#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cxh s SER 32 N 0.00 6.66 0.35 3.14 0.15 -1.26 -4.88 113.70 117.86 3cxh s SER 32 Ca 0.00 2.67 0.26 0.00 0.70 0.00 0.00 55.95 59.58 3cxh s SER 32 Cb 0.00 -2.62 1.16 0.00 -1.71 0.00 0.00 66.02 62.84 3cxh s SER 32 CO 0.00 -0.69 1.79 0.71 1.20 0.00 0.00 173.24 176.25 3cxh h THR 33 N 3.51 0.00 0.00 6.45 1.35 -2.10 -2.37 112.91 119.76 3cxh h THR 33 Ca -0.46 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 3cxh h THR 33 Cb 1.22 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.64 3cxh h THR 33 CO 0.77 0.00 0.00 1.88 -0.25 0.00 0.00 175.52 177.92 3cxh h TYR 34 N 0.00 0.00 -3.28 4.73 0.05 -2.08 -3.39 116.97 112.99 3cxh h TYR 34 Ca 0.00 0.00 -0.75 0.00 0.05 0.00 0.00 58.73 58.03 3cxh h TYR 34 Cb 0.32 0.00 -0.23 0.00 1.01 0.00 0.00 36.73 37.84 3cxh h TYR 34 CO 0.00 0.00 0.23 1.03 -1.05 0.00 0.00 178.16 178.37 3cxh s ARG 35 N -3.29 3.45 0.30 4.88 0.52 -0.89 -5.04 118.95 118.88 3cxh s ARG 35 Ca 0.06 -2.04 -0.30 0.00 -0.52 0.00 0.00 55.73 52.93 3cxh s ARG 35 Cb 0.10 -4.50 -0.12 0.00 0.52 0.00 0.00 34.95 30.95 3cxh s ARG 35 CO 0.49 -1.44 1.56 2.41 0.02 0.00 0.00 175.30 178.34 3cxh n THR 36 N 4.70 1.14 -1.00 0.02 -1.04 -1.26 -4.94 114.28 111.90 3cxh n THR 36 Ca 0.09 -0.28 -0.29 0.00 -2.04 0.00 0.00 64.05 61.53 3cxh n THR 36 Cb 0.46 -1.90 0.19 0.00 -1.82 0.00 0.00 70.33 67.26 3cxh n THR 36 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3cxh s PRO 37 N -0.69 0.22 -0.06 -2.82 0.04 -1.26 -4.95 135.00 125.48 3cxh s PRO 37 Ca 0.63 0.68 -0.30 0.00 0.04 0.00 0.00 61.00 62.06 3cxh s PRO 37 Cb -0.51 -1.70 -0.05 0.00 0.04 0.00 0.00 34.50 32.28 3cxh s PRO 37 CO 0.51 -2.92 1.50 1.21 0.04 0.00 0.00 177.00 177.33 3cxh s ASN 38 N -3.18 6.78 -0.04 6.66 3.04 -1.26 -4.88 114.94 122.06 3cxh s ASN 38 Ca 0.66 2.09 0.05 0.00 0.04 0.00 0.00 52.86 55.70 3cxh s ASN 38 Cb -0.20 -2.54 0.09 0.00 -1.54 0.00 0.00 41.25 37.06 3cxh s ASN 38 CO 0.59 -0.83 1.05 0.49 -3.04 0.00 0.00 177.10 175.37 3cxh n PHE 39 N 6.46 0.03 0.10 0.43 3.01 -1.26 -4.77 117.46 121.45 3cxh n PHE 39 Ca 0.15 -0.63 0.10 0.00 1.01 0.00 0.00 57.45 58.08 3cxh n PHE 39 Cb 0.43 -0.08 0.58 0.00 -0.01 0.00 0.00 39.48 40.40 3cxh n PHE 39 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 3cxh h ASP 40 N 0.11 0.17 0.32 4.37 3.32 -1.90 -1.92 116.42 120.89 3cxh h ASP 40 Ca 0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3cxh h ASP 40 Cb 0.65 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.16 3cxh h ASP 40 CO 0.00 0.11 0.00 -0.90 -1.72 0.00 0.00 179.24 176.74 3cxh n ASP 41 N -4.49 0.39 0.00 6.45 5.68 -1.26 -3.13 116.55 120.19 3cxh n ASP 41 Ca 0.03 0.63 0.00 0.00 -0.50 0.00 0.00 54.79 54.95 3cxh n ASP 41 Cb 0.22 -0.70 0.00 0.00 -1.14 0.00 0.00 41.12 39.50 3cxh n ASP 41 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 3cxh n VAL 42 N -1.97 0.00 -2.51 2.12 0.31 -0.96 -5.04 118.33 110.28 3cxh n VAL 42 Ca 0.01 -0.05 -0.42 0.00 -0.01 0.00 0.00 64.34 63.87 3cxh n VAL 42 Cb 0.11 0.45 -0.03 0.00 -0.91 0.00 0.00 33.84 33.47 3cxh n VAL 42 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3cxh s LEU 43 N -2.05 4.30 0.44 7.52 1.43 -0.76 -5.03 118.68 124.53 3cxh s LEU 43 Ca 0.00 1.79 -0.20 0.00 -1.03 0.00 0.00 54.13 54.69 3cxh s LEU 43 Cb 0.00 -3.56 -0.10 0.00 0.03 0.00 0.00 46.19 42.55 3cxh s LEU 43 CO 0.00 -0.50 0.95 -1.59 0.23 0.00 0.00 176.35 175.43 3cxh s LYS 44 N 1.82 4.18 0.84 1.70 -2.85 -1.26 -4.90 119.74 119.27 3cxh s LYS 44 Ca 0.55 1.08 -0.12 0.00 -1.00 0.00 0.00 55.97 56.48 3cxh s LYS 44 Cb -0.24 -2.18 0.10 0.00 -2.06 0.00 0.00 37.83 33.44 3cxh s LYS 44 CO 0.23 -0.06 1.10 -2.00 0.10 0.00 0.00 175.35 174.73 3cxh s GLU 45 N -3.30 1.72 0.00 1.78 2.56 -1.26 -4.88 118.70 115.32 3cxh s GLU 45 Ca 0.61 0.60 -0.01 0.00 0.00 0.00 0.00 54.97 56.17 3cxh s GLU 45 Cb -0.09 -1.88 -0.05 0.00 2.00 0.00 0.00 34.13 34.10 3cxh s GLU 45 CO 0.16 -1.86 1.14 0.09 -0.56 0.00 0.00 175.26 174.23 3cxh n ASN 46 N -3.59 1.49 0.00 -1.70 3.02 -1.26 -4.37 115.26 108.85 3cxh n ASN 46 Ca 0.07 -1.67 0.00 0.00 -0.03 0.00 0.00 54.58 52.95 3cxh n ASN 46 Cb 0.57 -0.38 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 3cxh n ASN 46 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3cxh n ASN 47 N 2.57 0.00 -3.97 6.41 3.02 -1.26 -4.92 115.26 117.10 3cxh n ASN 47 Ca 0.09 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.34 3cxh n ASN 47 Cb 0.23 0.00 -0.16 0.00 -0.61 0.00 0.00 39.78 39.23 3cxh n ASN 47 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3cxh s ASP 48 N -1.00 2.94 0.47 6.41 3.68 -1.26 -5.01 116.67 122.90 3cxh s ASP 48 Ca 0.00 -0.66 0.24 0.00 2.13 0.00 0.00 52.55 54.27 3cxh s ASP 48 Cb 0.00 -1.11 1.17 0.00 -1.45 0.00 0.00 42.92 41.53 3cxh s ASP 48 CO 0.00 -0.12 1.95 0.00 0.13 0.00 0.00 175.17 177.13 3cxh h ALA 49 N 8.05 1.20 -0.44 3.66 0.00 -1.91 -2.89 119.26 126.93 3cxh h ALA 49 Ca -0.30 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3cxh h ALA 49 Cb 1.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3cxh h ALA 49 CO 0.47 0.24 0.00 -0.25 0.00 0.00 0.00 179.25 179.71 3cxh n ASP 50 N -3.61 3.89 0.09 0.00 10.43 -1.26 -4.29 116.55 121.81 3cxh n ASP 50 Ca -0.01 -2.47 -0.13 0.00 2.57 0.00 0.00 54.79 54.75 3cxh n ASP 50 Cb 0.33 -0.55 -0.08 0.00 1.84 0.00 0.00 41.12 42.65 3cxh n ASP 50 CO 0.00 0.00 0.00 0.50 -1.07 0.00 0.00 177.20 176.63 3cxh h LYS 51 N 2.86 -0.21 -0.58 -1.24 3.11 -1.95 0.26 116.57 118.83 3cxh h LYS 51 Ca 0.00 0.01 -0.03 0.00 -2.81 0.00 0.00 60.65 57.83 3cxh h LYS 51 Cb 1.30 0.05 -0.03 0.00 -1.00 0.00 0.00 32.23 32.56 3cxh h LYS 51 CO 0.25 0.06 0.26 0.78 -2.81 0.00 0.00 179.45 177.99 3cxh h GLY 52 N -0.48 0.91 0.97 5.01 0.00 -1.83 -2.48 103.07 105.17 3cxh h GLY 52 Ca -0.02 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 3cxh h GLY 52 CO 0.04 0.45 -0.30 -0.09 0.00 0.00 0.00 176.54 176.64 3cxh h ARG 53 N 0.79 -0.80 -0.78 4.80 2.43 -1.76 -0.29 114.38 118.76 3cxh h ARG 53 Ca 0.20 0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.48 3cxh h ARG 53 Cb 0.16 0.18 -0.06 0.00 -0.42 0.00 0.00 29.97 29.83 3cxh h ARG 53 CO -0.02 -0.52 0.47 0.77 -1.51 0.00 0.00 179.97 179.16 3cxh h SER 54 N -0.88 0.73 -0.36 -3.80 0.02 -0.48 0.21 113.55 108.99 3cxh h SER 54 Ca -0.09 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.84 3cxh h SER 54 Cb 0.65 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 3cxh h SER 54 CO 0.14 0.47 0.06 1.88 -1.14 0.00 0.00 176.83 178.24 3cxh h TYR 55 N 0.86 0.64 0.04 3.45 0.05 -1.41 -1.32 116.97 119.29 3cxh h TYR 55 Ca 0.34 -0.09 -0.00 0.00 0.05 0.00 0.00 58.73 59.03 3cxh h TYR 55 Cb 0.17 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 37.74 3cxh h TYR 55 CO -0.05 0.66 -0.02 0.00 -1.05 0.00 0.00 178.16 177.70 3cxh h ALA 56 N 0.91 -0.05 0.00 3.88 0.00 -0.31 -1.40 119.26 122.29 3cxh h ALA 56 Ca 0.11 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 3cxh h ALA 56 Cb 0.36 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3cxh h ALA 56 CO 0.01 -0.53 -0.33 1.88 0.00 0.00 0.00 179.25 180.28 3cxh h TYR 57 N -0.06 0.00 -0.14 0.00 -1.99 -0.58 -2.02 116.97 112.18 3cxh h TYR 57 Ca -0.01 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 60.58 3cxh h TYR 57 Cb 0.04 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.78 3cxh h TYR 57 CO -0.08 0.33 -0.46 0.35 -0.00 0.00 0.00 178.16 178.30 3cxh h PHE 58 N 0.00 0.74 0.00 4.88 3.57 -0.92 -1.16 116.94 124.06 3cxh h PHE 58 Ca -0.00 -0.30 -0.00 0.00 3.53 0.00 0.00 57.97 61.20 3cxh h PHE 58 Cb 0.62 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.24 3cxh h PHE 58 CO 0.00 1.07 -0.00 0.52 -2.23 0.00 0.00 178.31 177.67 3cxh h MET 59 N 0.20 -0.00 -0.44 1.11 2.86 -1.09 -0.08 114.93 117.49 3cxh h MET 59 Ca -0.02 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.57 3cxh h MET 59 Cb 1.09 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.73 3cxh h MET 59 CO 0.10 0.04 0.06 0.28 1.06 0.00 0.00 176.91 178.45 3cxh h VAL 60 N -0.05 1.21 -0.45 -2.22 2.07 -1.41 -0.50 116.25 114.91 3cxh h VAL 60 Ca -0.00 -0.80 -0.13 0.00 0.82 0.00 0.00 66.70 66.59 3cxh h VAL 60 Cb 0.04 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 3cxh h VAL 60 CO 0.00 0.29 -0.22 1.23 0.02 0.00 0.00 177.57 178.89 3cxh h GLY 61 N 0.90 1.02 1.27 2.17 0.00 -0.93 -0.12 103.07 107.38 3cxh h GLY 61 Ca 0.14 -0.92 -0.14 0.00 0.00 0.00 0.00 47.33 46.41 3cxh h GLY 61 CO 0.00 0.84 -0.32 0.00 0.00 0.00 0.00 176.54 177.06 3cxh h ALA 62 N 0.84 0.74 -0.36 3.60 0.00 -0.66 0.15 119.26 123.57 3cxh h ALA 62 Ca 0.10 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.52 3cxh h ALA 62 Cb 0.80 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3cxh h ALA 62 CO 0.07 0.66 -0.03 1.98 0.00 0.00 0.00 179.25 181.92 3cxh h MET 63 N 0.68 0.66 -0.78 0.00 4.05 -0.97 0.56 114.93 119.13 3cxh h MET 63 Ca 0.07 -0.23 -0.05 0.00 -0.28 0.00 0.00 59.70 59.22 3cxh h MET 63 Cb 0.87 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 31.58 3cxh h MET 63 CO 0.08 0.79 0.30 0.78 0.23 0.00 0.00 176.91 179.08 3cxh h GLY 64 N 0.47 1.25 0.88 1.39 0.00 -0.83 -0.20 103.07 106.03 3cxh h GLY 64 Ca 0.10 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.73 3cxh h GLY 64 CO 0.02 0.65 0.00 -2.00 0.00 0.00 0.00 176.54 175.22 3cxh h LEU 65 N 1.13 0.01 -0.68 3.11 7.12 -0.39 -1.98 115.31 123.63 3cxh h LEU 65 Ca 0.26 -0.12 -0.12 0.00 0.13 0.00 0.00 57.88 58.03 3cxh h LEU 65 Cb 0.23 -0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.35 3cxh h LEU 65 CO -0.02 0.13 -0.24 -0.07 -0.13 0.00 0.00 178.44 178.12 3cxh h LEU 66 N -0.11 0.78 -0.61 2.25 3.38 -0.71 -2.48 115.31 117.82 3cxh h LEU 66 Ca 0.00 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 3cxh h LEU 66 Cb 0.12 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3cxh h LEU 66 CO -0.00 0.99 0.28 0.28 0.09 0.00 0.00 178.44 180.08 3cxh h SER 67 N 0.67 0.80 -0.55 -0.43 0.02 -0.98 0.00 113.55 113.08 3cxh h SER 67 Ca 0.09 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 3cxh h SER 67 Cb 0.75 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.06 3cxh h SER 67 CO 0.06 0.72 0.31 0.28 -1.14 0.00 0.00 176.83 177.06 3cxh h SER 68 N 0.83 0.68 -0.43 3.07 0.02 -1.24 0.35 113.55 116.84 3cxh h SER 68 Ca 0.21 -0.08 -0.07 0.00 -0.84 0.00 0.00 61.79 61.00 3cxh h SER 68 Cb 0.14 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 3cxh h SER 68 CO -0.02 0.57 0.01 0.00 -1.14 0.00 0.00 176.83 176.24 3cxh h ALA 69 N 1.15 1.07 -0.16 3.77 0.00 -1.16 -0.54 119.26 123.39 3cxh h ALA 69 Ca 0.20 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3cxh h ALA 69 Cb 0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3cxh h ALA 69 CO -0.03 0.58 -0.00 0.78 0.00 0.00 0.00 179.25 180.58 3cxh h GLY 70 N 0.98 0.31 1.00 0.00 0.00 -0.13 -1.39 103.07 103.84 3cxh h GLY 70 Ca 0.15 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 3cxh h GLY 70 CO 0.02 0.21 0.35 0.00 0.00 0.00 0.00 176.54 177.12 3cxh h ALA 71 N 0.76 0.83 -0.66 3.60 0.00 -0.15 0.90 119.26 124.55 3cxh h ALA 71 Ca 0.05 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3cxh h ALA 71 Cb 0.39 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3cxh h ALA 71 CO 0.01 0.36 0.30 -0.22 0.00 0.00 0.00 179.25 179.69 3cxh h LYS 72 N 0.89 0.96 0.00 0.00 3.64 -1.02 0.23 116.57 121.26 3cxh h LYS 72 Ca 0.23 -0.16 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 3cxh h LYS 72 Cb 0.06 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 3cxh h LYS 72 CO -0.04 0.78 -0.22 0.66 -2.27 0.00 0.00 179.45 178.37 3cxh h SER 73 N 0.92 0.00 -0.03 4.20 4.64 -0.78 -1.67 113.55 120.84 3cxh h SER 73 Ca 0.22 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.38 3cxh h SER 73 Cb 0.15 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.26 3cxh h SER 73 CO -0.02 0.22 -0.63 0.74 -0.87 0.00 0.00 176.83 176.27 3cxh h THR 74 N 0.00 1.39 -0.68 2.95 2.02 -0.35 -1.93 112.91 116.31 3cxh h THR 74 Ca -0.00 -2.04 -0.06 0.00 0.77 0.00 0.00 66.41 65.08 3cxh h THR 74 Cb 1.01 2.47 -0.03 0.00 -1.74 0.00 0.00 68.15 69.86 3cxh h THR 74 CO 0.03 0.60 0.19 0.58 0.37 0.00 0.00 175.52 177.29 3cxh h VAL 75 N 0.01 1.25 0.00 3.16 2.07 -0.90 -2.55 116.25 119.30 3cxh h VAL 75 Ca -0.07 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.46 3cxh h VAL 75 Cb 1.32 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 3cxh h VAL 75 CO 0.13 0.35 -0.38 -0.33 0.02 0.00 0.00 177.57 177.36 3cxh h GLU 76 N 1.02 0.00 -0.17 1.57 5.08 -1.30 -0.55 114.58 120.23 3cxh h GLU 76 Ca 0.22 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.53 3cxh h GLU 76 Cb 0.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 3cxh h GLU 76 CO -0.00 0.38 -0.08 1.15 -1.00 0.00 0.00 179.01 179.46 3cxh h THR 77 N 0.00 1.31 -0.19 1.13 2.02 -0.94 -1.74 112.91 114.50 3cxh h THR 77 Ca -0.00 -1.12 -0.08 0.00 0.77 0.00 0.00 66.41 65.98 3cxh h THR 77 Cb 0.79 1.68 -0.00 0.00 -1.74 0.00 0.00 68.15 68.88 3cxh h THR 77 CO 0.05 0.33 -0.19 -0.26 0.37 0.00 0.00 175.52 175.82 3cxh h PHE 78 N 0.04 0.55 -0.43 3.16 0.04 -1.36 -2.74 116.94 116.20 3cxh h PHE 78 Ca 0.04 -0.17 0.05 0.00 2.80 0.00 0.00 57.97 60.69 3cxh h PHE 78 Cb 0.55 -0.12 -0.04 0.00 2.20 0.00 0.00 35.95 38.54 3cxh h PHE 78 CO 0.06 0.82 0.18 0.82 -0.60 0.00 0.00 178.31 179.60 3cxh h ILE 79 N 0.12 0.91 0.00 -0.55 2.04 -1.12 -2.19 117.51 116.72 3cxh h ILE 79 Ca 0.03 -0.13 -0.05 0.00 1.00 0.00 0.00 64.86 65.72 3cxh h ILE 79 Cb 0.73 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 3cxh h ILE 79 CO 0.05 0.07 -0.23 0.77 0.00 0.00 0.00 178.15 178.81 3cxh h SER 80 N 0.37 0.00 0.12 1.72 4.64 -1.34 -2.25 113.55 116.81 3cxh h SER 80 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3cxh h SER 80 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3cxh h SER 80 CO -0.17 0.23 0.00 0.77 -0.87 0.00 0.00 176.83 176.78 3cxh h SER 81 N 0.00 0.00 0.59 4.97 4.64 -1.07 -0.09 113.55 122.59 3cxh h SER 81 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3cxh h SER 81 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 3cxh h SER 81 CO 0.03 0.00 -0.74 0.23 -0.87 0.00 0.00 176.83 175.48 3cxh n MET 82 N -2.58 0.20 -1.80 4.77 2.00 -0.84 -4.93 117.12 113.94 3cxh n MET 82 Ca -0.02 0.03 -0.33 0.00 0.00 0.00 0.00 57.70 57.39 3cxh n MET 82 Cb 0.08 -1.60 0.04 0.00 0.00 0.00 0.00 33.22 31.74 3cxh n MET 82 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 3cxh s THR 83 N -3.13 3.52 0.01 2.03 -4.23 -0.05 -4.89 115.64 108.91 3cxh s THR 83 Ca 0.07 0.67 -0.33 0.00 -1.18 0.00 0.00 61.69 60.92 3cxh s THR 83 Cb 0.15 -3.21 -0.17 0.00 1.34 0.00 0.00 72.50 70.61 3cxh s THR 83 CO 0.75 -0.47 0.87 0.00 -0.54 0.00 0.00 174.62 175.23 3cxh n ALA 84 N -2.44 -3.12 -1.77 3.99 0.00 -1.26 -4.92 120.51 110.99 3cxh n ALA 84 Ca 0.09 0.50 -0.31 0.00 0.00 0.00 0.00 53.44 53.72 3cxh n ALA 84 Cb 0.52 -1.47 0.02 0.00 0.00 0.00 0.00 19.45 18.53 3cxh n ALA 84 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3cxh s THR 85 N -0.05 4.47 0.46 0.00 -4.23 -1.26 -4.94 115.64 110.08 3cxh s THR 85 Ca 0.75 0.82 0.19 0.00 -1.18 0.00 0.00 61.69 62.27 3cxh s THR 85 Cb -1.05 -3.70 0.37 0.00 1.34 0.00 0.00 72.50 69.46 3cxh s THR 85 CO 0.48 -1.03 1.94 0.00 -0.54 0.00 0.00 174.62 175.47 3cxh h ALA 86 N -0.39 2.25 0.00 3.99 0.00 -2.02 -1.93 119.26 121.16 3cxh h ALA 86 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3cxh h ALA 86 Cb 1.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3cxh h ALA 86 CO 0.60 -0.44 0.00 -0.40 0.00 0.00 0.00 179.25 179.01 3cxh n ASP 87 N -4.45 0.00 -0.25 0.00 3.85 -1.26 -3.75 116.55 110.69 3cxh n ASP 87 Ca 0.14 0.40 0.03 0.00 -0.71 0.00 0.00 54.79 54.65 3cxh n ASP 87 Cb 0.57 -0.47 0.03 0.00 -1.35 0.00 0.00 41.12 39.91 3cxh n ASP 87 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.20 177.52 3cxh n VAL 88 N -1.47 0.07 1.88 2.12 0.24 -0.73 -4.59 118.33 115.85 3cxh n VAL 88 Ca 0.08 -0.53 0.12 0.00 -2.04 0.00 0.00 64.34 61.96 3cxh n VAL 88 Cb 0.31 1.08 0.68 0.00 -1.47 0.00 0.00 33.84 34.45 3cxh n VAL 88 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3cxh n LEU 89 N 0.33 0.00 -4.63 1.34 4.77 -1.19 -4.85 117.00 112.76 3cxh n LEU 89 Ca 0.04 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.59 3cxh n LEU 89 Cb 0.17 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 3cxh n LEU 89 CO 0.04 0.00 1.50 0.00 -1.33 0.00 0.00 177.39 177.60 3cxh s ALA 90 N -2.00 3.17 -0.79 -1.18 0.00 -1.26 -4.95 121.76 114.75 3cxh s ALA 90 Ca 0.35 0.60 -0.18 0.00 0.00 0.00 0.00 51.96 52.73 3cxh s ALA 90 Cb 0.16 -3.91 0.13 0.00 0.00 0.00 0.00 23.12 19.50 3cxh s ALA 90 CO 0.27 -2.12 0.94 1.41 0.00 0.00 0.00 175.76 176.25 3cxh s MET 91 N 5.04 3.40 0.00 0.00 1.75 -1.26 -4.99 119.30 123.24 3cxh s MET 91 Ca 0.79 -1.66 0.00 0.00 -1.25 0.00 0.00 55.69 53.57 3cxh s MET 91 Cb -0.28 -4.58 0.00 0.00 2.84 0.00 0.00 34.83 32.81 3cxh s MET 91 CO 0.32 -1.63 0.00 0.00 -0.65 0.00 0.00 175.02 173.06 3cxh n ALA 92 N 6.17 0.00 -3.60 4.11 0.00 -1.26 -5.12 120.51 120.81 3cxh n ALA 92 Ca 0.10 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.40 3cxh n ALA 92 Cb 0.47 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.84 3cxh n ALA 92 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3cxh s LYS 93 N -0.68 0.82 0.09 0.00 2.20 -1.26 -4.86 119.74 116.05 3cxh s LYS 93 Ca 0.00 0.94 0.09 0.00 -0.36 0.00 0.00 55.97 56.65 3cxh s LYS 93 Cb 0.00 0.40 -0.04 0.00 -1.51 0.00 0.00 37.83 36.68 3cxh s LYS 93 CO 0.00 -0.10 -0.22 0.54 -0.36 0.00 0.00 175.35 175.20 3cxh s VAL 94 N 0.32 2.52 -0.10 4.02 0.11 -1.05 -5.03 120.40 121.19 3cxh s VAL 94 Ca -0.00 -1.51 0.03 0.00 -2.93 0.00 0.00 61.98 57.57 3cxh s VAL 94 Cb -0.05 -2.10 -0.01 0.00 -1.53 0.00 0.00 36.38 32.70 3cxh s VAL 94 CO 0.01 0.19 -0.20 -1.61 -3.33 0.00 0.00 175.10 170.16 3cxh s GLU 95 N -1.83 3.00 -0.03 1.54 2.02 -1.26 -2.21 118.70 119.93 3cxh s GLU 95 Ca 0.15 -0.80 0.07 0.00 0.02 0.00 0.00 54.97 54.40 3cxh s GLU 95 Cb -0.10 -2.39 -0.02 0.00 0.10 0.00 0.00 34.13 31.73 3cxh s GLU 95 CO 0.06 0.28 -0.24 0.08 0.02 0.00 0.00 175.26 175.46 3cxh s VAL 96 N 0.13 1.89 -0.83 2.63 1.01 -0.85 -4.98 120.40 119.40 3cxh s VAL 96 Ca -0.10 -1.01 -0.20 0.00 0.00 0.00 0.00 61.98 60.67 3cxh s VAL 96 Cb -0.16 -1.58 0.11 0.00 0.00 0.00 0.00 36.38 34.75 3cxh s VAL 96 CO 0.06 0.53 1.05 0.21 0.00 0.00 0.00 175.10 176.95 3cxh s ASN 97 N -0.43 6.47 0.66 3.32 3.04 -1.26 -1.86 114.94 124.90 3cxh s ASN 97 Ca 0.05 -1.73 0.34 0.00 0.04 0.00 0.00 52.86 51.56 3cxh s ASN 97 Cb -0.10 -2.39 1.83 0.00 -1.54 0.00 0.00 41.25 39.04 3cxh s ASN 97 CO 0.00 -1.16 2.04 -0.07 -3.04 0.00 0.00 177.10 174.87 3cxh h LEU 98 N 10.60 0.00 -1.43 3.21 3.38 -1.60 -2.41 115.31 127.05 3cxh h LEU 98 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 3cxh h LEU 98 Cb 1.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 3cxh h LEU 98 CO 1.12 0.00 -0.25 0.00 0.09 0.00 0.00 178.44 179.40 3cxh h ALA 99 N 1.51 1.53 0.00 1.53 0.00 -1.91 -2.62 119.26 119.30 3cxh h ALA 99 Ca 0.00 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 3cxh h ALA 99 Cb 0.51 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3cxh h ALA 99 CO -0.00 0.35 -0.27 0.00 0.00 0.00 0.00 179.25 179.33 3cxh h ALA 100 N 1.70 0.89 -1.77 0.00 0.00 -1.81 -3.43 119.26 114.85 3cxh h ALA 100 Ca 0.01 -0.25 -0.56 0.00 0.00 0.00 0.00 54.91 54.11 3cxh h ALA 100 Cb 0.47 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 3cxh h ALA 100 CO 0.03 0.34 0.94 0.42 0.00 0.00 0.00 179.25 180.99 3cxh s ILE 101 N -3.32 4.19 0.00 0.00 1.01 -0.99 -5.02 121.20 117.07 3cxh s ILE 101 Ca 0.03 1.24 0.00 0.00 0.00 0.00 0.00 60.65 61.92 3cxh s ILE 101 Cb 0.08 -4.51 0.00 0.00 0.01 0.00 0.00 42.46 38.04 3cxh s ILE 101 CO 0.68 -0.90 0.00 -2.65 0.00 0.00 0.00 174.94 172.07 3cxh n PRO 102 N 7.76 2.65 0.00 2.79 -0.02 -1.26 -4.97 135.00 141.95 3cxh n PRO 102 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 3cxh n PRO 102 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.97 3cxh n PRO 102 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3cxh n LEU 103 N 0.00 0.00 -3.78 2.45 7.94 -1.26 -4.57 117.00 117.78 3cxh n LEU 103 Ca 0.00 0.00 -0.41 0.00 -1.11 0.00 0.00 56.01 54.49 3cxh n LEU 103 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 3cxh n LEU 103 CO 0.00 0.00 1.96 0.61 -1.11 0.00 0.00 177.39 178.85 3cxh n GLY 104 N 4.19 2.14 3.04 -3.96 0.00 -1.21 -4.09 105.19 105.30 3cxh n GLY 104 Ca 0.00 -1.14 -0.24 0.00 0.00 0.00 0.00 46.02 44.64 3cxh n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cxh s LYS 105 N 5.42 1.50 0.20 1.61 -0.14 -1.24 -4.98 119.74 122.10 3cxh s LYS 105 Ca 0.60 -0.42 -0.02 0.00 -1.36 0.00 0.00 55.97 54.77 3cxh s LYS 105 Cb 0.12 -1.29 -0.05 0.00 -1.68 0.00 0.00 37.83 34.93 3cxh s LYS 105 CO 0.14 0.10 0.41 -0.80 -0.76 0.00 0.00 175.35 174.44 3cxh s ASN 106 N 0.40 6.41 -0.02 2.83 0.02 -1.26 -2.30 114.94 121.03 3cxh s ASN 106 Ca -0.09 0.48 -0.02 0.00 -1.02 0.00 0.00 52.86 52.21 3cxh s ASN 106 Cb -0.13 -2.04 0.01 0.00 0.02 0.00 0.00 41.25 39.10 3cxh s ASN 106 CO 0.02 -0.04 0.06 -0.69 0.02 0.00 0.00 177.10 176.47 3cxh s VAL 107 N -1.85 -0.00 -0.16 1.60 1.01 -0.23 -4.98 120.40 115.79 3cxh s VAL 107 Ca 0.40 0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.39 3cxh s VAL 107 Cb -0.11 -0.10 0.00 0.00 0.00 0.00 0.00 36.38 36.18 3cxh s VAL 107 CO 0.28 0.00 -0.17 -0.69 0.00 0.00 0.00 175.10 174.53 3cxh s VAL 108 N 0.07 2.48 0.06 2.92 1.01 -1.26 -1.74 120.40 123.95 3cxh s VAL 108 Ca -0.00 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.19 3cxh s VAL 108 Cb -0.01 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 3cxh s VAL 108 CO -0.00 0.52 -0.13 0.68 0.00 0.00 0.00 175.10 176.17 3cxh s VAL 109 N 0.88 1.00 -0.00 2.92 -7.23 -0.84 -4.92 120.40 112.21 3cxh s VAL 109 Ca -0.05 -1.22 -0.22 0.00 -1.81 0.00 0.00 61.98 58.68 3cxh s VAL 109 Cb -0.15 -0.98 -0.05 0.00 0.56 0.00 0.00 36.38 35.76 3cxh s VAL 109 CO -0.02 -0.22 0.66 -0.75 -0.31 0.00 0.00 175.10 174.46 3cxh s LYS 110 N -1.63 4.39 -0.12 4.82 2.20 -1.26 0.32 119.74 128.46 3cxh s LYS 110 Ca -0.03 0.84 -0.05 0.00 -0.36 0.00 0.00 55.97 56.38 3cxh s LYS 110 Cb -0.10 -3.37 0.06 0.00 -1.51 0.00 0.00 37.83 32.92 3cxh s LYS 110 CO 0.02 0.29 0.24 -0.46 -0.36 0.00 0.00 175.35 175.08 3cxh s TRP 111 N 0.01 -0.36 -1.29 4.03 -0.00 0.24 -4.87 118.94 116.70 3cxh s TRP 111 Ca 0.34 0.88 -0.05 0.00 -0.00 0.00 0.00 56.10 57.27 3cxh s TRP 111 Cb -0.19 -0.06 0.03 0.00 -0.00 0.00 0.00 33.47 33.25 3cxh s TRP 111 CO 0.19 -0.32 0.32 0.94 -0.00 0.00 0.00 176.95 178.08 3cxh n GLN 112 N 5.14 -3.22 0.00 5.86 7.27 -1.26 -1.18 117.38 129.98 3cxh n GLN 112 Ca -0.09 0.63 0.00 0.00 0.07 0.00 0.00 57.00 57.61 3cxh n GLN 112 Cb 0.50 -5.33 0.00 0.00 2.41 0.00 0.00 30.24 27.82 3cxh n GLN 112 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3cxh n GLY 113 N -1.11 2.45 3.81 1.69 0.00 -1.26 -5.00 105.19 105.76 3cxh n GLY 113 Ca -0.09 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 3cxh n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cxh s LYS 114 N 0.00 4.31 0.39 1.61 3.01 -0.33 -5.04 119.74 123.69 3cxh s LYS 114 Ca 0.00 1.08 -0.19 0.00 -1.01 0.00 0.00 55.97 55.85 3cxh s LYS 114 Cb 0.00 -2.51 -0.10 0.00 -1.01 0.00 0.00 37.83 34.21 3cxh s LYS 114 CO 0.00 0.16 0.87 -1.25 0.51 0.00 0.00 175.35 175.64 3cxh s PRO 115 N -2.63 4.16 -0.09 -1.68 0.04 -1.26 -0.59 135.00 132.95 3cxh s PRO 115 Ca 0.54 0.96 0.03 0.00 0.04 0.00 0.00 61.00 62.58 3cxh s PRO 115 Cb -0.13 -2.29 0.01 0.00 0.04 0.00 0.00 34.50 32.12 3cxh s PRO 115 CO 0.18 0.05 -0.19 0.08 0.04 0.00 0.00 177.00 177.16 3cxh s VAL 116 N -2.09 1.71 -0.17 -0.36 1.01 0.15 -1.84 120.40 118.80 3cxh s VAL 116 Ca 0.59 -0.80 -0.14 0.00 0.00 0.00 0.00 61.98 61.62 3cxh s VAL 116 Cb -0.10 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 3cxh s VAL 116 CO 0.15 0.48 0.32 -0.36 0.00 0.00 0.00 175.10 175.69 3cxh s PHE 117 N 0.56 3.43 -0.15 5.22 2.99 0.61 -1.98 117.98 128.67 3cxh s PHE 117 Ca -0.15 0.59 -0.01 0.00 0.00 0.00 0.00 56.93 57.35 3cxh s PHE 117 Cb -0.17 -2.39 0.04 0.00 0.00 0.00 0.00 43.02 40.50 3cxh s PHE 117 CO 0.05 0.16 -0.02 0.42 -0.00 0.00 0.00 175.22 175.83 3cxh s ILE 118 N 0.73 0.81 -0.07 0.64 1.01 -0.71 -1.10 121.20 122.51 3cxh s ILE 118 Ca 0.17 -0.43 0.05 0.00 0.00 0.00 0.00 60.65 60.45 3cxh s ILE 118 Cb -0.13 -1.05 -0.01 0.00 0.01 0.00 0.00 42.46 41.28 3cxh s ILE 118 CO 0.05 0.10 -0.24 -0.60 0.00 0.00 0.00 174.94 174.25 3cxh s ARG 119 N 1.76 2.67 -0.73 2.79 3.52 0.24 -1.07 118.95 128.13 3cxh s ARG 119 Ca 0.02 -0.88 -0.20 0.00 -0.13 0.00 0.00 55.73 54.54 3cxh s ARG 119 Cb -0.15 -2.22 0.11 0.00 -1.56 0.00 0.00 34.95 31.13 3cxh s ARG 119 CO -0.07 0.36 0.91 -1.58 -0.81 0.00 0.00 175.30 174.11 3cxh s HIS 120 N -0.09 3.00 0.29 5.12 5.65 -0.97 -1.44 115.29 126.84 3cxh s HIS 120 Ca -0.05 -1.05 -0.29 0.00 0.25 0.00 0.00 55.06 53.92 3cxh s HIS 120 Cb -0.14 -4.16 -0.09 0.00 -1.18 0.00 0.00 32.58 27.00 3cxh s HIS 120 CO 0.04 -1.44 1.08 1.03 -0.65 0.00 0.00 174.74 174.81 3cxh s ARG 121 N 2.90 4.60 0.70 2.88 0.52 0.31 -3.36 118.95 127.50 3cxh s ARG 121 Ca 0.21 1.74 -0.08 0.00 -0.52 0.00 0.00 55.73 57.09 3cxh s ARG 121 Cb -0.15 -3.12 0.05 0.00 0.52 0.00 0.00 34.95 32.25 3cxh s ARG 121 CO 0.02 0.19 1.03 0.95 0.02 0.00 0.00 175.30 177.51 3cxh s THR 122 N -1.23 2.70 0.17 0.02 -4.23 -1.26 -4.78 115.64 107.03 3cxh s THR 122 Ca 0.46 -0.06 -0.14 0.00 -1.18 0.00 0.00 61.69 60.76 3cxh s THR 122 Cb -0.30 -3.17 0.06 0.00 1.34 0.00 0.00 72.50 70.43 3cxh s THR 122 CO 0.39 -0.19 1.75 -0.65 -0.54 0.00 0.00 174.62 175.38 3cxh h PRO 123 N -0.59 0.32 -0.81 3.99 0.11 -1.99 -0.95 132.00 132.08 3cxh h PRO 123 Ca -0.45 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 3cxh h PRO 123 Cb 1.30 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.30 3cxh h PRO 123 CO 0.62 0.21 0.45 0.45 -0.21 0.00 0.00 178.00 179.52 3cxh h HIS 124 N 0.33 1.11 -0.58 0.65 3.86 -1.99 -2.09 115.15 116.44 3cxh h HIS 124 Ca 0.20 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.37 3cxh h HIS 124 Cb 0.19 -0.36 -0.03 0.00 1.06 0.00 0.00 27.41 28.28 3cxh h HIS 124 CO -0.15 0.77 0.27 0.93 0.86 0.00 0.00 177.93 180.61 3cxh h GLU 125 N 1.13 0.83 -0.84 2.45 5.08 -1.84 -0.13 114.58 121.26 3cxh h GLU 125 Ca 0.29 -0.13 0.02 0.00 -1.00 0.00 0.00 59.36 58.54 3cxh h GLU 125 Cb 0.02 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.08 3cxh h GLU 125 CO -0.05 0.68 0.55 0.82 -1.00 0.00 0.00 179.01 180.01 3cxh h ILE 126 N 0.78 1.17 -0.22 3.13 2.04 -0.85 0.02 117.51 123.58 3cxh h ILE 126 Ca 0.20 -0.38 -0.14 0.00 1.00 0.00 0.00 64.86 65.54 3cxh h ILE 126 Cb 0.13 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.18 3cxh h ILE 126 CO -0.02 0.20 -0.45 -0.61 0.00 0.00 0.00 178.15 177.26 3cxh h GLN 127 N 1.09 0.56 -0.65 2.37 4.15 -0.96 -2.71 115.11 118.96 3cxh h GLN 127 Ca 0.32 -0.30 -0.05 0.00 0.77 0.00 0.00 58.65 59.39 3cxh h GLN 127 Cb -0.06 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 3cxh h GLN 127 CO -0.09 0.90 0.23 1.49 -1.93 0.00 0.00 178.83 179.42 3cxh h GLU 128 N 0.45 0.98 -0.66 1.69 4.81 -0.12 -1.38 114.58 120.36 3cxh h GLU 128 Ca 0.03 -0.18 -0.08 0.00 -0.13 0.00 0.00 59.36 58.99 3cxh h GLU 128 Cb 0.97 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.16 3cxh h GLU 128 CO 0.09 0.83 0.09 0.00 -0.73 0.00 0.00 179.01 179.28 3cxh h ALA 129 N 1.29 0.88 -0.50 2.92 0.00 -0.82 -3.16 119.26 119.86 3cxh h ALA 129 Ca 0.22 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3cxh h ALA 129 Cb 0.24 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3cxh h ALA 129 CO -0.01 0.67 0.00 0.27 0.00 0.00 0.00 179.25 180.17 3cxh n ASN 130 N -4.21 3.23 -2.12 0.00 0.23 -1.02 -4.40 115.26 106.96 3cxh n ASN 130 Ca 0.04 -1.97 -0.25 0.00 -0.53 0.00 0.00 54.58 51.87 3cxh n ASN 130 Cb 0.31 -0.33 0.02 0.00 -2.08 0.00 0.00 39.78 37.69 3cxh n ASN 130 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 3cxh n SER 131 N 1.29 5.05 -4.19 0.53 7.64 -0.55 -4.99 113.62 118.40 3cxh n SER 131 Ca 0.20 -3.75 -0.31 0.00 1.01 0.00 0.00 58.87 56.03 3cxh n SER 131 Cb 0.54 -0.40 -0.17 0.00 -1.01 0.00 0.00 64.21 63.17 3cxh n SER 131 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3cxh s VAL 132 N -4.78 1.91 0.31 0.44 1.01 -1.26 -4.99 120.40 113.04 3cxh s VAL 132 Ca 0.51 -0.93 -0.29 0.00 0.00 0.00 0.00 61.98 61.27 3cxh s VAL 132 Cb 0.41 -1.66 -0.10 0.00 0.00 0.00 0.00 36.38 35.04 3cxh s VAL 132 CO -0.01 0.53 1.29 -0.62 0.00 0.00 0.00 175.10 176.28 3cxh s ASP 133 N 0.38 6.84 0.37 3.32 3.68 -1.26 -4.93 116.67 125.07 3cxh s ASP 133 Ca -0.18 2.61 0.05 0.00 2.13 0.00 0.00 52.55 57.16 3cxh s ASP 133 Cb -0.17 -2.64 0.72 0.00 -1.45 0.00 0.00 42.92 39.37 3cxh s ASP 133 CO 0.08 -0.49 1.99 0.24 0.13 0.00 0.00 175.17 177.12 3cxh h MET 134 N 3.68 0.61 0.00 4.34 2.86 -1.97 -2.76 114.93 121.69 3cxh h MET 134 Ca -0.48 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.09 3cxh h MET 134 Cb 1.22 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.76 3cxh h MET 134 CO 0.67 0.47 0.18 0.66 1.06 0.00 0.00 176.91 179.95 3cxh h SER 135 N 0.61 0.00 -0.97 1.22 4.64 -2.03 -0.78 113.55 116.24 3cxh h SER 135 Ca 0.16 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.99 3cxh h SER 135 Cb 0.06 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 61.85 3cxh h SER 135 CO -0.02 0.00 0.62 0.00 -0.87 0.00 0.00 176.83 176.56 3cxh n ALA 136 N -1.85 5.51 -3.69 5.18 0.00 -1.04 -4.91 120.51 119.71 3cxh n ALA 136 Ca -0.02 -2.86 -0.16 0.00 0.00 0.00 0.00 53.44 50.40 3cxh n ALA 136 Cb 0.22 -1.43 -0.16 0.00 0.00 0.00 0.00 19.45 18.09 3cxh n ALA 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3cxh s LEU 137 N -3.27 1.19 0.35 0.00 1.43 -0.30 -4.96 118.68 113.12 3cxh s LEU 137 Ca 0.57 -0.01 0.10 0.00 -1.03 0.00 0.00 54.13 53.75 3cxh s LEU 137 Cb 0.48 -0.19 0.64 0.00 0.03 0.00 0.00 46.19 47.15 3cxh s LEU 137 CO 0.11 -0.10 1.80 0.11 0.23 0.00 0.00 176.35 178.50 3cxh h LYS 138 N 7.21 0.15 -2.72 1.70 1.57 -1.86 -3.32 116.57 119.30 3cxh h LYS 138 Ca -0.43 -0.05 -0.61 0.00 -1.87 0.00 0.00 60.65 57.69 3cxh h LYS 138 Cb 1.13 -0.01 -0.40 0.00 0.08 0.00 0.00 32.23 33.03 3cxh h LYS 138 CO 0.48 0.46 -0.74 -3.47 -0.57 0.00 0.00 179.45 175.61 3cxh n ASP 139 N -4.12 1.72 -4.62 0.86 4.64 -1.26 -5.04 116.55 108.74 3cxh n ASP 139 Ca -0.01 -2.91 -0.49 0.00 -1.38 0.00 0.00 54.79 50.00 3cxh n ASP 139 Cb 0.40 -0.67 -0.05 0.00 -1.04 0.00 0.00 41.12 39.75 3cxh n ASP 139 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 3cxh n PRO 140 N 2.15 1.86 -3.65 -0.67 -0.02 -1.25 -4.81 135.00 128.62 3cxh n PRO 140 Ca 0.24 0.64 -0.08 0.00 -2.02 0.00 0.00 63.50 62.28 3cxh n PRO 140 Cb 0.41 -2.66 -0.08 0.00 -0.02 0.00 0.00 33.50 31.15 3cxh n PRO 140 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3cxh s GLN 141 N 4.85 0.63 0.67 -0.52 0.74 -1.26 -5.16 119.66 119.60 3cxh s GLN 141 Ca 0.98 1.12 -0.13 0.00 0.05 0.00 0.00 55.36 57.38 3cxh s GLN 141 Cb -0.70 0.10 -0.00 0.00 1.10 0.00 0.00 33.01 33.51 3cxh s GLN 141 CO 0.50 -0.15 1.07 0.95 -0.55 0.00 0.00 175.29 177.10 3cxh s THR 142 N 1.57 3.83 0.33 -0.34 -4.23 -1.26 -4.93 115.64 110.61 3cxh s THR 142 Ca -0.10 0.70 0.28 0.00 -1.18 0.00 0.00 61.69 61.39 3cxh s THR 142 Cb -0.06 -3.32 0.29 0.00 1.34 0.00 0.00 72.50 70.75 3cxh s THR 142 CO -0.18 -0.67 2.01 -0.78 -0.54 0.00 0.00 174.62 174.46 3cxh h ASP 143 N -0.31 0.00 0.31 3.99 -0.00 -1.95 -2.46 116.42 116.01 3cxh h ASP 143 Ca -0.45 0.00 -0.18 0.00 -0.00 0.00 0.00 57.03 56.40 3cxh h ASP 143 Cb 1.22 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.54 3cxh h ASP 143 CO 0.56 0.14 -0.72 0.00 -0.00 0.00 0.00 179.24 179.22 3cxh h ALA 144 N 1.86 0.64 0.00 -0.78 0.00 -1.92 -2.30 119.26 116.77 3cxh h ALA 144 Ca -0.00 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3cxh h ALA 144 Cb 0.44 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3cxh h ALA 144 CO 0.02 0.77 0.00 -0.25 0.00 0.00 0.00 179.25 179.79 3cxh n ASP 145 N -3.83 0.28 -0.07 0.00 8.00 -0.93 -3.55 116.55 116.45 3cxh n ASP 145 Ca -0.04 0.56 -0.07 0.00 0.71 0.00 0.00 54.79 55.95 3cxh n ASP 145 Cb 0.70 -0.62 -0.11 0.00 -0.02 0.00 0.00 41.12 41.07 3cxh n ASP 145 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3cxh n ARG 146 N -1.80 1.63 -5.00 -1.24 1.74 -1.11 -5.00 116.66 105.88 3cxh n ARG 146 Ca 0.03 -0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.84 3cxh n ARG 146 Cb 0.22 -1.36 -0.16 0.00 -1.02 0.00 0.00 32.46 30.14 3cxh n ARG 146 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3cxh s VAL 147 N -2.34 1.62 0.02 1.55 -7.23 -0.88 -4.83 120.40 108.30 3cxh s VAL 147 Ca -0.08 -0.87 -0.13 0.00 -1.81 0.00 0.00 61.98 59.09 3cxh s VAL 147 Cb 0.04 -1.35 -0.34 0.00 0.56 0.00 0.00 36.38 35.30 3cxh s VAL 147 CO 0.57 0.46 0.95 0.11 -0.31 0.00 0.00 175.10 176.88 3cxh h LYS 148 N 5.71 0.47 -4.99 4.82 1.57 -1.83 -3.43 116.57 118.88 3cxh h LYS 148 Ca -0.38 -0.80 -0.67 0.00 -1.87 0.00 0.00 60.65 56.93 3cxh h LYS 148 Cb 1.14 0.30 -0.36 0.00 0.08 0.00 0.00 32.23 33.40 3cxh h LYS 148 CO 0.48 1.38 -0.84 0.34 -0.57 0.00 0.00 179.45 180.24 3cxh s ASP 149 N -7.45 3.60 0.61 0.86 -1.08 -1.26 -5.02 116.67 106.92 3cxh s ASP 149 Ca -0.10 -0.91 0.28 0.00 -0.52 0.00 0.00 52.55 51.31 3cxh s ASP 149 Cb 0.05 -1.51 1.37 0.00 -1.46 0.00 0.00 42.92 41.37 3cxh s ASP 149 CO 0.92 -0.07 1.78 1.55 0.52 0.00 0.00 175.17 179.87 3cxh h PRO 150 N 7.88 0.00 0.00 4.34 0.13 -1.96 -0.37 132.00 142.03 3cxh h PRO 150 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3cxh h PRO 150 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3cxh h PRO 150 CO 0.58 0.00 -0.49 0.94 -0.23 0.00 0.00 178.00 178.80 3cxh n GLN 151 N -3.48 0.27 -3.92 0.86 7.27 -1.26 -4.68 117.38 112.44 3cxh n GLN 151 Ca 0.09 0.11 -0.33 0.00 0.07 0.00 0.00 57.00 56.94 3cxh n GLN 151 Cb 0.77 -1.70 -0.14 0.00 2.41 0.00 0.00 30.24 31.59 3cxh n GLN 151 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 3cxh s TRP 152 N -3.15 3.67 -0.40 3.69 0.52 -0.15 -0.53 118.94 122.60 3cxh s TRP 152 Ca 0.07 -2.78 -0.23 0.00 0.02 0.00 0.00 56.10 53.18 3cxh s TRP 152 Cb 0.13 -3.05 0.02 0.00 -1.15 0.00 0.00 33.47 29.42 3cxh s TRP 152 CO 0.69 -0.95 0.76 -1.17 0.02 0.00 0.00 176.95 176.30 3cxh s LEU 153 N 0.92 4.20 -0.20 2.99 2.96 -0.52 -4.58 118.68 124.45 3cxh s LEU 153 Ca 0.10 0.13 0.02 0.00 -0.22 0.00 0.00 54.13 54.16 3cxh s LEU 153 Cb -0.21 -2.96 0.03 0.00 0.50 0.00 0.00 46.19 43.55 3cxh s LEU 153 CO -0.06 -0.79 -0.18 -0.63 -1.32 0.00 0.00 176.35 173.38 3cxh s ILE 154 N 3.11 2.08 0.17 6.68 1.01 -1.26 -0.59 121.20 132.41 3cxh s ILE 154 Ca 0.30 -1.12 -0.15 0.00 0.00 0.00 0.00 60.65 59.68 3cxh s ILE 154 Cb -0.13 -1.96 0.02 0.00 0.01 0.00 0.00 42.46 40.40 3cxh s ILE 154 CO 0.19 0.39 0.44 0.00 0.00 0.00 0.00 174.94 175.96 3cxh s MET 155 N 1.24 1.27 -0.39 2.79 0.23 -0.26 -4.56 119.30 119.63 3cxh s MET 155 Ca 0.01 -0.90 -0.29 0.00 -1.03 0.00 0.00 55.69 53.48 3cxh s MET 155 Cb -0.15 0.48 0.02 0.00 -1.53 0.00 0.00 34.83 33.65 3cxh s MET 155 CO -0.11 -0.52 1.13 -0.51 -2.03 0.00 0.00 175.02 172.98 3cxh s LEU 156 N -2.88 3.78 -0.45 0.18 1.43 0.28 -0.28 118.68 120.74 3cxh s LEU 156 Ca 0.10 0.79 -0.06 0.00 -1.03 0.00 0.00 54.13 53.93 3cxh s LEU 156 Cb 0.01 -3.55 -0.16 0.00 0.03 0.00 0.00 46.19 42.52 3cxh s LEU 156 CO -0.04 -1.08 2.75 0.61 0.23 0.00 0.00 176.35 178.82 3cxh n GLY 157 N 4.38 2.93 3.05 -3.19 0.00 -0.77 -4.27 105.19 107.32 3cxh n GLY 157 Ca 0.12 -1.00 -0.31 0.00 0.00 0.00 0.00 46.02 44.82 3cxh n GLY 157 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cxh s ILE 158 N 1.97 1.88 0.22 -0.61 -1.09 -1.26 -4.26 121.20 118.05 3cxh s ILE 158 Ca 0.52 -1.13 -0.32 0.00 -2.23 0.00 0.00 60.65 57.49 3cxh s ILE 158 Cb 0.21 -1.88 -0.13 0.00 -1.58 0.00 0.00 42.46 39.08 3cxh s ILE 158 CO -0.02 0.23 1.58 0.00 -1.23 0.00 0.00 174.94 175.50 3cxh n THR 160 N 2.89 0.00 0.00 0.00 -2.24 -1.26 -2.14 114.28 111.53 3cxh n THR 160 Ca 0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 3cxh n THR 160 Cb 0.33 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 3cxh n THR 160 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 3cxh n HIS 161 N -0.95 0.00 -1.11 4.78 -0.00 -1.26 -4.43 115.22 112.25 3cxh n HIS 161 Ca 0.18 0.00 0.05 0.00 -0.00 0.00 0.00 57.72 57.95 3cxh n HIS 161 Cb 0.08 -0.10 0.06 0.00 -0.00 0.00 0.00 29.99 30.03 3cxh n HIS 161 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3cxh n LEU 162 N -0.95 1.44 0.00 0.27 4.77 -1.26 -5.01 117.00 116.27 3cxh n LEU 162 Ca 0.00 -2.04 0.00 0.00 -0.03 0.00 0.00 56.01 53.94 3cxh n LEU 162 Cb 0.00 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 3cxh n LEU 162 CO 0.00 0.48 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 3cxh n GLY 163 N -0.75 0.73 3.79 -0.72 0.00 -0.91 -5.03 105.19 102.29 3cxh n GLY 163 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 3cxh n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cxh s VAL 165 N -3.15 5.10 0.50 0.00 1.01 -1.26 -0.13 120.40 122.47 3cxh s VAL 165 Ca 0.62 0.36 -0.22 0.00 0.00 0.00 0.00 61.98 62.74 3cxh s VAL 165 Cb -0.15 -3.85 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 3cxh s VAL 165 CO 0.54 -0.07 1.26 -2.84 0.00 0.00 0.00 175.10 174.00 3cxh s PRO 166 N 2.21 3.46 -0.07 2.72 0.02 -1.26 -4.75 135.00 137.33 3cxh s PRO 166 Ca 0.16 2.01 -0.26 0.00 0.02 0.00 0.00 61.00 62.94 3cxh s PRO 166 Cb -0.16 -2.34 -0.03 0.00 0.02 0.00 0.00 34.50 31.99 3cxh s PRO 166 CO 0.12 -0.86 0.81 0.42 -0.33 0.00 0.00 177.00 177.15 3cxh s ILE 167 N -1.42 4.96 0.53 2.83 1.01 0.14 -4.81 121.20 124.44 3cxh s ILE 167 Ca 0.67 1.66 -0.20 0.00 0.00 0.00 0.00 60.65 62.78 3cxh s ILE 167 Cb -0.35 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 37.92 3cxh s ILE 167 CO 0.41 0.18 1.12 -0.83 0.00 0.00 0.00 174.94 175.83 3cxh s GLY 168 N 0.93 2.64 -1.29 6.18 0.00 -1.26 -1.84 107.32 112.68 3cxh s GLY 168 Ca 0.42 0.81 -0.06 0.00 0.00 0.00 0.00 44.72 45.89 3cxh s GLY 168 CO 0.20 1.18 0.62 1.18 0.00 0.00 0.00 173.10 176.27 3cxh n GLU 169 N -1.17 -3.22 -3.92 2.90 1.02 -0.24 -4.94 120.64 111.07 3cxh n GLU 169 Ca 0.11 0.50 -0.09 0.00 -0.02 0.00 0.00 57.16 57.65 3cxh n GLU 169 Cb 0.51 -4.66 -0.07 0.00 -0.02 0.00 0.00 31.44 27.20 3cxh n GLU 169 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3cxh s ALA 170 N -3.72 -0.14 0.00 0.62 0.00 -0.41 -5.00 121.76 113.11 3cxh s ALA 170 Ca 0.14 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.33 3cxh s ALA 170 Cb -0.05 0.81 0.00 0.00 0.00 0.00 0.00 23.12 23.89 3cxh s ALA 170 CO 0.85 -0.65 0.00 0.41 0.00 0.00 0.00 175.76 176.38 3cxh n GLY 171 N -0.21 0.76 0.67 0.00 0.00 -1.26 -3.09 105.19 102.05 3cxh n GLY 171 Ca -0.09 -1.93 0.05 0.00 0.00 0.00 0.00 46.02 44.05 3cxh n GLY 171 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3cxh n ASP 172 N -0.37 1.93 -1.01 1.61 8.00 -1.26 -4.11 116.55 121.34 3cxh n ASP 172 Ca 0.00 -2.03 0.05 0.00 0.71 0.00 0.00 54.79 53.52 3cxh n ASP 172 Cb 0.00 -0.26 0.11 0.00 -0.02 0.00 0.00 41.12 40.96 3cxh n ASP 172 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3cxh n PHE 173 N 0.49 0.00 -1.78 1.24 3.01 -1.26 -4.99 117.46 114.17 3cxh n PHE 173 Ca 0.12 -0.98 -0.21 0.00 1.01 0.00 0.00 57.45 57.39 3cxh n PHE 173 Cb 0.32 -0.20 -0.07 0.00 -0.01 0.00 0.00 39.48 39.52 3cxh n PHE 173 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3cxh n GLY 174 N -0.33 1.41 0.00 1.37 0.00 -1.26 -3.69 105.19 102.69 3cxh n GLY 174 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3cxh n GLY 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cxh n GLY 175 N -0.58 2.51 3.49 -0.02 0.00 -1.20 -4.17 105.19 105.21 3cxh n GLY 175 Ca -0.21 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.27 3cxh n GLY 175 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3cxh s TRP 176 N 2.03 2.43 -0.03 1.61 0.51 -0.67 -1.08 118.94 123.74 3cxh s TRP 176 Ca 0.00 -0.30 0.01 0.00 -2.12 0.00 0.00 56.10 53.69 3cxh s TRP 176 Cb 0.00 -1.18 0.02 0.00 -0.81 0.00 0.00 33.47 31.50 3cxh s TRP 176 CO 0.00 0.52 -0.03 0.12 -0.51 0.00 0.00 176.95 177.06 3cxh s PHE 177 N -1.77 0.51 -0.28 -1.98 5.36 -0.76 -0.52 117.98 118.54 3cxh s PHE 177 Ca 0.23 -0.10 -0.17 0.00 -0.96 0.00 0.00 56.93 55.93 3cxh s PHE 177 Cb -0.08 -0.49 -0.02 0.00 -0.34 0.00 0.00 43.02 42.09 3cxh s PHE 177 CO 0.12 -0.13 0.48 0.00 -1.46 0.00 0.00 175.22 174.23 3cxh h PRO 179 N 8.17 0.00 0.17 0.00 0.13 -1.90 -2.47 132.00 136.10 3cxh h PRO 179 Ca -0.29 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.83 3cxh h PRO 179 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3cxh h PRO 179 CO 0.71 0.00 -0.08 0.00 -0.23 0.00 0.00 178.00 178.40 3cxh n HIS 181 N -5.10 0.00 -2.22 0.00 8.25 -1.26 -5.07 115.22 109.82 3cxh n HIS 181 Ca -0.09 -0.08 -0.01 0.00 -0.26 0.00 0.00 57.72 57.29 3cxh n HIS 181 Cb 0.19 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.28 3cxh n HIS 181 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3cxh n GLY 182 N -0.09 0.60 3.74 -1.41 0.00 -0.93 -4.65 105.19 102.44 3cxh n GLY 182 Ca 0.00 -0.53 -0.37 0.00 0.00 0.00 0.00 46.02 45.13 3cxh n GLY 182 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3cxh s SER 183 N -3.03 6.46 -0.16 1.61 0.01 -1.23 -4.12 113.70 113.25 3cxh s SER 183 Ca 0.01 0.54 -0.07 0.00 1.31 0.00 0.00 55.95 57.74 3cxh s SER 183 Cb -0.00 -2.19 -0.04 0.00 0.21 0.00 0.00 66.02 64.00 3cxh s SER 183 CO 0.02 0.12 0.07 -1.00 0.41 0.00 0.00 173.24 172.86 3cxh s HIS 184 N 0.34 3.31 0.06 2.43 0.09 0.31 -1.15 115.29 120.69 3cxh s HIS 184 Ca 0.17 0.19 0.09 0.00 -0.00 0.00 0.00 55.06 55.52 3cxh s HIS 184 Cb -0.13 -2.03 -0.03 0.00 -0.00 0.00 0.00 32.58 30.39 3cxh s HIS 184 CO 0.05 0.31 -0.26 0.71 -0.00 0.00 0.00 174.74 175.54 3cxh s TYR 185 N -0.03 2.26 0.21 1.40 1.51 0.33 -0.64 117.35 122.39 3cxh s TYR 185 Ca 0.07 -0.40 -0.01 0.00 -1.01 0.00 0.00 57.07 55.72 3cxh s TYR 185 Cb -0.12 -1.32 0.04 0.00 -0.11 0.00 0.00 41.96 40.45 3cxh s TYR 185 CO 0.01 0.17 0.29 -0.40 -1.11 0.00 0.00 175.55 174.50 3cxh n ASP 186 N 1.60 0.29 0.00 2.29 5.68 -0.63 -1.67 116.55 124.11 3cxh n ASP 186 Ca -0.17 -1.27 0.03 0.00 -0.50 0.00 0.00 54.79 52.88 3cxh n ASP 186 Cb 0.52 -0.20 0.18 0.00 -1.14 0.00 0.00 41.12 40.49 3cxh n ASP 186 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3cxh n ILE 187 N -1.93 0.00 0.04 2.12 0.13 -1.24 -0.29 119.36 118.19 3cxh n ILE 187 Ca 0.04 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.70 3cxh n ILE 187 Cb 0.16 -0.59 0.00 0.00 -0.84 0.00 0.00 39.64 38.37 3cxh n ILE 187 CO 0.00 0.00 0.00 -0.24 2.80 0.00 0.00 176.55 179.11 3cxh n SER 188 N -0.76 0.95 -0.06 9.51 2.88 -1.26 -4.86 113.62 120.02 3cxh n SER 188 Ca 0.04 -0.98 -0.01 0.00 -1.33 0.00 0.00 58.87 56.60 3cxh n SER 188 Cb 0.02 0.13 -0.00 0.00 -0.75 0.00 0.00 64.21 63.60 3cxh n SER 188 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3cxh n GLY 189 N 0.18 0.40 3.87 0.46 0.00 0.61 -4.91 105.19 105.79 3cxh n GLY 189 Ca 0.01 -1.00 -0.34 0.00 0.00 0.00 0.00 46.02 44.68 3cxh n GLY 189 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cxh s ARG 190 N -2.70 3.79 -0.08 1.61 0.52 -1.26 -0.62 118.95 120.21 3cxh s ARG 190 Ca 0.00 0.21 -0.30 0.00 -0.52 0.00 0.00 55.73 55.12 3cxh s ARG 190 Cb 0.00 -2.92 -0.03 0.00 0.52 0.00 0.00 34.95 32.52 3cxh s ARG 190 CO 0.00 0.50 1.33 -1.50 0.02 0.00 0.00 175.30 175.65 3cxh s ILE 191 N -1.50 4.06 -0.09 1.52 1.10 -1.26 -1.61 121.20 123.43 3cxh s ILE 191 Ca 0.37 1.35 0.05 0.00 -0.51 0.00 0.00 60.65 61.91 3cxh s ILE 191 Cb -0.14 -3.87 -0.09 0.00 0.15 0.00 0.00 42.46 38.52 3cxh s ILE 191 CO 0.19 -0.06 -0.01 0.54 -2.11 0.00 0.00 174.94 173.50 3cxh n ARG 192 N 6.02 2.02 -3.60 3.50 5.12 0.19 -4.24 116.66 125.67 3cxh n ARG 192 Ca 0.13 0.01 -0.16 0.00 -1.93 0.00 0.00 57.85 55.91 3cxh n ARG 192 Cb 0.45 -1.21 -0.07 0.00 -1.16 0.00 0.00 32.46 30.47 3cxh n ARG 192 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 3cxh s LYS 193 N -2.20 0.90 0.00 5.56 2.20 -1.17 -4.93 119.74 120.10 3cxh s LYS 193 Ca -0.07 0.35 0.00 0.00 -0.36 0.00 0.00 55.97 55.89 3cxh s LYS 193 Cb 0.03 0.43 0.00 0.00 -1.51 0.00 0.00 37.83 36.77 3cxh s LYS 193 CO 0.30 -0.24 0.00 0.41 -0.36 0.00 0.00 175.35 175.46 3cxh n GLY 194 N 1.48 1.24 0.12 5.54 0.00 -1.26 0.11 105.19 112.42 3cxh n GLY 194 Ca -0.18 -2.21 0.12 0.00 0.00 0.00 0.00 46.02 43.75 3cxh n GLY 194 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3cxh n PRO 195 N -0.48 0.22 -1.87 1.61 -0.04 -1.26 -4.84 135.00 128.34 3cxh n PRO 195 Ca 0.00 0.34 -0.42 0.00 -0.04 0.00 0.00 63.50 63.38 3cxh n PRO 195 Cb 0.00 -1.84 -0.02 0.00 -0.04 0.00 0.00 33.50 31.60 3cxh n PRO 195 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3cxh s ALA 196 N -3.23 3.73 -0.17 0.55 0.00 -1.26 -4.84 121.76 116.55 3cxh s ALA 196 Ca 0.07 1.47 0.18 0.00 0.00 0.00 0.00 51.96 53.68 3cxh s ALA 196 Cb 0.11 -3.62 -0.06 0.00 0.00 0.00 0.00 23.12 19.54 3cxh s ALA 196 CO 0.47 -0.87 0.98 -1.00 0.00 0.00 0.00 175.76 175.34 3cxh h PRO 197 N 5.36 0.00 -5.60 0.00 0.13 -1.89 -3.48 132.00 126.53 3cxh h PRO 197 Ca -0.46 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.16 3cxh h PRO 197 Cb 1.22 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 3cxh h PRO 197 CO 0.82 0.22 -0.68 -0.51 -0.23 0.00 0.00 178.00 177.62 3cxh s LEU 198 N -5.75 2.53 0.58 1.56 1.43 -1.26 -4.52 118.68 113.25 3cxh s LEU 198 Ca -0.01 -1.18 -0.15 0.00 -1.03 0.00 0.00 54.13 51.76 3cxh s LEU 198 Cb 0.09 -0.71 -0.05 0.00 0.03 0.00 0.00 46.19 45.55 3cxh s LEU 198 CO 0.79 -0.30 1.03 0.20 0.23 0.00 0.00 176.35 178.30 3cxh s ASN 199 N -3.47 6.09 0.20 2.29 0.01 -1.26 -4.32 114.94 114.48 3cxh s ASN 199 Ca 0.30 1.65 -0.33 0.00 -0.71 0.00 0.00 52.86 53.77 3cxh s ASN 199 Cb 0.03 -2.51 -0.14 0.00 0.41 0.00 0.00 41.25 39.04 3cxh s ASN 199 CO 0.13 -0.95 1.50 0.18 -1.51 0.00 0.00 177.10 176.44 3cxh n LEU 200 N -2.10 3.13 -4.76 0.60 4.77 0.21 -4.89 117.00 113.95 3cxh n LEU 200 Ca 0.07 1.11 -0.38 0.00 -0.03 0.00 0.00 56.01 56.79 3cxh n LEU 200 Cb 0.53 -1.43 0.01 0.00 -2.33 0.00 0.00 43.42 40.21 3cxh n LEU 200 CO 0.49 -0.37 0.92 -0.70 -1.33 0.00 0.00 177.39 176.40 3cxh s GLU 201 N 0.26 3.51 -0.25 3.23 2.12 -1.26 -4.82 118.70 121.48 3cxh s GLU 201 Ca 0.73 2.04 -0.07 0.00 0.36 0.00 0.00 54.97 58.03 3cxh s GLU 201 Cb -0.66 -2.39 -0.03 0.00 0.26 0.00 0.00 34.13 31.31 3cxh s GLU 201 CO 0.44 -0.83 0.08 0.42 -0.54 0.00 0.00 175.26 174.82 3cxh s ILE 202 N -1.40 4.35 0.79 -3.70 1.09 -1.26 -0.55 121.20 120.53 3cxh s ILE 202 Ca 0.66 -0.17 -0.11 0.00 -1.10 0.00 0.00 60.65 59.93 3cxh s ILE 202 Cb -0.35 -3.04 0.08 0.00 -1.06 0.00 0.00 42.46 38.09 3cxh s ILE 202 CO 0.43 0.33 1.15 -2.16 -0.10 0.00 0.00 174.94 174.58 3cxh s PRO 203 N 1.62 1.94 0.28 2.79 0.04 -1.26 -4.97 135.00 135.43 3cxh s PRO 203 Ca 0.06 -0.01 -0.29 0.00 0.04 0.00 0.00 61.00 60.81 3cxh s PRO 203 Cb -0.15 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 3cxh s PRO 203 CO 0.04 -1.57 1.04 0.00 0.04 0.00 0.00 177.00 176.55 3cxh s ALA 204 N -3.52 3.35 -0.19 8.56 0.00 -1.26 -4.97 121.76 123.73 3cxh s ALA 204 Ca 0.62 0.78 -0.28 0.00 0.00 0.00 0.00 51.96 53.08 3cxh s ALA 204 Cb -0.10 -3.28 0.11 0.00 0.00 0.00 0.00 23.12 19.84 3cxh s ALA 204 CO 0.48 -0.04 0.91 1.52 0.00 0.00 0.00 175.76 178.64 3cxh s TYR 205 N -1.23 -0.51 0.29 0.00 1.13 -1.26 -1.50 117.35 114.26 3cxh s TYR 205 Ca 0.45 1.07 0.05 0.00 -1.41 0.00 0.00 57.07 57.23 3cxh s TYR 205 Cb -0.29 0.39 -0.06 0.00 -1.10 0.00 0.00 41.96 40.90 3cxh s TYR 205 CO 0.36 -0.36 -0.02 -1.21 -2.51 0.00 0.00 175.55 171.81 3cxh s GLU 206 N -0.50 1.55 0.23 -3.49 8.01 -1.08 -4.99 118.70 118.43 3cxh s GLU 206 Ca -0.02 -1.81 0.08 0.00 0.01 0.00 0.00 54.97 53.23 3cxh s GLU 206 Cb -0.02 -1.02 -0.04 0.00 -4.31 0.00 0.00 34.13 28.73 3cxh s GLU 206 CO 0.01 -0.04 0.06 -0.06 0.01 0.00 0.00 175.26 175.24 3cxh s PHE 207 N -3.13 2.88 -0.50 1.61 0.40 -1.26 -1.28 117.98 116.69 3cxh s PHE 207 Ca 0.31 -0.15 0.07 0.00 -0.60 0.00 0.00 56.93 56.55 3cxh s PHE 207 Cb 0.05 -1.33 0.19 0.00 0.51 0.00 0.00 43.02 42.45 3cxh s PHE 207 CO 0.12 0.56 0.68 -0.25 0.70 0.00 0.00 175.22 177.03 3cxh n ASP 208 N -0.69 -3.00 0.00 1.36 8.00 -0.43 -4.93 116.55 116.86 3cxh n ASP 208 Ca -0.08 -2.86 0.00 0.00 0.71 0.00 0.00 54.79 52.56 3cxh n ASP 208 Cb 0.57 1.43 0.00 0.00 -0.02 0.00 0.00 41.12 43.10 3cxh n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cxh n GLY 209 N 2.85 2.77 0.02 0.44 0.00 -1.26 -2.76 105.19 107.25 3cxh n GLY 209 Ca 0.19 -0.25 0.12 0.00 0.00 0.00 0.00 46.02 46.09 3cxh n GLY 209 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3cxh n ASP 210 N 9.17 0.46 -4.54 1.61 8.00 -1.26 -4.91 116.55 125.07 3cxh n ASP 210 Ca 0.00 0.01 -0.29 0.00 0.71 0.00 0.00 54.79 55.22 3cxh n ASP 210 Cb 0.00 0.05 -0.10 0.00 -0.02 0.00 0.00 41.12 41.04 3cxh n ASP 210 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 3cxh s LYS 211 N -3.04 1.98 0.03 -1.24 0.00 -1.11 -1.40 119.74 114.96 3cxh s LYS 211 Ca 0.10 -1.10 0.04 0.00 0.00 0.00 0.00 55.97 55.02 3cxh s LYS 211 Cb 0.17 -2.22 -0.04 0.00 0.00 0.00 0.00 37.83 35.74 3cxh s LYS 211 CO 0.67 0.49 -0.07 0.54 0.00 0.00 0.00 175.35 176.98 3cxh s VAL 212 N -1.21 3.59 -0.47 1.79 0.11 -0.77 -1.31 120.40 122.13 3cxh s VAL 212 Ca 0.20 -0.91 0.03 0.00 -2.93 0.00 0.00 61.98 58.38 3cxh s VAL 212 Cb -0.11 -2.59 0.12 0.00 -1.53 0.00 0.00 36.38 32.27 3cxh s VAL 212 CO 0.12 0.31 0.21 -0.51 -3.33 0.00 0.00 175.10 171.90 3cxh s ILE 213 N -1.06 2.62 0.22 7.04 2.07 -0.41 -2.00 121.20 129.68 3cxh s ILE 213 Ca 0.19 -2.92 -0.29 0.00 -1.41 0.00 0.00 60.65 56.21 3cxh s ILE 213 Cb -0.11 -2.84 -0.09 0.00 0.13 0.00 0.00 42.46 39.55 3cxh s ILE 213 CO 0.10 -0.74 0.91 -0.69 -1.91 0.00 0.00 174.94 172.61 3cxh s VAL 214 N 0.17 4.15 0.00 4.00 1.01 -0.94 -2.62 120.40 126.17 3cxh s VAL 214 Ca 0.15 2.02 0.00 0.00 0.00 0.00 0.00 61.98 64.15 3cxh s VAL 214 Cb -0.23 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.85 3cxh s VAL 214 CO -0.03 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.17