#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1z h THR 6 N 0.00 0.00 -0.04 0.00 1.35 -2.01 -2.60 112.91 109.61 3g1z h THR 6 Ca 0.00 -0.13 -0.11 0.00 -0.55 0.00 0.00 66.41 65.61 3g1z h THR 6 Cb 0.00 0.86 -0.01 0.00 -1.73 0.00 0.00 68.15 67.26 3g1z h THR 6 CO 0.00 0.00 -0.50 4.11 -0.25 0.00 0.00 175.52 178.88 3g1z h TRP 7 N 0.00 0.12 -4.04 4.73 5.08 -2.03 -3.45 115.95 116.36 3g1z h TRP 7 Ca 0.00 -0.04 -0.52 0.00 1.08 0.00 0.00 58.89 59.42 3g1z h TRP 7 Cb 0.17 -0.02 0.09 0.00 -3.00 0.00 0.00 29.16 26.39 3g1z h TRP 7 CO 0.00 0.58 0.50 -1.14 -1.28 0.00 0.00 178.44 177.09 3g1z s GLN 8 N -3.92 3.45 0.63 0.12 0.74 -0.98 -4.99 119.66 114.70 3g1z s GLN 8 Ca -0.03 1.84 -0.18 0.00 0.05 0.00 0.00 55.36 57.04 3g1z s GLN 8 Cb 0.13 -2.23 -0.02 0.00 1.10 0.00 0.00 33.01 31.99 3g1z s GLN 8 CO 0.76 -0.83 1.22 -2.14 -0.55 0.00 0.00 175.29 173.76 3g1z s PRO 9 N -2.93 2.75 0.10 1.67 0.02 -1.26 -4.95 135.00 130.40 3g1z s PRO 9 Ca 0.69 1.85 -0.22 0.00 0.02 0.00 0.00 61.00 63.34 3g1z s PRO 9 Cb -0.30 -1.90 -0.11 0.00 0.02 0.00 0.00 34.50 32.21 3g1z s PRO 9 CO 0.36 -1.39 1.73 0.77 -0.33 0.00 0.00 177.00 178.14 3g1z h SER 10 N 0.60 -0.04 -3.32 2.53 0.02 -1.09 -3.44 113.55 108.80 3g1z h SER 10 Ca -0.50 0.02 -0.56 0.00 -0.84 0.00 0.00 61.79 59.91 3g1z h SER 10 Cb 1.30 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 63.84 3g1z h SER 10 CO 0.54 -0.01 -0.04 0.00 -1.14 0.00 0.00 176.83 176.17 3g1z s ALA 11 N -6.19 3.56 0.74 3.77 0.00 -1.05 -4.60 121.76 118.00 3g1z s ALA 11 Ca -0.13 -0.04 -0.13 0.00 0.00 0.00 0.00 51.96 51.67 3g1z s ALA 11 Cb 0.07 -2.60 0.04 0.00 0.00 0.00 0.00 23.12 20.64 3g1z s ALA 11 CO 0.67 0.42 1.12 -1.54 0.00 0.00 0.00 175.76 176.43 3g1z s SER 12 N -1.48 4.51 0.13 0.00 1.04 -1.26 -4.87 113.70 111.77 3g1z s SER 12 Ca 0.35 1.99 -0.27 0.00 0.48 0.00 0.00 55.95 58.50 3g1z s SER 12 Cb -0.17 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.36 3g1z s SER 12 CO 0.19 -2.03 1.61 0.40 0.98 0.00 0.00 173.24 174.39 3g1z h ILE 13 N -0.70 0.28 -1.00 -1.02 2.04 -1.97 -1.84 117.51 113.31 3g1z h ILE 13 Ca -0.45 0.00 0.22 0.00 1.00 0.00 0.00 64.86 65.63 3g1z h ILE 13 Cb 1.25 0.28 -0.10 0.00 -0.74 0.00 0.00 36.82 37.50 3g1z h ILE 13 CO 0.51 0.00 0.62 -0.65 0.00 0.00 0.00 178.15 178.63 3g1z h PRO 14 N -0.45 0.60 -0.28 2.37 0.11 -1.99 -1.68 132.00 130.67 3g1z h PRO 14 Ca 0.07 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 65.96 3g1z h PRO 14 Cb 0.56 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.54 3g1z h PRO 14 CO -0.31 0.39 -0.55 -0.91 -0.21 0.00 0.00 178.00 176.42 3g1z h ASN 15 N 0.61 0.93 0.43 -2.05 4.21 -1.79 -1.97 115.58 115.96 3g1z h ASN 15 Ca 0.58 -0.50 -0.07 0.00 1.21 0.00 0.00 56.30 57.52 3g1z h ASN 15 Cb 1.11 -0.27 -0.01 0.00 -1.12 0.00 0.00 38.32 38.04 3g1z h ASN 15 CO -0.35 1.29 -0.32 -0.07 -1.29 0.00 0.00 177.43 176.68 3g1z h LEU 16 N 0.64 0.00 -0.13 1.61 3.38 -0.73 0.33 115.31 120.42 3g1z h LEU 16 Ca 0.01 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.76 3g1z h LEU 16 Cb 1.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.91 3g1z h LEU 16 CO 0.12 0.32 -0.81 -0.07 0.09 0.00 0.00 178.44 178.10 3g1z h LEU 17 N 0.00 0.93 -0.56 1.67 3.38 -1.18 -2.02 115.31 117.54 3g1z h LEU 17 Ca -0.00 -0.65 -0.11 0.00 0.09 0.00 0.00 57.88 57.21 3g1z h LEU 17 Cb 0.62 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3g1z h LEU 17 CO 0.04 1.43 -0.08 0.50 0.09 0.00 0.00 178.44 180.42 3g1z h LYS 18 N 0.50 1.04 -0.62 1.13 1.63 -1.12 -2.51 116.57 116.61 3g1z h LYS 18 Ca -0.06 -0.37 0.07 0.00 -0.85 0.00 0.00 60.65 59.44 3g1z h LYS 18 Cb 1.44 -0.07 -0.06 0.00 -0.60 0.00 0.00 32.23 32.94 3g1z h LYS 18 CO 0.17 1.07 0.30 -0.09 -3.45 0.00 0.00 179.45 177.44 3g1z h ARG 19 N 0.92 0.52 -0.73 1.90 2.43 -0.24 -1.59 114.38 117.60 3g1z h ARG 19 Ca 0.15 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.22 3g1z h ARG 19 Cb 0.65 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 3g1z h ARG 19 CO 0.05 0.35 0.20 0.00 -1.51 0.00 0.00 179.97 179.05 3g1z h ALA 20 N 1.37 0.95 -0.69 2.80 0.00 -1.28 -0.39 119.26 122.02 3g1z h ALA 20 Ca 0.30 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3g1z h ALA 20 Cb 0.28 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3g1z h ALA 20 CO -0.23 0.66 0.38 0.00 0.00 0.00 0.00 179.25 180.05 3g1z h ALA 21 N 1.10 0.89 -0.34 0.00 0.00 -1.09 -1.69 119.26 118.12 3g1z h ALA 21 Ca 0.23 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3g1z h ALA 21 Cb 0.34 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3g1z h ALA 21 CO -0.00 0.40 0.17 0.82 0.00 0.00 0.00 179.25 180.64 3g1z h ILE 22 N 0.95 1.16 -0.75 0.00 2.04 -1.00 -0.15 117.51 119.75 3g1z h ILE 22 Ca 0.24 -0.44 0.12 0.00 1.00 0.00 0.00 64.86 65.79 3g1z h ILE 22 Cb 0.04 0.82 -0.09 0.00 -0.74 0.00 0.00 36.82 36.85 3g1z h ILE 22 CO -0.04 0.16 0.34 0.24 0.00 0.00 0.00 178.15 178.85 3g1z h MET 23 N 0.42 0.51 -0.02 2.37 2.86 -0.86 -0.46 114.93 119.76 3g1z h MET 23 Ca 0.12 -0.03 -0.15 0.00 -2.06 0.00 0.00 59.70 57.57 3g1z h MET 23 Cb 0.11 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 3g1z h MET 23 CO -0.02 0.34 -0.70 0.00 1.06 0.00 0.00 176.91 177.59 3g1z h ALA 24 N 1.50 0.80 -0.57 6.32 0.00 -0.92 -2.09 119.26 124.30 3g1z h ALA 24 Ca 0.39 -0.62 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 3g1z h ALA 24 Cb 0.53 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3g1z h ALA 24 CO -0.35 0.84 0.13 1.49 0.00 0.00 0.00 179.25 181.36 3g1z h GLU 25 N 0.06 0.92 -0.33 0.00 4.81 -0.54 -0.41 114.58 119.09 3g1z h GLU 25 Ca -0.01 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 58.98 3g1z h GLU 25 Cb 1.24 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 3g1z h GLU 25 CO 0.10 0.86 0.19 0.82 -0.73 0.00 0.00 179.01 180.25 3g1z h ILE 26 N 0.83 1.13 -0.88 2.32 2.04 -0.95 -1.42 117.51 120.57 3g1z h ILE 26 Ca 0.18 -0.32 0.01 0.00 1.00 0.00 0.00 64.86 65.72 3g1z h ILE 26 Cb 0.36 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 3g1z h ILE 26 CO 0.00 0.13 0.57 0.03 0.00 0.00 0.00 178.15 178.89 3g1z h ARG 27 N 0.42 1.17 -0.85 2.37 3.08 -1.27 -2.29 114.38 117.01 3g1z h ARG 27 Ca 0.12 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 3g1z h ARG 27 Cb 0.04 -0.26 -0.04 0.00 0.08 0.00 0.00 29.97 29.79 3g1z h ARG 27 CO -0.02 0.79 0.44 0.00 -1.07 0.00 0.00 179.97 180.11 3g1z h ARG 28 N 1.20 1.21 -0.22 0.04 3.08 -0.95 -1.27 114.38 117.47 3g1z h ARG 28 Ca 0.32 -0.16 0.04 0.00 0.07 0.00 0.00 59.98 60.25 3g1z h ARG 28 Cb -0.12 -0.23 -0.04 0.00 0.08 0.00 0.00 29.97 29.67 3g1z h ARG 28 CO -0.07 0.91 -0.00 0.35 -1.07 0.00 0.00 179.97 180.09 3g1z h PHE 29 N 1.20 -0.01 -0.02 3.04 3.04 -0.75 0.29 116.94 123.73 3g1z h PHE 29 Ca 0.30 0.02 -0.23 0.00 3.98 0.00 0.00 57.97 62.04 3g1z h PHE 29 Cb 0.08 0.04 0.00 0.00 2.56 0.00 0.00 35.95 38.63 3g1z h PHE 29 CO 0.01 -0.03 -0.92 0.74 -2.02 0.00 0.00 178.31 176.08 3g1z h PHE 30 N 0.07 0.68 -0.75 0.41 -1.00 -1.33 -2.99 116.94 112.03 3g1z h PHE 30 Ca 0.10 -0.36 0.03 0.00 2.81 0.00 0.00 57.97 60.55 3g1z h PHE 30 Cb 0.13 -0.08 -0.04 0.00 3.61 0.00 0.00 35.95 39.57 3g1z h PHE 30 CO -0.19 1.18 0.48 0.00 -1.61 0.00 0.00 178.31 178.17 3g1z h ALA 31 N 0.71 0.97 0.00 2.45 0.00 -1.00 0.42 119.26 122.81 3g1z h ALA 31 Ca -0.08 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3g1z h ALA 31 Cb 1.55 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 3g1z h ALA 31 CO 0.16 0.29 -0.11 -0.44 0.00 0.00 0.00 179.25 179.15 3g1z h ASP 32 N 0.94 0.00 -0.46 0.00 3.32 -0.86 -2.05 116.42 117.32 3g1z h ASP 32 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 3g1z h ASP 32 Cb -0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3g1z h ASP 32 CO -0.10 0.11 0.00 0.54 -1.72 0.00 0.00 179.24 178.06 3g1z n ARG 33 N -3.79 2.55 -2.29 3.56 1.74 -0.89 -4.97 116.66 112.57 3g1z n ARG 33 Ca -0.02 -2.37 -0.16 0.00 -0.77 0.00 0.00 57.85 54.53 3g1z n ARG 33 Cb 0.21 -1.52 -0.01 0.00 -1.02 0.00 0.00 32.46 30.11 3g1z n ARG 33 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3g1z n GLY 34 N 1.52 -0.27 3.77 -0.13 0.00 -0.76 -5.00 105.19 104.32 3g1z n GLY 34 Ca 0.20 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 3g1z n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1z s VAL 35 N -2.82 5.02 0.11 1.61 1.01 0.06 -4.96 120.40 120.44 3g1z s VAL 35 Ca 0.00 1.05 -0.25 0.00 0.00 0.00 0.00 61.98 62.77 3g1z s VAL 35 Cb 0.00 -3.84 -0.07 0.00 0.00 0.00 0.00 36.38 32.47 3g1z s VAL 35 CO 0.00 0.44 0.78 -0.22 0.00 0.00 0.00 175.10 176.10 3g1z s LEU 36 N -0.19 4.52 0.03 3.92 2.96 -0.74 -4.38 118.68 124.79 3g1z s LEU 36 Ca 0.27 1.56 -0.22 0.00 -0.22 0.00 0.00 54.13 55.53 3g1z s LEU 36 Cb -0.17 -3.28 -0.06 0.00 0.50 0.00 0.00 46.19 43.18 3g1z s LEU 36 CO 0.14 0.10 0.64 -0.70 -1.32 0.00 0.00 176.35 175.22 3g1z s GLU 37 N -0.57 4.36 0.33 1.98 2.12 -1.26 -0.82 118.70 124.83 3g1z s GLU 37 Ca 0.38 0.84 0.06 0.00 0.36 0.00 0.00 54.97 56.60 3g1z s GLU 37 Cb -0.22 -3.33 -0.07 0.00 0.26 0.00 0.00 34.13 30.78 3g1z s GLU 37 CO 0.25 0.39 0.01 0.14 -0.54 0.00 0.00 175.26 175.51 3g1z s VAL 38 N -0.33 1.54 -0.05 3.70 -7.23 -0.11 -4.93 120.40 112.99 3g1z s VAL 38 Ca 0.33 -2.05 0.01 0.00 -1.81 0.00 0.00 61.98 58.46 3g1z s VAL 38 Cb -0.19 -2.72 0.02 0.00 0.56 0.00 0.00 36.38 34.05 3g1z s VAL 38 CO 0.19 -0.11 -0.05 -1.61 -0.31 0.00 0.00 175.10 173.21 3g1z s GLU 39 N -3.79 0.91 0.29 4.82 2.02 -1.26 -4.49 118.70 117.20 3g1z s GLU 39 Ca 0.34 -0.14 0.03 0.00 0.02 0.00 0.00 54.97 55.22 3g1z s GLU 39 Cb 0.07 -0.89 -0.06 0.00 0.10 0.00 0.00 34.13 33.35 3g1z s GLU 39 CO 0.15 -0.07 0.06 0.95 0.02 0.00 0.00 175.26 176.37 3g1z s THR 40 N 0.88 1.02 0.63 3.63 -4.23 -1.26 -5.12 115.64 111.20 3g1z s THR 40 Ca -0.12 -2.01 -0.18 0.00 -1.18 0.00 0.00 61.69 58.20 3g1z s THR 40 Cb -0.14 -2.68 -0.02 0.00 1.34 0.00 0.00 72.50 70.99 3g1z s THR 40 CO 0.01 -0.05 1.29 -2.65 -0.54 0.00 0.00 174.62 172.67 3g1z n PRO 41 N -0.59 1.17 0.07 3.99 -0.02 -1.26 -4.92 135.00 133.44 3g1z n PRO 41 Ca -0.02 0.46 0.12 0.00 -2.02 0.00 0.00 63.50 62.03 3g1z n PRO 41 Cb 0.66 -2.52 0.14 0.00 -0.02 0.00 0.00 33.50 31.76 3g1z n PRO 41 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g1z s MET 43 N -3.20 1.49 -0.00 0.00 -1.94 -1.26 -0.01 119.30 114.38 3g1z s MET 43 Ca 0.05 -0.99 -0.06 0.00 -1.71 0.00 0.00 55.69 52.98 3g1z s MET 43 Cb 0.13 -1.63 0.00 0.00 2.01 0.00 0.00 34.83 35.34 3g1z s MET 43 CO 0.73 0.42 0.12 0.45 -0.01 0.00 0.00 175.02 176.73 3g1z s SER 44 N -1.21 0.03 0.19 3.03 0.15 -0.10 -4.95 113.70 110.84 3g1z s SER 44 Ca 0.09 -0.19 0.23 0.00 0.70 0.00 0.00 55.95 56.77 3g1z s SER 44 Cb -0.09 0.20 0.90 0.00 -1.71 0.00 0.00 66.02 65.32 3g1z s SER 44 CO 0.02 -0.32 1.69 0.00 1.20 0.00 0.00 173.24 175.82 3g1z n GLN 45 N 1.65 0.16 -3.73 5.44 6.02 -1.26 -0.12 117.38 125.53 3g1z n GLN 45 Ca -0.22 0.33 -0.22 0.00 -0.01 0.00 0.00 57.00 56.88 3g1z n GLN 45 Cb 0.56 -1.77 -0.04 0.00 1.02 0.00 0.00 30.24 30.02 3g1z n GLN 45 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3g1z s ALA 46 N -3.20 4.02 0.00 -1.58 0.00 -1.26 -4.83 121.76 114.91 3g1z s ALA 46 Ca 0.06 -1.85 0.00 0.00 0.00 0.00 0.00 51.96 50.17 3g1z s ALA 46 Cb 0.10 -0.84 0.00 0.00 0.00 0.00 0.00 23.12 22.39 3g1z s ALA 46 CO 0.41 -0.26 0.00 -2.37 0.00 0.00 0.00 175.76 173.54 3g1z n THR 47 N -1.52 0.00 -4.24 0.00 5.66 -1.26 -4.45 114.28 108.46 3g1z n THR 47 Ca 0.02 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.77 3g1z n THR 47 Cb 0.63 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.33 3g1z n THR 47 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 3g1z s VAL 48 N -1.80 3.59 -0.44 1.08 -7.23 -1.26 -4.55 120.40 109.80 3g1z s VAL 48 Ca 0.00 -1.58 0.16 0.00 -1.81 0.00 0.00 61.98 58.75 3g1z s VAL 48 Cb 0.00 -2.84 -0.21 0.00 0.56 0.00 0.00 36.38 33.89 3g1z s VAL 48 CO 0.00 -0.19 0.54 0.35 -0.31 0.00 0.00 175.10 175.49 3g1z n THR 49 N -0.33 0.00 -1.35 5.32 -2.24 -1.26 -4.81 114.28 109.61 3g1z n THR 49 Ca -0.09 -0.23 -0.53 0.00 -2.27 0.00 0.00 64.05 60.93 3g1z n THR 49 Cb 0.56 0.62 -0.07 0.00 -2.10 0.00 0.00 70.33 69.34 3g1z n THR 49 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3g1z n ASP 50 N -1.68 0.46 0.11 3.42 -0.08 -1.26 -4.56 116.55 112.95 3g1z n ASP 50 Ca 0.00 0.98 0.12 0.00 -1.51 0.00 0.00 54.79 54.38 3g1z n ASP 50 Cb 0.33 -0.75 0.46 0.00 2.34 0.00 0.00 41.12 43.50 3g1z n ASP 50 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 3g1z n ILE 51 N 2.20 0.76 1.12 5.18 2.08 -1.26 -2.49 119.36 126.95 3g1z n ILE 51 Ca 0.21 0.11 0.12 0.00 0.56 0.00 0.00 62.75 63.75 3g1z n ILE 51 Cb 0.01 -0.99 0.17 0.00 -0.75 0.00 0.00 39.64 38.08 3g1z n ILE 51 CO 0.00 0.00 0.00 1.41 0.56 0.00 0.00 176.55 178.52 3g1z n HIS 52 N -2.14 0.00 -4.66 1.39 8.25 -1.26 -4.94 115.22 111.86 3g1z n HIS 52 Ca 0.03 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.16 3g1z n HIS 52 Cb 0.27 -0.04 -0.12 0.00 1.12 0.00 0.00 29.99 31.22 3g1z n HIS 52 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3g1z s LEU 53 N -2.42 3.09 -0.32 2.41 1.02 -1.04 -5.08 118.68 116.34 3g1z s LEU 53 Ca 0.22 -0.07 0.01 0.00 0.02 0.00 0.00 54.13 54.32 3g1z s LEU 53 Cb 0.19 -1.67 0.10 0.00 0.02 0.00 0.00 46.19 44.82 3g1z s LEU 53 CO 0.52 0.33 0.06 -0.36 0.02 0.00 0.00 176.35 176.93 3g1z s PHE 54 N -0.64 2.66 0.72 0.29 0.40 -1.26 -4.92 117.98 115.24 3g1z s PHE 54 Ca 0.10 -2.29 -0.11 0.00 -0.60 0.00 0.00 56.93 54.02 3g1z s PHE 54 Cb -0.11 -2.23 0.02 0.00 0.51 0.00 0.00 43.02 41.21 3g1z s PHE 54 CO 0.02 -0.90 1.10 -1.25 0.70 0.00 0.00 175.22 174.88 3g1z s PRO 55 N 1.29 2.71 0.16 0.24 0.04 -1.26 0.11 135.00 138.29 3g1z s PRO 55 Ca 0.09 0.51 -0.16 0.00 0.04 0.00 0.00 61.00 61.48 3g1z s PRO 55 Cb -0.18 -2.00 -0.07 0.00 0.04 0.00 0.00 34.50 32.29 3g1z s PRO 55 CO -0.16 -1.15 0.60 -0.06 0.04 0.00 0.00 177.00 176.27 3g1z s PHE 56 N -3.31 3.64 0.05 0.56 0.08 -1.26 -4.58 117.98 113.16 3g1z s PHE 56 Ca 0.59 1.18 0.09 0.00 0.12 0.00 0.00 56.93 58.91 3g1z s PHE 56 Cb -0.12 -2.46 -0.03 0.00 -0.57 0.00 0.00 43.02 39.84 3g1z s PHE 56 CO 0.52 0.42 -0.24 -2.00 -0.10 0.00 0.00 175.22 173.82 3g1z s GLU 57 N -1.86 1.61 0.03 0.44 2.12 -1.26 -0.95 118.70 118.82 3g1z s GLU 57 Ca 0.38 -1.06 -0.15 0.00 0.36 0.00 0.00 54.97 54.50 3g1z s GLU 57 Cb -0.16 -1.78 0.02 0.00 0.26 0.00 0.00 34.13 32.47 3g1z s GLU 57 CO 0.20 0.46 0.33 -0.08 -0.54 0.00 0.00 175.26 175.63 3g1z s THR 58 N -0.82 0.07 -0.22 -1.70 -1.32 -0.31 -5.00 115.64 106.34 3g1z s THR 58 Ca 0.10 -0.57 -0.10 0.00 -1.21 0.00 0.00 61.69 59.91 3g1z s THR 58 Cb -0.10 -0.86 -0.05 0.00 -1.51 0.00 0.00 72.50 69.98 3g1z s THR 58 CO 0.02 -0.31 0.14 -0.60 -2.21 0.00 0.00 174.62 171.65 3g1z s ARG 59 N -2.20 4.12 -0.13 7.08 6.06 -1.26 -0.54 118.95 132.08 3g1z s ARG 59 Ca -0.07 -0.25 -0.05 0.00 -2.50 0.00 0.00 55.73 52.86 3g1z s ARG 59 Cb -0.02 -3.46 -0.04 0.00 0.06 0.00 0.00 34.95 31.50 3g1z s ARG 59 CO -0.01 0.20 0.04 0.12 -2.50 0.00 0.00 175.30 173.14 3g1z s PHE 60 N 0.66 3.23 0.33 5.12 5.36 0.07 -4.95 117.98 127.80 3g1z s PHE 60 Ca 0.08 0.13 0.06 0.00 -0.96 0.00 0.00 56.93 56.24 3g1z s PHE 60 Cb -0.12 -1.93 0.73 0.00 -0.34 0.00 0.00 43.02 41.35 3g1z s PHE 60 CO 0.01 0.33 1.87 -0.39 -1.46 0.00 0.00 175.22 175.57 3g1z h VAL 61 N 4.52 0.88 0.00 3.12 -1.51 -1.94 0.84 116.25 122.16 3g1z h VAL 61 Ca -0.44 -0.27 0.00 0.00 -1.23 0.00 0.00 66.70 64.76 3g1z h VAL 61 Cb 1.19 0.02 0.00 0.00 -2.13 0.00 0.00 31.29 30.36 3g1z h VAL 61 CO 0.62 0.15 0.00 0.61 -1.23 0.00 0.00 177.57 177.71 3g1z n GLY 62 N -1.41 -2.63 0.20 5.19 0.00 -1.26 -1.81 105.19 103.48 3g1z n GLY 62 Ca 0.17 -1.67 0.10 0.00 0.00 0.00 0.00 46.02 44.62 3g1z n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3g1z h PRO 63 N 0.00 0.00 -7.49 1.61 0.13 -2.03 -3.47 132.00 120.75 3g1z h PRO 63 Ca 0.00 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.69 3g1z h PRO 63 Cb 0.00 0.00 0.16 0.00 0.13 0.00 0.00 31.00 31.29 3g1z h PRO 63 CO 0.00 0.15 0.24 1.14 -0.23 0.00 0.00 178.00 179.30 3g1z s GLN 67 N -3.21 0.10 1.02 0.86 0.00 -1.26 -5.18 119.66 111.99 3g1z s GLN 67 Ca 0.05 0.10 -0.18 0.00 -0.00 0.00 0.00 55.36 55.33 3g1z s GLN 67 Cb 0.06 -1.74 -0.03 0.00 0.00 0.00 0.00 33.01 31.31 3g1z s GLN 67 CO 0.68 -2.86 -0.33 0.41 0.00 0.00 0.00 175.29 173.19 3g1z n GLY 68 N -1.81 -2.91 2.95 2.60 0.00 -0.75 -4.98 105.19 100.30 3g1z n GLY 68 Ca 0.10 -0.66 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 3g1z n GLY 68 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g1z s ILE 69 N -2.19 -0.02 -0.05 -0.61 1.01 0.29 -4.89 121.20 114.74 3g1z s ILE 69 Ca 0.49 0.06 -0.30 0.00 0.00 0.00 0.00 60.65 60.90 3g1z s ILE 69 Cb -0.12 -0.16 -0.02 0.00 0.01 0.00 0.00 42.46 42.16 3g1z s ILE 69 CO 0.70 0.02 1.03 0.20 0.00 0.00 0.00 174.94 176.90 3g1z s ASN 70 N 0.38 7.26 0.05 3.58 0.01 -1.26 -0.75 114.94 124.20 3g1z s ASN 70 Ca -0.03 1.64 0.05 0.00 -0.71 0.00 0.00 52.86 53.81 3g1z s ASN 70 Cb -0.04 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 39.02 3g1z s ASN 70 CO -0.01 -0.40 -0.06 -0.76 -1.51 0.00 0.00 177.10 174.36 3g1z s LEU 71 N 1.63 3.23 0.01 0.60 1.43 0.30 -4.59 118.68 121.27 3g1z s LEU 71 Ca 0.51 -0.21 0.05 0.00 -1.03 0.00 0.00 54.13 53.45 3g1z s LEU 71 Cb -0.21 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 3g1z s LEU 71 CO 0.23 0.23 -0.15 -0.31 0.23 0.00 0.00 176.35 176.58 3g1z s TYR 72 N -1.14 2.67 0.42 0.29 1.51 0.83 -1.16 117.35 120.76 3g1z s TYR 72 Ca 0.21 -0.18 -0.19 0.00 -1.01 0.00 0.00 57.07 55.89 3g1z s TYR 72 Cb -0.11 -1.54 -0.10 0.00 -0.11 0.00 0.00 41.96 40.09 3g1z s TYR 72 CO 0.12 0.25 0.91 -0.51 -1.11 0.00 0.00 175.55 175.21 3g1z s LEU 73 N -1.21 3.91 -0.16 -1.29 1.43 -0.12 -0.93 118.68 120.31 3g1z s LEU 73 Ca 0.14 1.57 -0.24 0.00 -1.03 0.00 0.00 54.13 54.57 3g1z s LEU 73 Cb -0.11 -4.43 -0.02 0.00 0.03 0.00 0.00 46.19 41.66 3g1z s LEU 73 CO 0.04 -0.37 0.79 -0.04 0.23 0.00 0.00 176.35 177.00 3g1z s MET 74 N -3.30 4.30 0.29 1.70 -1.94 0.99 -4.56 119.30 116.79 3g1z s MET 74 Ca 0.60 0.94 0.06 0.00 -1.71 0.00 0.00 55.69 55.58 3g1z s MET 74 Cb -0.09 -3.56 0.45 0.00 2.01 0.00 0.00 34.83 33.63 3g1z s MET 74 CO 0.17 -0.26 1.70 1.79 -0.01 0.00 0.00 175.02 178.41 3g1z h THR 75 N 5.13 1.30 -3.20 2.05 1.35 -1.90 0.19 112.91 117.83 3g1z h THR 75 Ca -0.31 -1.49 -0.04 0.00 -0.55 0.00 0.00 66.41 64.02 3g1z h THR 75 Cb 1.14 1.64 -0.13 0.00 -1.73 0.00 0.00 68.15 69.07 3g1z h THR 75 CO 0.81 0.45 0.02 -0.94 -0.25 0.00 0.00 175.52 175.61 3g1z s SER 76 N -6.87 -0.36 0.00 5.36 1.04 -1.26 -4.36 113.70 107.25 3g1z s SER 76 Ca -0.05 -0.16 0.02 0.00 0.48 0.00 0.00 55.95 56.25 3g1z s SER 76 Cb 0.13 0.51 0.15 0.00 0.10 0.00 0.00 66.02 66.91 3g1z s SER 76 CO 0.77 -0.87 1.08 -0.81 0.98 0.00 0.00 173.24 174.39 3g1z n PRO 77 N -0.18 0.98 -0.11 4.02 -0.04 -1.26 -4.53 135.00 133.87 3g1z n PRO 77 Ca -0.17 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.22 3g1z n PRO 77 Cb 0.64 -1.04 -0.01 0.00 -0.04 0.00 0.00 33.50 33.05 3g1z n PRO 77 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3g1z h GLU 78 N 0.00 -0.23 -0.51 0.54 4.81 -1.98 -1.35 114.58 115.85 3g1z h GLU 78 Ca 0.00 0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 3g1z h GLU 78 Cb 0.00 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 3g1z h GLU 78 CO 0.00 -0.15 -0.05 1.88 -0.73 0.00 0.00 179.01 179.96 3g1z h TYR 79 N -0.23 0.99 -0.11 0.92 -1.99 -2.00 0.34 116.97 114.89 3g1z h TYR 79 Ca 0.18 -0.17 -0.20 0.00 2.00 0.00 0.00 58.73 60.54 3g1z h TYR 79 Cb 0.52 -0.26 0.00 0.00 2.00 0.00 0.00 36.73 38.99 3g1z h TYR 79 CO -0.51 0.91 -0.74 0.45 -0.00 0.00 0.00 178.16 178.27 3g1z h HIS 80 N 0.83 0.74 -0.12 4.88 3.86 -1.82 -2.39 115.15 121.13 3g1z h HIS 80 Ca 0.15 -0.32 -0.11 0.00 -1.16 0.00 0.00 60.37 58.93 3g1z h HIS 80 Cb 0.56 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 3g1z h HIS 80 CO 0.03 1.11 -0.39 0.52 0.86 0.00 0.00 177.93 180.06 3g1z h MET 81 N 0.38 0.26 -0.44 2.45 2.86 -0.95 -1.48 114.93 118.02 3g1z h MET 81 Ca -0.04 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.40 3g1z h MET 81 Cb 1.33 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.97 3g1z h MET 81 CO 0.14 0.62 -0.06 0.87 1.06 0.00 0.00 176.91 179.54 3g1z h LYS 82 N 0.22 0.75 -0.46 1.72 1.57 -0.86 -0.00 116.57 119.51 3g1z h LYS 82 Ca 0.02 -0.22 -0.03 0.00 -1.87 0.00 0.00 60.65 58.55 3g1z h LYS 82 Cb 0.80 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 3g1z h LYS 82 CO 0.06 0.80 0.19 0.00 -0.57 0.00 0.00 179.45 179.93 3g1z h ARG 83 N 0.69 0.69 -0.25 3.15 3.08 -1.01 0.74 114.38 121.47 3g1z h ARG 83 Ca 0.13 -0.12 0.01 0.00 0.07 0.00 0.00 59.98 60.06 3g1z h ARG 83 Cb 0.51 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 3g1z h ARG 83 CO 0.03 0.62 0.14 -0.07 -1.07 0.00 0.00 179.97 179.62 3g1z h LEU 84 N 0.60 0.23 -0.52 3.04 3.38 -1.14 -1.91 115.31 118.98 3g1z h LEU 84 Ca 0.15 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.18 3g1z h LEU 84 Cb 0.19 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 3g1z h LEU 84 CO -0.01 0.17 0.24 -0.07 0.09 0.00 0.00 178.44 178.86 3g1z h LEU 85 N 0.29 0.32 -1.78 1.67 3.38 -0.66 -0.87 115.31 117.66 3g1z h LEU 85 Ca 0.10 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3g1z h LEU 85 Cb 0.00 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 3g1z h LEU 85 CO -0.05 0.22 -0.14 0.00 0.09 0.00 0.00 178.44 178.56 3g1z h ALA 86 N 1.30 1.66 -0.01 1.53 0.00 -0.68 -1.77 119.26 121.30 3g1z h ALA 86 Ca 0.24 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3g1z h ALA 86 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3g1z h ALA 86 CO -0.19 0.17 -0.02 0.00 0.00 0.00 0.00 179.25 179.21 3g1z n ALA 87 N -2.46 2.66 0.00 0.00 0.00 -0.40 -4.84 120.51 115.47 3g1z n ALA 87 Ca -0.02 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.12 3g1z n ALA 87 Cb 0.21 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.30 3g1z n ALA 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g1z n GLY 88 N 1.12 1.17 0.37 0.00 0.00 -0.66 -5.01 105.19 102.17 3g1z n GLY 88 Ca 0.20 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.37 3g1z n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1z n GLY 90 N -1.38 -1.96 3.70 0.00 0.00 -1.26 -4.86 105.19 99.43 3g1z n GLY 90 Ca 0.22 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 44.42 3g1z n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3g1z s PRO 91 N 0.00 4.16 0.01 1.61 0.04 -1.26 -4.87 135.00 134.68 3g1z s PRO 91 Ca 0.00 2.49 -0.01 0.00 0.04 0.00 0.00 61.00 63.52 3g1z s PRO 91 Cb 0.00 -3.46 -0.01 0.00 0.04 0.00 0.00 34.50 31.08 3g1z s PRO 91 CO 0.00 -0.76 0.01 0.14 0.04 0.00 0.00 177.00 176.42 3g1z s VAL 92 N 2.25 0.06 0.31 -0.36 -7.23 -1.11 -1.79 120.40 112.53 3g1z s VAL 92 Ca 0.76 -0.52 0.11 0.00 -1.81 0.00 0.00 61.98 60.52 3g1z s VAL 92 Cb -0.44 -0.19 -0.06 0.00 0.56 0.00 0.00 36.38 36.25 3g1z s VAL 92 CO 0.34 -0.29 -0.15 0.72 -0.31 0.00 0.00 175.10 175.42 3g1z s PHE 93 N -0.86 2.33 -0.04 2.82 -0.71 -0.00 -1.54 117.98 119.97 3g1z s PHE 93 Ca -0.09 -0.42 -0.03 0.00 -1.04 0.00 0.00 56.93 55.34 3g1z s PHE 93 Cb -0.06 -1.18 0.02 0.00 -1.21 0.00 0.00 43.02 40.59 3g1z s PHE 93 CO -0.00 0.64 0.10 -1.14 -1.34 0.00 0.00 175.22 173.48 3g1z s GLN 94 N -3.57 0.10 -0.47 1.99 0.74 0.21 -0.93 119.66 117.73 3g1z s GLN 94 Ca 0.31 0.18 -0.03 0.00 0.05 0.00 0.00 55.36 55.87 3g1z s GLN 94 Cb -0.01 -0.01 0.12 0.00 1.10 0.00 0.00 33.01 34.21 3g1z s GLN 94 CO 0.15 -0.05 0.27 -0.51 -0.55 0.00 0.00 175.29 174.61 3g1z s LEU 95 N 0.33 5.28 0.27 3.68 1.43 -1.26 -1.57 118.68 126.84 3g1z s LEU 95 Ca -0.02 -2.25 0.08 0.00 -1.03 0.00 0.00 54.13 50.91 3g1z s LEU 95 Cb -0.04 -1.85 -0.05 0.00 0.03 0.00 0.00 46.19 44.28 3g1z s LEU 95 CO -0.01 -0.51 -0.10 0.00 0.23 0.00 0.00 176.35 175.96 3g1z s ARG 97 N -3.67 4.50 0.24 0.00 6.06 -1.26 -0.89 118.95 123.93 3g1z s ARG 97 Ca 0.28 1.19 0.10 0.00 -2.50 0.00 0.00 55.73 54.81 3g1z s ARG 97 Cb 0.02 -3.46 -0.04 0.00 0.06 0.00 0.00 34.95 31.52 3g1z s ARG 97 CO 0.11 -0.02 -0.10 -1.12 -2.50 0.00 0.00 175.30 171.67 3g1z s SER 98 N 0.93 4.13 -0.06 -2.12 0.01 0.44 -4.90 113.70 112.13 3g1z s SER 98 Ca 0.46 -0.75 -0.01 0.00 1.31 0.00 0.00 55.95 56.96 3g1z s SER 98 Cb -0.19 -0.62 0.03 0.00 0.21 0.00 0.00 66.02 65.44 3g1z s SER 98 CO 0.23 0.05 0.02 -0.36 0.41 0.00 0.00 173.24 173.59 3g1z s PHE 99 N -2.16 0.50 -0.06 2.43 0.40 0.66 -1.39 117.98 118.36 3g1z s PHE 99 Ca 0.28 -0.05 -0.01 0.00 -0.60 0.00 0.00 56.93 56.56 3g1z s PHE 99 Cb -0.07 -0.70 0.03 0.00 0.51 0.00 0.00 43.02 42.79 3g1z s PHE 99 CO 0.17 -0.28 -0.02 1.03 0.70 0.00 0.00 175.22 176.82 3g1z s ARG 100 N 1.96 0.71 -1.26 0.44 0.52 -0.09 -3.28 118.95 117.95 3g1z s ARG 100 Ca 0.04 0.02 -0.20 0.00 -0.52 0.00 0.00 55.73 55.08 3g1z s ARG 100 Cb -0.12 -0.94 0.01 0.00 0.52 0.00 0.00 34.95 34.42 3g1z s ARG 100 CO -0.04 -0.23 1.81 1.21 0.02 0.00 0.00 175.30 178.06 3g1z s ASN 101 N 1.60 6.19 -0.04 0.23 3.84 0.31 -4.44 114.94 122.64 3g1z s ASN 101 Ca -0.00 -2.16 -0.06 0.00 0.21 0.00 0.00 52.86 50.84 3g1z s ASN 101 Cb -0.13 -2.58 0.01 0.00 -0.55 0.00 0.00 41.25 38.00 3g1z s ASN 101 CO -0.04 -1.86 0.16 -1.83 -2.79 0.00 0.00 177.10 170.74 3g1z s GLU 102 N 5.03 0.30 0.69 0.43 -1.05 -1.26 -4.73 118.70 118.11 3g1z s GLU 102 Ca 0.59 0.02 -0.17 0.00 -0.15 0.00 0.00 54.97 55.26 3g1z s GLU 102 Cb 0.02 0.13 -0.03 0.00 -0.44 0.00 0.00 34.13 33.81 3g1z s GLU 102 CO 0.10 -0.05 0.68 -0.85 0.95 0.00 0.00 175.26 176.08 3g1z n GLU 103 N 2.46 0.43 -2.06 -4.83 0.28 -1.26 -4.08 120.64 111.59 3g1z n GLU 103 Ca -0.16 0.19 -0.40 0.00 -0.16 0.00 0.00 57.16 56.63 3g1z n GLU 103 Cb 0.58 -1.94 -0.01 0.00 1.43 0.00 0.00 31.44 31.50 3g1z n GLU 103 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 177.13 178.38 3g1z s MET 104 N -2.81 4.06 0.28 3.44 -2.45 -1.26 -4.70 119.30 115.86 3g1z s MET 104 Ca 0.69 2.18 0.01 0.00 -1.25 0.00 0.00 55.69 57.33 3g1z s MET 104 Cb -0.37 -2.83 -0.03 0.00 1.25 0.00 0.00 34.83 32.85 3g1z s MET 104 CO 0.54 -0.43 0.28 0.20 1.05 0.00 0.00 175.02 176.66 3g1z s GLY 105 N -0.66 1.75 0.38 2.11 0.00 -0.16 -4.94 107.32 105.80 3g1z s GLY 105 Ca 0.55 -1.76 0.16 0.00 0.00 0.00 0.00 44.72 43.67 3g1z s GLY 105 CO 0.50 -1.30 1.77 3.21 0.00 0.00 0.00 173.10 177.28 3g1z h ARG 106 N 2.31 0.44 -0.17 2.90 -0.00 -1.96 -2.94 114.38 114.95 3g1z h ARG 106 Ca -0.29 -0.03 0.00 0.00 -0.50 0.00 0.00 59.98 59.16 3g1z h ARG 106 Cb 1.24 -0.10 0.00 0.00 0.00 0.00 0.00 29.97 31.11 3g1z h ARG 106 CO 0.42 0.29 0.00 0.72 0.00 0.00 0.00 179.97 181.40 3g1z n HIS 107 N -4.67 0.23 -4.11 3.04 8.25 -1.26 -1.80 115.22 114.89 3g1z n HIS 107 Ca 0.25 -0.49 -0.15 0.00 -0.26 0.00 0.00 57.72 57.07 3g1z n HIS 107 Cb 0.83 -0.04 -0.14 0.00 1.12 0.00 0.00 29.99 31.76 3g1z n HIS 107 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3g1z s HIS 108 N -0.99 0.45 0.02 4.41 3.76 -1.11 -4.98 115.29 116.84 3g1z s HIS 108 Ca 0.12 -0.14 0.03 0.00 -0.15 0.00 0.00 55.06 54.91 3g1z s HIS 108 Cb 0.06 -0.28 -0.01 0.00 1.11 0.00 0.00 32.58 33.45 3g1z s HIS 108 CO 0.08 -0.02 -0.09 1.21 -0.85 0.00 0.00 174.74 175.07 3g1z s ASN 109 N -0.34 1.00 0.63 1.40 2.47 -1.26 -0.99 114.94 117.85 3g1z s ASN 109 Ca -0.00 -0.31 0.40 0.00 0.42 0.00 0.00 52.86 53.37 3g1z s ASN 109 Cb -0.03 -0.06 2.08 0.00 -1.45 0.00 0.00 41.25 41.80 3g1z s ASN 109 CO -0.00 -0.01 2.26 1.55 -3.72 0.00 0.00 177.10 177.18 3g1z h PRO 110 N 5.34 0.00 -5.57 0.43 0.13 -1.78 -3.38 132.00 127.17 3g1z h PRO 110 Ca -0.33 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.18 3g1z h PRO 110 Cb 1.19 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 32.00 3g1z h PRO 110 CO 0.46 0.01 -0.86 -1.83 -0.23 0.00 0.00 178.00 175.55 3g1z s GLU 111 N -4.07 2.17 0.13 0.86 -1.05 -1.26 -0.92 118.70 114.56 3g1z s GLU 111 Ca -0.03 -0.74 -0.12 0.00 -0.15 0.00 0.00 54.97 53.92 3g1z s GLU 111 Cb 0.12 -1.84 0.01 0.00 -0.44 0.00 0.00 34.13 31.98 3g1z s GLU 111 CO 0.46 0.29 0.32 -0.59 0.95 0.00 0.00 175.26 176.69 3g1z s PHE 112 N -0.00 0.03 -0.17 4.83 -0.71 -0.48 -4.97 117.98 116.51 3g1z s PHE 112 Ca -0.05 -0.40 -0.20 0.00 -1.04 0.00 0.00 56.93 55.23 3g1z s PHE 112 Cb -0.13 0.10 -0.03 0.00 -1.21 0.00 0.00 43.02 41.75 3g1z s PHE 112 CO 0.03 -0.67 0.60 0.99 -1.34 0.00 0.00 175.22 174.84 3g1z s THR 113 N -3.86 5.06 -0.11 -4.49 2.01 -1.26 -0.42 115.64 112.56 3g1z s THR 113 Ca 0.07 1.16 -0.03 0.00 0.31 0.00 0.00 61.69 63.20 3g1z s THR 113 Cb 0.03 -3.93 -0.03 0.00 0.01 0.00 0.00 72.50 68.58 3g1z s THR 113 CO -0.09 0.17 -0.00 -0.32 -0.69 0.00 0.00 174.62 173.68 3g1z s MET 114 N 1.56 3.26 -0.35 4.92 1.75 -0.07 -1.96 119.30 128.41 3g1z s MET 114 Ca 0.29 -0.43 -0.10 0.00 -1.25 0.00 0.00 55.69 54.19 3g1z s MET 114 Cb -0.16 -2.87 0.02 0.00 2.84 0.00 0.00 34.83 34.66 3g1z s MET 114 CO 0.11 0.54 0.18 -1.17 -0.65 0.00 0.00 175.02 174.03 3g1z s LEU 115 N -0.42 4.48 -0.06 4.11 2.96 -0.32 -1.51 118.68 127.91 3g1z s LEU 115 Ca 0.08 -0.83 0.06 0.00 -0.22 0.00 0.00 54.13 53.22 3g1z s LEU 115 Cb -0.12 -2.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.55 3g1z s LEU 115 CO 0.02 -0.31 -0.24 -0.70 -1.32 0.00 0.00 176.35 173.80 3g1z s GLU 116 N 1.57 2.64 0.04 1.98 2.12 -0.61 -0.22 118.70 126.22 3g1z s GLU 116 Ca 0.03 -0.89 -0.01 0.00 0.36 0.00 0.00 54.97 54.46 3g1z s GLU 116 Cb -0.18 -2.20 -0.03 0.00 0.26 0.00 0.00 34.13 31.97 3g1z s GLU 116 CO 0.06 0.36 -0.02 1.67 -0.54 0.00 0.00 175.26 176.79 3g1z s TRP 117 N -0.10 0.44 -0.02 5.30 -2.14 -0.62 -0.62 118.94 121.17 3g1z s TRP 117 Ca -0.05 -0.91 0.03 0.00 2.66 0.00 0.00 56.10 57.83 3g1z s TRP 117 Cb -0.14 -0.33 -0.00 0.00 -3.10 0.00 0.00 33.47 29.90 3g1z s TRP 117 CO 0.04 -0.34 -0.11 0.71 -2.66 0.00 0.00 176.95 174.60 3g1z s TYR 118 N -3.26 1.09 -0.36 1.66 1.51 -0.59 -1.44 117.35 115.95 3g1z s TYR 118 Ca 0.01 -0.26 0.01 0.00 -1.01 0.00 0.00 57.07 55.82 3g1z s TYR 118 Cb 0.03 -0.74 0.11 0.00 -0.11 0.00 0.00 41.96 41.25 3g1z s TYR 118 CO -0.08 -0.08 0.13 1.03 -1.11 0.00 0.00 175.55 175.44 3g1z s ARG 119 N 0.03 1.07 0.31 -0.62 1.81 0.35 -2.77 118.95 119.14 3g1z s ARG 119 Ca -0.01 -1.54 -0.29 0.00 -1.72 0.00 0.00 55.73 52.17 3g1z s ARG 119 Cb -0.08 -2.40 -0.12 0.00 -0.45 0.00 0.00 34.95 31.89 3g1z s ARG 119 CO 0.00 -1.02 1.37 -2.30 -0.68 0.00 0.00 175.30 172.68 3g1z n PRO 120 N 4.33 2.20 -0.93 3.54 -0.02 -1.26 -2.13 135.00 140.73 3g1z n PRO 120 Ca 0.02 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 3g1z n PRO 120 Cb 0.40 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3g1z n PRO 120 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3g1z n HIS 121 N 1.03 0.00 -3.44 6.00 8.25 0.24 -4.95 115.22 122.35 3g1z n HIS 121 Ca 0.07 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.16 3g1z n HIS 121 Cb 0.35 -1.15 -0.06 0.00 1.12 0.00 0.00 29.99 30.24 3g1z n HIS 121 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3g1z s TYR 122 N -1.56 3.53 0.92 4.41 1.51 -1.05 -5.04 117.35 120.06 3g1z s TYR 122 Ca 0.00 0.78 -0.14 0.00 -1.01 0.00 0.00 57.07 56.70 3g1z s TYR 122 Cb 0.00 -2.41 0.18 0.00 -0.11 0.00 0.00 41.96 39.61 3g1z s TYR 122 CO 0.00 0.29 1.27 0.16 -1.11 0.00 0.00 175.55 176.16 3g1z s ASP 123 N 0.24 3.42 0.27 2.29 1.47 -1.26 -3.26 116.67 119.85 3g1z s ASP 123 Ca 0.22 0.28 -0.01 0.00 1.18 0.00 0.00 52.55 54.22 3g1z s ASP 123 Cb -0.14 -0.42 0.45 0.00 -0.34 0.00 0.00 42.92 42.47 3g1z s ASP 123 CO 0.08 -2.54 1.87 -0.03 0.68 0.00 0.00 175.17 175.23 3g1z h MET 124 N -1.46 1.09 -0.28 2.11 1.85 -1.94 -1.90 114.93 114.39 3g1z h MET 124 Ca -0.44 -0.07 -0.09 0.00 -0.61 0.00 0.00 59.70 58.49 3g1z h MET 124 Cb 1.25 -0.25 -0.01 0.00 0.43 0.00 0.00 31.60 33.03 3g1z h MET 124 CO 0.42 0.72 -0.19 1.88 -0.40 0.00 0.00 176.91 179.34 3g1z h TYR 125 N 1.13 0.74 -0.48 1.39 -1.99 -1.99 -0.85 116.97 114.91 3g1z h TYR 125 Ca 0.45 -0.20 -0.04 0.00 2.00 0.00 0.00 58.73 60.94 3g1z h TYR 125 Cb 0.25 -0.16 -0.02 0.00 2.00 0.00 0.00 36.73 38.79 3g1z h TYR 125 CO -0.00 0.90 0.14 -0.09 -0.00 0.00 0.00 178.16 179.10 3g1z h ARG 126 N 0.37 0.72 -0.21 4.88 2.43 -1.88 -2.31 114.38 118.37 3g1z h ARG 126 Ca 0.06 -0.13 -0.08 0.00 -0.81 0.00 0.00 59.98 59.01 3g1z h ARG 126 Cb 0.73 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.16 3g1z h ARG 126 CO 0.05 0.64 -0.20 1.25 -1.51 0.00 0.00 179.97 180.21 3g1z h LEU 127 N 0.70 0.54 -0.66 3.80 5.85 -1.15 -2.40 115.31 122.00 3g1z h LEU 127 Ca 0.16 -0.47 0.12 0.00 0.84 0.00 0.00 57.88 58.53 3g1z h LEU 127 Cb 0.23 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.03 3g1z h LEU 127 CO -0.01 0.90 0.22 0.24 -0.34 0.00 0.00 178.44 179.45 3g1z h MET 128 N 0.20 0.36 -0.77 1.25 2.86 -0.99 -0.29 114.93 117.55 3g1z h MET 128 Ca 0.04 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.70 3g1z h MET 128 Cb 0.74 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 32.27 3g1z h MET 128 CO 0.05 0.24 0.47 -0.97 1.06 0.00 0.00 176.91 177.76 3g1z h ASN 129 N 0.37 0.76 -0.67 1.22 -1.24 -1.30 -1.19 115.58 113.53 3g1z h ASN 129 Ca 0.35 0.01 -0.07 0.00 0.71 0.00 0.00 56.30 57.29 3g1z h ASN 129 Cb 0.49 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 39.36 3g1z h ASN 129 CO -0.37 0.51 0.15 -0.08 -1.29 0.00 0.00 177.43 176.35 3g1z h GLU 130 N 0.90 1.09 -0.47 6.67 4.81 -0.74 -1.92 114.58 124.92 3g1z h GLU 130 Ca 0.32 -0.27 0.02 0.00 -0.13 0.00 0.00 59.36 59.30 3g1z h GLU 130 Cb 0.08 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 3g1z h GLU 130 CO -0.14 0.98 0.28 0.28 -0.73 0.00 0.00 179.01 179.68 3g1z h VAL 131 N 1.01 1.04 -0.26 0.32 2.07 -0.74 -2.05 116.25 117.65 3g1z h VAL 131 Ca 0.21 -0.19 0.05 0.00 0.82 0.00 0.00 66.70 67.58 3g1z h VAL 131 Cb 0.39 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 3g1z h VAL 131 CO 0.01 0.10 -0.02 -0.78 0.02 0.00 0.00 177.57 176.90 3g1z h ASP 132 N 0.55 -0.14 -0.62 0.57 3.58 -0.99 -0.36 116.42 119.02 3g1z h ASP 132 Ca 0.19 0.06 0.08 0.00 0.42 0.00 0.00 57.03 57.78 3g1z h ASP 132 Cb 0.02 0.12 -0.06 0.00 1.72 0.00 0.00 39.33 41.13 3g1z h ASP 132 CO -0.09 -0.04 0.29 0.44 -2.88 0.00 0.00 179.24 176.96 3g1z h ASP 133 N 0.06 0.37 -0.50 2.28 3.32 -1.14 -0.23 116.42 120.57 3g1z h ASP 133 Ca 0.12 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 3g1z h ASP 133 Cb 0.17 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 3g1z h ASP 133 CO -0.22 0.23 0.20 0.25 -1.72 0.00 0.00 179.24 177.98 3g1z h LEU 134 N 0.52 0.68 -0.39 1.55 5.85 -0.60 -1.02 115.31 121.90 3g1z h LEU 134 Ca 0.30 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 3g1z h LEU 134 Cb 0.29 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 3g1z h LEU 134 CO -0.24 0.66 0.22 -0.07 -0.34 0.00 0.00 178.44 178.67 3g1z h LEU 135 N 0.66 0.48 -1.25 2.25 3.38 -0.70 -0.04 115.31 120.09 3g1z h LEU 135 Ca 0.17 -0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.14 3g1z h LEU 135 Cb 0.19 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.76 3g1z h LEU 135 CO -0.01 0.42 0.54 1.56 0.09 0.00 0.00 178.44 181.04 3g1z h GLN 136 N 0.51 0.85 -0.24 1.13 4.20 -0.93 0.17 115.11 120.80 3g1z h GLN 136 Ca 0.14 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 3g1z h GLN 136 Cb 0.03 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 3g1z h GLN 136 CO -0.02 0.56 -0.06 0.37 -0.67 0.00 0.00 178.83 179.01 3g1z h GLN 137 N 0.88 0.46 0.02 1.46 5.75 -0.36 -1.38 115.11 121.94 3g1z h GLN 137 Ca 0.37 -0.18 -0.04 0.00 -0.15 0.00 0.00 58.65 58.65 3g1z h GLN 137 Cb 0.30 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.83 3g1z h GLN 137 CO -0.14 0.69 -0.19 0.28 -2.65 0.00 0.00 178.83 176.83 3g1z h VAL 138 N 0.20 1.65 0.00 2.39 2.07 -0.85 -3.37 116.25 118.35 3g1z h VAL 138 Ca 0.06 -2.16 0.00 0.00 0.82 0.00 0.00 66.70 65.42 3g1z h VAL 138 Cb 0.52 3.09 0.00 0.00 -1.52 0.00 0.00 31.29 33.38 3g1z h VAL 138 CO 0.02 0.58 -0.60 0.18 0.02 0.00 0.00 177.57 177.77 3g1z n LEU 139 N -4.53 0.63 -3.93 2.57 4.77 0.59 -4.92 117.00 112.18 3g1z n LEU 139 Ca -0.10 0.17 -0.29 0.00 -0.03 0.00 0.00 56.01 55.76 3g1z n LEU 139 Cb 0.52 -0.20 0.01 0.00 -2.33 0.00 0.00 43.42 41.42 3g1z n LEU 139 CO 0.38 -0.01 0.01 -0.67 -1.33 0.00 0.00 177.39 175.77 3g1z n ASP 140 N -1.95 -3.34 -5.00 -1.43 4.64 -0.52 -4.97 116.55 103.99 3g1z n ASP 140 Ca 0.04 -0.85 -0.19 0.00 -1.38 0.00 0.00 54.79 52.41 3g1z n ASP 140 Cb 0.41 -3.64 0.04 0.00 -1.04 0.00 0.00 41.12 36.90 3g1z n ASP 140 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3g1z s GLN 142 N -4.58 3.29 0.38 0.00 -0.21 -1.26 -4.69 119.66 112.59 3g1z s GLN 142 Ca 0.59 1.13 -0.26 0.00 0.02 0.00 0.00 55.36 56.84 3g1z s GLN 142 Cb -0.08 -2.03 -0.12 0.00 1.00 0.00 0.00 33.01 31.79 3g1z s GLN 142 CO 0.37 -0.83 1.10 -2.30 -2.12 0.00 0.00 175.29 171.51 3g1z n PRO 143 N -2.22 1.59 -2.17 2.91 -0.02 -1.26 -4.52 135.00 129.30 3g1z n PRO 143 Ca 0.08 0.56 -0.36 0.00 -2.02 0.00 0.00 63.50 61.77 3g1z n PRO 143 Cb 0.53 -2.10 0.01 0.00 -0.02 0.00 0.00 33.50 31.92 3g1z n PRO 143 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g1z s ALA 144 N -1.18 2.72 0.35 3.55 0.00 -1.26 -4.79 121.76 121.15 3g1z s ALA 144 Ca 0.60 0.93 -0.04 0.00 0.00 0.00 0.00 51.96 53.45 3g1z s ALA 144 Cb -0.58 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.09 3g1z s ALA 144 CO 0.59 -0.89 0.61 -1.83 0.00 0.00 0.00 175.76 174.25 3g1z s GLU 145 N -3.15 3.58 -0.01 0.00 -1.05 -1.04 -5.00 118.70 112.04 3g1z s GLU 145 Ca 0.72 -0.02 0.01 0.00 -0.15 0.00 0.00 54.97 55.53 3g1z s GLU 145 Cb -0.28 -2.58 -0.00 0.00 -0.44 0.00 0.00 34.13 30.84 3g1z s GLU 145 CO 0.31 0.09 -0.04 -1.12 0.95 0.00 0.00 175.26 175.46 3g1z s SER 146 N -3.60 0.49 0.07 0.83 0.01 -1.26 -0.94 113.70 109.29 3g1z s SER 146 Ca 0.44 -0.07 -0.17 0.00 1.31 0.00 0.00 55.95 57.45 3g1z s SER 146 Cb -0.10 -0.07 0.04 0.00 0.21 0.00 0.00 66.02 66.09 3g1z s SER 146 CO 0.35 0.04 0.41 -1.48 0.41 0.00 0.00 173.24 172.97 3g1z s LEU 147 N 0.00 0.39 0.64 2.44 2.34 -0.39 -4.96 118.68 119.14 3g1z s LEU 147 Ca 0.00 -0.11 -0.11 0.00 0.06 0.00 0.00 54.13 53.97 3g1z s LEU 147 Cb -0.03 1.79 -0.02 0.00 -0.56 0.00 0.00 46.19 47.37 3g1z s LEU 147 CO -0.00 -0.74 1.04 -0.94 -1.06 0.00 0.00 176.35 174.65 3g1z s SER 148 N -2.30 5.96 0.30 1.48 1.04 -1.26 -1.79 113.70 117.12 3g1z s SER 148 Ca -0.02 1.47 0.05 0.00 0.48 0.00 0.00 55.95 57.93 3g1z s SER 148 Cb 0.00 -2.46 0.75 0.00 0.10 0.00 0.00 66.02 64.41 3g1z s SER 148 CO -0.06 -1.05 1.73 0.22 0.98 0.00 0.00 173.24 175.06 3g1z h TYR 149 N -0.45 0.86 -0.01 5.02 3.20 -0.68 -1.24 116.97 123.68 3g1z h TYR 149 Ca -0.44 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.47 3g1z h TYR 149 Cb 1.20 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 39.23 3g1z h TYR 149 CO 0.64 0.08 0.00 0.37 -1.64 0.00 0.00 178.16 177.61 3g1z h GLN 150 N 0.56 0.01 -0.87 1.82 4.15 -1.83 -2.41 115.11 116.55 3g1z h GLN 150 Ca 0.57 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.99 3g1z h GLN 150 Cb 1.02 -0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.66 3g1z h GLN 150 CO -0.46 0.19 0.54 1.96 -1.93 0.00 0.00 178.83 179.13 3g1z h GLN 151 N -0.16 1.17 -0.46 1.69 4.20 -1.77 -0.41 115.11 119.35 3g1z h GLN 151 Ca 0.00 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 3g1z h GLN 151 Cb 0.18 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 3g1z h GLN 151 CO -0.00 0.80 0.22 0.00 -0.67 0.00 0.00 178.83 179.18 3g1z h ALA 152 N 1.41 0.60 -0.68 3.87 0.00 -1.09 0.75 119.26 124.12 3g1z h ALA 152 Ca 0.31 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 3g1z h ALA 152 Cb -0.08 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 3g1z h ALA 152 CO -0.06 0.16 0.25 0.74 0.00 0.00 0.00 179.25 180.34 3g1z h PHE 153 N 0.60 1.06 -0.40 0.00 0.04 -1.09 -1.72 116.94 115.43 3g1z h PHE 153 Ca 0.16 -0.09 -0.03 0.00 2.80 0.00 0.00 57.97 60.81 3g1z h PHE 153 Cb 0.13 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 37.95 3g1z h PHE 153 CO -0.01 0.84 0.13 1.96 -0.60 0.00 0.00 178.31 180.63 3g1z h GLN 154 N 0.97 0.62 -0.01 1.51 4.20 -0.63 0.10 115.11 121.87 3g1z h GLN 154 Ca 0.22 -0.13 -0.19 0.00 0.06 0.00 0.00 58.65 58.61 3g1z h GLN 154 Cb 0.25 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 3g1z h GLN 154 CO -0.01 0.61 -0.84 0.00 -0.67 0.00 0.00 178.83 177.92 3g1z h ARG 155 N 0.50 0.22 0.00 1.46 3.08 -0.79 -2.30 114.38 116.56 3g1z h ARG 155 Ca 0.13 -0.23 -0.38 0.00 0.07 0.00 0.00 59.98 59.58 3g1z h ARG 155 Cb 0.24 0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.29 3g1z h ARG 155 CO -0.01 0.94 -2.40 0.72 -1.07 0.00 0.00 179.97 178.16 3g1z n HIS 156 N -3.70 0.06 0.13 3.04 8.25 -0.65 -4.64 115.22 117.70 3g1z n HIS 156 Ca -0.04 0.02 0.01 0.00 -0.26 0.00 0.00 57.72 57.46 3g1z n HIS 156 Cb 0.78 -1.01 0.01 0.00 1.12 0.00 0.00 29.99 30.89 3g1z n HIS 156 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3g1z n LEU 157 N -2.98 1.07 -3.01 2.41 4.77 -0.03 -5.01 117.00 114.21 3g1z n LEU 157 Ca -0.38 -0.92 -0.20 0.00 -0.03 0.00 0.00 56.01 54.49 3g1z n LEU 157 Cb 1.09 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.18 3g1z n LEU 157 CO 0.36 0.24 -0.07 -0.62 -1.33 0.00 0.00 177.39 175.98 3g1z n GLU 158 N -0.03 -3.36 -4.22 3.23 4.71 -0.86 -4.96 120.64 115.16 3g1z n GLU 158 Ca 0.02 0.62 -0.15 0.00 -0.01 0.00 0.00 57.16 57.64 3g1z n GLU 158 Cb 0.07 -5.33 -0.10 0.00 -1.01 0.00 0.00 31.44 25.07 3g1z n GLU 158 CO 0.00 0.00 0.00 0.96 0.09 0.00 0.00 177.13 178.18 3g1z s ILE 159 N -2.90 1.08 -0.41 -3.67 -4.36 -1.15 -4.95 121.20 104.84 3g1z s ILE 159 Ca 0.26 -1.85 -0.15 0.00 -0.26 0.00 0.00 60.65 58.65 3g1z s ILE 159 Cb -0.13 -1.61 0.03 0.00 1.25 0.00 0.00 42.46 41.99 3g1z s ILE 159 CO 0.32 -0.64 0.30 -0.62 0.24 0.00 0.00 174.94 174.54 3g1z s ASP 160 N -2.79 6.07 0.06 4.36 -1.08 -1.26 -2.25 116.67 119.77 3g1z s ASP 160 Ca 0.11 -0.97 0.19 0.00 -0.52 0.00 0.00 52.55 51.37 3g1z s ASP 160 Cb -0.00 -2.14 0.80 0.00 -1.46 0.00 0.00 42.92 40.12 3g1z s ASP 160 CO 0.00 -0.47 1.61 -0.81 0.52 0.00 0.00 175.17 176.03 3g1z n PRO 161 N 5.14 0.05 0.01 4.34 -0.04 -1.26 -0.28 135.00 142.97 3g1z n PRO 161 Ca -0.11 0.24 0.11 0.00 -0.04 0.00 0.00 63.50 63.70 3g1z n PRO 161 Cb 0.46 -1.59 0.08 0.00 -0.04 0.00 0.00 33.50 32.42 3g1z n PRO 161 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3g1z n LEU 162 N -1.69 0.65 0.00 1.53 4.77 -1.26 -4.50 117.00 116.50 3g1z n LEU 162 Ca 0.04 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3g1z n LEU 162 Cb 0.22 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3g1z n LEU 162 CO 0.18 0.11 -0.02 -1.54 -1.33 0.00 0.00 177.39 174.79 3g1z n SER 163 N -1.71 0.16 -4.74 -1.43 3.41 -1.02 -5.09 113.62 103.20 3g1z n SER 163 Ca 0.04 -0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.23 3g1z n SER 163 Cb 0.38 0.04 -0.02 0.00 -0.26 0.00 0.00 64.21 64.35 3g1z n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g1z s ALA 164 N -0.07 3.71 0.89 7.33 0.00 0.62 -5.01 121.76 129.22 3g1z s ALA 164 Ca 0.00 1.44 -0.14 0.00 0.00 0.00 0.00 51.96 53.26 3g1z s ALA 164 Cb 0.00 -3.61 0.14 0.00 0.00 0.00 0.00 23.12 19.66 3g1z s ALA 164 CO 0.00 -0.84 1.25 0.16 0.00 0.00 0.00 175.76 176.33 3g1z s ASP 165 N 0.57 3.79 0.27 0.00 1.47 -1.26 -4.82 116.67 116.69 3g1z s ASP 165 Ca 0.63 0.50 -0.01 0.00 1.18 0.00 0.00 52.55 54.85 3g1z s ASP 165 Cb -0.45 -0.76 0.38 0.00 -0.34 0.00 0.00 42.92 41.76 3g1z s ASP 165 CO 0.42 -2.33 1.80 0.11 0.68 0.00 0.00 175.17 175.85 3g1z h LYS 166 N -1.35 0.79 -0.20 2.11 1.57 -1.98 -0.63 116.57 116.87 3g1z h LYS 166 Ca -0.45 -0.18 0.01 0.00 -1.87 0.00 0.00 60.65 58.16 3g1z h LYS 166 Cb 1.28 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 3g1z h LYS 166 CO 0.51 0.76 0.09 1.15 -0.57 0.00 0.00 179.45 181.39 3g1z h THR 167 N 0.75 0.99 -0.91 -0.16 2.02 -1.99 0.13 112.91 113.74 3g1z h THR 167 Ca 0.16 -0.07 0.07 0.00 0.77 0.00 0.00 66.41 67.34 3g1z h THR 167 Cb 0.37 0.77 -0.07 0.00 -1.74 0.00 0.00 68.15 67.48 3g1z h THR 167 CO 0.01 0.04 0.57 1.56 0.37 0.00 0.00 175.52 178.07 3g1z h GLN 168 N 0.21 0.98 -0.25 6.66 4.20 -1.80 -1.40 115.11 123.71 3g1z h GLN 168 Ca 0.08 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.67 3g1z h GLN 168 Cb 0.02 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 3g1z h GLN 168 CO -0.06 0.65 -0.11 -0.07 -0.67 0.00 0.00 178.83 178.57 3g1z h LEU 169 N 1.01 0.52 -0.86 1.46 4.07 -0.72 -2.84 115.31 117.95 3g1z h LEU 169 Ca 0.41 -0.40 -0.05 0.00 0.08 0.00 0.00 57.88 57.91 3g1z h LEU 169 Cb 0.23 -0.14 -0.03 0.00 1.08 0.00 0.00 40.66 41.79 3g1z h LEU 169 CO -0.19 0.81 0.22 0.03 -1.08 0.00 0.00 178.44 178.22 3g1z h ARG 170 N 0.24 1.06 -0.05 1.13 3.08 -0.47 -0.57 114.38 118.79 3g1z h ARG 170 Ca 0.06 -0.22 -0.05 0.00 0.07 0.00 0.00 59.98 59.84 3g1z h ARG 170 Cb 0.61 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 3g1z h ARG 170 CO 0.03 0.90 -0.22 0.93 -1.07 0.00 0.00 179.97 180.55 3g1z h GLU 171 N 1.02 0.08 -0.16 0.04 3.07 -1.27 0.22 114.58 117.58 3g1z h GLU 171 Ca 0.22 -0.02 -0.07 0.00 -0.50 0.00 0.00 59.36 58.99 3g1z h GLU 171 Cb 0.29 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.18 3g1z h GLU 171 CO -0.01 0.30 -0.18 0.00 -1.40 0.00 0.00 179.01 177.72 3g1z h ALA 172 N 1.70 0.24 -0.36 3.43 0.00 -1.18 -2.87 119.26 120.23 3g1z h ALA 172 Ca 0.01 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3g1z h ALA 172 Cb 0.43 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3g1z h ALA 172 CO 0.03 0.16 0.16 0.00 0.00 0.00 0.00 179.25 179.60 3g1z h ALA 173 N 0.61 1.61 -0.53 0.00 0.00 -0.76 -2.23 119.26 117.96 3g1z h ALA 173 Ca 0.02 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3g1z h ALA 173 Cb 0.73 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3g1z h ALA 173 CO 0.04 0.32 0.15 0.00 0.00 0.00 0.00 179.25 179.76 3g1z h ALA 174 N 1.68 1.26 0.00 0.00 0.00 -0.57 -1.97 119.26 119.66 3g1z h ALA 174 Ca 0.13 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3g1z h ALA 174 Cb 0.08 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3g1z h ALA 174 CO -0.02 0.52 0.00 0.87 0.00 0.00 0.00 179.25 180.62 3g1z h LYS 175 N 0.78 0.00 -0.34 0.00 1.57 -1.17 -2.69 116.57 114.72 3g1z h LYS 175 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3g1z h LYS 175 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3g1z h LYS 175 CO -0.01 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.15 3g1z n LEU 176 N -2.79 2.24 -3.06 2.94 4.77 -0.95 -4.94 117.00 115.21 3g1z n LEU 176 Ca 0.03 -1.04 -0.18 0.00 -0.03 0.00 0.00 56.01 54.79 3g1z n LEU 176 Cb 0.37 -0.22 0.07 0.00 -2.33 0.00 0.00 43.42 41.31 3g1z n LEU 176 CO 0.28 0.52 0.16 0.47 -1.33 0.00 0.00 177.39 177.49 3g1z n ASP 177 N 0.70 -4.13 0.00 -1.43 9.92 -1.01 -5.09 116.55 115.51 3g1z n ASP 177 Ca 0.16 -0.48 0.00 0.00 -0.53 0.00 0.00 54.79 53.94 3g1z n ASP 177 Cb 0.38 -4.31 0.00 0.00 -0.64 0.00 0.00 41.12 36.55 3g1z n ASP 177 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3g1z n LEU 178 N -3.99 0.00 0.00 0.64 4.32 -0.78 -5.05 117.00 112.14 3g1z n LEU 178 Ca -0.10 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.89 3g1z n LEU 178 Cb 0.59 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.39 3g1z n LEU 178 CO 0.53 0.00 0.00 1.21 -1.22 0.00 0.00 177.39 177.91 3g1z n GLU 185 N 0.00 0.00 -0.00 3.23 4.07 -1.26 -4.62 120.64 122.06 3g1z n GLU 185 Ca 0.00 0.00 0.07 0.00 -0.06 0.00 0.00 57.16 57.17 3g1z n GLU 185 Cb 0.00 0.00 -0.09 0.00 -0.06 0.00 0.00 31.44 31.29 3g1z n GLU 185 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 3g1z n GLU 186 N 0.85 1.94 -3.06 5.31 -0.58 -1.26 -4.92 120.64 118.92 3g1z n GLU 186 Ca 0.00 -0.03 -0.40 0.00 -0.42 0.00 0.00 57.16 56.31 3g1z n GLU 186 Cb 0.00 -1.20 -0.05 0.00 -0.57 0.00 0.00 31.44 29.62 3g1z n GLU 186 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3g1z s ASP 187 N -2.63 6.86 0.22 1.62 2.15 -1.26 -4.97 116.67 118.67 3g1z s ASP 187 Ca 0.03 1.04 -0.08 0.00 0.43 0.00 0.00 52.55 53.96 3g1z s ASP 187 Cb 0.10 -2.39 0.22 0.00 -0.30 0.00 0.00 42.92 40.55 3g1z s ASP 187 CO 0.58 -0.22 1.88 -0.09 -0.17 0.00 0.00 175.17 177.15 3g1z h ARG 188 N 7.12 1.02 -0.52 4.34 2.43 -1.99 -1.31 114.38 125.47 3g1z h ARG 188 Ca -0.35 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 58.64 3g1z h ARG 188 Cb 1.16 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 30.47 3g1z h ARG 188 CO 0.78 0.68 -0.12 0.22 -1.51 0.00 0.00 179.97 180.02 3g1z h ASP 189 N 1.05 1.01 -0.59 -3.80 3.58 -1.99 -0.74 116.42 114.94 3g1z h ASP 189 Ca 0.31 -0.36 -0.00 0.00 0.42 0.00 0.00 57.03 57.41 3g1z h ASP 189 Cb -0.05 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 40.70 3g1z h ASP 189 CO -0.09 1.13 0.36 0.74 -2.88 0.00 0.00 179.24 178.50 3g1z h THR 190 N 0.87 1.17 -0.42 2.25 2.02 -1.94 -0.71 112.91 116.14 3g1z h THR 190 Ca 0.13 -0.37 0.08 0.00 0.77 0.00 0.00 66.41 67.02 3g1z h THR 190 Cb 0.68 0.35 -0.07 0.00 -1.74 0.00 0.00 68.15 67.37 3g1z h THR 190 CO 0.05 0.17 0.01 -0.07 0.37 0.00 0.00 175.52 176.05 3g1z h LEU 191 N 0.80 -0.15 -1.35 2.58 3.38 -0.97 -1.48 115.31 118.11 3g1z h LEU 191 Ca 0.21 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.28 3g1z h LEU 191 Cb -0.03 0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 3g1z h LEU 191 CO -0.04 -0.04 0.36 -0.07 0.09 0.00 0.00 178.44 178.74 3g1z h LEU 192 N 0.12 0.70 -0.44 1.67 3.38 -0.74 -1.34 115.31 118.66 3g1z h LEU 192 Ca 0.21 -0.03 -0.14 0.00 0.09 0.00 0.00 57.88 58.01 3g1z h LEU 192 Cb 0.30 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3g1z h LEU 192 CO -0.34 0.54 -0.26 1.56 0.09 0.00 0.00 178.44 180.02 3g1z h GLN 193 N 0.81 0.96 -0.13 1.13 4.20 -0.40 -0.61 115.11 121.08 3g1z h GLN 193 Ca 0.21 -0.44 -0.01 0.00 0.06 0.00 0.00 58.65 58.48 3g1z h GLN 193 Cb -0.04 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 3g1z h GLN 193 CO -0.04 1.11 0.05 1.25 -0.67 0.00 0.00 178.83 180.52 3g1z h LEU 194 N 0.80 0.18 -0.72 1.46 5.85 -0.94 -1.58 115.31 120.35 3g1z h LEU 194 Ca 0.09 -0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.72 3g1z h LEU 194 Cb 0.85 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.76 3g1z h LEU 194 CO 0.07 0.31 0.38 -0.07 -0.34 0.00 0.00 178.44 178.80 3g1z h LEU 195 N 0.04 0.53 -0.11 2.25 3.38 -1.15 0.42 115.31 120.69 3g1z h LEU 195 Ca 0.04 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 3g1z h LEU 195 Cb 0.19 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 3g1z h LEU 195 CO -0.00 0.32 -0.09 0.15 0.09 0.00 0.00 178.44 178.91 3g1z h PHE 196 N 0.67 0.30 -0.17 1.13 3.57 -0.98 0.41 116.94 121.85 3g1z h PHE 196 Ca 0.34 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 3g1z h PHE 196 Cb 0.31 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 3g1z h PHE 196 CO -0.09 0.65 0.11 1.15 -2.23 0.00 0.00 178.31 177.90 3g1z h THR 197 N -0.14 1.07 0.01 4.41 2.02 -1.15 0.35 112.91 119.48 3g1z h THR 197 Ca 0.02 -0.18 -0.27 0.00 0.77 0.00 0.00 66.41 66.75 3g1z h THR 197 Cb 0.59 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.84 3g1z h THR 197 CO 0.02 0.07 -1.52 0.24 0.37 0.00 0.00 175.52 174.70 3g1z h MET 198 N 0.21 0.01 0.00 6.66 2.86 -0.96 -3.34 114.93 120.37 3g1z h MET 198 Ca 0.06 -0.02 -0.12 0.00 -2.06 0.00 0.00 59.70 57.55 3g1z h MET 198 Cb 0.02 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 3g1z h MET 198 CO -0.01 0.66 -1.88 0.41 1.06 0.00 0.00 176.91 177.15 3g1z n GLY 199 N 1.51 -0.75 0.51 8.32 0.00 0.14 -4.68 105.19 110.25 3g1z n GLY 199 Ca -0.13 -0.33 -0.12 0.00 0.00 0.00 0.00 46.02 45.44 3g1z n GLY 199 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3g1z n VAL 200 N -2.29 1.07 -0.32 1.61 0.31 -0.39 -4.76 118.33 113.56 3g1z n VAL 200 Ca -0.13 -0.03 0.15 0.00 -0.01 0.00 0.00 64.34 64.32 3g1z n VAL 200 Cb 0.68 -1.83 0.34 0.00 -0.91 0.00 0.00 33.84 32.12 3g1z n VAL 200 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3g1z h GLU 201 N -0.56 0.41 0.00 5.55 5.08 -0.49 0.37 114.58 124.93 3g1z h GLU 201 Ca -0.24 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 3g1z h GLU 201 Cb 1.04 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.20 3g1z h GLU 201 CO -0.15 0.27 0.00 -2.30 -1.00 0.00 0.00 179.01 175.83 3g1z n PRO 202 N -5.02 0.30 -0.39 2.33 -0.02 -1.26 -3.38 135.00 127.57 3g1z n PRO 202 Ca 0.24 0.08 0.06 0.00 -2.02 0.00 0.00 63.50 61.86 3g1z n PRO 202 Cb 0.71 -1.50 0.09 0.00 -0.02 0.00 0.00 33.50 32.78 3g1z n PRO 202 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3g1z n HIS 203 N -1.13 0.00 -4.21 6.00 8.25 0.12 -5.01 115.22 119.24 3g1z n HIS 203 Ca 0.08 -0.69 -0.12 0.00 -0.26 0.00 0.00 57.72 56.73 3g1z n HIS 203 Cb 0.07 -0.13 -0.10 0.00 1.12 0.00 0.00 29.99 30.95 3g1z n HIS 203 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 3g1z s ILE 204 N -1.75 0.63 -0.43 1.59 -4.36 -1.21 -4.89 121.20 110.77 3g1z s ILE 204 Ca 0.22 -1.96 0.00 0.00 -0.26 0.00 0.00 60.65 58.66 3g1z s ILE 204 Cb 0.21 -1.95 0.00 0.00 1.25 0.00 0.00 42.46 41.97 3g1z s ILE 204 CO -0.01 -0.62 0.00 0.61 0.24 0.00 0.00 174.94 175.16 3g1z n GLY 205 N -0.15 0.62 0.38 6.27 0.00 -1.26 -4.46 105.19 106.58 3g1z n GLY 205 Ca -0.08 -0.22 -0.16 0.00 0.00 0.00 0.00 46.02 45.55 3g1z n GLY 205 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g1z h LYS 206 N 0.31 -0.89 0.00 1.61 6.56 -1.91 0.15 116.57 122.40 3g1z h LYS 206 Ca -0.08 0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 3g1z h LYS 206 Cb 0.56 0.20 0.00 0.00 -0.57 0.00 0.00 32.23 32.42 3g1z h LYS 206 CO 0.12 -0.56 -1.67 -1.91 -2.06 0.00 0.00 179.45 173.37 3g1z n GLU 207 N -5.43 0.52 -3.43 3.15 4.07 -1.26 -4.66 120.64 113.60 3g1z n GLU 207 Ca -0.13 -0.14 -0.12 0.00 -0.06 0.00 0.00 57.16 56.72 3g1z n GLU 207 Cb 0.38 -1.49 -0.02 0.00 -0.06 0.00 0.00 31.44 30.25 3g1z n GLU 207 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 3g1z s LYS 208 N -3.31 1.22 0.45 5.31 -2.85 -1.26 -4.63 119.74 114.67 3g1z s LYS 208 Ca -0.03 -0.41 -0.24 0.00 -1.00 0.00 0.00 55.97 54.28 3g1z s LYS 208 Cb 0.14 0.56 -0.09 0.00 -2.06 0.00 0.00 37.83 36.38 3g1z s LYS 208 CO 0.87 -0.53 1.22 -2.30 0.10 0.00 0.00 175.35 174.71 3g1z n PRO 209 N -0.29 1.75 -4.26 1.78 -0.02 -1.26 -4.11 135.00 128.58 3g1z n PRO 209 Ca -0.16 0.63 -0.34 0.00 -2.02 0.00 0.00 63.50 61.61 3g1z n PRO 209 Cb 0.64 -2.33 -0.15 0.00 -0.02 0.00 0.00 33.50 31.64 3g1z n PRO 209 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3g1z s THR 210 N -1.24 2.83 -0.29 3.45 2.01 0.89 -2.51 115.64 120.78 3g1z s THR 210 Ca 0.63 -0.70 -0.18 0.00 0.31 0.00 0.00 61.69 61.76 3g1z s THR 210 Cb -0.50 -2.23 -0.02 0.00 0.01 0.00 0.00 72.50 69.76 3g1z s THR 210 CO 0.56 0.49 0.51 -0.36 -0.69 0.00 0.00 174.62 175.13 3g1z s PHE 211 N 1.08 3.24 -0.20 4.92 0.40 -0.12 -1.15 117.98 126.15 3g1z s PHE 211 Ca -0.00 0.50 -0.08 0.00 -0.60 0.00 0.00 56.93 56.74 3g1z s PHE 211 Cb -0.15 -2.78 -0.04 0.00 0.51 0.00 0.00 43.02 40.57 3g1z s PHE 211 CO -0.03 -0.35 0.09 0.42 0.70 0.00 0.00 175.22 176.04 3g1z s ILE 212 N 2.33 4.94 0.29 0.64 -1.09 0.74 -1.26 121.20 127.79 3g1z s ILE 212 Ca 0.20 0.02 0.03 0.00 -2.23 0.00 0.00 60.65 58.67 3g1z s ILE 212 Cb -0.16 -3.25 -0.06 0.00 -1.58 0.00 0.00 42.46 37.42 3g1z s ILE 212 CO 0.10 0.43 0.07 -0.72 -1.23 0.00 0.00 174.94 173.59 3g1z s TYR 213 N 0.59 1.76 -1.31 3.97 -0.85 -0.74 -0.39 117.35 120.38 3g1z s TYR 213 Ca 0.05 -1.04 -0.04 0.00 -0.52 0.00 0.00 57.07 55.52 3g1z s TYR 213 Cb -0.13 -1.10 0.01 0.00 0.38 0.00 0.00 41.96 41.13 3g1z s TYR 213 CO 0.01 -0.12 0.96 0.72 -1.52 0.00 0.00 175.55 175.60 3g1z n HIS 214 N -0.57 -2.30 -1.44 -3.49 8.25 -0.42 -0.11 115.22 115.14 3g1z n HIS 214 Ca -0.02 0.93 -0.38 0.00 -0.26 0.00 0.00 57.72 57.99 3g1z n HIS 214 Cb 0.66 -4.75 0.05 0.00 1.12 0.00 0.00 29.99 27.07 3g1z n HIS 214 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3g1z n PHE 215 N -4.45 -0.58 -0.93 4.41 3.72 -1.24 -4.18 117.46 114.21 3g1z n PHE 215 Ca -0.18 0.42 -0.33 0.00 -0.05 0.00 0.00 57.45 57.31 3g1z n PHE 215 Cb 0.63 -1.96 0.12 0.00 -0.94 0.00 0.00 39.48 37.32 3g1z n PHE 215 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 3g1z n PRO 216 N -0.27 -0.11 -0.34 -1.08 -0.02 -1.26 -1.29 135.00 130.64 3g1z n PRO 216 Ca 0.11 0.02 0.14 0.00 -2.02 0.00 0.00 63.50 61.76 3g1z n PRO 216 Cb 0.48 -2.01 0.35 0.00 -0.02 0.00 0.00 33.50 32.29 3g1z n PRO 216 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g1z h ALA 217 N -1.24 1.75 0.00 3.55 0.00 -1.16 -1.15 119.26 121.01 3g1z h ALA 217 Ca -0.44 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3g1z h ALA 217 Cb 1.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3g1z h ALA 217 CO 0.39 -0.11 0.00 -1.13 0.00 0.00 0.00 179.25 178.40 3g1z n SER 218 N -4.72 0.63 -1.68 0.00 3.41 -1.26 -1.78 113.62 108.21 3g1z n SER 218 Ca 0.23 0.64 -0.17 0.00 -0.26 0.00 0.00 58.87 59.31 3g1z n SER 218 Cb 0.59 -0.78 0.13 0.00 -0.26 0.00 0.00 64.21 63.89 3g1z n SER 218 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g1z n GLN 219 N -2.18 2.49 -0.03 4.33 6.02 -0.45 -4.77 117.38 122.79 3g1z n GLN 219 Ca 0.03 -3.47 0.01 0.00 -0.01 0.00 0.00 57.00 53.56 3g1z n GLN 219 Cb 0.25 -2.05 0.33 0.00 1.02 0.00 0.00 30.24 29.79 3g1z n GLN 219 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3g1z h ALA 220 N 1.50 1.50 -0.60 -1.58 0.00 -1.25 -3.45 119.26 115.38 3g1z h ALA 220 Ca 0.36 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3g1z h ALA 220 Cb 1.54 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3g1z h ALA 220 CO 0.76 0.39 0.00 0.45 0.00 0.00 0.00 179.25 180.85 3g1z n SER 221 N -4.37 0.00 -0.04 0.00 2.88 -1.26 -1.28 113.62 109.55 3g1z n SER 221 Ca 0.03 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.70 3g1z n SER 221 Cb 0.15 0.00 0.35 0.00 -0.75 0.00 0.00 64.21 63.96 3g1z n SER 221 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3g1z n LEU 222 N 0.00 0.48 -4.79 2.46 4.77 -1.26 -4.95 117.00 113.70 3g1z n LEU 222 Ca 0.00 0.05 -0.36 0.00 -0.03 0.00 0.00 56.01 55.67 3g1z n LEU 222 Cb 0.00 -0.27 -0.06 0.00 -2.33 0.00 0.00 43.42 40.76 3g1z n LEU 222 CO 0.00 0.11 0.69 0.00 -1.33 0.00 0.00 177.39 176.85 3g1z s ALA 223 N -2.90 3.12 0.64 -1.18 0.00 -0.40 -3.38 121.76 117.66 3g1z s ALA 223 Ca 0.14 0.57 -0.18 0.00 0.00 0.00 0.00 51.96 52.50 3g1z s ALA 223 Cb 0.18 -3.21 -0.01 0.00 0.00 0.00 0.00 23.12 20.08 3g1z s ALA 223 CO 0.63 -0.00 1.29 -0.65 0.00 0.00 0.00 175.76 177.03 3g1z s GLN 224 N -2.48 2.58 0.40 0.00 -0.21 -0.61 -4.76 119.66 114.57 3g1z s GLN 224 Ca 0.56 2.04 -0.25 0.00 0.02 0.00 0.00 55.36 57.73 3g1z s GLN 224 Cb -0.18 -1.85 -0.08 0.00 1.00 0.00 0.00 33.01 31.89 3g1z s GLN 224 CO 0.23 -1.57 1.18 0.42 -2.12 0.00 0.00 175.29 173.43 3g1z s ILE 225 N -1.42 3.11 0.09 1.08 -1.09 -1.26 -0.22 121.20 121.49 3g1z s ILE 225 Ca 0.82 0.94 -0.31 0.00 -2.23 0.00 0.00 60.65 59.87 3g1z s ILE 225 Cb -0.37 -3.53 -0.08 0.00 -1.58 0.00 0.00 42.46 36.90 3g1z s ILE 225 CO 0.39 0.09 1.57 -0.55 -1.23 0.00 0.00 174.94 175.21 3g1z s SER 226 N -1.10 6.66 0.51 3.58 0.15 0.21 -4.72 113.70 118.99 3g1z s SER 226 Ca 0.57 2.45 0.30 0.00 0.70 0.00 0.00 55.95 59.97 3g1z s SER 226 Cb -0.31 -2.57 1.02 0.00 -1.71 0.00 0.00 66.02 62.44 3g1z s SER 226 CO 0.39 -0.82 1.86 0.71 1.20 0.00 0.00 173.24 176.58 3g1z h THR 227 N 4.58 0.02 0.00 6.45 1.35 -1.94 -3.17 112.91 120.20 3g1z h THR 227 Ca -0.42 -0.70 0.00 0.00 -0.55 0.00 0.00 66.41 64.74 3g1z h THR 227 Cb 1.20 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 69.30 3g1z h THR 227 CO 0.92 0.01 -1.11 -0.62 -0.25 0.00 0.00 175.52 174.46 3g1z n GLU 228 N -3.10 0.57 -3.24 4.72 1.02 -1.26 -4.67 120.64 114.68 3g1z n GLU 228 Ca 0.02 0.07 -0.04 0.00 -0.02 0.00 0.00 57.16 57.19 3g1z n GLU 228 Cb 0.38 -1.76 -0.03 0.00 -0.02 0.00 0.00 31.44 30.01 3g1z n GLU 228 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3g1z s ASP 229 N -5.08 -0.45 0.00 1.62 3.68 -1.20 -5.04 116.67 110.20 3g1z s ASP 229 Ca -0.01 -0.18 0.07 0.00 2.13 0.00 0.00 52.55 54.56 3g1z s ASP 229 Cb 0.11 1.49 0.35 0.00 -1.45 0.00 0.00 42.92 43.41 3g1z s ASP 229 CO 0.80 -0.33 1.18 1.41 0.13 0.00 0.00 175.17 178.36 3g1z n HIS 230 N 5.34 0.00 0.70 -5.34 8.25 -1.21 -2.01 115.22 120.96 3g1z n HIS 230 Ca 0.03 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.60 3g1z n HIS 230 Cb 0.51 -0.41 0.46 0.00 1.12 0.00 0.00 29.99 31.68 3g1z n HIS 230 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3g1z n ARG 231 N -1.41 0.05 -4.24 -0.41 1.74 -1.26 -4.68 116.66 106.45 3g1z n ARG 231 Ca 0.03 0.16 -0.13 0.00 -0.77 0.00 0.00 57.85 57.14 3g1z n ARG 231 Cb 0.07 -1.57 -0.10 0.00 -1.02 0.00 0.00 32.46 29.85 3g1z n ARG 231 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3g1z s VAL 232 N -3.04 0.68 0.24 1.55 -7.23 -0.85 -0.68 120.40 111.06 3g1z s VAL 232 Ca 0.10 -1.98 0.11 0.00 -1.81 0.00 0.00 61.98 58.40 3g1z s VAL 232 Cb 0.14 -2.12 -0.05 0.00 0.56 0.00 0.00 36.38 34.91 3g1z s VAL 232 CO 0.42 -0.47 -0.21 0.00 -0.31 0.00 0.00 175.10 174.52 3g1z s ALA 233 N -3.66 2.57 -1.48 1.32 0.00 -0.41 -0.62 121.76 119.49 3g1z s ALA 233 Ca 0.24 -1.75 -0.09 0.00 0.00 0.00 0.00 51.96 50.36 3g1z s ALA 233 Cb 0.06 -0.27 0.02 0.00 0.00 0.00 0.00 23.12 22.93 3g1z s ALA 233 CO 0.04 0.32 2.57 0.39 0.00 0.00 0.00 175.76 179.08 3g1z n GLU 234 N -0.22 3.84 -4.90 0.00 1.02 0.70 -3.51 120.64 117.56 3g1z n GLU 234 Ca -0.08 -2.78 -0.26 0.00 -0.02 0.00 0.00 57.16 54.02 3g1z n GLU 234 Cb 0.58 -2.84 -0.15 0.00 -0.02 0.00 0.00 31.44 29.01 3g1z n GLU 234 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3g1z s ARG 235 N 1.14 1.52 0.13 3.49 3.52 -1.26 -0.88 118.95 126.61 3g1z s ARG 235 Ca 0.59 -0.66 0.07 0.00 -0.13 0.00 0.00 55.73 55.59 3g1z s ARG 235 Cb 0.17 -1.46 -0.04 0.00 -1.56 0.00 0.00 34.95 32.06 3g1z s ARG 235 CO -0.07 0.40 -0.15 -0.59 -0.81 0.00 0.00 175.30 174.08 3g1z s PHE 236 N -0.42 1.51 -0.01 5.12 -0.12 0.15 -1.30 117.98 122.91 3g1z s PHE 236 Ca 0.07 -0.53 0.02 0.00 -0.05 0.00 0.00 56.93 56.44 3g1z s PHE 236 Cb -0.07 -0.78 -0.00 0.00 -0.63 0.00 0.00 43.02 41.54 3g1z s PHE 236 CO -0.01 0.19 -0.07 -2.00 -0.05 0.00 0.00 175.22 173.28 3g1z s GLU 237 N -2.70 0.67 -0.15 1.99 2.12 0.48 -0.85 118.70 120.26 3g1z s GLU 237 Ca 0.11 -0.24 -0.05 0.00 0.36 0.00 0.00 54.97 55.14 3g1z s GLU 237 Cb -0.05 -0.65 -0.04 0.00 0.26 0.00 0.00 34.13 33.65 3g1z s GLU 237 CO 0.04 0.12 0.02 0.54 -0.54 0.00 0.00 175.26 175.44 3g1z s VAL 238 N 0.03 4.46 -0.03 3.70 0.11 -0.23 -0.19 120.40 128.26 3g1z s VAL 238 Ca -0.00 -0.17 0.07 0.00 -2.93 0.00 0.00 61.98 58.95 3g1z s VAL 238 Cb -0.05 -2.96 -0.02 0.00 -1.53 0.00 0.00 36.38 31.82 3g1z s VAL 238 CO -0.00 0.52 -0.24 -0.31 -3.33 0.00 0.00 175.10 171.73 3g1z s TYR 239 N -0.03 2.22 -0.11 1.54 1.51 -0.30 -0.71 117.35 121.47 3g1z s TYR 239 Ca 0.04 -0.50 -0.07 0.00 -1.01 0.00 0.00 57.07 55.53 3g1z s TYR 239 Cb -0.13 -1.44 0.04 0.00 -0.11 0.00 0.00 41.96 40.33 3g1z s TYR 239 CO 0.02 -0.09 0.28 -0.47 -1.11 0.00 0.00 175.55 174.18 3g1z s TYR 240 N -0.43 -0.36 -1.51 2.71 5.04 -0.23 -0.08 117.35 122.49 3g1z s TYR 240 Ca 0.05 0.85 -0.13 0.00 -2.44 0.00 0.00 57.07 55.40 3g1z s TYR 240 Cb -0.11 0.10 0.09 0.00 0.35 0.00 0.00 41.96 42.40 3g1z s TYR 240 CO 0.00 -0.22 0.81 1.63 -1.34 0.00 0.00 175.55 176.43 3g1z n LYS 241 N 3.76 -4.50 -0.73 4.97 5.02 0.53 -0.80 118.16 126.41 3g1z n LYS 241 Ca -0.21 0.54 0.00 0.00 -2.02 0.00 0.00 58.31 56.62 3g1z n LYS 241 Cb 0.55 -5.35 0.00 0.00 -0.02 0.00 0.00 35.03 30.21 3g1z n LYS 241 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g1z n GLY 242 N -1.50 0.86 3.33 0.72 0.00 -1.26 -5.04 105.19 102.30 3g1z n GLY 242 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 3g1z n GLY 242 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3g1z s ILE 243 N -3.43 2.08 -0.35 -0.61 -4.36 0.02 -5.04 121.20 109.51 3g1z s ILE 243 Ca 0.00 -1.36 -0.28 0.00 -0.26 0.00 0.00 60.65 58.76 3g1z s ILE 243 Cb 0.00 -1.78 0.02 0.00 1.25 0.00 0.00 42.46 41.95 3g1z s ILE 243 CO 0.00 0.36 1.01 -0.70 0.24 0.00 0.00 174.94 175.85 3g1z s GLU 244 N -1.20 3.97 -0.17 0.37 2.12 -1.26 -1.06 118.70 121.46 3g1z s GLU 244 Ca 0.11 0.85 0.14 0.00 0.36 0.00 0.00 54.97 56.44 3g1z s GLU 244 Cb -0.10 -3.77 -0.21 0.00 0.26 0.00 0.00 34.13 30.32 3g1z s GLU 244 CO 0.02 -0.94 0.05 1.28 -0.54 0.00 0.00 175.26 175.13 3g1z n LEU 245 N 6.87 0.10 -3.57 2.70 4.77 0.11 -4.85 117.00 123.13 3g1z n LEU 245 Ca 0.10 -0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.93 3g1z n LEU 245 Cb 0.48 0.38 -0.05 0.00 -2.33 0.00 0.00 43.42 41.89 3g1z n LEU 245 CO 0.59 0.43 0.30 0.00 -1.33 0.00 0.00 177.39 177.38 3g1z s ALA 246 N -2.41 -1.38 -0.06 -1.18 0.00 -1.17 -1.04 121.76 114.52 3g1z s ALA 246 Ca -0.09 0.68 -0.00 0.00 0.00 0.00 0.00 51.96 52.55 3g1z s ALA 246 Cb 0.05 0.34 0.03 0.00 0.00 0.00 0.00 23.12 23.53 3g1z s ALA 246 CO 0.68 -0.49 -0.02 -0.80 0.00 0.00 0.00 175.76 175.13 3g1z s ASN 247 N -1.87 1.39 0.14 0.00 0.01 -0.01 -1.06 114.94 113.54 3g1z s ASN 247 Ca -0.06 -0.12 0.07 0.00 -0.71 0.00 0.00 52.86 52.04 3g1z s ASN 247 Cb -0.01 -0.48 -0.04 0.00 0.41 0.00 0.00 41.25 41.14 3g1z s ASN 247 CO -0.00 -0.14 -0.15 -0.83 -1.51 0.00 0.00 177.10 174.47 3g1z s GLY 248 N 1.56 1.19 -0.03 0.66 0.00 -0.03 -0.90 107.32 109.77 3g1z s GLY 248 Ca -0.01 -1.37 -0.12 0.00 0.00 0.00 0.00 44.72 43.22 3g1z s GLY 248 CO -0.04 -1.43 0.25 -1.36 0.00 0.00 0.00 173.10 170.53 3g1z s PHE 249 N -2.18 -0.14 -0.31 1.90 0.08 -0.22 -0.67 117.98 116.44 3g1z s PHE 249 Ca 0.12 0.24 -0.29 0.00 0.12 0.00 0.00 56.93 57.11 3g1z s PHE 249 Cb -0.05 0.06 0.01 0.00 -0.57 0.00 0.00 43.02 42.47 3g1z s PHE 249 CO 0.04 -0.31 1.20 -1.58 -0.10 0.00 0.00 175.22 174.47 3g1z s HIS 250 N -1.07 2.89 0.49 0.36 5.65 -0.06 -1.51 115.29 122.03 3g1z s HIS 250 Ca -0.11 1.00 -0.22 0.00 0.25 0.00 0.00 55.06 55.98 3g1z s HIS 250 Cb -0.05 -3.83 -0.07 0.00 -1.18 0.00 0.00 32.58 27.45 3g1z s HIS 250 CO 0.03 -1.31 1.15 -1.21 -0.65 0.00 0.00 174.74 172.74 3g1z s GLU 251 N 3.94 3.63 -0.02 2.88 0.41 -0.22 -1.58 118.70 127.75 3g1z s GLU 251 Ca 0.51 1.70 -0.30 0.00 -0.41 0.00 0.00 54.97 56.48 3g1z s GLU 251 Cb -0.15 -2.26 -0.05 0.00 -1.78 0.00 0.00 34.13 29.89 3g1z s GLU 251 CO 0.20 -0.64 1.37 -0.51 -0.49 0.00 0.00 175.26 175.19 3g1z s LEU 252 N -3.29 4.30 -0.01 1.80 1.02 -1.22 -4.62 118.68 116.67 3g1z s LEU 252 Ca 0.67 2.05 0.10 0.00 0.02 0.00 0.00 54.13 56.97 3g1z s LEU 252 Cb -0.26 -3.56 -0.13 0.00 0.02 0.00 0.00 46.19 42.26 3g1z s LEU 252 CO 0.31 -0.71 0.30 0.35 0.02 0.00 0.00 176.35 176.63 3g1z n THR 253 N 4.72 0.00 -2.80 5.49 -2.24 -1.26 -4.98 114.28 113.21 3g1z n THR 253 Ca 0.13 -0.25 -0.42 0.00 -2.27 0.00 0.00 64.05 61.24 3g1z n THR 253 Cb 0.44 0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 69.23 3g1z n THR 253 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3g1z s ASP 254 N -2.59 7.00 0.19 3.42 -1.08 -1.26 -4.65 116.67 117.70 3g1z s ASP 254 Ca -0.00 1.24 -0.10 0.00 -0.52 0.00 0.00 52.55 53.16 3g1z s ASP 254 Cb 0.07 -2.49 0.12 0.00 -1.46 0.00 0.00 42.92 39.16 3g1z s ASP 254 CO 0.40 -0.52 1.77 0.00 0.52 0.00 0.00 175.17 177.35 3g1z h ALA 255 N 7.43 0.89 -0.06 3.66 0.00 -1.89 -1.48 119.26 127.81 3g1z h ALA 255 Ca -0.25 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 3g1z h ALA 255 Cb 1.10 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 3g1z h ALA 255 CO 0.89 0.47 0.03 -0.09 0.00 0.00 0.00 179.25 180.55 3g1z h ARG 256 N 0.96 0.08 -0.62 0.00 9.65 -1.95 -1.23 114.38 121.28 3g1z h ARG 256 Ca 0.23 -0.01 -0.08 0.00 -1.10 0.00 0.00 59.98 59.03 3g1z h ARG 256 Cb 0.14 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.68 3g1z h ARG 256 CO -0.03 0.12 0.08 1.49 2.80 0.00 0.00 179.97 184.43 3g1z h GLU 257 N 0.02 1.04 -0.23 0.20 4.81 -1.96 -1.07 114.58 117.38 3g1z h GLU 257 Ca 0.02 -0.29 0.02 0.00 -0.13 0.00 0.00 59.36 58.98 3g1z h GLU 257 Cb 0.06 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 3g1z h GLU 257 CO -0.00 0.98 0.11 0.37 -0.73 0.00 0.00 179.01 179.73 3g1z h GLN 258 N 0.95 0.23 -0.79 1.92 5.75 -1.13 -1.56 115.11 120.47 3g1z h GLN 258 Ca 0.19 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.65 3g1z h GLN 258 Cb 0.46 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.92 3g1z h GLN 258 CO 0.02 0.15 0.40 0.37 -2.65 0.00 0.00 178.83 177.12 3g1z h GLN 259 N 0.24 1.13 -0.79 1.69 4.15 -1.00 -1.56 115.11 118.96 3g1z h GLN 259 Ca 0.10 -0.15 -0.02 0.00 0.77 0.00 0.00 58.65 59.34 3g1z h GLN 259 Cb 0.03 -0.21 -0.04 0.00 0.21 0.00 0.00 27.48 27.47 3g1z h GLN 259 CO -0.07 0.86 0.42 1.96 -1.93 0.00 0.00 178.83 180.07 3g1z h GLN 260 N 1.11 1.10 -0.70 1.69 4.20 -0.94 -0.12 115.11 121.45 3g1z h GLN 260 Ca 0.27 -0.13 0.04 0.00 0.06 0.00 0.00 58.65 58.89 3g1z h GLN 260 Cb 0.09 -0.21 -0.05 0.00 0.30 0.00 0.00 27.48 27.61 3g1z h GLN 260 CO -0.04 0.82 0.43 0.00 -0.67 0.00 0.00 178.83 179.37 3g1z h ARG 261 N 1.10 0.79 -0.59 1.46 3.08 -0.99 0.84 114.38 120.07 3g1z h ARG 261 Ca 0.28 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.23 3g1z h ARG 261 Cb 0.05 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 3g1z h ARG 261 CO -0.04 0.53 0.20 0.74 -1.07 0.00 0.00 179.97 180.32 3g1z h PHE 262 N 0.82 0.94 0.38 3.04 0.04 -0.81 0.20 116.94 121.55 3g1z h PHE 262 Ca 0.29 -0.09 -0.01 0.00 2.80 0.00 0.00 57.97 60.96 3g1z h PHE 262 Cb 0.08 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 37.94 3g1z h PHE 262 CO -0.05 0.77 -0.27 0.93 -0.60 0.00 0.00 178.31 179.09 3g1z h GLU 263 N 0.83 -0.62 -0.68 1.51 5.08 -0.74 -1.80 114.58 118.17 3g1z h GLU 263 Ca 0.19 0.04 0.11 0.00 -1.00 0.00 0.00 59.36 58.71 3g1z h GLU 263 Cb 0.27 0.14 -0.08 0.00 0.50 0.00 0.00 28.75 29.58 3g1z h GLU 263 CO -0.01 -0.42 0.25 0.37 -1.00 0.00 0.00 179.01 178.21 3g1z h GLN 264 N -0.65 0.41 -0.55 2.33 4.15 -0.74 -1.98 115.11 118.09 3g1z h GLN 264 Ca -0.04 -0.02 0.09 0.00 0.77 0.00 0.00 58.65 59.45 3g1z h GLN 264 Cb 0.55 -0.09 -0.11 0.00 0.21 0.00 0.00 27.48 28.04 3g1z h GLN 264 CO 0.01 0.27 -0.37 -0.44 -1.93 0.00 0.00 178.83 176.37 3g1z h ASP 265 N 0.42 -1.28 -0.13 -0.69 3.45 -0.32 -0.73 116.42 117.14 3g1z h ASP 265 Ca 0.35 0.23 -0.00 0.00 0.43 0.00 0.00 57.03 58.04 3g1z h ASP 265 Cb 0.49 0.61 -0.01 0.00 -0.56 0.00 0.00 39.33 39.85 3g1z h ASP 265 CO -0.35 -0.32 0.08 0.78 -1.57 0.00 0.00 179.24 177.85 3g1z h ASN 266 N -0.21 0.17 1.49 6.45 -0.26 -0.63 -1.81 115.58 120.79 3g1z h ASN 266 Ca 0.20 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.93 3g1z h ASN 266 Cb 0.56 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.78 3g1z h ASN 266 CO -0.66 0.14 -0.10 0.03 -1.06 0.00 0.00 177.43 175.78 3g1z h ARG 267 N 0.20 0.00 0.12 0.81 3.08 -0.50 -3.11 114.38 114.97 3g1z h ARG 267 Ca 0.05 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.79 3g1z h ARG 267 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3g1z h ARG 267 CO -0.01 0.00 -1.61 0.87 -1.07 0.00 0.00 179.97 178.15 3g1z h LYS 268 N 0.00 0.24 -6.31 0.04 1.57 -0.74 -3.51 116.57 107.86 3g1z h LYS 268 Ca 0.00 -0.42 -0.54 0.00 -1.87 0.00 0.00 60.65 57.82 3g1z h LYS 268 Cb 0.80 0.16 0.02 0.00 0.08 0.00 0.00 32.23 33.28 3g1z h LYS 268 CO 0.00 1.09 1.27 1.03 -0.57 0.00 0.00 179.45 182.27 3g1z s ARG 269 N -2.61 4.00 0.00 3.15 0.52 -0.73 -4.86 118.95 118.42 3g1z s ARG 269 Ca -0.11 2.53 0.00 0.00 -0.52 0.00 0.00 55.73 57.63 3g1z s ARG 269 Cb 0.07 -4.19 0.00 0.00 0.52 0.00 0.00 34.95 31.35 3g1z s ARG 269 CO 0.84 -1.12 0.45 0.41 0.02 0.00 0.00 175.30 175.91 3g1z n GLY 273 N 4.71 0.90 3.88 -3.53 0.00 -1.26 -4.64 105.19 105.26 3g1z n GLY 273 Ca 0.21 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.97 3g1z n GLY 273 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g1z s LEU 274 N 0.00 4.12 0.49 0.99 1.43 -1.26 -5.09 118.68 119.36 3g1z s LEU 274 Ca 0.00 0.06 -0.22 0.00 -1.03 0.00 0.00 54.13 52.94 3g1z s LEU 274 Cb 0.00 -2.71 -0.07 0.00 0.03 0.00 0.00 46.19 43.44 3g1z s LEU 274 CO 0.00 0.07 1.18 -2.16 0.23 0.00 0.00 176.35 175.67 3g1z s PRO 275 N -3.09 3.60 -0.02 1.29 0.04 -1.26 -4.98 135.00 130.57 3g1z s PRO 275 Ca 0.33 1.79 -0.30 0.00 0.04 0.00 0.00 61.00 62.86 3g1z s PRO 275 Cb -0.11 -2.30 -0.03 0.00 0.04 0.00 0.00 34.50 32.10 3g1z s PRO 275 CO 0.26 -0.69 1.02 -1.14 0.04 0.00 0.00 177.00 176.50 3g1z s GLN 276 N -2.84 4.50 -0.05 4.56 2.00 -1.26 -4.97 119.66 121.60 3g1z s GLN 276 Ca 0.66 1.46 -0.02 0.00 -2.00 0.00 0.00 55.36 55.47 3g1z s GLN 276 Cb -0.29 -3.48 -0.04 0.00 0.80 0.00 0.00 33.01 30.01 3g1z s GLN 276 CO 0.34 -0.16 0.05 -0.65 -0.50 0.00 0.00 175.29 174.37 3g1z s GLN 277 N 1.34 3.04 0.41 1.67 -1.52 -1.26 -5.09 119.66 118.25 3g1z s GLN 277 Ca 0.52 -0.42 -0.26 0.00 -1.95 0.00 0.00 55.36 53.24 3g1z s GLN 277 Cb -0.21 -2.85 -0.09 0.00 -0.22 0.00 0.00 33.01 29.64 3g1z s GLN 277 CO 0.25 0.68 1.36 -1.25 -0.25 0.00 0.00 175.29 176.09 3g1z s PRO 278 N -1.27 3.91 -0.04 2.91 0.04 -1.26 -4.89 135.00 134.40 3g1z s PRO 278 Ca 0.17 2.29 -0.30 0.00 0.04 0.00 0.00 61.00 63.21 3g1z s PRO 278 Cb -0.12 -2.76 -0.03 0.00 0.04 0.00 0.00 34.50 31.63 3g1z s PRO 278 CO 0.07 -0.59 1.06 0.42 0.04 0.00 0.00 177.00 178.00 3g1z s ILE 279 N -1.22 4.62 -0.59 0.56 1.01 -1.26 -4.54 121.20 119.78 3g1z s ILE 279 Ca 0.57 1.89 -0.27 0.00 0.00 0.00 0.00 60.65 62.84 3g1z s ILE 279 Cb -0.41 -4.21 -0.02 0.00 0.01 0.00 0.00 42.46 37.83 3g1z s ILE 279 CO 0.53 0.07 1.83 -0.62 0.00 0.00 0.00 174.94 176.75 3g1z s ASP 280 N 1.13 5.36 0.33 3.58 -1.08 -1.26 -4.90 116.67 119.83 3g1z s ASP 280 Ca 0.52 0.39 0.02 0.00 -0.52 0.00 0.00 52.55 52.96 3g1z s ASP 280 Cb -0.22 -2.53 0.56 0.00 -1.46 0.00 0.00 42.92 39.27 3g1z s ASP 280 CO 0.24 -2.30 1.92 -0.61 0.52 0.00 0.00 175.17 174.94 3g1z h GLN 281 N 14.60 0.76 -0.95 4.34 5.75 -1.99 -2.97 115.11 134.66 3g1z h GLN 281 Ca -0.27 -0.10 0.09 0.00 -0.15 0.00 0.00 58.65 58.22 3g1z h GLN 281 Cb 1.16 -0.14 -0.07 0.00 1.07 0.00 0.00 27.48 29.50 3g1z h GLN 281 CO 1.21 0.61 0.61 -0.91 -2.65 0.00 0.00 178.83 177.70 3g1z h ASN 282 N 0.76 0.90 0.24 -0.69 2.35 -1.98 0.28 115.58 117.43 3g1z h ASN 282 Ca 0.19 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 3g1z h ASN 282 Cb 0.12 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.32 3g1z h ASN 282 CO -0.02 0.54 -0.11 0.25 -1.65 0.00 0.00 177.43 176.44 3g1z h LEU 283 N 1.00 -0.27 -0.75 1.61 5.85 -1.86 -1.43 115.31 119.47 3g1z h LEU 283 Ca 0.43 -0.17 0.12 0.00 0.84 0.00 0.00 57.88 59.10 3g1z h LEU 283 Cb 0.34 0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.36 3g1z h LEU 283 CO -0.19 0.03 0.36 -0.07 -0.34 0.00 0.00 178.44 178.23 3g1z h LEU 284 N -0.58 0.44 -1.23 2.25 3.38 -1.34 -1.21 115.31 117.03 3g1z h LEU 284 Ca -0.03 0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3g1z h LEU 284 Cb 0.42 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3g1z h LEU 284 CO 0.05 0.22 0.02 0.44 0.09 0.00 0.00 178.44 179.27 3g1z h ASP 285 N 0.58 0.51 -0.46 -0.43 3.32 -0.30 0.20 116.42 119.84 3g1z h ASP 285 Ca 0.39 -0.09 -0.12 0.00 0.02 0.00 0.00 57.03 57.22 3g1z h ASP 285 Cb 0.48 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 3g1z h ASP 285 CO -0.32 0.57 -0.19 0.00 -1.72 0.00 0.00 179.24 177.58 3g1z h ALA 286 N 1.50 0.75 -0.35 3.45 0.00 -0.52 -1.71 119.26 122.38 3g1z h ALA 286 Ca 0.12 -0.38 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 3g1z h ALA 286 Cb 0.31 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3g1z h ALA 286 CO 0.01 0.67 -0.15 -0.07 0.00 0.00 0.00 179.25 179.70 3g1z h LEU 287 N 0.84 0.74 -0.61 0.00 4.07 -0.35 -0.97 115.31 119.04 3g1z h LEU 287 Ca 0.12 -0.40 0.07 0.00 0.08 0.00 0.00 57.88 57.75 3g1z h LEU 287 Cb 0.75 -0.20 -0.06 0.00 1.08 0.00 0.00 40.66 42.23 3g1z h LEU 287 CO 0.06 0.98 0.29 0.00 -1.08 0.00 0.00 178.44 178.69 3g1z h ALA 288 N 0.79 0.80 -0.11 1.53 0.00 -0.59 -2.58 119.26 119.10 3g1z h ALA 288 Ca 0.08 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 3g1z h ALA 288 Cb 0.69 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3g1z h ALA 288 CO 0.05 -0.08 -0.33 0.00 0.00 0.00 0.00 179.25 178.89 3g1z h ALA 289 N 1.36 1.24 0.00 0.00 0.00 -1.00 -3.47 119.26 117.38 3g1z h ALA 289 Ca 0.29 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3g1z h ALA 289 Cb 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3g1z h ALA 289 CO -0.22 0.52 0.00 0.41 0.00 0.00 0.00 179.25 179.95 3g1z n GLY 290 N -0.39 3.08 3.49 0.00 0.00 -0.40 -5.10 105.19 105.86 3g1z n GLY 290 Ca -0.01 -0.75 -0.37 0.00 0.00 0.00 0.00 46.02 44.89 3g1z n GLY 290 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g1z s LEU 291 N 0.00 3.61 0.53 0.99 2.96 -1.26 -4.34 118.68 121.17 3g1z s LEU 291 Ca 0.00 -0.16 -0.20 0.00 -0.22 0.00 0.00 54.13 53.55 3g1z s LEU 291 Cb 0.00 -1.98 -0.08 0.00 0.50 0.00 0.00 46.19 44.64 3g1z s LEU 291 CO 0.00 -0.04 0.87 -0.81 -1.32 0.00 0.00 176.35 175.05 3g1z n PRO 292 N 4.96 0.95 -1.64 0.98 -0.04 -1.26 -4.86 135.00 134.08 3g1z n PRO 292 Ca -0.16 0.36 -0.51 0.00 -0.04 0.00 0.00 63.50 63.15 3g1z n PRO 292 Cb 0.52 -2.01 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 3g1z n PRO 292 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3g1z n ASP 293 N -0.05 2.42 -3.54 3.54 2.03 -1.26 -4.93 116.55 114.77 3g1z n ASP 293 Ca 0.12 1.08 -0.11 0.00 0.52 0.00 0.00 54.79 56.40 3g1z n ASP 293 Cb 0.45 -1.28 -0.02 0.00 -0.72 0.00 0.00 41.12 39.55 3g1z n ASP 293 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3g1z s SER 295 N -2.79 2.64 0.15 0.00 0.01 -0.91 -1.05 113.70 111.75 3g1z s SER 295 Ca 0.04 -0.47 0.03 0.00 1.31 0.00 0.00 55.95 56.85 3g1z s SER 295 Cb -0.02 -0.26 -0.05 0.00 0.21 0.00 0.00 66.02 65.90 3g1z s SER 295 CO -0.08 0.23 -0.05 -0.83 0.41 0.00 0.00 173.24 172.93 3g1z s GLY 296 N -0.87 1.10 -0.07 3.44 0.00 -0.57 -0.50 107.32 109.85 3g1z s GLY 296 Ca 0.09 -1.52 -0.08 0.00 0.00 0.00 0.00 44.72 43.20 3g1z s GLY 296 CO 0.01 -1.54 0.23 0.54 0.00 0.00 0.00 173.10 172.33 3g1z s VAL 297 N -3.53 0.02 -0.16 1.40 0.11 -0.52 -1.06 120.40 116.66 3g1z s VAL 297 Ca 0.19 -0.13 -0.01 0.00 -2.93 0.00 0.00 61.98 59.10 3g1z s VAL 297 Cb 0.05 -0.36 -0.01 0.00 -1.53 0.00 0.00 36.38 34.52 3g1z s VAL 297 CO 0.01 -0.07 -0.11 0.00 -3.33 0.00 0.00 175.10 171.60 3g1z s ALA 298 N -0.19 2.66 -0.02 1.54 0.00 -0.08 -1.58 121.76 124.09 3g1z s ALA 298 Ca -0.03 -1.00 0.05 0.00 0.00 0.00 0.00 51.96 50.98 3g1z s ALA 298 Cb -0.03 -1.36 -0.01 0.00 0.00 0.00 0.00 23.12 21.72 3g1z s ALA 298 CO 0.01 -0.01 -0.19 -1.17 0.00 0.00 0.00 175.76 174.40 3g1z s LEU 299 N 0.77 2.00 -0.70 0.00 0.20 0.70 -0.83 118.68 120.82 3g1z s LEU 299 Ca -0.04 -0.35 -0.26 0.00 0.69 0.00 0.00 54.13 54.17 3g1z s LEU 299 Cb -0.15 -0.99 0.04 0.00 -0.43 0.00 0.00 46.19 44.66 3g1z s LEU 299 CO 0.01 0.21 1.17 -0.83 -0.29 0.00 0.00 176.35 176.62 3g1z s GLY 300 N -0.30 1.05 0.17 7.98 0.00 -0.20 -1.17 107.32 114.86 3g1z s GLY 300 Ca 0.04 -1.48 -0.11 0.00 0.00 0.00 0.00 44.72 43.16 3g1z s GLY 300 CO 0.00 2.45 1.69 -2.08 0.00 0.00 0.00 173.10 175.17 3g1z h VAL 301 N 6.02 1.25 -0.65 1.40 2.07 -1.72 -0.26 116.25 124.36 3g1z h VAL 301 Ca -0.28 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.37 3g1z h VAL 301 Cb 1.06 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 3g1z h VAL 301 CO 1.24 0.33 0.37 0.44 0.02 0.00 0.00 177.57 179.97 3g1z h ASP 302 N 0.86 0.79 -0.59 0.57 3.32 -1.91 0.21 116.42 119.68 3g1z h ASP 302 Ca 0.19 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 3g1z h ASP 302 Cb 0.32 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 3g1z h ASP 302 CO -0.00 0.64 0.33 0.03 -1.72 0.00 0.00 179.24 178.52 3g1z h ARG 303 N 0.88 0.82 -0.34 3.56 3.08 -1.87 -0.19 114.38 120.32 3g1z h ARG 303 Ca 0.23 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 3g1z h ARG 303 Cb 0.01 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 3g1z h ARG 303 CO -0.04 0.62 0.19 1.25 -1.07 0.00 0.00 179.97 180.91 3g1z h LEU 304 N 0.80 0.43 -0.43 3.04 5.85 -0.34 -1.22 115.31 123.44 3g1z h LEU 304 Ca 0.21 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 3g1z h LEU 304 Cb 0.03 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 3g1z h LEU 304 CO -0.04 0.40 0.26 0.58 -0.34 0.00 0.00 178.44 179.31 3g1z h VAL 305 N 0.43 1.13 -0.32 1.05 2.07 -0.46 -0.21 116.25 119.94 3g1z h VAL 305 Ca 0.12 -0.30 0.07 0.00 0.82 0.00 0.00 66.70 67.41 3g1z h VAL 305 Cb 0.07 0.56 -0.07 0.00 -1.52 0.00 0.00 31.29 30.33 3g1z h VAL 305 CO -0.02 0.14 -0.12 -0.03 0.02 0.00 0.00 177.57 177.55 3g1z h MET 306 N 0.57 -0.06 -0.68 1.57 1.85 -0.90 0.56 114.93 117.85 3g1z h MET 306 Ca 0.15 0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.26 3g1z h MET 306 Cb -0.01 0.01 -0.04 0.00 0.43 0.00 0.00 31.60 32.00 3g1z h MET 306 CO -0.03 -0.04 0.45 -0.07 -0.40 0.00 0.00 176.91 176.81 3g1z h LEU 307 N -0.06 0.76 -1.64 3.39 3.38 -1.04 -1.20 115.31 118.89 3g1z h LEU 307 Ca 0.16 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.13 3g1z h LEU 307 Cb 0.31 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3g1z h LEU 307 CO -0.37 0.54 0.26 0.00 0.09 0.00 0.00 178.44 178.96 3g1z h ALA 308 N 1.26 1.76 -0.01 1.53 0.00 -0.23 -2.28 119.26 121.30 3g1z h ALA 308 Ca 0.26 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3g1z h ALA 308 Cb -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.58 3g1z h ALA 308 CO -0.07 0.21 -0.08 1.28 0.00 0.00 0.00 179.25 180.59 3g1z n LEU 309 N -4.48 0.87 -2.20 0.00 4.77 0.12 -4.94 117.00 111.13 3g1z n LEU 309 Ca 0.03 -0.23 -0.20 0.00 -0.03 0.00 0.00 56.01 55.59 3g1z n LEU 309 Cb 0.09 -0.07 -0.01 0.00 -2.33 0.00 0.00 43.42 41.09 3g1z n LEU 309 CO 0.35 0.15 -0.25 0.61 -1.33 0.00 0.00 177.39 176.92 3g1z n GLY 310 N 1.20 -0.28 3.97 -0.72 0.00 -0.76 -5.01 105.19 103.60 3g1z n GLY 310 Ca 0.17 -0.06 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 3g1z n GLY 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1z s ALA 311 N -2.97 3.96 -0.06 4.61 0.00 -0.53 -5.04 121.76 121.74 3g1z s ALA 311 Ca 0.00 -1.27 0.21 0.00 0.00 0.00 0.00 51.96 50.89 3g1z s ALA 311 Cb 0.00 -1.98 -0.31 0.00 0.00 0.00 0.00 23.12 20.82 3g1z s ALA 311 CO 0.00 -0.41 0.39 0.39 0.00 0.00 0.00 175.76 176.13 3g1z n GLU 312 N -2.05 0.67 -3.85 0.00 4.71 -1.26 -4.67 120.64 114.18 3g1z n GLU 312 Ca 0.04 -0.16 -0.09 0.00 -0.01 0.00 0.00 57.16 56.93 3g1z n GLU 312 Cb 0.58 -1.50 -0.05 0.00 -1.01 0.00 0.00 31.44 29.46 3g1z n GLU 312 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 3g1z s SER 313 N -4.63 -0.12 0.39 1.62 1.04 -1.26 -4.89 113.70 105.85 3g1z s SER 313 Ca -0.08 -0.68 0.28 0.00 0.48 0.00 0.00 55.95 55.95 3g1z s SER 313 Cb 0.12 0.52 1.01 0.00 0.10 0.00 0.00 66.02 67.77 3g1z s SER 313 CO 0.87 -1.00 1.81 -0.07 0.98 0.00 0.00 173.24 175.83 3g1z h LEU 314 N 2.34 0.00 -0.97 2.42 3.38 -1.64 -2.29 115.31 118.56 3g1z h LEU 314 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3g1z h LEU 314 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3g1z h LEU 314 CO 0.41 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.94 3g1z h ALA 315 N 2.16 1.00 0.00 1.53 0.00 -1.87 -1.28 119.26 120.80 3g1z h ALA 315 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g1z h ALA 315 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3g1z h ALA 315 CO 0.00 0.00 -0.24 -0.25 0.00 0.00 0.00 179.25 178.76 3g1z n ASP 316 N -2.38 0.38 0.00 0.00 8.00 -0.86 -2.52 116.55 119.17 3g1z n ASP 316 Ca 0.01 0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.75 3g1z n ASP 316 Cb 0.21 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 3g1z n ASP 316 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3g1z n VAL 317 N -1.71 0.00 -4.46 2.53 0.24 -0.88 -4.28 118.33 109.77 3g1z n VAL 317 Ca 0.06 -0.11 -0.34 0.00 -2.04 0.00 0.00 64.34 61.91 3g1z n VAL 317 Cb 0.37 1.72 -0.13 0.00 -1.47 0.00 0.00 33.84 34.33 3g1z n VAL 317 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3g1z s ILE 318 N -0.02 3.45 0.21 1.34 1.01 -0.54 -4.93 121.20 121.73 3g1z s ILE 318 Ca 0.00 -0.51 -0.08 0.00 0.00 0.00 0.00 60.65 60.06 3g1z s ILE 318 Cb 0.00 -2.50 0.16 0.00 0.01 0.00 0.00 42.46 40.13 3g1z s ILE 318 CO 0.00 0.49 1.75 0.00 0.00 0.00 0.00 174.94 177.18 3g1z h ALA 319 N 6.98 0.85 -2.57 9.38 0.00 -1.90 -3.12 119.26 128.88 3g1z h ALA 319 Ca -0.31 0.08 -0.35 0.00 0.00 0.00 0.00 54.91 54.32 3g1z h ALA 319 Cb 1.19 0.03 -0.37 0.00 0.00 0.00 0.00 17.79 18.65 3g1z h ALA 319 CO 0.59 -0.16 -0.66 -0.06 0.00 0.00 0.00 179.25 178.97 3g1z s PHE 320 N -6.08 -0.19 0.95 0.00 0.08 -1.26 -0.66 117.98 110.82 3g1z s PHE 320 Ca -0.13 0.02 -0.12 0.00 0.12 0.00 0.00 56.93 56.82 3g1z s PHE 320 Cb 0.17 -0.46 0.16 0.00 -0.57 0.00 0.00 43.02 42.33 3g1z s PHE 320 CO 0.75 -0.64 1.09 0.95 -0.10 0.00 0.00 175.22 177.27 3g1z s THR 321 N 2.29 2.34 0.35 0.64 -4.23 -1.26 -4.56 115.64 111.22 3g1z s THR 321 Ca 0.07 0.11 0.05 0.00 -1.18 0.00 0.00 61.69 60.74 3g1z s THR 321 Cb -0.16 -2.59 0.17 0.00 1.34 0.00 0.00 72.50 71.26 3g1z s THR 321 CO -0.16 -0.15 1.91 1.62 -0.54 0.00 0.00 174.62 177.30 3g1z h VAL 322 N -1.74 1.18 -0.07 2.29 3.04 -1.97 -0.88 116.25 118.10 3g1z h VAL 322 Ca -0.52 -0.70 0.02 0.00 -1.01 0.00 0.00 66.70 64.49 3g1z h VAL 322 Cb 1.31 0.91 -0.00 0.00 -2.01 0.00 0.00 31.29 31.50 3g1z h VAL 322 CO 0.56 0.24 0.18 -2.24 -1.01 0.00 0.00 177.57 175.30 3g1z h ASP 323 N 0.48 0.00 0.00 3.17 2.03 -2.03 -2.99 116.42 117.08 3g1z h ASP 323 Ca 0.11 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.41 3g1z h ASP 323 Cb 0.28 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.78 3g1z h ASP 323 CO 0.01 0.00 0.00 -2.11 -1.03 0.00 0.00 179.24 176.11 3g1z n ARG 324 N -3.28 -0.35 0.00 4.15 1.85 -0.44 -5.16 116.66 113.43 3g1z n ARG 324 Ca -0.01 -0.37 0.07 0.00 -1.00 0.00 0.00 57.85 56.53 3g1z n ARG 324 Cb 0.26 -0.79 0.39 0.00 -1.05 0.00 0.00 32.46 31.27 3g1z n ARG 324 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62