 1z4k n PHE 155 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 1z4k h LEU 156 N 0.00 0.10 -1.72 -2.13 3.38 -1.53 -0.77 115.31 112.64 1z4k h LEU 156 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1z4k h LEU 156 Cb 0.45 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1z4k h LEU 156 CO 0.00 0.18 0.13 -0.33 0.09 0.00 0.00 178.44 178.50 1z4k h GLU 157 N 0.11 0.00 -0.33 1.13 4.39 -1.74 -2.58 114.58 115.57 1z4k h GLU 157 Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1z4k h GLU 157 Cb 0.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1z4k h GLU 157 CO 0.01 0.00 0.00 1.04 -1.16 0.00 0.00 179.01 178.90 1z4k n GLN 158 N -2.48 2.47 -3.12 2.33 1.13 -0.29 -4.94 117.38 112.48 1z4k n GLN 158 Ca -0.02 -2.21 -0.39 0.00 -1.94 0.00 0.00 57.00 52.44 1z4k n GLN 158 Cb 0.17 -1.51 -0.05 0.00 0.11 0.00 0.00 30.24 28.96 1z4k n GLN 158 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1z4k s ILE 159 N -1.59 5.04 -0.26 5.09 1.01 -0.97 -0.85 121.20 128.66 1z4k s ILE 159 Ca 0.37 1.33 0.03 0.00 0.00 0.00 0.00 60.65 62.38 1z4k s ILE 159 Cb 0.22 -3.98 0.06 0.00 0.01 0.00 0.00 42.46 38.77 1z4k s ILE 159 CO 0.31 0.30 -0.11 -0.69 0.00 0.00 0.00 174.94 174.76 1z4k s VAL 160 N 0.58 2.19 -0.32 2.92 1.01 0.59 -4.94 120.40 122.43 1z4k s VAL 160 Ca 0.34 -1.64 -0.15 0.00 0.00 0.00 0.00 61.98 60.53 1z4k s VAL 160 Cb -0.17 -2.30 -0.02 0.00 0.00 0.00 0.00 36.38 33.89 1z4k s VAL 160 CO 0.17 -0.04 0.37 -0.22 0.00 0.00 0.00 175.10 175.38 1z4k s LEU 161 N 1.10 4.30 -0.09 3.92 0.20 -1.26 -1.60 118.68 125.25 1z4k s LEU 161 Ca -0.09 -0.07 -0.26 0.00 0.69 0.00 0.00 54.13 54.40 1z4k s LEU 161 Cb -0.20 -2.37 0.06 0.00 -0.43 0.00 0.00 46.19 43.25 1z4k s LEU 161 CO -0.05 -0.30 0.61 0.28 -0.29 0.00 0.00 176.35 176.61 1z4k s THR 162 N 2.05 0.01 -0.82 3.68 -1.32 -0.38 -4.99 115.64 113.87 1z4k s THR 162 Ca 0.13 -0.08 0.25 0.00 -1.21 0.00 0.00 61.69 60.79 1z4k s THR 162 Cb -0.16 -0.91 0.09 0.00 -1.51 0.00 0.00 72.50 70.01 1z4k s THR 162 CO 0.11 -0.04 1.50 0.54 -2.21 0.00 0.00 174.62 174.52 1z4k n ARG 163 N 1.43 0.15 -3.94 7.08 5.12 -1.26 -3.55 116.66 121.69 1z4k n ARG 163 Ca -0.18 0.06 -0.31 0.00 -1.93 0.00 0.00 57.85 55.49 1z4k n ARG 163 Cb 0.56 -1.61 -0.15 0.00 -1.16 0.00 0.00 32.46 30.10 1z4k n ARG 163 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1z4k s ASP 164 N -3.67 4.22 0.13 0.55 -1.08 -1.26 -4.98 116.67 110.57 1z4k s ASP 164 Ca 0.09 -1.56 0.25 0.00 -0.52 0.00 0.00 52.55 50.82 1z4k s ASP 164 Cb 0.15 -1.30 0.58 0.00 -1.46 0.00 0.00 42.92 40.89 1z4k s ASP 164 CO 0.67 -0.30 1.52 0.29 0.52 0.00 0.00 175.17 177.87 1z4k n LYS 165 N 4.55 0.24 0.25 4.34 5.02 -1.26 -3.90 118.16 127.40 1z4k n LYS 165 Ca -0.06 0.12 0.14 0.00 -2.02 0.00 0.00 58.31 56.49 1z4k n LYS 165 Cb 0.43 -1.70 0.57 0.00 -0.02 0.00 0.00 35.03 34.31 1z4k n LYS 165 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1z4k h THR 166 N 0.00 0.21 -0.07 -0.18 1.35 -1.91 -2.24 112.91 110.07 1z4k h THR 166 Ca 0.00 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 1z4k h THR 166 Cb 0.70 1.64 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 1z4k h THR 166 CO 0.00 0.08 0.00 1.33 -0.25 0.00 0.00 175.52 176.68 1z4k n VAL 167 N -3.21 0.08 -3.61 6.82 0.24 -1.25 -4.62 118.33 112.78 1z4k n VAL 167 Ca 0.01 -0.23 -0.37 0.00 -2.04 0.00 0.00 64.34 61.71 1z4k n VAL 167 Cb 0.37 0.23 -0.09 0.00 -1.47 0.00 0.00 33.84 32.88 1z4k n VAL 167 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1z4k s VAL 168 N -1.92 5.33 -0.03 3.34 1.01 -0.85 -5.08 120.40 122.22 1z4k s VAL 168 Ca 0.36 0.27 -0.16 0.00 0.00 0.00 0.00 61.98 62.45 1z4k s VAL 168 Cb 0.19 -3.54 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 1z4k s VAL 168 CO 0.30 0.33 0.43 -0.94 0.00 0.00 0.00 175.10 175.21 1z4k s SER 169 N 1.05 6.78 0.12 3.32 1.04 -1.26 -4.74 113.70 120.01 1z4k s SER 169 Ca 0.09 0.93 -0.25 0.00 0.48 0.00 0.00 55.95 57.20 1z4k s SER 169 Cb -0.14 -2.26 0.08 0.00 0.10 0.00 0.00 66.02 63.80 1z4k s SER 169 CO 0.05 0.24 1.07 0.00 0.98 0.00 0.00 173.24 175.58 1z4k s ALA 170 N -0.64 -1.80 -0.03 5.32 0.00 -1.26 -5.01 121.76 118.35 1z4k s ALA 170 Ca 0.24 0.05 0.02 0.00 0.00 0.00 0.00 51.96 52.27 1z4k s ALA 170 Cb -0.16 0.65 -0.25 0.00 0.00 0.00 0.00 23.12 23.35 1z4k s ALA 170 CO 0.13 -1.06 0.72 -0.44 0.00 0.00 0.00 175.76 175.10 1z4k h ASP 171 N 2.00 0.24 -4.01 0.00 5.19 -1.28 -2.24 116.42 116.32 1z4k h ASP 171 Ca -0.26 -0.42 -0.26 0.00 -0.62 0.00 0.00 57.03 55.46 1z4k h ASP 171 Cb 1.22 -0.08 -0.27 0.00 0.18 0.00 0.00 39.33 40.38 1z4k h ASP 171 CO 0.30 1.36 -0.73 -0.76 -3.12 0.00 0.00 179.24 176.29 1z4k s LEU 172 N -6.69 2.05 -0.18 1.55 1.43 -1.07 -1.55 118.68 114.23 1z4k s LEU 172 Ca -0.10 -0.13 0.01 0.00 -1.03 0.00 0.00 54.13 52.88 1z4k s LEU 172 Cb 0.07 -0.11 0.03 0.00 0.03 0.00 0.00 46.19 46.21 1z4k s LEU 172 CO 0.82 -0.02 -0.15 -0.22 0.23 0.00 0.00 176.35 177.01 1z4k s LEU 173 N -0.32 2.09 -0.36 1.79 2.96 -0.27 -0.43 118.68 124.14 1z4k s LEU 173 Ca -0.02 -0.69 -0.12 0.00 -0.22 0.00 0.00 54.13 53.08 1z4k s LEU 173 Cb -0.03 -1.32 0.01 0.00 0.50 0.00 0.00 46.19 45.35 1z4k s LEU 173 CO -0.00 -0.06 0.23 -0.63 -1.32 0.00 0.00 176.35 174.57 1z4k s ILE 174 N 1.37 4.99 -0.20 6.68 1.01 0.12 -0.41 121.20 134.76 1z4k s ILE 174 Ca 0.03 -0.53 -0.14 0.00 0.00 0.00 0.00 60.65 60.01 1z4k s ILE 174 Cb -0.14 -3.68 0.06 0.00 0.01 0.00 0.00 42.46 38.71 1z4k s ILE 174 CO -0.11 -0.14 0.49 -0.62 0.00 0.00 0.00 174.94 174.57 1z4k s ASP 175 N 1.65 -0.59 0.32 3.58 -1.08 -0.84 -1.06 116.67 118.66 1z4k s ASP 175 Ca 0.05 1.04 0.26 0.00 -0.52 0.00 0.00 52.55 53.37 1z4k s ASP 175 Cb -0.18 0.97 0.76 0.00 -1.46 0.00 0.00 42.92 43.01 1z4k s ASP 175 CO 0.09 -0.19 1.74 -2.24 0.52 0.00 0.00 175.17 175.08 1z4k h ASP 176 N 6.38 0.00 -3.13 -0.34 2.03 -1.84 -1.78 116.42 117.74 1z4k h ASP 176 Ca -0.32 0.00 -0.56 0.00 -0.73 0.00 0.00 57.03 55.43 1z4k h ASP 176 Cb 1.19 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.66 1z4k h ASP 176 CO 0.23 0.00 0.68 -0.60 -1.03 0.00 0.00 179.24 178.52 1z4k s ARG 177 N -3.22 4.36 0.19 4.15 3.52 -1.26 -4.75 118.95 121.94 1z4k s ARG 177 Ca 0.08 1.57 -0.09 0.00 -0.13 0.00 0.00 55.73 57.16 1z4k s ARG 177 Cb 0.09 -3.57 0.10 0.00 -1.56 0.00 0.00 34.95 30.02 1z4k s ARG 177 CO 0.58 -0.43 1.69 -1.35 -0.81 0.00 0.00 175.30 174.98 1z4k h PRO 178 N 7.39 1.12 -4.36 5.12 0.11 -1.98 -3.41 132.00 136.00 1z4k h PRO 178 Ca -0.32 -0.29 -0.72 0.00 0.11 0.00 0.00 66.00 64.77 1z4k h PRO 178 Cb 1.15 -0.14 -0.27 0.00 0.11 0.00 0.00 31.00 31.85 1z4k h PRO 178 CO 0.88 1.01 -0.41 0.16 -0.21 0.00 0.00 178.00 179.44 1z4k s ASP 179 N -6.48 5.77 -0.39 -2.05 -4.77 -1.26 -5.02 116.67 102.47 1z4k s ASP 179 Ca -0.12 -1.60 -0.02 0.00 -3.30 0.00 0.00 52.55 47.50 1z4k s ASP 179 Cb 0.14 -2.04 0.10 0.00 -1.09 0.00 0.00 42.92 40.03 1z4k s ASP 179 CO 0.85 -0.62 0.16 -0.63 0.70 0.00 0.00 175.17 175.64 1z4k s ILE 180 N 1.45 3.16 0.29 2.11 1.01 -1.26 -5.07 121.20 122.90 1z4k s ILE 180 Ca 0.04 -1.99 0.05 0.00 0.00 0.00 0.00 60.65 58.75 1z4k s ILE 180 Cb -0.25 -3.14 -0.06 0.00 0.01 0.00 0.00 42.46 39.03 1z4k s ILE 180 CO 0.02 -0.60 -0.01 0.42 0.00 0.00 0.00 174.94 174.77 1z4k s THR 181 N 1.14 1.44 -2.05 2.92 -4.23 -1.26 -4.94 115.64 108.65 1z4k s THR 181 Ca 0.07 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 1z4k s THR 181 Cb -0.22 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.05 1z4k s THR 181 CO -0.04 -0.19 0.00 0.61 -0.54 0.00 0.00 174.62 174.46 1z4k n GLY 182 N -0.62 -0.56 0.24 3.99 0.00 -1.26 -4.61 105.19 102.37 1z4k n GLY 182 Ca -0.04 -0.74 0.13 0.00 0.00 0.00 0.00 46.02 45.36 1z4k n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z4k h ALA 183 N 0.00 0.98 -2.50 4.61 0.00 -1.96 -3.41 119.26 116.98 1z4k h ALA 183 Ca 0.00 -0.10 -0.68 0.00 0.00 0.00 0.00 54.91 54.12 1z4k h ALA 183 Cb 0.00 -0.02 -0.18 0.00 0.00 0.00 0.00 17.79 17.59 1z4k h ALA 183 CO 0.00 0.14 -0.29 -2.00 0.00 0.00 0.00 179.25 177.10 1z4k s GLU 184 N -3.52 3.28 0.52 0.00 2.56 -1.26 -4.96 118.70 115.32 1z4k s GLU 184 Ca 0.02 -0.66 0.32 0.00 0.00 0.00 0.00 54.97 54.65 1z4k s GLU 184 Cb 0.08 -3.90 1.28 0.00 2.00 0.00 0.00 34.13 33.60 1z4k s GLU 184 CO 0.62 -0.69 1.94 -1.00 -0.56 0.00 0.00 175.26 175.57 1z4k h PRO 185 N 8.60 0.00 -2.39 4.30 0.13 -1.94 -3.35 132.00 137.35 1z4k h PRO 185 Ca -0.28 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.26 1z4k h PRO 185 Cb 1.13 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.86 1z4k h PRO 185 CO 0.74 0.00 -0.85 0.25 -0.23 0.00 0.00 178.00 177.90 1z4k n THR 186 N -3.01 0.21 -1.11 1.56 -2.24 -1.26 -5.10 114.28 103.32 1z4k n THR 186 Ca 0.01 -4.23 -0.34 0.00 -2.27 0.00 0.00 64.05 57.22 1z4k n THR 186 Cb 0.31 -1.93 0.11 0.00 -2.10 0.00 0.00 70.33 66.72 1z4k n THR 186 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1z4k n PRO 187 N 1.89 0.16 0.14 -0.78 -0.02 -1.26 -4.91 135.00 130.23 1z4k n PRO 187 Ca 0.25 0.12 0.02 0.00 -2.02 0.00 0.00 63.50 61.88 1z4k n PRO 187 Cb 0.45 -2.19 0.04 0.00 -0.02 0.00 0.00 33.50 31.78 1z4k n PRO 187 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1z4k h SER 188 N -0.83 0.00 -3.90 2.55 4.64 -1.84 -3.46 113.55 110.71 1z4k h SER 188 Ca -0.46 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.37 1z4k h SER 188 Cb 1.31 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.43 1z4k h SER 188 CO 0.43 0.51 0.23 -1.66 -0.87 0.00 0.00 176.83 175.47 1z4k s TRP 189 N -2.98 3.53 -0.14 4.77 1.48 -0.84 -4.65 118.94 120.11 1z4k s TRP 189 Ca 0.04 1.11 -0.19 0.00 -1.06 0.00 0.00 56.10 55.99 1z4k s TRP 189 Cb 0.08 -2.53 -0.04 0.00 -1.16 0.00 0.00 33.47 29.82 1z4k s TRP 189 CO 0.74 -0.33 0.54 -2.00 -4.06 0.00 0.00 176.95 171.84 1z4k s GLU 190 N -4.44 4.31 -0.35 3.25 2.12 -0.59 -4.89 118.70 118.10 1z4k s GLU 190 Ca 0.52 0.53 -0.26 0.00 0.36 0.00 0.00 54.97 56.12 1z4k s GLU 190 Cb -0.10 -3.48 0.01 0.00 0.26 0.00 0.00 34.13 30.82 1z4k s GLU 190 CO 0.40 0.02 0.94 -1.58 -0.54 0.00 0.00 175.26 174.51 1z4k s HIS 191 N 1.04 3.11 -0.26 5.30 5.65 -1.26 -1.11 115.29 127.76 1z4k s HIS 191 Ca 0.28 0.88 -0.11 0.00 0.25 0.00 0.00 55.06 56.36 1z4k s HIS 191 Cb -0.16 -3.60 -0.05 0.00 -1.18 0.00 0.00 32.58 27.60 1z4k s HIS 191 CO 0.11 -0.77 0.18 0.08 -0.65 0.00 0.00 174.74 173.69 1z4k s VAL 192 N 3.45 5.33 -0.27 0.89 1.01 0.45 -4.42 120.40 126.84 1z4k s VAL 192 Ca 0.39 0.19 -0.29 0.00 0.00 0.00 0.00 61.98 62.27 1z4k s VAL 192 Cb -0.12 -3.52 0.01 0.00 0.00 0.00 0.00 36.38 32.75 1z4k s VAL 192 CO 0.17 0.30 1.05 -0.22 0.00 0.00 0.00 175.10 176.40 1z4k s LEU 193 N 1.39 4.03 -0.14 3.92 2.96 -0.29 -1.98 118.68 128.57 1z4k s LEU 193 Ca 0.08 1.22 -0.25 0.00 -0.22 0.00 0.00 54.13 54.96 1z4k s LEU 193 Cb -0.15 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 42.99 1z4k s LEU 193 CO 0.08 -0.76 0.79 0.12 -1.32 0.00 0.00 176.35 175.26 1z4k s PHE 194 N 3.39 3.47 0.24 5.38 5.36 -0.67 -0.67 117.98 134.47 1z4k s PHE 194 Ca 0.44 1.25 -0.30 0.00 -0.96 0.00 0.00 56.93 57.37 1z4k s PHE 194 Cb -0.14 -2.96 -0.10 0.00 -0.34 0.00 0.00 43.02 39.49 1z4k s PHE 194 CO 0.10 -0.15 1.42 0.99 -1.46 0.00 0.00 175.22 176.13 1z4k s THR 195 N 1.76 2.75 0.09 0.12 2.01 -0.54 -4.19 115.64 117.65 1z4k s THR 195 Ca 0.38 0.63 -0.02 0.00 0.31 0.00 0.00 61.69 62.99 1z4k s THR 195 Cb -0.17 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 1z4k s THR 195 CO 0.14 0.10 0.04 0.00 -0.69 0.00 0.00 174.62 174.21 1z4k s ALA 196 N 0.05 0.61 0.29 7.40 0.00 -1.26 -4.83 121.76 124.03 1z4k s ALA 196 Ca 0.59 -1.29 0.04 0.00 0.00 0.00 0.00 51.96 51.30 1z4k s ALA 196 Cb -0.41 0.59 0.67 0.00 0.00 0.00 0.00 23.12 23.97 1z4k s ALA 196 CO 0.42 -0.45 1.78 0.00 0.00 0.00 0.00 175.76 177.51 1z4k h HIS 198 N 0.75 0.00 0.00 0.00 2.07 -1.86 -3.26 115.15 112.85 1z4k h HIS 198 Ca 0.54 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.06 1z4k h HIS 198 Cb 0.80 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.78 1z4k h HIS 198 CO -0.03 0.00 0.00 0.27 -3.07 0.00 0.00 177.93 175.10 1z4k n ASN 199 N -2.69 0.82 0.28 3.10 0.23 -0.45 -2.88 115.26 113.67 1z4k n ASN 199 Ca 0.01 -0.93 0.14 0.00 -0.53 0.00 0.00 54.58 53.27 1z4k n ASN 199 Cb 0.27 0.12 0.81 0.00 -2.08 0.00 0.00 39.78 38.90 1z4k n ASN 199 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 1z4k h GLN 200 N 0.00 0.00 -0.01 -3.83 3.07 -1.34 -1.43 115.11 111.57 1z4k h GLN 200 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1z4k h GLN 200 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.59 1z4k h GLN 200 CO 0.00 0.08 -0.30 0.72 0.09 0.00 0.00 178.83 179.42 1z4k n HIS 201 N -3.57 0.00 -2.37 0.06 8.25 -1.26 -4.96 115.22 111.36 1z4k n HIS 201 Ca -0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 1z4k n HIS 201 Cb 0.20 -0.09 -0.03 0.00 1.12 0.00 0.00 29.99 31.19 1z4k n HIS 201 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1z4k s LEU 202 N -2.48 4.29 -0.18 2.41 1.43 -0.54 -5.00 118.68 118.60 1z4k s LEU 202 Ca 0.23 1.92 -0.27 0.00 -1.03 0.00 0.00 54.13 54.99 1z4k s LEU 202 Cb 0.19 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.84 1z4k s LEU 202 CO 0.53 -0.63 0.91 -1.58 0.23 0.00 0.00 176.35 175.80 1z4k s GLN 203 N 2.28 4.30 0.30 1.70 0.74 -1.26 -5.05 119.66 122.66 1z4k s GLN 203 Ca 0.59 1.15 -0.01 0.00 0.05 0.00 0.00 55.36 57.13 1z4k s GLN 203 Cb -0.27 -3.59 -0.04 0.00 1.10 0.00 0.00 33.01 30.21 1z4k s GLN 203 CO 0.24 -0.41 0.51 -0.51 -0.55 0.00 0.00 175.29 174.57 1z4k s LEU 204 N 2.43 4.08 -0.02 3.68 1.43 -1.26 -5.05 118.68 123.97 1z4k s LEU 204 Ca 0.41 0.52 -0.31 0.00 -1.03 0.00 0.00 54.13 53.72 1z4k s LEU 204 Cb -0.16 -3.35 -0.09 0.00 0.03 0.00 0.00 46.19 42.62 1z4k s LEU 204 CO 0.11 -0.21 1.98 0.00 0.23 0.00 0.00 176.35 178.47 1z4k n GLN 205 N -1.27 2.61 -0.18 1.70 1.13 -1.26 -4.87 117.38 115.24 1z4k n GLN 205 Ca -0.04 0.94 0.01 0.00 -1.94 0.00 0.00 57.00 55.97 1z4k n GLN 205 Cb 0.55 -2.94 0.04 0.00 0.11 0.00 0.00 30.24 28.00 1z4k n GLN 205 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 1z4k n PRO 206 N 7.45 -0.09 0.27 -1.09 -0.02 -1.26 -0.75 135.00 139.52 1z4k n PRO 206 Ca 0.22 0.73 0.15 0.00 -2.02 0.00 0.00 63.50 62.58 1z4k n PRO 206 Cb 0.38 -1.08 0.89 0.00 -0.02 0.00 0.00 33.50 33.66 1z4k n PRO 206 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1z4k h PRO 207 N 0.00 0.00 -6.87 0.52 0.14 -2.05 -3.43 132.00 120.31 1z4k h PRO 207 Ca 0.19 0.00 -0.52 0.00 0.14 0.00 0.00 66.00 65.80 1z4k h PRO 207 Cb 0.30 0.00 0.07 0.00 0.14 0.00 0.00 31.00 31.51 1z4k h PRO 207 CO -0.47 0.00 0.66 1.03 0.14 0.00 0.00 178.00 179.36 1z4k s ARG 208 N -4.65 4.33 0.23 0.86 0.52 0.07 -5.04 118.95 115.27 1z4k s ARG 208 Ca -0.05 2.26 0.11 0.00 -0.52 0.00 0.00 55.73 57.53 1z4k s ARG 208 Cb 0.15 -3.07 -0.05 0.00 0.52 0.00 0.00 34.95 32.51 1z4k s ARG 208 CO 0.55 -0.24 -0.17 0.50 0.02 0.00 0.00 175.30 175.96 1z4k s ARG 209 N -1.68 1.78 0.09 3.54 3.52 -1.26 -4.90 118.95 120.04 1z4k s ARG 209 Ca 0.50 -1.56 0.08 0.00 -0.13 0.00 0.00 55.73 54.62 1z4k s ARG 209 Cb -0.41 -1.91 -0.03 0.00 -1.56 0.00 0.00 34.95 31.04 1z4k s ARG 209 CO 0.53 0.37 -0.21 1.03 -0.81 0.00 0.00 175.30 176.21 1z4k s ARG 210 N -3.16 1.16 -0.25 5.12 0.52 -1.26 -1.14 118.95 119.94 1z4k s ARG 210 Ca 0.26 -1.13 -0.03 0.00 -0.52 0.00 0.00 55.73 54.32 1z4k s ARG 210 Cb -0.07 -1.41 0.02 0.00 0.52 0.00 0.00 34.95 34.01 1z4k s ARG 210 CO 0.14 0.33 -0.03 -1.17 0.02 0.00 0.00 175.30 174.59 1z4k s LEU 211 N -1.79 3.26 0.38 2.53 2.96 0.15 -4.87 118.68 121.29 1z4k s LEU 211 Ca 0.07 -0.78 0.21 0.00 -0.22 0.00 0.00 54.13 53.41 1z4k s LEU 211 Cb -0.10 -1.71 0.24 0.00 0.50 0.00 0.00 46.19 45.12 1z4k s LEU 211 CO 0.04 -0.12 1.50 0.45 -1.32 0.00 0.00 176.35 176.89 1z4k h HIS 212 N 8.06 0.00 -1.53 5.38 3.86 -1.94 -1.44 115.15 127.54 1z4k h HIS 212 Ca -0.34 0.00 0.38 0.00 -1.16 0.00 0.00 60.37 59.25 1z4k h HIS 212 Cb 1.12 0.00 -0.11 0.00 1.06 0.00 0.00 27.41 29.48 1z4k h HIS 212 CO 0.58 0.11 0.96 -1.54 0.86 0.00 0.00 177.93 178.90 1z4k s SER 213 N -6.15 -0.01 0.38 2.45 1.04 -1.26 -4.24 113.70 105.91 1z4k s SER 213 Ca 0.05 -0.06 0.27 0.00 0.48 0.00 0.00 55.95 56.69 1z4k s SER 213 Cb 0.06 0.06 0.88 0.00 0.10 0.00 0.00 66.02 67.12 1z4k s SER 213 CO 0.70 -0.11 1.78 -0.50 0.98 0.00 0.00 173.24 176.09 1z4k h TRP 214 N 2.00 0.00 0.00 5.02 4.06 -1.92 -2.27 115.95 122.84 1z4k h TRP 214 Ca -0.28 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.64 1z4k h TRP 214 Cb 1.19 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.34 1z4k h TRP 214 CO 0.79 0.00 -0.14 0.00 -3.56 0.00 0.00 178.44 175.52 1z4k h ALA 215 N 2.18 1.00 -2.24 1.49 0.00 -1.92 -3.45 119.26 116.31 1z4k h ALA 215 Ca 0.00 -0.13 -0.45 0.00 0.00 0.00 0.00 54.91 54.32 1z4k h ALA 215 Cb 0.66 -0.02 0.19 0.00 0.00 0.00 0.00 17.79 18.62 1z4k h ALA 215 CO 0.00 0.18 0.11 0.34 0.00 0.00 0.00 179.25 179.88 1z4k s ASP 216 N -6.05 1.88 -1.23 0.00 2.15 -0.85 -4.88 116.67 107.68 1z4k s ASP 216 Ca 0.01 1.47 -0.13 0.00 0.43 0.00 0.00 52.55 54.33 1z4k s ASP 216 Cb 0.09 -2.18 0.16 0.00 -0.30 0.00 0.00 42.92 40.70 1z4k s ASP 216 CO 0.61 -3.64 1.51 -0.67 -0.17 0.00 0.00 175.17 172.82 1z4k n ASP 217 N -4.54 5.19 0.12 -0.34 2.03 -1.26 -4.76 116.55 112.99 1z4k n ASP 217 Ca 0.05 -2.99 -0.01 0.00 0.52 0.00 0.00 54.79 52.36 1z4k n ASP 217 Cb 0.55 -1.57 0.24 0.00 -0.72 0.00 0.00 41.12 39.63 1z4k n ASP 217 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 1z4k h TRP 218 N 6.97 0.19 -0.74 -0.67 5.08 -1.89 -2.89 115.95 122.00 1z4k h TRP 218 Ca 0.34 -0.05 0.01 0.00 1.08 0.00 0.00 58.89 60.27 1z4k h TRP 218 Cb 0.84 -0.04 -0.04 0.00 -3.00 0.00 0.00 29.16 26.92 1z4k h TRP 218 CO 1.14 0.57 0.49 0.87 -1.28 0.00 0.00 178.44 180.23 1z4k h LYS 219 N 0.13 0.96 -0.28 0.12 1.57 -1.98 -1.93 116.57 115.16 1z4k h LYS 219 Ca 0.01 -0.06 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 1z4k h LYS 219 Cb 0.82 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 1z4k h LYS 219 CO 0.06 0.63 -0.32 0.00 -0.57 0.00 0.00 179.45 179.26 1z4k h ALA 220 N 1.54 0.93 -0.28 3.86 0.00 -1.92 -0.70 119.26 122.69 1z4k h ALA 220 Ca 0.28 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1z4k h ALA 220 Cb -0.08 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1z4k h ALA 220 CO -0.06 0.62 0.15 0.82 0.00 0.00 0.00 179.25 180.77 1z4k h ILE 221 N 0.50 1.13 -0.21 0.00 2.04 -1.29 -1.90 117.51 117.78 1z4k h ILE 221 Ca 0.06 -0.36 0.02 0.00 1.00 0.00 0.00 64.86 65.58 1z4k h ILE 221 Cb 0.80 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 1z4k h ILE 221 CO 0.07 0.13 0.08 -0.07 0.00 0.00 0.00 178.15 178.36 1z4k h LEU 222 N 0.34 0.09 -1.21 1.44 4.07 -1.07 -2.93 115.31 116.04 1z4k h LEU 222 Ca 0.10 0.02 0.08 0.00 0.08 0.00 0.00 57.88 58.16 1z4k h LEU 222 Cb 0.08 0.01 -0.06 0.00 1.08 0.00 0.00 40.66 41.77 1z4k h LEU 222 CO -0.01 0.08 0.56 0.44 -1.08 0.00 0.00 178.44 178.43 1z4k h ASP 223 N 0.18 0.82 0.01 -0.43 3.32 -1.00 -0.90 116.42 118.42 1z4k h ASP 223 Ca 0.09 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1z4k h ASP 223 Cb 0.05 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.44 1z4k h ASP 223 CO -0.09 0.51 0.00 0.77 -1.72 0.00 0.00 179.24 178.71 1z4k h SER 224 N 0.92 0.00 -0.01 6.45 4.64 -1.15 -2.13 113.55 122.28 1z4k h SER 224 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1z4k h SER 224 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1z4k h SER 224 CO -0.15 0.00 -0.55 0.29 -0.87 0.00 0.00 176.83 175.55 1z4k n LYS 225 N -2.48 1.41 -2.57 4.77 4.76 -0.35 -4.99 118.16 118.69 1z4k n LYS 225 Ca -0.02 -0.55 -0.36 0.00 -2.87 0.00 0.00 58.31 54.51 1z4k n LYS 225 Cb 0.05 -1.34 -0.04 0.00 -1.84 0.00 0.00 35.03 31.85 1z4k n LYS 225 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1z4k s ARG 226 N -2.32 4.20 0.00 1.97 0.52 -0.80 -5.05 118.95 117.47 1z4k s ARG 226 Ca 0.12 1.48 0.07 0.00 -0.52 0.00 0.00 55.73 56.88 1z4k s ARG 226 Cb 0.14 -2.54 0.44 0.00 0.52 0.00 0.00 34.95 33.51 1z4k s ARG 226 CO 0.56 -0.10 0.90 -0.35 0.02 0.00 0.00 175.30 176.33