#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gjq h ALA 6 N 0.00 0.25 0.00 7.82 0.00 -2.05 -2.86 119.26 122.41 1gjq h ALA 6 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1gjq h ALA 6 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1gjq h ALA 6 CO 0.00 0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.58 1gjq n ALA 7 N -2.51 1.95 0.02 0.00 0.00 -1.26 -2.02 120.51 116.70 1gjq n ALA 7 Ca -0.07 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.26 1gjq n ALA 7 Cb 0.52 -1.40 -0.14 0.00 0.00 0.00 0.00 19.45 18.44 1gjq n ALA 7 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1gjq h GLU 8 N 0.00 0.09 0.00 0.00 5.08 -1.94 -3.22 114.58 114.59 1gjq h GLU 8 Ca 0.00 -0.15 -0.12 0.00 -1.00 0.00 0.00 59.36 58.09 1gjq h GLU 8 Cb 0.48 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1gjq h GLU 8 CO 0.00 0.83 -0.86 0.37 -1.00 0.00 0.00 179.01 178.35 1gjq h GLN 9 N 0.02 0.00 -0.35 2.33 4.15 -1.38 -3.08 115.11 116.80 1gjq h GLN 9 Ca -0.22 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.07 1gjq h GLN 9 Cb 1.96 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.64 1gjq h GLN 9 CO 0.11 0.39 -0.28 -0.92 -1.93 0.00 0.00 178.83 176.20 1gjq h TYR 10 N 0.00 0.85 -0.48 3.99 3.20 -1.51 -2.89 116.97 120.13 1gjq h TYR 10 Ca -0.06 -0.21 -0.21 0.00 3.14 0.00 0.00 58.73 61.39 1gjq h TYR 10 Cb 1.43 -0.20 -0.13 0.00 1.54 0.00 0.00 36.73 39.38 1gjq h TYR 10 CO 0.00 0.93 0.09 1.04 -1.64 0.00 0.00 178.16 178.59 1gjq n GLN 11 N -4.09 2.27 0.16 1.82 6.02 -1.21 -4.66 117.38 117.69 1gjq n GLN 11 Ca -0.01 -3.09 0.06 0.00 -0.01 0.00 0.00 57.00 53.96 1gjq n GLN 11 Cb 0.46 -1.92 0.07 0.00 1.02 0.00 0.00 30.24 29.87 1gjq n GLN 11 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1gjq h GLY 12 N 1.29 0.00 -1.42 1.08 0.00 -1.41 -3.47 103.07 99.14 1gjq h GLY 12 Ca 0.26 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 47.07 1gjq h GLY 12 CO 0.52 0.00 0.32 0.00 0.00 0.00 0.00 176.54 177.38 1gjq s ALA 13 N -3.07 2.16 0.44 3.60 0.00 -1.26 -5.01 121.76 118.62 1gjq s ALA 13 Ca 0.04 0.42 -0.23 0.00 0.00 0.00 0.00 51.96 52.19 1gjq s ALA 13 Cb 0.07 -3.32 -0.08 0.00 0.00 0.00 0.00 23.12 19.78 1gjq s ALA 13 CO 0.73 -1.83 1.12 0.00 0.00 0.00 0.00 175.76 175.78 1gjq s ALA 14 N -2.68 3.02 0.53 0.00 0.00 -1.26 -5.02 121.76 116.34 1gjq s ALA 14 Ca 0.64 0.85 -0.20 0.00 0.00 0.00 0.00 51.96 53.25 1gjq s ALA 14 Cb -0.20 -3.34 -0.06 0.00 0.00 0.00 0.00 23.12 19.53 1gjq s ALA 14 CO 0.53 -0.50 1.18 0.45 0.00 0.00 0.00 175.76 177.42 1gjq s SER 15 N -1.43 5.68 0.00 0.00 0.15 -1.26 -4.92 113.70 111.92 1gjq s SER 15 Ca 0.61 2.32 0.25 0.00 0.70 0.00 0.00 55.95 59.83 1gjq s SER 15 Cb -0.26 -2.60 1.14 0.00 -1.71 0.00 0.00 66.02 62.59 1gjq s SER 15 CO 0.32 -1.25 1.82 0.00 1.20 0.00 0.00 173.24 175.33 1gjq n ALA 16 N -1.11 2.19 -2.39 5.45 0.00 -1.26 -4.78 120.51 118.61 1gjq n ALA 16 Ca 0.11 -0.10 -0.42 0.00 0.00 0.00 0.00 53.44 53.03 1gjq n ALA 16 Cb 0.49 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.51 1gjq n ALA 16 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1gjq s VAL 17 N -2.87 4.10 -0.27 0.00 1.01 -1.26 -4.99 120.40 116.11 1gjq s VAL 17 Ca 0.16 1.44 -0.29 0.00 0.00 0.00 0.00 61.98 63.29 1gjq s VAL 17 Cb 0.17 -3.92 -0.00 0.00 0.00 0.00 0.00 36.38 32.62 1gjq s VAL 17 CO 0.44 -0.00 1.31 -0.62 0.00 0.00 0.00 175.10 176.23 1gjq s ASP 18 N 1.59 6.70 0.58 3.32 -1.08 -1.26 -4.90 116.67 121.62 1gjq s ASP 18 Ca 0.58 1.31 0.28 0.00 -0.52 0.00 0.00 52.55 54.20 1gjq s ASP 18 Cb -0.27 -2.54 1.67 0.00 -1.46 0.00 0.00 42.92 40.33 1gjq s ASP 18 CO 0.23 -1.04 2.14 1.55 0.52 0.00 0.00 175.17 178.57 1gjq h PRO 19 N 9.19 0.00 0.00 4.34 0.13 -1.94 -1.72 132.00 142.00 1gjq h PRO 19 Ca -0.27 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.79 1gjq h PRO 19 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1gjq h PRO 19 CO 1.02 0.00 -0.34 0.00 -0.23 0.00 0.00 178.00 178.45 1gjq h ALA 20 N 1.83 1.38 -0.01 -0.56 0.00 -2.04 -2.51 119.26 117.36 1gjq h ALA 20 Ca 0.07 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1gjq h ALA 20 Cb 0.36 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1gjq h ALA 20 CO -0.00 0.42 -0.27 0.72 0.00 0.00 0.00 179.25 180.12 1gjq n HIS 21 N -4.05 0.00 -3.19 0.00 8.25 -0.65 -4.69 115.22 110.89 1gjq n HIS 21 Ca -0.02 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.01 1gjq n HIS 21 Cb 0.39 -0.14 -0.07 0.00 1.12 0.00 0.00 29.99 31.28 1gjq n HIS 21 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1gjq s VAL 22 N -2.55 4.93 -0.10 1.59 1.01 -0.95 -5.05 120.40 119.28 1gjq s VAL 22 Ca 0.23 -0.18 -0.09 0.00 0.00 0.00 0.00 61.98 61.93 1gjq s VAL 22 Cb 0.19 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 1gjq s VAL 22 CO 0.54 -0.59 0.21 0.68 0.00 0.00 0.00 175.10 175.94 1gjq s VAL 23 N 2.55 5.38 -0.09 2.92 -7.23 -1.26 -4.97 120.40 117.69 1gjq s VAL 23 Ca 0.17 0.37 -0.30 0.00 -1.81 0.00 0.00 61.98 60.42 1gjq s VAL 23 Cb -0.16 -3.49 -0.02 0.00 0.56 0.00 0.00 36.38 33.27 1gjq s VAL 23 CO 0.16 0.58 1.04 -0.60 -0.31 0.00 0.00 175.10 175.97 1gjq s ARG 24 N -0.84 4.42 -0.42 4.82 3.52 -1.26 -5.00 118.95 124.18 1gjq s ARG 24 Ca 0.17 1.44 -0.20 0.00 -0.13 0.00 0.00 55.73 57.01 1gjq s ARG 24 Cb -0.13 -3.54 0.02 0.00 -1.56 0.00 0.00 34.95 29.74 1gjq s ARG 24 CO 0.06 -0.32 0.60 0.99 -0.81 0.00 0.00 175.30 175.81 1gjq s THR 25 N 1.99 4.89 -0.05 4.11 2.01 -1.26 -4.99 115.64 122.35 1gjq s THR 25 Ca 0.50 0.12 -0.30 0.00 0.31 0.00 0.00 61.69 62.32 1gjq s THR 25 Cb -0.19 -4.14 0.10 0.00 0.01 0.00 0.00 72.50 68.28 1gjq s THR 25 CO 0.19 -0.50 1.33 0.21 -0.69 0.00 0.00 174.62 175.16 1gjq s ASN 26 N 1.93 -0.00 0.00 3.53 3.84 -1.26 -4.92 114.94 118.05 1gjq s ASN 26 Ca 0.21 -0.12 0.00 0.00 0.21 0.00 0.00 52.86 53.16 1gjq s ASN 26 Cb -0.15 0.09 0.00 0.00 -0.55 0.00 0.00 41.25 40.64 1gjq s ASN 26 CO 0.17 -0.18 0.00 0.61 -2.79 0.00 0.00 177.10 174.91 1gjq n GLY 27 N -0.89 1.74 3.87 1.21 0.00 -1.26 -5.12 105.19 104.74 1gjq n GLY 27 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1gjq n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gjq s ALA 28 N -2.00 3.60 0.07 4.61 0.00 -1.26 -5.05 121.76 121.73 1gjq s ALA 28 Ca 0.00 -0.29 -0.31 0.00 0.00 0.00 0.00 51.96 51.36 1gjq s ALA 28 Cb 0.00 -2.40 -0.08 0.00 0.00 0.00 0.00 23.12 20.64 1gjq s ALA 28 CO 0.00 0.52 1.66 -1.25 0.00 0.00 0.00 175.76 176.69 1gjq s PRO 29 N -2.66 4.20 0.12 0.00 0.04 -1.26 -4.93 135.00 130.51 1gjq s PRO 29 Ca 0.45 2.34 -0.35 0.00 0.04 0.00 0.00 61.00 63.47 1gjq s PRO 29 Cb -0.12 -3.60 -0.15 0.00 0.04 0.00 0.00 34.50 30.67 1gjq s PRO 29 CO 0.21 -0.74 1.48 -0.25 0.04 0.00 0.00 177.00 177.74 1gjq n ASP 30 N 5.60 2.45 -3.74 6.66 8.00 -1.26 -4.94 116.55 129.32 1gjq n ASP 30 Ca 0.16 1.10 -0.12 0.00 0.71 0.00 0.00 54.79 56.63 1gjq n ASP 30 Cb 0.40 -1.32 -0.12 0.00 -0.02 0.00 0.00 41.12 40.07 1gjq n ASP 30 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gjq s MET 31 N 0.81 0.28 1.15 -1.24 0.23 -1.26 -5.14 119.30 114.13 1gjq s MET 31 Ca 0.82 0.53 -0.16 0.00 -1.03 0.00 0.00 55.69 55.85 1gjq s MET 31 Cb -0.81 -0.02 0.26 0.00 -1.53 0.00 0.00 34.83 32.73 1gjq s MET 31 CO 0.42 -0.12 1.08 -1.54 -2.03 0.00 0.00 175.02 172.83 1gjq s SER 32 N 0.95 1.35 0.29 -1.18 1.04 -1.26 -4.73 113.70 110.16 1gjq s SER 32 Ca -0.07 0.93 -0.02 0.00 0.48 0.00 0.00 55.95 57.28 1gjq s SER 32 Cb -0.07 -1.40 0.41 0.00 0.10 0.00 0.00 66.02 65.06 1gjq s SER 32 CO -0.07 -3.89 1.89 -0.08 0.98 0.00 0.00 173.24 172.07 1gjq h GLU 33 N -2.42 0.96 -0.48 4.02 4.81 -2.02 -0.69 114.58 118.76 1gjq h GLU 33 Ca -0.50 -0.13 -0.12 0.00 -0.13 0.00 0.00 59.36 58.48 1gjq h GLU 33 Cb 1.32 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 1gjq h GLU 33 CO 0.44 0.74 -0.17 1.03 -0.73 0.00 0.00 179.01 180.33 1gjq h SER 34 N 0.96 0.98 -0.29 1.04 0.87 -1.99 -1.82 113.55 113.29 1gjq h SER 34 Ca 0.23 -0.38 -0.18 0.00 -1.23 0.00 0.00 61.79 60.24 1gjq h SER 34 Cb 0.10 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 61.79 1gjq h SER 34 CO -0.03 1.14 -0.50 -0.33 -0.53 0.00 0.00 176.83 176.57 1gjq h GLU 35 N 0.81 0.85 -0.38 2.24 5.08 -1.85 -2.81 114.58 118.53 1gjq h GLU 35 Ca 0.12 -0.53 -0.12 0.00 -1.00 0.00 0.00 59.36 57.83 1gjq h GLU 35 Cb 0.74 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 1gjq h GLU 35 CO 0.06 1.16 -0.22 0.35 -1.00 0.00 0.00 179.01 179.36 1gjq h PHE 36 N 0.63 0.95 -0.20 4.33 3.04 -1.10 -2.73 116.94 121.86 1gjq h PHE 36 Ca 0.02 -0.25 -0.11 0.00 3.98 0.00 0.00 57.97 61.61 1gjq h PHE 36 Cb 1.11 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 39.39 1gjq h PHE 36 CO 0.07 1.01 -0.35 -0.91 -2.02 0.00 0.00 178.31 176.11 1gjq h ASN 37 N 0.61 0.44 -0.46 0.41 2.35 -1.38 -0.47 115.58 117.09 1gjq h ASN 37 Ca 0.08 -0.18 -0.10 0.00 -0.55 0.00 0.00 56.30 55.55 1gjq h ASN 37 Cb 0.78 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.02 1gjq h ASN 37 CO 0.06 0.77 -0.12 -0.08 -1.65 0.00 0.00 177.43 176.41 1gjq h GLU 38 N 0.37 0.89 -0.35 0.81 4.81 -1.50 -1.68 114.58 117.92 1gjq h GLU 38 Ca 0.04 -0.34 -0.08 0.00 -0.13 0.00 0.00 59.36 58.84 1gjq h GLU 38 Cb 0.79 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 1gjq h GLU 38 CO 0.06 0.99 -0.11 0.00 -0.73 0.00 0.00 179.01 179.22 1gjq h ALA 39 N 0.87 0.48 -0.18 2.92 0.00 -1.35 -2.66 119.26 119.35 1gjq h ALA 39 Ca 0.11 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1gjq h ALA 39 Cb 0.66 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1gjq h ALA 39 CO 0.05 0.36 -0.07 -0.22 0.00 0.00 0.00 179.25 179.37 1gjq h LYS 40 N 0.48 0.27 -0.21 0.00 3.64 -1.00 -1.30 116.57 118.44 1gjq h LYS 40 Ca 0.08 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 1gjq h LYS 40 Cb 0.63 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1gjq h LYS 40 CO 0.04 0.35 -0.19 0.37 -2.27 0.00 0.00 179.45 177.75 1gjq h GLN 41 N 0.26 0.50 -0.56 1.90 4.15 -1.15 -2.93 115.11 117.28 1gjq h GLN 41 Ca 0.06 -0.26 -0.06 0.00 0.77 0.00 0.00 58.65 59.16 1gjq h GLN 41 Cb 0.29 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.96 1gjq h GLN 41 CO 0.01 0.84 0.12 0.82 -1.93 0.00 0.00 178.83 178.68 1gjq h ILE 42 N 0.19 1.24 0.01 2.39 2.04 -1.10 -2.55 117.51 119.72 1gjq h ILE 42 Ca 0.04 -0.88 0.02 0.00 1.00 0.00 0.00 64.86 65.04 1gjq h ILE 42 Cb 0.74 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 1gjq h ILE 42 CO 0.05 0.33 -0.11 0.22 0.00 0.00 0.00 178.15 178.64 1gjq h TYR 43 N 0.84 -0.27 0.00 1.37 3.20 -1.14 0.22 116.97 121.18 1gjq h TYR 43 Ca 0.18 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 1gjq h TYR 43 Cb 0.33 0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.72 1gjq h TYR 43 CO 0.02 -0.16 -0.04 0.74 -1.64 0.00 0.00 178.16 177.07 1gjq h PHE 44 N -0.19 0.00 0.14 -3.82 0.04 -1.48 0.19 116.94 111.83 1gjq h PHE 44 Ca 0.04 0.00 -0.31 0.00 2.80 0.00 0.00 57.97 60.50 1gjq h PHE 44 Cb 0.23 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.38 1gjq h PHE 44 CO -0.16 0.04 -1.49 1.96 -0.60 0.00 0.00 178.31 178.06 1gjq h GLN 45 N 0.00 0.29 0.00 1.51 4.20 -1.11 -3.41 115.11 116.58 1gjq h GLN 45 Ca -0.00 -0.50 -0.00 0.00 0.06 0.00 0.00 58.65 58.21 1gjq h GLN 45 Cb 0.82 0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.79 1gjq h GLN 45 CO 0.01 1.18 -1.04 0.54 -0.67 0.00 0.00 178.83 178.84 1gjq n ARG 46 N -3.50 1.05 -0.01 1.46 5.12 0.73 -4.94 116.66 116.57 1gjq n ARG 46 Ca -0.16 -0.01 -0.00 0.00 -1.93 0.00 0.00 57.85 55.75 1gjq n ARG 46 Cb 1.05 -1.02 -0.03 0.00 -1.16 0.00 0.00 32.46 31.30 1gjq n ARG 46 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1gjq h ALA 48 N 0.26 1.69 -0.42 0.00 0.00 -1.24 -2.19 119.26 117.36 1gjq h ALA 48 Ca -0.07 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1gjq h ALA 48 Cb 0.87 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 1gjq h ALA 48 CO 0.00 0.01 0.22 0.78 0.00 0.00 0.00 179.25 180.26 1gjq h GLY 49 N 0.03 0.58 0.51 0.00 0.00 -1.86 0.76 103.07 103.10 1gjq h GLY 49 Ca -0.00 -0.16 -0.33 0.00 0.00 0.00 0.00 47.33 46.84 1gjq h GLY 49 CO 0.00 0.12 -2.04 0.00 0.00 0.00 0.00 176.54 174.62 1gjq n HIS 51 N -2.94 0.16 0.00 0.00 8.25 -0.83 -1.12 115.22 118.74 1gjq n HIS 51 Ca -0.25 0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.25 1gjq n HIS 51 Cb 1.10 -0.33 0.00 0.00 1.12 0.00 0.00 29.99 31.88 1gjq n HIS 51 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gjq n GLY 52 N 1.41 -1.16 0.30 -1.41 0.00 0.26 -2.48 105.19 102.11 1gjq n GLY 52 Ca 0.03 -1.51 -0.01 0.00 0.00 0.00 0.00 46.02 44.52 1gjq n GLY 52 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1gjq h VAL 53 N 0.00 1.20 -0.26 1.61 2.07 -1.96 -2.61 116.25 116.30 1gjq h VAL 53 Ca 0.00 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1gjq h VAL 53 Cb 0.00 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1gjq h VAL 53 CO 0.00 0.26 0.00 0.18 0.02 0.00 0.00 177.57 178.03 1gjq n LEU 54 N -4.31 2.86 -0.55 2.57 4.77 -1.26 -4.89 117.00 116.19 1gjq n LEU 54 Ca 0.04 -1.17 -0.07 0.00 -0.03 0.00 0.00 56.01 54.77 1gjq n LEU 54 Cb 0.19 -0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 1gjq n LEU 54 CO 0.39 0.59 -0.07 0.54 -1.33 0.00 0.00 177.39 177.51 1gjq n ARG 55 N 1.12 -1.53 0.00 3.23 1.74 -0.98 -4.85 116.66 115.39 1gjq n ARG 55 Ca 0.18 0.71 0.12 0.00 -0.77 0.00 0.00 57.85 58.08 1gjq n ARG 55 Cb 0.53 -4.99 0.57 0.00 -1.02 0.00 0.00 32.46 27.55 1gjq n ARG 55 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1gjq n LYS 56 N -0.73 0.23 0.00 5.56 4.76 -1.25 -0.31 118.16 126.42 1gjq n LYS 56 Ca -0.07 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1gjq n LYS 56 Cb 0.49 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.18 1gjq n LYS 56 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1gjq n GLY 57 N 0.79 -0.22 0.00 0.72 0.00 -1.03 -4.31 105.19 101.13 1gjq n GLY 57 Ca 0.10 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1gjq n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gjq n ALA 58 N 1.27 0.00 0.11 4.61 0.00 -1.16 -4.91 120.51 120.43 1gjq n ALA 58 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1gjq n ALA 58 Cb 0.00 0.00 0.32 0.00 0.00 0.00 0.00 19.45 19.77 1gjq n ALA 58 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1gjq h THR 59 N 0.00 1.24 -2.84 0.00 2.02 -1.55 -3.44 112.91 108.34 1gjq h THR 59 Ca 0.00 -1.13 -0.48 0.00 0.77 0.00 0.00 66.41 65.57 1gjq h THR 59 Cb 0.00 1.44 0.01 0.00 -1.74 0.00 0.00 68.15 67.86 1gjq h THR 59 CO 0.00 0.34 -0.18 -0.83 0.37 0.00 0.00 175.52 175.22 1gjq s GLY 60 N -4.14 1.37 0.77 2.16 0.00 -0.28 -5.03 107.32 102.18 1gjq s GLY 60 Ca -0.05 -0.88 -0.13 0.00 0.00 0.00 0.00 44.72 43.66 1gjq s GLY 60 CO 0.75 -0.81 1.17 0.54 0.00 0.00 0.00 173.10 174.74 1gjq s LYS 61 N -4.28 1.99 0.18 2.90 1.02 -1.26 -4.47 119.74 115.82 1gjq s LYS 61 Ca 0.40 1.60 -0.31 0.00 0.02 0.00 0.00 55.97 57.68 1gjq s LYS 61 Cb -0.10 -1.83 -0.10 0.00 -0.52 0.00 0.00 37.83 35.28 1gjq s LYS 61 CO 0.36 -1.91 1.57 -2.14 -0.92 0.00 0.00 175.35 172.30 1gjq s PRO 62 N -4.21 4.21 -0.37 -1.68 0.02 -1.26 -4.48 135.00 127.22 1gjq s PRO 62 Ca 0.70 2.38 0.06 0.00 0.02 0.00 0.00 61.00 64.16 1gjq s PRO 62 Cb -0.25 -3.14 0.55 0.00 0.02 0.00 0.00 34.50 31.68 1gjq s PRO 62 CO 0.49 -0.60 1.64 1.28 -0.33 0.00 0.00 177.00 179.48 1gjq n LEU 63 N 3.74 5.27 -4.82 -5.54 4.77 0.57 -4.81 117.00 116.18 1gjq n LEU 63 Ca 0.13 -3.83 -0.33 0.00 -0.03 0.00 0.00 56.01 51.95 1gjq n LEU 63 Cb 0.38 -0.71 -0.04 0.00 -2.33 0.00 0.00 43.42 40.72 1gjq n LEU 63 CO 0.62 1.27 0.69 0.42 -1.33 0.00 0.00 177.39 179.05 1gjq s THR 64 N -3.46 4.16 0.50 -5.08 -4.23 -1.23 -4.78 115.64 101.53 1gjq s THR 64 Ca 0.50 1.20 0.33 0.00 -1.18 0.00 0.00 61.69 62.54 1gjq s THR 64 Cb 0.44 -3.55 0.52 0.00 1.34 0.00 0.00 72.50 71.25 1gjq s THR 64 CO 0.03 -0.43 1.77 1.55 -0.54 0.00 0.00 174.62 177.01 1gjq h PRO 65 N 1.28 0.10 -0.56 3.99 0.13 -1.79 -1.70 132.00 133.44 1gjq h PRO 65 Ca -0.48 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.62 1gjq h PRO 65 Cb 1.20 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1gjq h PRO 65 CO 0.60 0.06 0.27 0.38 -0.23 0.00 0.00 178.00 179.08 1gjq h ASP 66 N 0.10 0.70 0.08 1.44 2.03 -1.92 -1.91 116.42 116.93 1gjq h ASP 66 Ca 0.61 -0.06 -0.27 0.00 -0.73 0.00 0.00 57.03 56.58 1gjq h ASP 66 Cb 2.18 -0.18 -0.01 0.00 -0.83 0.00 0.00 39.33 40.48 1gjq h ASP 66 CO -0.10 0.59 -1.41 0.40 -1.03 0.00 0.00 179.24 177.70 1gjq h ILE 67 N 0.78 0.96 -0.26 4.15 1.08 -1.68 -3.34 117.51 119.19 1gjq h ILE 67 Ca 0.20 -2.32 -0.12 0.00 -0.39 0.00 0.00 64.86 62.22 1gjq h ILE 67 Cb 0.08 2.56 -0.01 0.00 -3.07 0.00 0.00 36.82 36.38 1gjq h ILE 67 CO -0.03 0.62 -0.36 0.71 -0.69 0.00 0.00 178.15 178.41 1gjq h THR 68 N -0.48 1.29 0.00 -0.27 1.35 -1.36 -2.70 112.91 110.74 1gjq h THR 68 Ca -0.32 -1.49 -0.09 0.00 -0.55 0.00 0.00 66.41 63.96 1gjq h THR 68 Cb 1.64 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 69.52 1gjq h THR 68 CO -0.02 0.47 -0.43 1.56 -0.25 0.00 0.00 175.52 176.85 1gjq h GLN 69 N 0.48 0.00 -0.42 4.72 4.20 -1.56 -2.21 115.11 120.32 1gjq h GLN 69 Ca 0.05 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.63 1gjq h GLN 69 Cb 0.84 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.61 1gjq h GLN 69 CO 0.07 0.43 -0.26 0.37 -0.67 0.00 0.00 178.83 178.77 1gjq h GLN 70 N 0.00 0.92 -0.25 1.46 4.15 -1.64 -3.14 115.11 116.61 1gjq h GLN 70 Ca -0.00 -0.43 -0.06 0.00 0.77 0.00 0.00 58.65 58.92 1gjq h GLN 70 Cb 0.93 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.60 1gjq h GLN 70 CO 0.06 1.09 -0.09 0.00 -1.93 0.00 0.00 178.83 177.96 1gjq h ARG 71 N 0.75 0.50 0.00 1.69 2.47 -1.30 -3.50 114.38 114.99 1gjq h ARG 71 Ca 0.09 -0.20 0.00 0.00 -1.26 0.00 0.00 59.98 58.60 1gjq h ARG 71 Cb 0.84 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.14 1gjq h ARG 71 CO 0.07 0.74 0.00 0.41 0.56 0.00 0.00 179.97 181.75 1gjq n GLY 72 N -0.10 -0.08 0.27 0.04 0.00 -0.85 -4.44 105.19 100.03 1gjq n GLY 72 Ca -0.04 -1.64 0.01 0.00 0.00 0.00 0.00 46.02 44.35 1gjq n GLY 72 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1gjq h GLN 73 N 0.00 0.01 -0.25 1.61 1.08 -1.89 -2.56 115.11 113.11 1gjq h GLN 73 Ca 0.00 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1gjq h GLN 73 Cb 0.00 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1gjq h GLN 73 CO 0.00 0.01 0.13 1.96 -0.95 0.00 0.00 178.83 179.98 1gjq h GLN 74 N 0.01 0.35 0.31 1.46 4.20 -2.00 -1.70 115.11 117.75 1gjq h GLN 74 Ca 0.35 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 59.01 1gjq h GLN 74 Cb 0.55 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 1gjq h GLN 74 CO -0.72 0.33 -0.21 -0.92 -0.67 0.00 0.00 178.83 176.64 1gjq h TYR 75 N 0.28 -0.56 -0.65 2.96 5.03 -1.71 -1.43 116.97 120.89 1gjq h TYR 75 Ca 0.09 -0.00 0.06 0.00 2.58 0.00 0.00 58.73 61.45 1gjq h TYR 75 Cb 0.09 0.20 -0.05 0.00 1.55 0.00 0.00 36.73 38.52 1gjq h TYR 75 CO -0.03 -0.33 0.36 -0.07 -1.32 0.00 0.00 178.16 176.77 1gjq h LEU 76 N -0.51 0.53 -0.64 2.82 3.38 -1.44 0.65 115.31 120.09 1gjq h LEU 76 Ca -0.03 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1gjq h LEU 76 Cb 0.44 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1gjq h LEU 76 CO 0.01 0.34 0.32 -0.33 0.09 0.00 0.00 178.44 178.88 1gjq h GLU 77 N 0.66 0.91 -0.53 1.13 5.08 -1.15 -1.52 114.58 119.17 1gjq h GLU 77 Ca 0.29 -0.12 -0.10 0.00 -1.00 0.00 0.00 59.36 58.42 1gjq h GLU 77 Cb 0.18 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1gjq h GLU 77 CO -0.18 0.71 -0.08 0.00 -1.00 0.00 0.00 179.01 178.46 1gjq h ALA 78 N 1.15 0.85 -0.21 3.43 0.00 -0.74 -1.86 119.26 121.88 1gjq h ALA 78 Ca 0.22 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 1gjq h ALA 78 Cb 0.09 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1gjq h ALA 78 CO -0.03 0.65 -0.49 1.25 0.00 0.00 0.00 179.25 180.63 1gjq h LEU 79 N 0.87 0.80 -1.22 0.00 6.46 -0.58 -1.66 115.31 119.97 1gjq h LEU 79 Ca 0.14 -0.56 -0.07 0.00 -0.12 0.00 0.00 57.88 57.27 1gjq h LEU 79 Cb 0.62 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.31 1gjq h LEU 79 CO 0.04 1.21 -0.22 0.40 -0.62 0.00 0.00 178.44 179.25 1gjq h ILE 80 N 0.41 1.23 0.22 4.05 2.04 -1.27 0.35 117.51 124.54 1gjq h ILE 80 Ca -0.00 -1.05 -0.01 0.00 1.00 0.00 0.00 64.86 64.80 1gjq h ILE 80 Cb 1.10 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 1gjq h ILE 80 CO 0.11 0.32 -0.11 0.74 0.00 0.00 0.00 178.15 179.21 1gjq h THR 81 N 0.23 0.78 0.00 -0.27 2.02 -1.19 -0.82 112.91 113.66 1gjq h THR 81 Ca 0.04 -0.91 0.00 0.00 0.77 0.00 0.00 66.41 66.31 1gjq h THR 81 Cb 0.53 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 1gjq h THR 81 CO 0.04 0.17 -1.26 -1.22 0.37 0.00 0.00 175.52 173.63 1gjq n TYR 82 N -5.01 0.55 -4.52 3.16 4.01 -0.64 -1.37 117.16 113.36 1gjq n TYR 82 Ca -0.08 0.16 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 1gjq n TYR 82 Cb 0.26 -0.72 0.00 0.00 -0.31 0.00 0.00 39.34 38.57 1gjq n TYR 82 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gjq n GLY 83 N 1.25 -0.80 3.15 2.72 0.00 0.12 -4.37 105.19 107.26 1gjq n GLY 83 Ca -0.01 -1.12 -0.09 0.00 0.00 0.00 0.00 46.02 44.79 1gjq n GLY 83 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gjq s THR 84 N 0.00 0.20 -1.20 2.61 -4.23 -0.61 -4.90 115.64 107.51 1gjq s THR 84 Ca 0.00 -1.90 0.30 0.00 -1.18 0.00 0.00 61.69 58.91 1gjq s THR 84 Cb 0.00 -1.93 0.37 0.00 1.34 0.00 0.00 72.50 72.27 1gjq s THR 84 CO 0.00 -0.59 1.98 -0.81 -0.54 0.00 0.00 174.62 174.66 1gjq n PRO 85 N -0.06 0.20 -0.63 3.99 -0.04 -1.26 -3.51 135.00 133.68 1gjq n PRO 85 Ca -0.08 -0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.27 1gjq n PRO 85 Cb 0.63 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.70 1gjq n PRO 85 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1gjq n LEU 86 N -1.40 4.81 0.00 1.53 4.77 -1.26 -4.80 117.00 120.65 1gjq n LEU 86 Ca 0.10 -2.52 0.00 0.00 -0.03 0.00 0.00 56.01 53.57 1gjq n LEU 86 Cb 0.30 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 1gjq n LEU 86 CO 0.25 0.75 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 1gjq n GLY 87 N -0.29 1.04 3.45 -0.72 0.00 -1.26 -5.09 105.19 102.33 1gjq n GLY 87 Ca 0.30 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.90 1gjq n GLY 87 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1gjq s MET 88 N -0.86 3.04 0.50 1.61 0.00 -1.23 -5.00 119.30 117.36 1gjq s MET 88 Ca 0.00 -0.96 -0.23 0.00 0.00 0.00 0.00 55.69 54.51 1gjq s MET 88 Cb 0.00 -3.88 -0.06 0.00 0.00 0.00 0.00 34.83 30.89 1gjq s MET 88 CO 0.00 -0.67 1.31 -1.25 0.00 0.00 0.00 175.02 174.41 1gjq s PRO 89 N 1.66 3.42 -0.55 4.11 0.04 -1.26 -1.57 135.00 140.85 1gjq s PRO 89 Ca 0.05 2.13 -0.25 0.00 0.04 0.00 0.00 61.00 62.96 1gjq s PRO 89 Cb -0.19 -2.38 0.04 0.00 0.04 0.00 0.00 34.50 32.01 1gjq s PRO 89 CO 0.09 -0.94 1.01 0.54 0.04 0.00 0.00 177.00 177.74 1gjq s ASN 90 N -0.99 6.39 0.32 6.66 4.22 -1.26 -4.18 114.94 126.09 1gjq s ASN 90 Ca 0.67 -0.17 0.21 0.00 -2.14 0.00 0.00 52.86 51.44 1gjq s ASN 90 Cb -0.38 -2.47 0.16 0.00 1.28 0.00 0.00 41.25 39.84 1gjq s ASN 90 CO 0.45 -1.27 1.35 -0.50 -2.04 0.00 0.00 177.10 175.10 1gjq h TRP 91 N 9.34 0.00 0.02 1.54 4.06 -1.06 -3.29 115.95 126.56 1gjq h TRP 91 Ca -0.26 0.00 -0.39 0.00 2.06 0.00 0.00 58.89 60.30 1gjq h TRP 91 Cb 1.07 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 29.17 1gjq h TRP 91 CO 0.94 0.12 -2.25 0.41 -3.56 0.00 0.00 178.44 174.10 1gjq n GLY 92 N 1.17 -0.50 0.23 1.49 0.00 -0.47 -1.12 105.19 105.98 1gjq n GLY 92 Ca 0.01 -0.13 0.05 0.00 0.00 0.00 0.00 46.02 45.95 1gjq n GLY 92 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1gjq h SER 93 N -0.52 0.04 0.54 1.61 0.02 -1.61 -1.64 113.55 111.99 1gjq h SER 93 Ca -0.57 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.37 1gjq h SER 93 Cb 1.72 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.25 1gjq h SER 93 CO -0.21 0.21 -0.22 -1.54 -1.14 0.00 0.00 176.83 173.93 1gjq n SER 94 N -4.32 0.43 -0.64 3.07 3.41 -1.24 -4.94 113.62 109.39 1gjq n SER 94 Ca -0.02 -0.26 -0.08 0.00 -0.26 0.00 0.00 58.87 58.25 1gjq n SER 94 Cb 0.24 -0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 64.11 1gjq n SER 94 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gjq n GLY 95 N 1.40 1.01 0.20 5.00 0.00 -0.62 -4.91 105.19 107.27 1gjq n GLY 95 Ca 0.10 -0.53 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 1gjq n GLY 95 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1gjq h GLU 96 N 0.07 0.65 -6.63 1.61 4.39 -1.71 -3.45 114.58 109.50 1gjq h GLU 96 Ca -0.17 -0.37 -0.64 0.00 0.34 0.00 0.00 59.36 58.52 1gjq h GLU 96 Cb 0.60 0.03 -0.22 0.00 -0.10 0.00 0.00 28.75 29.06 1gjq h GLU 96 CO 0.25 0.98 -0.85 -0.51 -1.16 0.00 0.00 179.01 177.72 1gjq s LEU 97 N -8.92 2.32 0.68 1.33 1.43 -0.28 -5.06 118.68 110.17 1gjq s LEU 97 Ca -0.12 -0.73 -0.07 0.00 -1.03 0.00 0.00 54.13 52.17 1gjq s LEU 97 Cb 0.08 -1.10 0.04 0.00 0.03 0.00 0.00 46.19 45.24 1gjq s LEU 97 CO 0.82 0.13 1.00 -0.94 0.23 0.00 0.00 176.35 177.60 1gjq s SER 98 N -2.04 5.12 0.34 2.29 1.04 -1.26 -4.50 113.70 114.70 1gjq s SER 98 Ca 0.12 0.65 0.03 0.00 0.48 0.00 0.00 55.95 57.22 1gjq s SER 98 Cb -0.10 -1.42 0.63 0.00 0.10 0.00 0.00 66.02 65.23 1gjq s SER 98 CO 0.06 -1.42 1.98 0.11 0.98 0.00 0.00 173.24 174.95 1gjq h LYS 99 N -0.50 0.86 -0.46 4.02 1.79 -1.97 -1.38 116.57 118.92 1gjq h LYS 99 Ca -0.45 -0.05 -0.11 0.00 -2.18 0.00 0.00 60.65 57.85 1gjq h LYS 99 Cb 1.29 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 31.73 1gjq h LYS 99 CO 0.61 0.57 -0.16 0.93 -1.08 0.00 0.00 179.45 180.32 1gjq h GLU 100 N 0.88 0.92 -0.31 3.15 3.07 -1.99 -1.87 114.58 118.43 1gjq h GLU 100 Ca 0.29 -0.37 -0.18 0.00 -0.50 0.00 0.00 59.36 58.60 1gjq h GLU 100 Cb 0.05 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1gjq h GLU 100 CO -0.08 1.03 -0.50 1.96 -1.40 0.00 0.00 179.01 180.01 1gjq h GLN 101 N 0.76 0.88 -0.29 2.33 4.20 -1.80 -2.29 115.11 118.90 1gjq h GLN 101 Ca 0.11 -0.53 -0.09 0.00 0.06 0.00 0.00 58.65 58.20 1gjq h GLN 101 Cb 0.72 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.54 1gjq h GLN 101 CO 0.06 1.17 -0.19 0.82 -0.67 0.00 0.00 178.83 180.02 1gjq h ILE 102 N 0.69 1.25 -0.35 2.54 2.04 -1.23 0.38 117.51 122.83 1gjq h ILE 102 Ca 0.03 -1.17 -0.13 0.00 1.00 0.00 0.00 64.86 64.58 1gjq h ILE 102 Cb 1.11 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 38.41 1gjq h ILE 102 CO 0.11 0.38 -0.31 0.74 0.00 0.00 0.00 178.15 179.08 1gjq h THR 103 N 0.48 1.28 -0.13 -0.27 2.02 -1.27 -0.50 112.91 114.52 1gjq h THR 103 Ca 0.08 -1.45 -0.13 0.00 0.77 0.00 0.00 66.41 65.68 1gjq h THR 103 Cb 0.60 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 1gjq h THR 103 CO 0.04 0.48 -0.51 -0.07 0.37 0.00 0.00 175.52 175.83 1gjq h LEU 104 N 0.63 0.37 -0.28 2.58 3.38 -0.89 -2.05 115.31 119.06 1gjq h LEU 104 Ca 0.07 -0.18 -0.20 0.00 0.09 0.00 0.00 57.88 57.66 1gjq h LEU 104 Cb 0.83 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1gjq h LEU 104 CO 0.07 0.81 -0.64 0.24 0.09 0.00 0.00 178.44 179.01 1gjq h MET 105 N 0.27 0.79 -0.29 1.13 2.86 -0.61 -0.95 114.93 118.12 1gjq h MET 105 Ca 0.01 -0.55 -0.08 0.00 -2.06 0.00 0.00 59.70 57.02 1gjq h MET 105 Cb 0.98 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.72 1gjq h MET 105 CO 0.08 1.18 -0.15 0.00 1.06 0.00 0.00 176.91 179.08 1gjq h ALA 106 N 0.69 1.20 -0.15 6.32 0.00 -0.99 -2.22 119.26 124.11 1gjq h ALA 106 Ca -0.01 -0.29 -0.20 0.00 0.00 0.00 0.00 54.91 54.41 1gjq h ALA 106 Cb 1.25 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.91 1gjq h ALA 106 CO 0.13 0.51 -0.68 0.87 0.00 0.00 0.00 179.25 180.09 1gjq h LYS 107 N 0.46 0.73 0.38 0.00 1.57 -1.29 -3.34 116.57 115.08 1gjq h LYS 107 Ca 0.08 -0.58 -0.02 0.00 -1.87 0.00 0.00 60.65 58.26 1gjq h LYS 107 Cb 0.54 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1gjq h LYS 107 CO 0.03 1.19 -0.18 -0.92 -0.57 0.00 0.00 179.45 179.00 1gjq h TYR 108 N 0.43 -0.48 0.00 -1.35 3.20 -0.92 -2.99 116.97 114.86 1gjq h TYR 108 Ca -0.04 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.82 1gjq h TYR 108 Cb 1.31 0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.74 1gjq h TYR 108 CO 0.09 -0.25 0.00 0.44 -1.64 0.00 0.00 178.16 176.81 1gjq n ILE 109 N -5.28 0.56 0.94 1.81 -5.35 -0.86 -1.13 119.36 110.04 1gjq n ILE 109 Ca -0.11 0.14 0.11 0.00 -0.27 0.00 0.00 62.75 62.62 1gjq n ILE 109 Cb 0.24 -1.06 0.06 0.00 -1.74 0.00 0.00 39.64 37.15 1gjq n ILE 109 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1gjq n GLN 110 N -1.17 0.04 -3.04 6.28 6.02 -1.13 -4.06 117.38 120.33 1gjq n GLN 110 Ca 0.03 -0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.79 1gjq n GLN 110 Cb 0.03 -1.51 0.01 0.00 1.02 0.00 0.00 30.24 29.79 1gjq n GLN 110 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1gjq s HIS 111 N -3.03 3.20 0.22 1.08 3.76 -0.29 -4.58 115.29 115.65 1gjq s HIS 111 Ca 0.09 0.17 -0.31 0.00 -0.15 0.00 0.00 55.06 54.85 1gjq s HIS 111 Cb 0.16 -2.28 -0.11 0.00 1.11 0.00 0.00 32.58 31.47 1gjq s HIS 111 CO 0.79 -0.32 1.56 0.99 -0.85 0.00 0.00 174.74 176.91 1gjq s THR 112 N -2.51 2.44 0.13 1.30 2.01 -1.26 -4.49 115.64 113.26 1gjq s THR 112 Ca 0.48 0.34 -0.33 0.00 0.31 0.00 0.00 61.69 62.49 1gjq s THR 112 Cb -0.10 -3.22 -0.12 0.00 0.01 0.00 0.00 72.50 69.07 1gjq s THR 112 CO 0.37 0.04 1.71 -2.65 -0.69 0.00 0.00 174.62 173.40 1gjq n PRO 113 N 3.23 2.43 -1.81 4.92 -0.02 -1.26 -4.92 135.00 137.57 1gjq n PRO 113 Ca 0.11 0.88 -0.40 0.00 -2.02 0.00 0.00 63.50 62.07 1gjq n PRO 113 Cb 0.38 -2.70 0.01 0.00 -0.02 0.00 0.00 33.50 31.16 1gjq n PRO 113 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1gjq s PRO 114 N 1.82 3.91 -0.13 0.52 0.02 -1.26 -4.96 135.00 134.93 1gjq s PRO 114 Ca 0.81 2.49 -0.29 0.00 0.02 0.00 0.00 61.00 64.03 1gjq s PRO 114 Cb -0.60 -2.82 -0.01 0.00 0.02 0.00 0.00 34.50 31.09 1gjq s PRO 114 CO 0.38 -0.66 0.97 -0.65 -0.33 0.00 0.00 177.00 176.72 1gjq s GLN 115 N -2.26 4.39 0.55 5.54 -1.52 -1.26 -4.95 119.66 120.15 1gjq s GLN 115 Ca 0.57 1.31 -0.10 0.00 -1.95 0.00 0.00 55.36 55.18 1gjq s GLN 115 Cb -0.45 -3.56 -0.05 0.00 -0.22 0.00 0.00 33.01 28.74 1gjq s GLN 115 CO 0.60 -0.34 0.94 -1.25 -0.25 0.00 0.00 175.29 174.99 1gjq s PRO 116 N 2.12 3.64 0.68 2.91 0.05 -1.26 -5.06 135.00 138.08 1gjq s PRO 116 Ca 0.46 0.61 -0.12 0.00 0.05 0.00 0.00 61.00 62.00 1gjq s PRO 116 Cb -0.18 -2.19 0.00 0.00 0.05 0.00 0.00 34.50 32.19 1gjq s PRO 116 CO 0.16 -0.40 1.06 -1.25 0.05 0.00 0.00 177.00 176.62 1gjq s PRO 117 N -4.82 2.99 0.64 0.56 0.04 -1.26 -5.07 135.00 128.08 1gjq s PRO 117 Ca 0.53 1.01 0.01 0.00 0.04 0.00 0.00 61.00 62.59 1gjq s PRO 117 Cb -0.11 -2.00 0.09 0.00 0.04 0.00 0.00 34.50 32.53 1gjq s PRO 117 CO 0.47 -1.06 0.89 -1.21 0.04 0.00 0.00 177.00 176.13 1gjq s GLU 118 N -4.85 2.06 -0.37 4.56 0.41 -1.26 -4.76 118.70 114.49 1gjq s GLU 118 Ca 0.59 -1.06 0.05 0.00 -0.41 0.00 0.00 54.97 54.14 1gjq s GLU 118 Cb -0.14 -2.43 0.17 0.00 -1.78 0.00 0.00 34.13 29.95 1gjq s GLU 118 CO 0.51 -1.12 0.49 -0.46 -0.49 0.00 0.00 175.26 174.20 1gjq s TRP 119 N -2.95 -1.04 0.00 1.61 -0.11 -1.26 -5.02 118.94 110.18 1gjq s TRP 119 Ca 0.63 -0.14 0.00 0.00 1.22 0.00 0.00 56.10 57.81 1gjq s TRP 119 Cb -0.07 -0.05 0.00 0.00 -1.50 0.00 0.00 33.47 31.85 1gjq s TRP 119 CO 0.42 -1.06 0.00 0.41 -4.62 0.00 0.00 176.95 172.10 1gjq n GLY 120 N 4.53 2.80 0.32 5.86 0.00 -1.26 -4.87 105.19 112.56 1gjq n GLY 120 Ca 0.09 -2.02 -0.02 0.00 0.00 0.00 0.00 46.02 44.07 1gjq n GLY 120 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1gjq h MET 121 N 0.00 1.03 -0.50 1.61 4.05 -2.00 -1.24 114.93 117.88 1gjq h MET 121 Ca 0.00 -0.06 0.01 0.00 -0.28 0.00 0.00 59.70 59.37 1gjq h MET 121 Cb 0.00 -0.23 -0.03 0.00 -0.80 0.00 0.00 31.60 30.54 1gjq h MET 121 CO 0.00 0.68 0.32 -1.35 0.23 0.00 0.00 176.91 176.79 1gjq h PRO 122 N 1.06 0.62 -0.39 0.39 0.11 -1.99 0.03 132.00 131.83 1gjq h PRO 122 Ca 0.32 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.28 1gjq h PRO 122 Cb -0.03 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 1gjq h PRO 122 CO -0.10 0.41 -0.24 0.93 -0.21 0.00 0.00 178.00 178.79 1gjq h GLU 123 N 0.64 0.78 -0.42 1.05 3.07 -1.90 -1.59 114.58 116.20 1gjq h GLU 123 Ca 0.19 -0.33 -0.10 0.00 -0.50 0.00 0.00 59.36 58.62 1gjq h GLU 123 Cb -0.04 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.83 1gjq h GLU 123 CO -0.06 0.95 -0.14 1.98 -1.40 0.00 0.00 179.01 180.33 1gjq h MET 124 N 0.68 0.85 -0.15 2.33 4.05 -0.96 -2.20 114.93 119.52 1gjq h MET 124 Ca 0.09 -0.34 -0.14 0.00 -0.28 0.00 0.00 59.70 59.03 1gjq h MET 124 Cb 0.76 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.51 1gjq h MET 124 CO 0.06 0.98 -0.49 0.00 0.23 0.00 0.00 176.91 177.69 1gjq h ARG 125 N 0.67 0.40 -0.60 0.39 3.08 -0.90 -1.75 114.38 115.66 1gjq h ARG 125 Ca 0.10 -0.23 -0.07 0.00 0.07 0.00 0.00 59.98 59.85 1gjq h ARG 125 Cb 0.69 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.73 1gjq h ARG 125 CO 0.05 0.80 0.09 1.49 -1.07 0.00 0.00 179.97 181.33 1gjq h GLU 126 N 0.32 0.98 0.00 0.04 4.57 -1.18 -2.76 114.58 116.55 1gjq h GLU 126 Ca 0.02 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 57.94 1gjq h GLU 126 Cb 0.97 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.44 1gjq h GLU 126 CO 0.08 0.92 -0.10 0.66 -1.18 0.00 0.00 179.01 179.39 1gjq h SER 127 N 0.93 0.00 -2.99 1.04 4.64 -1.19 -3.46 113.55 112.52 1gjq h SER 127 Ca 0.19 -0.01 -0.53 0.00 -0.47 0.00 0.00 61.79 60.97 1gjq h SER 127 Cb 0.42 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.53 1gjq h SER 127 CO 0.01 0.00 0.74 0.86 -0.87 0.00 0.00 176.83 177.58 1gjq s TRP 128 N -3.20 3.17 -0.01 4.77 -0.00 -0.68 -4.32 118.94 118.67 1gjq s TRP 128 Ca 0.07 0.93 0.00 0.00 -0.00 0.00 0.00 56.10 57.10 1gjq s TRP 128 Cb 0.07 -3.68 0.01 0.00 -0.00 0.00 0.00 33.47 29.88 1gjq s TRP 128 CO 0.67 -2.39 0.01 0.15 -0.00 0.00 0.00 176.95 175.38 1gjq s LYS 129 N 1.35 0.08 -0.37 5.86 1.02 -0.33 -4.99 119.74 122.36 1gjq s LYS 129 Ca 0.64 0.06 -0.06 0.00 0.02 0.00 0.00 55.97 56.64 1gjq s LYS 129 Cb -0.36 -0.21 0.07 0.00 -0.52 0.00 0.00 37.83 36.81 1gjq s LYS 129 CO 0.30 -0.07 0.16 0.08 -0.92 0.00 0.00 175.35 174.89 1gjq s VAL 130 N 0.53 3.69 -0.01 3.17 1.01 -1.26 -1.48 120.40 126.05 1gjq s VAL 130 Ca -0.05 -1.44 -0.21 0.00 0.00 0.00 0.00 61.98 60.28 1gjq s VAL 130 Cb -0.07 -3.23 -0.24 0.00 0.00 0.00 0.00 36.38 32.84 1gjq s VAL 130 CO -0.01 -0.37 1.07 -0.07 0.00 0.00 0.00 175.10 175.71 1gjq h LEU 131 N 8.21 0.47 -7.69 3.92 3.38 -0.90 -3.43 115.31 119.27 1gjq h LEU 131 Ca -0.21 -0.78 -0.58 0.00 0.09 0.00 0.00 57.88 56.41 1gjq h LEU 131 Cb 1.07 -0.14 -0.37 0.00 0.09 0.00 0.00 40.66 41.30 1gjq h LEU 131 CO 0.66 1.19 -0.80 -0.69 0.09 0.00 0.00 178.44 178.88 1gjq s VAL 132 N -3.12 1.30 0.51 1.22 1.01 -0.88 -5.01 120.40 115.43 1gjq s VAL 132 Ca -0.14 -0.74 -0.23 0.00 0.00 0.00 0.00 61.98 60.87 1gjq s VAL 132 Cb 0.03 -1.43 -0.06 0.00 0.00 0.00 0.00 36.38 34.92 1gjq s VAL 132 CO 0.81 0.17 1.40 -0.54 0.00 0.00 0.00 175.10 176.93 1gjq s LYS 133 N 1.55 3.35 0.46 2.72 1.02 -1.26 -4.82 119.74 122.75 1gjq s LYS 133 Ca 0.00 2.34 0.19 0.00 0.02 0.00 0.00 55.97 58.53 1gjq s LYS 133 Cb -0.15 -2.42 1.17 0.00 -0.52 0.00 0.00 37.83 35.91 1gjq s LYS 133 CO -0.08 -1.06 1.93 -1.35 -0.92 0.00 0.00 175.35 173.87 1gjq h PRO 134 N 1.80 0.27 -0.24 -1.68 0.11 -1.95 -0.95 132.00 129.36 1gjq h PRO 134 Ca -0.51 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.48 1gjq h PRO 134 Cb 1.29 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1gjq h PRO 134 CO 0.59 0.18 -0.30 0.93 -0.21 0.00 0.00 178.00 179.18 1gjq h GLU 135 N 0.28 0.49 -0.38 1.05 5.08 -2.00 -3.12 114.58 115.98 1gjq h GLU 135 Ca 0.35 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1gjq h GLU 135 Cb 0.96 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1gjq h GLU 135 CO -0.08 0.74 0.00 -0.25 -1.00 0.00 0.00 179.01 178.42 1gjq n ASP 136 N -4.09 2.85 -4.90 1.42 8.00 -0.39 -4.95 116.55 114.49 1gjq n ASP 136 Ca -0.01 -1.92 -0.28 0.00 0.71 0.00 0.00 54.79 53.29 1gjq n ASP 136 Cb 0.44 -0.25 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 1gjq n ASP 136 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1gjq s ARG 137 N -1.51 3.53 0.96 -1.24 0.52 -1.00 -4.90 118.95 115.31 1gjq s ARG 137 Ca 0.37 0.31 -0.11 0.00 -0.52 0.00 0.00 55.73 55.78 1gjq s ARG 137 Cb 0.20 -2.31 0.16 0.00 0.52 0.00 0.00 34.95 33.52 1gjq s ARG 137 CO 0.29 -0.30 1.03 -2.30 0.02 0.00 0.00 175.30 174.03 1gjq n PRO 138 N -2.38 -0.73 -0.00 3.54 -0.02 -1.26 -4.96 135.00 129.18 1gjq n PRO 138 Ca 0.02 -0.16 0.09 0.00 -2.02 0.00 0.00 63.50 61.43 1gjq n PRO 138 Cb 0.55 -2.28 -0.12 0.00 -0.02 0.00 0.00 33.50 31.63 1gjq n PRO 138 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1gjq n LYS 139 N -4.04 0.94 -3.99 -0.52 4.76 -1.26 -5.02 118.16 109.03 1gjq n LYS 139 Ca 0.10 -0.07 -0.11 0.00 -2.87 0.00 0.00 58.31 55.36 1gjq n LYS 139 Cb 0.53 -1.37 -0.04 0.00 -1.84 0.00 0.00 35.03 32.31 1gjq n LYS 139 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 1gjq s LYS 140 N -2.91 1.75 -0.38 1.97 -2.85 -1.26 -5.12 119.74 110.95 1gjq s LYS 140 Ca 0.01 -1.42 -0.29 0.00 -1.00 0.00 0.00 55.97 53.27 1gjq s LYS 140 Cb 0.12 0.49 -0.00 0.00 -2.06 0.00 0.00 37.83 36.38 1gjq s LYS 140 CO 0.72 -0.75 1.60 -1.14 0.10 0.00 0.00 175.35 175.89 1gjq s GLN 141 N -3.50 3.44 0.00 1.78 0.74 -1.26 -4.81 119.66 116.04 1gjq s GLN 141 Ca 0.23 1.16 0.18 0.00 0.05 0.00 0.00 55.36 56.98 1gjq s GLN 141 Cb -0.01 -4.11 0.83 0.00 1.10 0.00 0.00 33.01 30.82 1gjq s GLN 141 CO 0.13 -1.73 1.57 1.28 -0.55 0.00 0.00 175.29 175.99 1gjq n LEU 142 N 9.58 0.89 -4.55 3.68 4.77 -0.10 -4.87 117.00 126.40 1gjq n LEU 142 Ca 0.19 -0.38 -0.25 0.00 -0.03 0.00 0.00 56.01 55.54 1gjq n LEU 142 Cb 0.47 -0.06 -0.11 0.00 -2.33 0.00 0.00 43.42 41.39 1gjq n LEU 142 CO 0.70 0.19 -0.28 0.54 -1.33 0.00 0.00 177.39 177.20 1gjq s ASN 143 N -1.51 3.20 -0.28 -1.43 2.20 -1.26 -4.57 114.94 111.30 1gjq s ASN 143 Ca 0.28 -1.38 0.10 0.00 -0.94 0.00 0.00 52.86 50.92 1gjq s ASN 143 Cb 0.14 -0.24 0.52 0.00 -2.00 0.00 0.00 41.25 39.67 1gjq s ASN 143 CO 0.22 -0.53 1.48 0.47 -2.94 0.00 0.00 177.10 175.81 1gjq n ASP 144 N -0.85 2.86 -4.82 3.54 8.00 -1.26 -5.02 116.55 119.00 1gjq n ASP 144 Ca -0.04 -3.60 -0.33 0.00 0.71 0.00 0.00 54.79 51.53 1gjq n ASP 144 Cb 0.67 -0.63 -0.05 0.00 -0.02 0.00 0.00 41.12 41.09 1gjq n ASP 144 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1gjq s LEU 145 N -3.16 3.83 -1.15 0.64 1.43 -1.26 -4.97 118.68 114.04 1gjq s LEU 145 Ca 0.45 1.75 -0.14 0.00 -1.03 0.00 0.00 54.13 55.16 1gjq s LEU 145 Cb 0.40 -4.54 0.18 0.00 0.03 0.00 0.00 46.19 42.25 1gjq s LEU 145 CO 0.02 -0.58 1.35 -0.62 0.23 0.00 0.00 176.35 176.75 1gjq s ASP 146 N -2.31 7.04 0.28 2.29 2.15 -1.26 -4.87 116.67 119.99 1gjq s ASP 146 Ca 0.63 -2.94 0.01 0.00 0.43 0.00 0.00 52.55 50.69 1gjq s ASP 146 Cb -0.12 -2.38 0.58 0.00 -0.30 0.00 0.00 42.92 40.71 1gjq s ASP 146 CO 0.20 -0.73 1.80 -0.07 -0.17 0.00 0.00 175.17 176.19 1gjq h LEU 147 N 9.43 0.75 -2.33 -1.34 3.38 -1.97 -1.68 115.31 121.55 1gjq h LEU 147 Ca 0.28 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.31 1gjq h LEU 147 Cb 0.90 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1gjq h LEU 147 CO 1.19 0.35 -0.04 -0.65 0.09 0.00 0.00 178.44 179.38 1gjq h PRO 148 N 0.81 0.00 -0.65 1.13 0.11 -1.94 -2.34 132.00 129.12 1gjq h PRO 148 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.61 1gjq h PRO 148 Cb 0.63 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.74 1gjq h PRO 148 CO -0.32 0.04 0.00 -1.71 -0.21 0.00 0.00 178.00 175.80 1gjq n ASN 149 N -3.64 4.50 -4.85 -2.05 5.15 -0.64 -1.74 115.26 111.99 1gjq n ASN 149 Ca -0.02 -2.34 -0.32 0.00 -0.60 0.00 0.00 54.58 51.29 1gjq n ASN 149 Cb 0.14 -0.54 -0.01 0.00 -0.53 0.00 0.00 39.78 38.83 1gjq n ASN 149 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1gjq s LEU 150 N -1.65 3.44 -0.05 1.20 2.96 -0.88 -2.18 118.68 121.53 1gjq s LEU 150 Ca 0.49 1.50 0.04 0.00 -0.22 0.00 0.00 54.13 55.95 1gjq s LEU 150 Cb 0.31 -4.49 -0.00 0.00 0.50 0.00 0.00 46.19 42.50 1gjq s LEU 150 CO 0.26 -0.72 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.03 1gjq s PHE 151 N -2.88 1.82 -0.47 5.38 0.40 -0.61 -1.51 117.98 120.11 1gjq s PHE 151 Ca 0.57 -0.56 -0.12 0.00 -0.60 0.00 0.00 56.93 56.22 1gjq s PHE 151 Cb -0.10 -1.23 0.10 0.00 0.51 0.00 0.00 43.02 42.29 1gjq s PHE 151 CO 0.42 -0.20 0.37 0.45 0.70 0.00 0.00 175.22 176.96 1gjq s SER 152 N 0.09 5.92 -0.17 1.36 0.15 0.13 -1.61 113.70 119.57 1gjq s SER 152 Ca -0.06 -1.63 -0.08 0.00 0.70 0.00 0.00 55.95 54.88 1gjq s SER 152 Cb -0.13 -2.10 -0.04 0.00 -1.71 0.00 0.00 66.02 62.04 1gjq s SER 152 CO 0.03 -0.68 0.09 -0.69 1.20 0.00 0.00 173.24 173.19 1gjq s VAL 153 N 1.51 5.09 -0.12 4.45 1.01 -0.49 -0.88 120.40 130.96 1gjq s VAL 153 Ca 0.04 0.07 -0.24 0.00 0.00 0.00 0.00 61.98 61.85 1gjq s VAL 153 Cb -0.26 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 1gjq s VAL 153 CO 0.03 0.49 0.77 -0.89 0.00 0.00 0.00 175.10 175.50 1gjq s THR 154 N 0.05 4.96 -1.01 3.92 2.01 0.28 -0.62 115.64 125.23 1gjq s THR 154 Ca 0.07 1.54 -0.04 0.00 0.31 0.00 0.00 61.69 63.57 1gjq s THR 154 Cb -0.12 -4.09 0.27 0.00 0.01 0.00 0.00 72.50 68.57 1gjq s THR 154 CO 0.00 0.13 1.11 0.18 -0.69 0.00 0.00 174.62 175.35 1gjq n LEU 155 N 4.59 5.31 0.00 4.42 4.77 -0.20 -2.30 117.00 133.58 1gjq n LEU 155 Ca 0.02 -5.16 0.00 0.00 -0.03 0.00 0.00 56.01 50.84 1gjq n LEU 155 Cb 0.50 -1.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.35 1gjq n LEU 155 CO 0.47 1.58 0.13 -1.14 -1.33 0.00 0.00 177.39 177.11 1gjq n ARG 156 N 1.97 0.00 0.29 3.23 0.63 -0.79 -2.51 116.66 119.48 1gjq n ARG 156 Ca 0.25 0.26 0.20 0.00 -0.92 0.00 0.00 57.85 57.64 1gjq n ARG 156 Cb 0.37 -0.56 1.01 0.00 0.45 0.00 0.00 32.46 33.73 1gjq n ARG 156 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1gjq h ASP 157 N 0.00 0.00 0.96 6.15 5.19 -1.81 -2.20 116.42 124.71 1gjq h ASP 157 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1gjq h ASP 157 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1gjq h ASP 157 CO 0.00 0.00 -0.32 0.00 -3.12 0.00 0.00 179.24 175.80 1gjq n ALA 158 N -2.01 2.78 -3.26 3.45 0.00 -1.04 -4.92 120.51 115.51 1gjq n ALA 158 Ca -0.02 -0.19 -0.18 0.00 0.00 0.00 0.00 53.44 53.06 1gjq n ALA 158 Cb 0.10 -1.29 0.06 0.00 0.00 0.00 0.00 19.45 18.31 1gjq n ALA 158 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gjq n GLY 159 N 1.40 -0.16 3.26 0.00 0.00 -0.85 -4.95 105.19 103.89 1gjq n GLY 159 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1gjq n GLY 159 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gjq s GLN 160 N -5.92 1.37 0.05 1.61 -0.21 -1.12 -1.43 119.66 114.01 1gjq s GLN 160 Ca 0.41 -1.68 0.03 0.00 0.02 0.00 0.00 55.36 54.14 1gjq s GLN 160 Cb -0.18 0.30 -0.03 0.00 1.00 0.00 0.00 33.01 34.11 1gjq s GLN 160 CO 0.51 -0.48 -0.09 0.96 -2.12 0.00 0.00 175.29 174.07 1gjq s ILE 161 N -3.96 0.67 -0.05 1.08 -5.25 -0.86 -1.04 121.20 111.80 1gjq s ILE 161 Ca 0.38 -1.14 0.06 0.00 -0.99 0.00 0.00 60.65 58.95 1gjq s ILE 161 Cb 0.05 -0.72 -0.01 0.00 2.95 0.00 0.00 42.46 44.73 1gjq s ILE 161 CO 0.15 -0.35 -0.22 0.00 -1.79 0.00 0.00 174.94 172.73 1gjq s ALA 162 N -1.38 1.88 -0.36 2.27 0.00 0.21 -1.01 121.76 123.37 1gjq s ALA 162 Ca -0.08 -0.91 -0.16 0.00 0.00 0.00 0.00 51.96 50.81 1gjq s ALA 162 Cb -0.10 -0.58 -0.00 0.00 0.00 0.00 0.00 23.12 22.44 1gjq s ALA 162 CO 0.01 0.37 0.42 -0.51 0.00 0.00 0.00 175.76 176.05 1gjq s LEU 163 N -0.16 4.49 -0.20 0.00 1.43 0.13 -1.40 118.68 122.97 1gjq s LEU 163 Ca -0.02 -0.26 -0.06 0.00 -1.03 0.00 0.00 54.13 52.77 1gjq s LEU 163 Cb -0.12 -2.42 -0.03 0.00 0.03 0.00 0.00 46.19 43.65 1gjq s LEU 163 CO 0.02 -0.43 0.01 -0.69 0.23 0.00 0.00 176.35 175.50 1gjq s VAL 164 N 2.15 4.11 -0.01 -1.59 1.01 -0.63 -0.62 120.40 124.82 1gjq s VAL 164 Ca 0.14 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.56 1gjq s VAL 164 Cb -0.16 -2.86 -0.06 0.00 0.00 0.00 0.00 36.38 33.29 1gjq s VAL 164 CO 0.13 0.43 1.61 -0.62 0.00 0.00 0.00 175.10 176.64 1gjq s ASP 165 N 0.94 6.68 0.20 3.32 2.15 -0.46 -1.57 116.67 127.92 1gjq s ASP 165 Ca 0.02 2.30 -0.10 0.00 0.43 0.00 0.00 52.55 55.19 1gjq s ASP 165 Cb -0.14 -2.55 0.23 0.00 -0.30 0.00 0.00 42.92 40.16 1gjq s ASP 165 CO 0.02 -0.88 1.79 1.23 -0.17 0.00 0.00 175.17 177.16 1gjq h GLY 166 N 9.39 0.89 1.19 2.66 0.00 -1.78 -1.68 103.07 113.74 1gjq h GLY 166 Ca -0.40 -0.21 -0.34 0.00 0.00 0.00 0.00 47.33 46.38 1gjq h GLY 166 CO 0.94 0.11 -1.55 -0.55 0.00 0.00 0.00 176.54 175.48 1gjq h ASP 167 N 0.58 0.71 1.56 0.19 3.32 -1.92 -3.36 116.42 117.51 1gjq h ASP 167 Ca 0.28 -0.86 -0.05 0.00 0.02 0.00 0.00 57.03 56.43 1gjq h ASP 167 Cb 0.22 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1gjq h ASP 167 CO -0.20 1.69 -0.45 0.77 -1.72 0.00 0.00 179.24 179.33 1gjq h SER 168 N 0.12 0.00 -2.16 6.45 4.64 -1.98 -3.48 113.55 117.14 1gjq h SER 168 Ca -0.27 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 60.77 1gjq h SER 168 Cb 2.13 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 64.21 1gjq h SER 168 CO 0.23 0.22 -0.37 0.29 -0.87 0.00 0.00 176.83 176.34 1gjq n LYS 169 N -3.06 -1.45 -4.41 4.77 4.01 -0.63 -5.04 118.16 112.36 1gjq n LYS 169 Ca 0.01 0.67 -0.27 0.00 -0.51 0.00 0.00 58.31 58.21 1gjq n LYS 169 Cb 0.63 -4.93 -0.11 0.00 -0.51 0.00 0.00 35.03 30.11 1gjq n LYS 169 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1gjq s LYS 170 N -4.79 1.62 -0.11 1.97 1.02 -1.25 -4.81 119.74 113.39 1gjq s LYS 170 Ca 0.03 -1.51 -0.29 0.00 0.02 0.00 0.00 55.97 54.22 1gjq s LYS 170 Cb -0.01 -1.89 -0.01 0.00 -0.52 0.00 0.00 37.83 35.40 1gjq s LYS 170 CO 0.04 0.40 0.99 0.42 -0.92 0.00 0.00 175.35 176.28 1gjq s ILE 171 N -1.74 4.79 -0.17 2.17 1.01 -1.26 -1.36 121.20 124.63 1gjq s ILE 171 Ca 0.22 2.01 -0.05 0.00 0.00 0.00 0.00 60.65 62.83 1gjq s ILE 171 Cb -0.08 -4.30 -0.23 0.00 0.01 0.00 0.00 42.46 37.87 1gjq s ILE 171 CO 0.11 0.01 0.16 0.52 0.00 0.00 0.00 174.94 175.73 1gjq n VAL 172 N 4.55 1.67 -3.69 2.92 0.31 0.21 -4.96 118.33 119.35 1gjq n VAL 172 Ca 0.08 -0.58 -0.14 0.00 -0.01 0.00 0.00 64.34 63.69 1gjq n VAL 172 Cb 0.49 -1.67 -0.09 0.00 -0.91 0.00 0.00 33.84 31.66 1gjq n VAL 172 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1gjq s LYS 173 N -2.53 0.65 -0.16 5.55 2.47 -1.21 -5.01 119.74 119.49 1gjq s LYS 173 Ca -0.27 0.55 0.01 0.00 -1.56 0.00 0.00 55.97 54.69 1gjq s LYS 173 Cb 0.08 0.31 0.01 0.00 -1.46 0.00 0.00 37.83 36.76 1gjq s LYS 173 CO 0.70 -0.11 -0.17 0.08 0.16 0.00 0.00 175.35 176.01 1gjq s VAL 174 N -0.07 2.42 -0.05 4.02 1.01 -1.26 -0.70 120.40 125.77 1gjq s VAL 174 Ca -0.03 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.17 1gjq s VAL 174 Cb -0.03 -2.02 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 1gjq s VAL 174 CO 0.02 0.52 -0.21 -0.63 0.00 0.00 0.00 175.10 174.80 1gjq s ILE 175 N 1.01 2.44 -0.06 2.22 1.01 -0.18 -4.99 121.20 122.65 1gjq s ILE 175 Ca -0.02 -0.95 -0.30 0.00 0.00 0.00 0.00 60.65 59.39 1gjq s ILE 175 Cb -0.15 -1.91 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 1gjq s ILE 175 CO -0.04 0.58 1.25 -1.81 0.00 0.00 0.00 174.94 174.91 1gjq s ASP 176 N -0.45 6.99 0.00 3.58 1.01 -1.26 -2.03 116.67 124.51 1gjq s ASP 176 Ca 0.05 1.86 0.00 0.00 0.71 0.00 0.00 52.55 55.17 1gjq s ASP 176 Cb -0.12 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.26 1gjq s ASP 176 CO 0.01 -0.64 0.00 0.35 0.21 0.00 0.00 175.17 175.11 1gjq n THR 177 N 4.73 0.00 -2.12 -1.27 -2.24 -0.51 -4.97 114.28 107.91 1gjq n THR 177 Ca 0.12 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.62 1gjq n THR 177 Cb 0.45 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.74 1gjq n THR 177 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1gjq s GLY 178 N 0.00 1.63 0.09 3.38 0.00 -1.26 -4.75 107.32 106.40 1gjq s GLY 178 Ca 0.00 -0.62 -0.31 0.00 0.00 0.00 0.00 44.72 43.79 1gjq s GLY 178 CO 0.00 -0.26 1.36 -0.47 0.00 0.00 0.00 173.10 173.73 1gjq s TYR 179 N -3.25 3.21 -0.67 1.90 5.04 -1.26 -4.12 117.35 118.20 1gjq s TYR 179 Ca 0.58 0.99 -0.09 0.00 -2.44 0.00 0.00 57.07 56.10 1gjq s TYR 179 Cb -0.11 -3.64 0.01 0.00 0.35 0.00 0.00 41.96 38.58 1gjq s TYR 179 CO 0.48 -2.21 0.65 0.00 -1.34 0.00 0.00 175.55 173.12 1gjq n ALA 180 N 4.19 -2.66 -1.69 3.97 0.00 -1.10 -1.77 120.51 121.45 1gjq n ALA 180 Ca 0.11 0.19 -0.43 0.00 0.00 0.00 0.00 53.44 53.30 1gjq n ALA 180 Cb 0.43 -1.79 -0.03 0.00 0.00 0.00 0.00 19.45 18.05 1gjq n ALA 180 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1gjq n VAL 181 N -1.52 0.24 -0.09 0.00 0.31 -1.26 -2.32 118.33 113.69 1gjq n VAL 181 Ca -0.09 -0.04 -0.17 0.00 -0.01 0.00 0.00 64.34 64.03 1gjq n VAL 181 Cb 0.58 -1.96 -0.11 0.00 -0.91 0.00 0.00 33.84 31.43 1gjq n VAL 181 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 1gjq h HIS 182 N 7.75 0.00 -4.10 3.52 2.76 -1.50 -3.46 115.15 120.11 1gjq h HIS 182 Ca -0.46 0.00 -0.25 0.00 -2.20 0.00 0.00 60.37 57.46 1gjq h HIS 182 Cb 1.23 0.00 -0.15 0.00 1.55 0.00 0.00 27.41 30.04 1gjq h HIS 182 CO 0.74 1.18 -0.65 0.96 -1.30 0.00 0.00 177.93 178.85 1gjq s ILE 183 N -2.27 0.37 -0.04 6.26 -4.36 -1.26 -4.79 121.20 115.11 1gjq s ILE 183 Ca -0.23 -1.96 0.03 0.00 -0.26 0.00 0.00 60.65 58.23 1gjq s ILE 183 Cb 0.02 -2.19 0.00 0.00 1.25 0.00 0.00 42.46 41.54 1gjq s ILE 183 CO 0.60 -0.37 -0.13 -0.44 0.24 0.00 0.00 174.94 174.84 1gjq s SER 184 N -3.14 1.70 0.06 4.36 0.01 -1.26 -3.33 113.70 112.10 1gjq s SER 184 Ca 0.27 -0.28 0.04 0.00 1.31 0.00 0.00 55.95 57.30 1gjq s SER 184 Cb 0.07 -0.57 -0.03 0.00 0.21 0.00 0.00 66.02 65.70 1gjq s SER 184 CO 0.05 0.08 -0.12 -0.13 0.41 0.00 0.00 173.24 173.53 1gjq s ARG 185 N 0.30 0.72 0.16 12.44 1.81 -0.09 -4.97 118.95 129.31 1gjq s ARG 185 Ca -0.07 -0.87 0.04 0.00 -1.72 0.00 0.00 55.73 53.11 1gjq s ARG 185 Cb -0.12 -0.64 -0.04 0.00 -0.45 0.00 0.00 34.95 33.70 1gjq s ARG 185 CO 0.02 0.14 0.19 -1.64 -0.68 0.00 0.00 175.30 173.33 1gjq s MET 186 N -1.65 3.09 0.59 3.54 -1.94 -1.26 -0.45 119.30 121.22 1gjq s MET 186 Ca -0.05 -0.78 -0.10 0.00 -1.71 0.00 0.00 55.69 53.05 1gjq s MET 186 Cb -0.10 -2.76 -0.04 0.00 2.01 0.00 0.00 34.83 33.94 1gjq s MET 186 CO 0.02 0.50 0.98 -1.54 -0.01 0.00 0.00 175.02 174.96 1gjq s SER 187 N -3.16 6.26 0.35 3.03 1.04 -0.43 -4.71 113.70 116.07 1gjq s SER 187 Ca 0.32 1.33 0.25 0.00 0.48 0.00 0.00 55.95 58.34 1gjq s SER 187 Cb -0.10 -2.43 1.25 0.00 0.10 0.00 0.00 66.02 64.83 1gjq s SER 187 CO 0.25 -0.80 1.76 0.00 0.98 0.00 0.00 173.24 175.43 1gjq h ALA 188 N -0.15 1.00 0.00 5.32 0.00 -1.92 -1.65 119.26 121.86 1gjq h ALA 188 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1gjq h ALA 188 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1gjq h ALA 188 CO 0.62 0.00 -0.66 0.66 0.00 0.00 0.00 179.25 179.86 1gjq h SER 189 N 0.00 0.00 0.00 0.00 4.64 -1.94 -3.48 113.55 112.77 1gjq h SER 189 Ca 0.00 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1gjq h SER 189 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1gjq h SER 189 CO 0.00 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 1gjq n GLY 190 N 1.21 0.54 0.13 -0.77 0.00 -0.62 -4.93 105.19 100.74 1gjq n GLY 190 Ca 0.02 -0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 1gjq n GLY 190 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1gjq n ARG 191 N -2.92 0.65 -3.77 1.61 0.63 -1.26 -4.95 116.66 106.64 1gjq n ARG 191 Ca 0.00 0.26 -0.36 0.00 -0.92 0.00 0.00 57.85 56.83 1gjq n ARG 191 Cb 0.00 -1.58 -0.09 0.00 0.45 0.00 0.00 32.46 31.23 1gjq n ARG 191 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1gjq s TYR 192 N -2.51 3.31 -0.15 -0.14 2.02 -1.26 -1.90 117.35 116.72 1gjq s TYR 192 Ca -0.32 0.17 -0.13 0.00 -0.37 0.00 0.00 57.07 56.42 1gjq s TYR 192 Cb 0.10 -2.19 -0.05 0.00 -0.40 0.00 0.00 41.96 39.42 1gjq s TYR 192 CO 0.61 0.11 0.26 -1.17 -1.57 0.00 0.00 175.55 173.79 1gjq s LEU 193 N 0.75 4.26 -0.17 -1.29 2.96 -0.08 -1.31 118.68 123.81 1gjq s LEU 193 Ca 0.06 0.49 0.00 0.00 -0.22 0.00 0.00 54.13 54.47 1gjq s LEU 193 Cb -0.13 -2.32 0.01 0.00 0.50 0.00 0.00 46.19 44.25 1gjq s LEU 193 CO 0.02 0.15 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.27 1gjq s LEU 194 N 0.24 2.35 0.05 -0.68 1.43 0.41 -0.20 118.68 122.28 1gjq s LEU 194 Ca 0.15 -0.54 0.08 0.00 -1.03 0.00 0.00 54.13 52.79 1gjq s LEU 194 Cb -0.13 -1.54 -0.03 0.00 0.03 0.00 0.00 46.19 44.53 1gjq s LEU 194 CO 0.03 0.04 -0.22 0.68 0.23 0.00 0.00 176.35 177.12 1gjq s VAL 195 N 1.05 1.80 -0.04 -1.59 -7.23 -0.69 -0.92 120.40 112.78 1gjq s VAL 195 Ca -0.01 -1.31 0.02 0.00 -1.81 0.00 0.00 61.98 58.87 1gjq s VAL 195 Cb -0.14 -1.57 0.01 0.00 0.56 0.00 0.00 36.38 35.24 1gjq s VAL 195 CO -0.05 0.21 -0.08 -0.51 -0.31 0.00 0.00 175.10 174.36 1gjq s ILE 196 N -0.85 0.73 0.60 -0.62 2.07 -1.21 -1.22 121.20 120.70 1gjq s ILE 196 Ca 0.09 -0.27 -0.04 0.00 -1.41 0.00 0.00 60.65 59.01 1gjq s ILE 196 Cb -0.09 -0.70 0.03 0.00 0.13 0.00 0.00 42.46 41.83 1gjq s ILE 196 CO 0.02 0.25 0.88 -0.83 -1.91 0.00 0.00 174.94 173.36 1gjq s GLY 197 N 0.60 1.68 0.35 1.50 0.00 -0.25 -1.35 107.32 109.85 1gjq s GLY 197 Ca -0.10 -0.96 0.27 0.00 0.00 0.00 0.00 44.72 43.93 1gjq s GLY 197 CO 0.01 -0.65 1.80 0.07 0.00 0.00 0.00 173.10 174.33 1gjq h ARG 198 N -0.19 0.00 -0.07 2.90 0.11 -0.93 -2.19 114.38 114.01 1gjq h ARG 198 Ca -0.44 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.64 1gjq h ARG 198 Cb 1.29 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.37 1gjq h ARG 198 CO 0.58 0.00 0.00 -0.40 0.10 0.00 0.00 179.97 180.25 1gjq n ASP 199 N -2.53 0.53 -0.85 0.08 5.75 -1.25 -1.48 116.55 116.80 1gjq n ASP 199 Ca 0.02 -1.71 -0.11 0.00 -0.01 0.00 0.00 54.79 52.98 1gjq n ASP 199 Cb 0.28 -0.05 -0.05 0.00 -1.03 0.00 0.00 41.12 40.28 1gjq n ASP 199 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1gjq n ALA 200 N -0.34 -0.17 -2.69 2.12 0.00 -0.82 -4.48 120.51 114.12 1gjq n ALA 200 Ca 0.10 0.17 -0.38 0.00 0.00 0.00 0.00 53.44 53.33 1gjq n ALA 200 Cb 0.12 -1.32 -0.07 0.00 0.00 0.00 0.00 19.45 18.19 1gjq n ALA 200 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1gjq s ARG 201 N -2.98 4.26 -0.09 0.00 3.52 -1.26 -1.34 118.95 121.06 1gjq s ARG 201 Ca 0.00 0.36 -0.02 0.00 -0.13 0.00 0.00 55.73 55.94 1gjq s ARG 201 Cb 0.00 -3.49 -0.03 0.00 -1.56 0.00 0.00 34.95 29.86 1gjq s ARG 201 CO 0.00 0.03 -0.00 0.42 -0.81 0.00 0.00 175.30 174.94 1gjq s ILE 202 N 1.06 4.25 -0.05 4.11 1.01 0.73 -1.09 121.20 131.21 1gjq s ILE 202 Ca 0.23 -0.27 0.03 0.00 0.00 0.00 0.00 60.65 60.65 1gjq s ILE 202 Cb -0.15 -2.79 0.01 0.00 0.01 0.00 0.00 42.46 39.54 1gjq s ILE 202 CO 0.09 0.60 -0.14 -1.81 0.00 0.00 0.00 174.94 173.68 1gjq s ASP 203 N -0.78 1.89 -0.23 3.58 1.01 -0.36 -2.47 116.67 119.31 1gjq s ASP 203 Ca 0.12 -0.31 -0.06 0.00 0.71 0.00 0.00 52.55 53.01 1gjq s ASP 203 Cb -0.11 -0.71 -0.02 0.00 1.01 0.00 0.00 42.92 43.08 1gjq s ASP 203 CO 0.02 0.08 0.01 -0.32 0.21 0.00 0.00 175.17 175.18 1gjq s MET 204 N 0.37 3.54 -0.16 8.23 -2.45 -0.68 -1.70 119.30 126.45 1gjq s MET 204 Ca -0.10 -0.54 -0.01 0.00 -1.25 0.00 0.00 55.69 53.79 1gjq s MET 204 Cb -0.13 -3.16 -0.01 0.00 1.25 0.00 0.00 34.83 32.77 1gjq s MET 204 CO 0.03 -0.16 -0.11 0.42 1.05 0.00 0.00 175.02 176.25 1gjq s ILE 205 N 1.46 3.04 -0.43 10.11 1.01 0.72 -1.07 121.20 136.04 1gjq s ILE 205 Ca 0.05 -0.64 -0.24 0.00 0.00 0.00 0.00 60.65 59.82 1gjq s ILE 205 Cb -0.15 -2.31 0.02 0.00 0.01 0.00 0.00 42.46 40.04 1gjq s ILE 205 CO 0.01 0.50 0.85 -0.62 0.00 0.00 0.00 174.94 175.67 1gjq s ASP 206 N 0.79 6.49 0.00 3.58 2.15 -0.05 -0.90 116.67 128.73 1gjq s ASP 206 Ca -0.04 0.11 0.29 0.00 0.43 0.00 0.00 52.55 53.35 1gjq s ASP 206 Cb -0.15 -2.42 1.63 0.00 -0.30 0.00 0.00 42.92 41.69 1gjq s ASP 206 CO 0.01 -0.92 2.06 0.18 -0.17 0.00 0.00 175.17 176.33 1gjq n LEU 207 N 6.82 0.00 0.04 -1.34 4.77 -0.80 -2.93 117.00 123.57 1gjq n LEU 207 Ca 0.04 0.12 0.11 0.00 -0.03 0.00 0.00 56.01 56.26 1gjq n LEU 207 Cb 0.48 -0.12 0.04 0.00 -2.33 0.00 0.00 43.42 41.49 1gjq n LEU 207 CO 0.60 -0.01 0.05 0.79 -1.33 0.00 0.00 177.39 177.48 1gjq n TRP 208 N -1.12 0.38 -1.49 -1.77 7.02 -1.26 -4.78 117.44 114.40 1gjq n TRP 208 Ca 0.19 0.11 -0.32 0.00 -1.02 0.00 0.00 57.50 56.45 1gjq n TRP 208 Cb 0.16 -0.53 0.07 0.00 -2.42 0.00 0.00 31.31 28.59 1gjq n TRP 208 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1gjq s ALA 209 N -3.22 2.29 0.36 6.99 0.00 -1.23 -0.92 121.76 126.03 1gjq s ALA 209 Ca 0.03 0.52 0.18 0.00 0.00 0.00 0.00 51.96 52.69 1gjq s ALA 209 Cb 0.14 -3.34 1.18 0.00 0.00 0.00 0.00 23.12 21.10 1gjq s ALA 209 CO 0.79 -1.61 1.65 0.87 0.00 0.00 0.00 175.76 177.46 1gjq h LYS 210 N -0.48 0.23 -3.75 0.00 1.57 -1.93 -3.32 116.57 108.90 1gjq h LYS 210 Ca -0.46 -0.01 -0.38 0.00 -1.87 0.00 0.00 60.65 57.93 1gjq h LYS 210 Cb 1.25 -0.05 -0.35 0.00 0.08 0.00 0.00 32.23 33.16 1gjq h LYS 210 CO 0.52 0.15 -0.76 -2.00 -0.57 0.00 0.00 179.45 176.79 1gjq s GLU 211 N -5.58 0.46 -0.23 3.15 2.12 -1.26 -4.61 118.70 112.73 1gjq s GLU 211 Ca -0.09 0.06 -0.37 0.00 0.36 0.00 0.00 54.97 54.92 1gjq s GLU 211 Cb 0.31 -0.66 -0.14 0.00 0.26 0.00 0.00 34.13 33.89 1gjq s GLU 211 CO 0.79 -0.17 1.87 -2.30 -0.54 0.00 0.00 175.26 174.91 1gjq n PRO 212 N 4.41 1.46 -4.40 4.30 -0.02 -1.25 -4.97 135.00 134.53 1gjq n PRO 212 Ca -0.20 0.52 -0.21 0.00 -2.02 0.00 0.00 63.50 61.59 1gjq n PRO 212 Cb 0.50 -2.34 -0.10 0.00 -0.02 0.00 0.00 33.50 31.55 1gjq n PRO 212 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1gjq s THR 213 N 4.41 2.03 0.02 3.45 -4.23 -1.15 -4.94 115.64 115.23 1gjq s THR 213 Ca 0.99 -2.29 -0.30 0.00 -1.18 0.00 0.00 61.69 58.91 1gjq s THR 213 Cb -0.92 -2.16 -0.04 0.00 1.34 0.00 0.00 72.50 70.72 1gjq s THR 213 CO 0.59 -0.51 1.02 -0.54 -0.54 0.00 0.00 174.62 174.64 1gjq s LYS 214 N -3.59 4.55 -0.01 3.99 1.02 -1.26 -0.87 119.74 123.56 1gjq s LYS 214 Ca 0.26 1.48 0.15 0.00 0.02 0.00 0.00 55.97 57.88 1gjq s LYS 214 Cb -0.02 -3.43 -0.20 0.00 -0.52 0.00 0.00 37.83 33.65 1gjq s LYS 214 CO 0.10 -0.07 0.47 1.33 -0.92 0.00 0.00 175.35 176.26 1gjq n VAL 215 N 3.83 0.00 -3.54 3.17 0.24 -0.23 -4.48 118.33 117.31 1gjq n VAL 215 Ca 0.06 -0.26 -0.08 0.00 -2.04 0.00 0.00 64.34 62.02 1gjq n VAL 215 Cb 0.50 0.53 -0.03 0.00 -1.47 0.00 0.00 33.84 33.37 1gjq n VAL 215 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1gjq s ALA 216 N -2.77 -1.90 0.02 2.33 0.00 -1.24 -0.22 121.76 117.98 1gjq s ALA 216 Ca -0.01 1.30 -0.17 0.00 0.00 0.00 0.00 51.96 53.09 1gjq s ALA 216 Cb 0.10 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.21 1gjq s ALA 216 CO 0.63 -0.55 0.37 -1.83 0.00 0.00 0.00 175.76 174.38 1gjq s GLU 217 N -2.35 0.82 0.08 0.00 -1.05 -0.55 -1.69 118.70 113.97 1gjq s GLU 217 Ca 0.04 -0.30 -0.26 0.00 -0.15 0.00 0.00 54.97 54.30 1gjq s GLU 217 Cb -0.01 0.37 0.07 0.00 -0.44 0.00 0.00 34.13 34.12 1gjq s GLU 217 CO -0.05 -0.26 0.64 -1.50 0.95 0.00 0.00 175.26 175.04 1gjq s ILE 218 N -2.04 0.00 -0.24 1.83 2.07 -1.03 -1.19 121.20 120.60 1gjq s ILE 218 Ca -0.08 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.17 1gjq s ILE 218 Cb -0.02 -1.00 0.04 0.00 0.13 0.00 0.00 42.46 41.61 1gjq s ILE 218 CO 0.00 0.00 -0.11 -0.75 -1.91 0.00 0.00 174.94 172.17 1gjq s LYS 219 N -2.88 2.55 0.00 3.50 2.20 -1.26 -0.20 119.74 123.65 1gjq s LYS 219 Ca -0.03 -1.15 0.28 0.00 -0.36 0.00 0.00 55.97 54.71 1gjq s LYS 219 Cb -0.01 -2.86 1.04 0.00 -1.51 0.00 0.00 37.83 34.50 1gjq s LYS 219 CO -0.05 -0.46 1.74 0.44 -0.36 0.00 0.00 175.35 176.66 1gjq n ILE 220 N 4.54 0.00 -3.18 5.43 -6.64 -0.45 -4.56 119.36 114.50 1gjq n ILE 220 Ca -0.16 -0.23 0.00 0.00 -1.77 0.00 0.00 62.75 60.59 1gjq n ILE 220 Cb 0.45 0.47 0.00 0.00 -1.44 0.00 0.00 39.64 39.12 1gjq n ILE 220 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1gjq n GLY 221 N 1.19 -0.81 0.11 3.28 0.00 -1.26 -4.90 105.19 102.80 1gjq n GLY 221 Ca 0.18 -0.76 -0.14 0.00 0.00 0.00 0.00 46.02 45.30 1gjq n GLY 221 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1gjq n ILE 222 N 1.63 1.58 -3.78 -0.61 2.08 0.64 -4.60 119.36 116.30 1gjq n ILE 222 Ca 0.00 -0.72 -0.13 0.00 0.56 0.00 0.00 62.75 62.46 1gjq n ILE 222 Cb 0.00 -1.18 -0.14 0.00 -0.75 0.00 0.00 39.64 37.57 1gjq n ILE 222 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1gjq s GLU 223 N -2.55 0.11 0.25 0.38 2.12 -0.68 -4.26 118.70 114.07 1gjq s GLU 223 Ca -0.17 0.28 -0.10 0.00 0.36 0.00 0.00 54.97 55.34 1gjq s GLU 223 Cb 0.07 -0.08 -0.01 0.00 0.26 0.00 0.00 34.13 34.38 1gjq s GLU 223 CO 0.76 -0.10 0.42 0.00 -0.54 0.00 0.00 175.26 175.80 1gjq s ALA 224 N 0.71 0.07 0.00 6.30 0.00 -0.55 0.54 121.76 128.82 1gjq s ALA 224 Ca -0.05 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.84 1gjq s ALA 224 Cb -0.07 1.13 0.00 0.00 0.00 0.00 0.00 23.12 24.18 1gjq s ALA 224 CO -0.03 -0.81 0.00 0.54 0.00 0.00 0.00 175.76 175.46 1gjq n ARG 225 N -0.38 0.12 -4.32 0.00 5.12 -1.17 -4.21 116.66 111.82 1gjq n ARG 225 Ca -0.01 0.00 -0.30 0.00 -1.93 0.00 0.00 57.85 55.61 1gjq n ARG 225 Cb 0.63 -0.56 -0.11 0.00 -1.16 0.00 0.00 32.46 31.25 1gjq n ARG 225 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1gjq s SER 226 N -2.68 4.07 -0.02 0.55 0.15 -1.25 -4.30 113.70 110.22 1gjq s SER 226 Ca 0.00 -0.47 -0.04 0.00 0.70 0.00 0.00 55.95 56.14 1gjq s SER 226 Cb 0.00 -0.67 0.00 0.00 -1.71 0.00 0.00 66.02 63.64 1gjq s SER 226 CO 0.00 0.19 0.09 0.54 1.20 0.00 0.00 173.24 175.25 1gjq s VAL 227 N -1.14 0.04 0.05 4.45 0.11 -1.26 -1.32 120.40 121.33 1gjq s VAL 227 Ca 0.19 -0.32 -0.19 0.00 -2.93 0.00 0.00 61.98 58.73 1gjq s VAL 227 Cb -0.11 -0.23 0.04 0.00 -1.53 0.00 0.00 36.38 34.55 1gjq s VAL 227 CO 0.11 -0.18 0.44 -0.70 -3.33 0.00 0.00 175.10 171.44 1gjq s GLU 228 N -0.55 0.95 0.18 1.54 2.56 0.14 -4.82 118.70 118.71 1gjq s GLU 228 Ca -0.06 -0.34 0.11 0.00 0.00 0.00 0.00 54.97 54.68 1gjq s GLU 228 Cb -0.04 0.43 -0.04 0.00 2.00 0.00 0.00 34.13 36.48 1gjq s GLU 228 CO 0.00 -0.33 -0.20 0.45 -0.56 0.00 0.00 175.26 174.62 1gjq s SER 229 N -2.02 3.66 0.10 -1.70 0.15 -1.26 -0.41 113.70 112.22 1gjq s SER 229 Ca -0.05 -0.77 -0.31 0.00 0.70 0.00 0.00 55.95 55.52 1gjq s SER 229 Cb -0.01 -0.39 -0.09 0.00 -1.71 0.00 0.00 66.02 63.83 1gjq s SER 229 CO -0.02 0.12 1.58 -0.94 1.20 0.00 0.00 173.24 175.18 1gjq s SER 230 N -2.66 6.64 0.00 5.45 1.04 -0.80 -4.63 113.70 118.75 1gjq s SER 230 Ca 0.21 2.48 0.01 0.00 0.48 0.00 0.00 55.95 59.13 1gjq s SER 230 Cb -0.08 -2.57 0.02 0.00 0.10 0.00 0.00 66.02 63.48 1gjq s SER 230 CO 0.11 -0.83 0.71 0.29 0.98 0.00 0.00 173.24 174.50 1gjq n LYS 231 N 4.92 0.48 -2.51 4.02 5.02 -1.26 -4.45 118.16 124.38 1gjq n LYS 231 Ca 0.15 -0.92 -0.40 0.00 -2.02 0.00 0.00 58.31 55.11 1gjq n LYS 231 Cb 0.40 -1.03 -0.04 0.00 -0.02 0.00 0.00 35.03 34.34 1gjq n LYS 231 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1gjq s PHE 232 N -0.42 3.62 -0.06 2.13 5.36 -1.24 -4.83 117.98 122.55 1gjq s PHE 232 Ca 0.02 1.73 -0.38 0.00 -0.96 0.00 0.00 56.93 57.34 1gjq s PHE 232 Cb 0.01 -3.25 -0.16 0.00 -0.34 0.00 0.00 43.02 39.28 1gjq s PHE 232 CO 0.02 -0.43 1.50 1.63 -1.46 0.00 0.00 175.22 176.48 1gjq n LYS 233 N 1.20 1.14 -0.33 10.12 4.76 -1.26 -1.41 118.16 132.38 1gjq n LYS 233 Ca -0.01 0.41 0.00 0.00 -2.87 0.00 0.00 58.31 55.84 1gjq n LYS 233 Cb 0.45 -2.07 0.00 0.00 -1.84 0.00 0.00 35.03 31.57 1gjq n LYS 233 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1gjq n GLY 234 N 3.18 0.69 0.77 0.72 0.00 -1.26 -4.95 105.19 104.34 1gjq n GLY 234 Ca 0.22 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.29 1gjq n GLY 234 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1gjq n TYR 235 N -2.04 0.00 -1.74 1.61 4.02 -0.50 -5.04 117.16 113.47 1gjq n TYR 235 Ca 0.00 -1.29 -0.42 0.00 -0.01 0.00 0.00 57.90 56.18 1gjq n TYR 235 Cb 0.00 -0.23 -0.03 0.00 -0.02 0.00 0.00 39.34 39.06 1gjq n TYR 235 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 1gjq s GLU 236 N -2.57 4.13 -1.64 -0.72 2.02 -1.26 -2.18 118.70 116.49 1gjq s GLU 236 Ca 0.37 2.59 0.00 0.00 0.02 0.00 0.00 54.97 57.95 1gjq s GLU 236 Cb 0.37 -3.21 0.00 0.00 0.10 0.00 0.00 34.13 31.40 1gjq s GLU 236 CO -0.09 -0.77 0.00 -0.25 0.02 0.00 0.00 175.26 174.18 1gjq n ASP 237 N 4.40 -4.54 -0.04 -0.19 8.00 -1.26 -4.90 116.55 118.01 1gjq n ASP 237 Ca 0.16 0.30 -0.08 0.00 0.71 0.00 0.00 54.79 55.88 1gjq n ASP 237 Cb 0.36 -4.00 -0.07 0.00 -0.02 0.00 0.00 41.12 37.39 1gjq n ASP 237 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1gjq h ARG 238 N 0.00 -0.03 -5.18 -1.24 2.47 -1.72 -3.27 114.38 105.41 1gjq h ARG 238 Ca -0.36 0.00 -0.38 0.00 -1.26 0.00 0.00 59.98 57.98 1gjq h ARG 238 Cb 1.15 0.01 -0.21 0.00 -1.65 0.00 0.00 29.97 29.27 1gjq h ARG 238 CO 0.48 0.49 -0.77 0.71 0.56 0.00 0.00 179.97 181.44 1gjq s TYR 239 N -2.14 1.10 -0.07 3.04 2.02 -1.26 0.14 117.35 120.18 1gjq s TYR 239 Ca -0.11 -0.48 0.03 0.00 -0.37 0.00 0.00 57.07 56.15 1gjq s TYR 239 Cb -0.01 -0.62 0.01 0.00 -0.40 0.00 0.00 41.96 40.93 1gjq s TYR 239 CO 0.39 0.03 -0.15 0.99 -1.57 0.00 0.00 175.55 175.23 1gjq s THR 240 N -1.34 1.36 0.11 -0.71 2.01 -0.26 -1.90 115.64 114.91 1gjq s THR 240 Ca -0.03 -0.61 0.10 0.00 0.31 0.00 0.00 61.69 61.45 1gjq s THR 240 Cb -0.10 -1.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.16 1gjq s THR 240 CO 0.02 0.40 -0.24 -0.51 -0.69 0.00 0.00 174.62 173.60 1gjq s ILE 241 N 0.57 2.44 -0.00 1.82 2.07 0.46 0.19 121.20 128.74 1gjq s ILE 241 Ca -0.15 -1.58 -0.01 0.00 -1.41 0.00 0.00 60.65 57.49 1gjq s ILE 241 Cb -0.16 -2.07 -0.00 0.00 0.13 0.00 0.00 42.46 40.36 1gjq s ILE 241 CO 0.05 0.16 0.01 0.00 -1.91 0.00 0.00 174.94 173.25 1gjq s ALA 242 N -1.03 -0.02 -0.09 1.50 0.00 -0.72 -0.68 121.76 120.72 1gjq s ALA 242 Ca 0.15 -0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.01 1gjq s ALA 242 Cb -0.10 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 1gjq s ALA 242 CO 0.06 -0.05 -0.09 0.20 0.00 0.00 0.00 175.76 175.88 1gjq s GLY 243 N -0.37 1.63 0.11 0.00 0.00 -0.43 -1.12 107.32 107.15 1gjq s GLY 243 Ca -0.04 -0.90 0.07 0.00 0.00 0.00 0.00 44.72 43.85 1gjq s GLY 243 CO -0.00 -0.51 -0.07 0.00 0.00 0.00 0.00 173.10 172.52 1gjq s ALA 244 N -0.40 3.05 -0.20 3.20 0.00 0.40 -3.05 121.76 124.77 1gjq s ALA 244 Ca 0.05 -1.23 -0.21 0.00 0.00 0.00 0.00 51.96 50.58 1gjq s ALA 244 Cb -0.12 -0.97 -0.18 0.00 0.00 0.00 0.00 23.12 21.85 1gjq s ALA 244 CO 0.02 0.64 0.22 1.88 0.00 0.00 0.00 175.76 178.52 1gjq h TYR 245 N 3.48 0.00 -3.24 0.00 -1.99 -0.16 -2.34 116.97 112.72 1gjq h TYR 245 Ca -0.48 0.00 -0.48 0.00 2.00 0.00 0.00 58.73 59.77 1gjq h TYR 245 Cb 1.17 0.00 -0.37 0.00 2.00 0.00 0.00 36.73 39.53 1gjq h TYR 245 CO 0.61 1.29 -0.78 -0.46 -0.00 0.00 0.00 178.16 178.81 1gjq s TRP 246 N -2.33 1.04 0.68 4.88 -0.11 -0.99 -3.48 118.94 118.62 1gjq s TRP 246 Ca -0.26 -0.43 -0.15 0.00 1.22 0.00 0.00 56.10 56.48 1gjq s TRP 246 Cb 0.05 -0.99 0.01 0.00 -1.50 0.00 0.00 33.47 31.04 1gjq s TRP 246 CO 0.55 -0.40 1.12 -2.14 -4.62 0.00 0.00 176.95 171.47 1gjq s PRO 247 N 1.76 2.67 -0.79 5.86 0.02 -1.26 -0.26 135.00 143.00 1gjq s PRO 247 Ca 0.04 1.44 -0.25 0.00 0.02 0.00 0.00 61.00 62.24 1gjq s PRO 247 Cb -0.13 -1.93 -0.05 0.00 0.02 0.00 0.00 34.50 32.42 1gjq s PRO 247 CO -0.06 -1.36 1.99 -2.14 -0.33 0.00 0.00 177.00 175.10 1gjq s PRO 248 N -4.10 2.46 0.19 5.54 0.02 -1.23 -4.61 135.00 133.27 1gjq s PRO 248 Ca 0.68 0.14 -0.24 0.00 0.02 0.00 0.00 61.00 61.60 1gjq s PRO 248 Cb -0.22 -4.81 0.05 0.00 0.02 0.00 0.00 34.50 29.54 1gjq s PRO 248 CO 0.43 -3.29 0.90 1.14 -0.33 0.00 0.00 177.00 175.85 1gjq s GLN 249 N 7.27 1.37 0.12 5.54 -2.07 -1.25 -0.28 119.66 130.36 1gjq s GLN 249 Ca 0.73 -0.77 0.04 0.00 -1.82 0.00 0.00 55.36 53.54 1gjq s GLN 249 Cb -0.10 0.46 -0.04 0.00 -1.09 0.00 0.00 33.01 32.24 1gjq s GLN 249 CO 0.08 -0.63 -0.10 -0.59 -1.32 0.00 0.00 175.29 172.73 1gjq s PHE 250 N -3.38 1.14 -0.03 9.60 -0.12 -0.77 -0.45 117.98 123.97 1gjq s PHE 250 Ca 0.12 -0.75 0.01 0.00 -0.05 0.00 0.00 56.93 56.27 1gjq s PHE 250 Cb -0.03 -0.60 0.01 0.00 -0.63 0.00 0.00 43.02 41.77 1gjq s PHE 250 CO 0.04 0.02 -0.05 0.00 -0.05 0.00 0.00 175.22 175.18 1gjq s ALA 251 N -3.09 0.62 -0.19 1.99 0.00 -0.27 -1.86 121.76 118.96 1gjq s ALA 251 Ca 0.12 -0.12 -0.08 0.00 0.00 0.00 0.00 51.96 51.88 1gjq s ALA 251 Cb 0.01 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.77 1gjq s ALA 251 CO -0.00 0.04 0.08 0.42 0.00 0.00 0.00 175.76 176.30 1gjq s ILE 252 N 0.55 4.89 0.29 0.00 1.01 0.32 -1.75 121.20 126.50 1gjq s ILE 252 Ca -0.07 0.00 0.06 0.00 0.00 0.00 0.00 60.65 60.64 1gjq s ILE 252 Cb -0.11 -3.22 -0.06 0.00 0.01 0.00 0.00 42.46 39.09 1gjq s ILE 252 CO 0.00 0.44 -0.03 -0.04 0.00 0.00 0.00 174.94 175.31 1gjq s MET 253 N 0.50 1.59 0.09 2.79 -1.94 0.13 -1.46 119.30 120.99 1gjq s MET 253 Ca 0.04 -1.82 -0.31 0.00 -1.71 0.00 0.00 55.69 51.89 1gjq s MET 253 Cb -0.12 -1.11 -0.07 0.00 2.01 0.00 0.00 34.83 35.53 1gjq s MET 253 CO 0.00 -0.01 1.29 0.34 -0.01 0.00 0.00 175.02 176.63 1gjq s ASP 254 N -3.46 6.96 0.00 3.03 2.15 -0.56 -1.10 116.67 123.69 1gjq s ASP 254 Ca 0.31 2.16 0.21 0.00 0.43 0.00 0.00 52.55 55.66 1gjq s ASP 254 Cb 0.05 -2.58 1.12 0.00 -0.30 0.00 0.00 42.92 41.21 1gjq s ASP 254 CO 0.13 -0.56 1.67 0.61 -0.17 0.00 0.00 175.17 176.84 1gjq n GLY 255 N 3.35 -0.89 0.12 2.66 0.00 0.12 -0.89 105.19 109.67 1gjq n GLY 255 Ca 0.10 -0.11 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 1gjq n GLY 255 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1gjq n GLU 256 N -1.20 0.48 -0.00 1.61 -0.58 -1.23 -4.72 120.64 114.99 1gjq n GLU 256 Ca 0.12 0.12 0.04 0.00 -0.42 0.00 0.00 57.16 57.02 1gjq n GLU 256 Cb 0.14 -1.37 -0.06 0.00 -0.57 0.00 0.00 31.44 29.58 1gjq n GLU 256 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1gjq n THR 257 N -3.16 0.00 -1.40 2.62 -2.24 -1.24 -4.90 114.28 103.97 1gjq n THR 257 Ca -0.35 -0.23 -0.03 0.00 -2.27 0.00 0.00 64.05 61.16 1gjq n THR 257 Cb 0.86 0.53 -0.01 0.00 -2.10 0.00 0.00 70.33 69.61 1gjq n THR 257 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1gjq n LEU 258 N -1.60 -0.53 -4.67 3.22 4.77 -0.07 -4.77 117.00 113.34 1gjq n LEU 258 Ca -0.01 0.06 -0.42 0.00 -0.03 0.00 0.00 56.01 55.61 1gjq n LEU 258 Cb 0.20 -0.88 -0.03 0.00 -2.33 0.00 0.00 43.42 40.38 1gjq n LEU 258 CO 0.18 -0.13 1.36 -0.70 -1.33 0.00 0.00 177.39 176.77 1gjq s GLU 259 N -2.87 4.19 -0.08 3.23 2.12 -1.25 -4.57 118.70 119.47 1gjq s GLU 259 Ca 0.00 2.27 -0.29 0.00 0.36 0.00 0.00 54.97 57.31 1gjq s GLU 259 Cb 0.00 -3.81 -0.06 0.00 0.26 0.00 0.00 34.13 30.52 1gjq s GLU 259 CO 0.00 -0.79 1.77 -1.25 -0.54 0.00 0.00 175.26 174.45 1gjq s PRO 260 N 3.37 4.00 -0.21 4.30 0.04 -1.26 -1.50 135.00 143.75 1gjq s PRO 260 Ca 0.74 2.18 -0.12 0.00 0.04 0.00 0.00 61.00 63.84 1gjq s PRO 260 Cb -0.37 -4.07 -0.09 0.00 0.04 0.00 0.00 34.50 30.01 1gjq s PRO 260 CO 0.32 -1.07 -0.29 1.63 0.04 0.00 0.00 177.00 177.62 1gjq n LYS 261 N 7.48 0.47 -3.90 4.56 4.76 -0.53 -4.98 118.16 126.02 1gjq n LYS 261 Ca 0.19 0.20 -0.11 0.00 -2.87 0.00 0.00 58.31 55.72 1gjq n LYS 261 Cb 0.43 -1.29 -0.13 0.00 -1.84 0.00 0.00 35.03 32.19 1gjq n LYS 261 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1gjq s GLN 262 N -2.47 0.08 -0.07 1.97 -1.52 -0.94 -5.01 119.66 111.70 1gjq s GLN 262 Ca -0.30 -0.14 0.03 0.00 -1.95 0.00 0.00 55.36 52.99 1gjq s GLN 262 Cb 0.11 0.02 0.01 0.00 -0.22 0.00 0.00 33.01 32.92 1gjq s GLN 262 CO 0.39 -0.01 -0.15 0.42 -0.25 0.00 0.00 175.29 175.69 1gjq s ILE 263 N -0.33 1.36 -0.07 1.08 1.01 -1.26 -0.52 121.20 122.46 1gjq s ILE 263 Ca -0.04 -0.61 0.02 0.00 0.00 0.00 0.00 60.65 60.03 1gjq s ILE 263 Cb -0.02 -1.22 0.01 0.00 0.01 0.00 0.00 42.46 41.24 1gjq s ILE 263 CO -0.00 0.40 -0.13 -0.69 0.00 0.00 0.00 174.94 174.52 1gjq s VAL 264 N 0.57 1.25 0.33 2.92 1.01 -0.78 -5.01 120.40 120.70 1gjq s VAL 264 Ca -0.15 -0.54 -0.27 0.00 0.00 0.00 0.00 61.98 61.02 1gjq s VAL 264 Cb -0.16 -1.14 -0.09 0.00 0.00 0.00 0.00 36.38 34.99 1gjq s VAL 264 CO 0.05 0.38 1.06 -0.55 0.00 0.00 0.00 175.10 176.05 1gjq s SER 265 N 0.70 7.06 0.00 3.32 0.15 -1.26 -1.85 113.70 121.81 1gjq s SER 265 Ca -0.14 2.14 0.14 0.00 0.70 0.00 0.00 55.95 58.80 1gjq s SER 265 Cb -0.16 -2.61 0.36 0.00 -1.71 0.00 0.00 66.02 61.91 1gjq s SER 265 CO 0.03 -0.28 1.28 0.35 1.20 0.00 0.00 173.24 175.83 1gjq n THR 266 N 0.64 0.83 -2.07 6.45 -2.24 0.62 -4.91 114.28 113.59 1gjq n THR 266 Ca 0.02 -0.92 -0.42 0.00 -2.27 0.00 0.00 64.05 60.46 1gjq n THR 266 Cb 0.47 0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 69.31 1gjq n THR 266 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1gjq s ARG 267 N -1.04 4.21 0.00 -0.78 0.52 -1.26 -4.57 118.95 116.04 1gjq s ARG 267 Ca 0.29 2.13 0.00 0.00 -0.52 0.00 0.00 55.73 57.62 1gjq s ARG 267 Cb 0.16 -3.79 0.00 0.00 0.52 0.00 0.00 34.95 31.84 1gjq s ARG 267 CO 0.21 -0.75 0.00 0.41 0.02 0.00 0.00 175.30 175.19 1gjq n GLY 268 N 3.95 1.80 3.82 -3.53 0.00 -1.19 -5.03 105.19 105.00 1gjq n GLY 268 Ca 0.16 -0.57 -0.37 0.00 0.00 0.00 0.00 46.02 45.23 1gjq n GLY 268 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1gjq s MET 269 N 1.29 4.15 0.66 1.61 -1.94 -1.26 -0.77 119.30 123.04 1gjq s MET 269 Ca 0.00 0.69 -0.13 0.00 -1.71 0.00 0.00 55.69 54.55 1gjq s MET 269 Cb 0.00 -3.10 -0.01 0.00 2.01 0.00 0.00 34.83 33.73 1gjq s MET 269 CO 0.00 0.56 1.06 0.95 -0.01 0.00 0.00 175.02 177.58 1gjq s THR 270 N -1.27 3.90 0.04 2.05 -4.23 -0.46 -4.88 115.64 110.79 1gjq s THR 270 Ca 0.34 0.73 -0.17 0.00 -1.18 0.00 0.00 61.69 61.41 1gjq s THR 270 Cb -0.18 -3.36 -0.27 0.00 1.34 0.00 0.00 72.50 70.02 1gjq s THR 270 CO 0.20 -0.70 1.09 1.62 -0.54 0.00 0.00 174.62 176.29 1gjq h VAL 271 N -0.27 1.34 0.03 2.29 3.04 -1.17 -3.08 116.25 118.42 1gjq h VAL 271 Ca -0.45 -2.35 -0.00 0.00 -1.01 0.00 0.00 66.70 62.89 1gjq h VAL 271 Cb 1.22 2.68 0.00 0.00 -2.01 0.00 0.00 31.29 33.18 1gjq h VAL 271 CO 0.57 0.71 -0.01 -2.24 -1.01 0.00 0.00 177.57 175.58 1gjq h ASP 272 N 0.15 -0.04 1.50 3.17 2.03 -1.95 -3.39 116.42 117.89 1gjq h ASP 272 Ca -0.15 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.15 1gjq h ASP 272 Cb 1.73 0.01 0.00 0.00 -0.83 0.00 0.00 39.33 40.24 1gjq h ASP 272 CO 0.20 -0.00 -0.36 0.71 -1.03 0.00 0.00 179.24 178.76 1gjq h THR 273 N -0.08 0.00 -5.91 1.15 1.35 -1.98 -3.48 112.91 103.95 1gjq h THR 273 Ca -0.00 -0.85 -0.39 0.00 -0.55 0.00 0.00 66.41 64.61 1gjq h THR 273 Cb 0.03 1.66 0.10 0.00 -1.73 0.00 0.00 68.15 68.22 1gjq h THR 273 CO 0.01 0.00 -0.78 0.00 -0.25 0.00 0.00 175.52 174.49 1gjq n GLN 274 N -2.73 -6.00 -4.44 4.72 6.02 -1.16 -4.99 117.38 108.80 1gjq n GLN 274 Ca 0.03 0.73 -0.24 0.00 -0.01 0.00 0.00 57.00 57.51 1gjq n GLN 274 Cb 0.51 -5.56 -0.09 0.00 1.02 0.00 0.00 30.24 26.11 1gjq n GLN 274 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1gjq s THR 275 N -3.47 2.63 0.26 5.09 -4.23 -1.26 -4.78 115.64 109.87 1gjq s THR 275 Ca 0.13 -2.26 -0.29 0.00 -1.18 0.00 0.00 61.69 58.08 1gjq s THR 275 Cb -0.06 -2.48 -0.09 0.00 1.34 0.00 0.00 72.50 71.21 1gjq s THR 275 CO 0.77 -0.35 1.20 -0.47 -0.54 0.00 0.00 174.62 175.23 1gjq s TYR 276 N -2.49 3.37 -0.13 3.99 5.04 -1.26 -1.35 117.35 124.51 1gjq s TYR 276 Ca 0.31 1.49 0.00 0.00 -2.44 0.00 0.00 57.07 56.43 1gjq s TYR 276 Cb -0.04 -3.46 0.02 0.00 0.35 0.00 0.00 41.96 38.83 1gjq s TYR 276 CO 0.16 -1.22 -0.11 -1.58 -1.34 0.00 0.00 175.55 171.47 1gjq s HIS 277 N -0.70 1.78 -2.03 4.97 5.65 0.05 -4.93 115.29 120.08 1gjq s HIS 277 Ca 0.49 -0.94 0.31 0.00 0.25 0.00 0.00 55.06 55.17 1gjq s HIS 277 Cb -0.35 -1.39 1.71 0.00 -1.18 0.00 0.00 32.58 31.38 1gjq s HIS 277 CO 0.42 -0.57 2.12 -0.35 -0.65 0.00 0.00 174.74 175.71 1gjq n PRO 278 N 4.83 1.06 -3.12 2.88 -0.04 -1.26 -3.17 135.00 136.17 1gjq n PRO 278 Ca -0.15 -0.17 -0.18 0.00 -0.04 0.00 0.00 63.50 62.96 1gjq n PRO 278 Cb 0.50 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.44 1gjq n PRO 278 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1gjq n GLU 279 N -0.82 0.92 -2.81 0.54 2.13 -1.26 -4.90 120.64 114.44 1gjq n GLU 279 Ca 0.22 -3.13 -0.43 0.00 0.66 0.00 0.00 57.16 54.48 1gjq n GLU 279 Cb 0.17 -1.53 -0.04 0.00 0.27 0.00 0.00 31.44 30.30 1gjq n GLU 279 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 1gjq s PRO 280 N -1.80 3.14 0.27 5.31 0.02 -1.26 -4.78 135.00 135.90 1gjq s PRO 280 Ca 0.37 -0.69 -0.29 0.00 0.02 0.00 0.00 61.00 60.40 1gjq s PRO 280 Cb 0.31 -4.20 -0.09 0.00 0.02 0.00 0.00 34.50 30.53 1gjq s PRO 280 CO -0.09 -1.83 1.23 1.03 -0.33 0.00 0.00 177.00 177.01 1gjq s ARG 281 N 4.29 4.47 -0.08 5.54 0.52 -1.26 -4.62 118.95 127.81 1gjq s ARG 281 Ca 0.25 2.01 -0.26 0.00 -0.52 0.00 0.00 55.73 57.21 1gjq s ARG 281 Cb -0.15 -3.15 -0.03 0.00 0.52 0.00 0.00 34.95 32.14 1gjq s ARG 281 CO 0.12 -0.06 0.83 0.08 0.02 0.00 0.00 175.30 176.28 1gjq s VAL 282 N -0.76 4.94 0.00 3.52 1.01 -0.88 -1.17 120.40 127.06 1gjq s VAL 282 Ca 0.50 1.69 0.00 0.00 0.00 0.00 0.00 61.98 64.17 1gjq s VAL 282 Cb -0.36 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 31.87 1gjq s VAL 282 CO 0.44 0.16 0.00 0.00 0.00 0.00 0.00 175.10 175.70 1gjq n ALA 283 N 4.25 0.00 -1.76 5.51 0.00 -0.16 -4.58 120.51 123.76 1gjq n ALA 283 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.10 1gjq n ALA 283 Cb 0.50 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.96 1gjq n ALA 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gjq s ALA 284 N -2.86 2.87 -0.03 0.00 0.00 -0.96 -4.51 121.76 116.26 1gjq s ALA 284 Ca 0.00 1.03 0.02 0.00 0.00 0.00 0.00 51.96 53.01 1gjq s ALA 284 Cb 0.00 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.69 1gjq s ALA 284 CO 0.00 -0.90 -0.08 0.42 0.00 0.00 0.00 175.76 175.20 1gjq s ILE 285 N -1.51 0.76 -0.01 0.00 1.01 -1.26 -1.16 121.20 119.03 1gjq s ILE 285 Ca 0.68 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 61.00 1gjq s ILE 285 Cb -0.31 -0.69 0.01 0.00 0.01 0.00 0.00 42.46 41.48 1gjq s ILE 285 CO 0.37 0.25 0.00 -0.51 0.00 0.00 0.00 174.94 175.05 1gjq s ILE 286 N 0.35 0.08 0.02 2.92 2.07 -0.63 -4.86 121.20 121.15 1gjq s ILE 286 Ca -0.06 0.05 -0.29 0.00 -1.41 0.00 0.00 60.65 58.94 1gjq s ILE 286 Cb -0.10 -0.14 -0.04 0.00 0.13 0.00 0.00 42.46 42.31 1gjq s ILE 286 CO 0.01 0.07 0.94 0.00 -1.91 0.00 0.00 174.94 174.05 1gjq s ALA 287 N 0.50 3.20 0.37 1.50 0.00 -1.26 -0.45 121.76 125.61 1gjq s ALA 287 Ca -0.05 0.50 -0.25 0.00 0.00 0.00 0.00 51.96 52.17 1gjq s ALA 287 Cb -0.07 -3.28 -0.09 0.00 0.00 0.00 0.00 23.12 19.68 1gjq s ALA 287 CO -0.01 -0.17 1.01 0.45 0.00 0.00 0.00 175.76 177.05 1gjq s SER 288 N 0.74 7.00 -0.01 0.00 0.15 -0.62 -4.85 113.70 116.11 1gjq s SER 288 Ca 0.49 1.97 0.17 0.00 0.70 0.00 0.00 55.95 59.28 1gjq s SER 288 Cb -0.21 -2.58 -0.22 0.00 -1.71 0.00 0.00 66.02 61.29 1gjq s SER 288 CO 0.27 -0.31 0.52 1.41 1.20 0.00 0.00 173.24 176.32 1gjq n HIS 289 N 0.21 0.00 0.03 3.44 8.25 -1.26 -3.61 115.22 122.28 1gjq n HIS 289 Ca 0.04 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.35 1gjq n HIS 289 Cb 0.50 -0.21 -0.14 0.00 1.12 0.00 0.00 29.99 31.25 1gjq n HIS 289 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1gjq h GLU 290 N 0.00 0.17 -4.01 -0.41 4.39 -1.88 -3.44 114.58 109.40 1gjq h GLU 290 Ca 0.00 -0.28 -0.14 0.00 0.34 0.00 0.00 59.36 59.28 1gjq h GLU 290 Cb 0.60 0.11 -0.18 0.00 -0.10 0.00 0.00 28.75 29.17 1gjq h GLU 290 CO 0.00 0.95 -0.63 -1.01 -1.16 0.00 0.00 179.01 177.16 1gjq s HIS 291 N -2.61 0.32 -0.99 4.33 3.76 -1.26 -5.00 115.29 113.84 1gjq s HIS 291 Ca -0.10 -0.70 -0.21 0.00 -0.15 0.00 0.00 55.06 53.91 1gjq s HIS 291 Cb 0.07 -0.24 -0.10 0.00 1.11 0.00 0.00 32.58 33.42 1gjq s HIS 291 CO 0.83 -0.31 1.96 -0.35 -0.85 0.00 0.00 174.74 176.02 1gjq n PRO 292 N 0.84 1.84 -4.20 8.40 -0.04 -1.26 -4.57 135.00 136.00 1gjq n PRO 292 Ca -0.19 -2.18 -0.12 0.00 -0.04 0.00 0.00 63.50 60.97 1gjq n PRO 292 Cb 0.58 -3.17 -0.10 0.00 -0.04 0.00 0.00 33.50 30.77 1gjq n PRO 292 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1gjq s GLU 293 N 4.97 0.94 -0.11 0.54 2.02 -1.26 -1.37 118.70 124.43 1gjq s GLU 293 Ca 0.58 -1.41 0.03 0.00 0.02 0.00 0.00 54.97 54.19 1gjq s GLU 293 Cb 0.11 -0.26 -0.00 0.00 0.10 0.00 0.00 34.13 34.07 1gjq s GLU 293 CO 0.09 -0.04 -0.22 -0.06 0.02 0.00 0.00 175.26 175.04 1gjq s PHE 294 N -3.61 2.60 -0.53 1.61 0.08 -0.37 -1.59 117.98 116.18 1gjq s PHE 294 Ca 0.16 -1.00 -0.16 0.00 0.12 0.00 0.00 56.93 56.05 1gjq s PHE 294 Cb 0.05 -1.74 0.11 0.00 -0.57 0.00 0.00 43.02 40.88 1gjq s PHE 294 CO -0.01 -0.40 0.49 0.42 -0.10 0.00 0.00 175.22 175.62 1gjq s ILE 295 N 0.36 5.19 -0.22 0.64 1.01 0.40 -0.87 121.20 127.70 1gjq s ILE 295 Ca -0.17 -1.35 -0.10 0.00 0.00 0.00 0.00 60.65 59.03 1gjq s ILE 295 Cb -0.18 -4.30 -0.05 0.00 0.01 0.00 0.00 42.46 37.95 1gjq s ILE 295 CO 0.08 -0.82 0.14 -0.69 0.00 0.00 0.00 174.94 173.66 1gjq s VAL 296 N 1.69 5.33 -0.18 2.92 1.01 0.31 -1.61 120.40 129.88 1gjq s VAL 296 Ca 0.04 0.17 -0.19 0.00 0.00 0.00 0.00 61.98 62.00 1gjq s VAL 296 Cb -0.28 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1gjq s VAL 296 CO 0.04 0.38 0.52 0.20 0.00 0.00 0.00 175.10 176.24 1gjq s ASN 297 N 0.80 6.60 -0.32 3.32 0.01 -0.31 -0.23 114.94 124.81 1gjq s ASN 297 Ca 0.07 0.72 -0.02 0.00 -0.71 0.00 0.00 52.86 52.93 1gjq s ASN 297 Cb -0.13 -2.29 0.06 0.00 0.41 0.00 0.00 41.25 39.30 1gjq s ASN 297 CO 0.02 -0.14 0.03 -0.69 -1.51 0.00 0.00 177.10 174.81 1gjq s VAL 298 N 1.41 2.98 0.00 1.60 1.01 0.31 -0.99 120.40 126.72 1gjq s VAL 298 Ca 0.25 -1.54 0.00 0.00 0.00 0.00 0.00 61.98 60.69 1gjq s VAL 298 Cb -0.15 -2.79 0.00 0.00 0.00 0.00 0.00 36.38 33.44 1gjq s VAL 298 CO 0.10 -0.22 0.27 1.17 0.00 0.00 0.00 175.10 176.42 1gjq n LYS 299 N 4.60 0.00 0.04 2.72 4.81 -0.32 -1.81 118.16 128.19 1gjq n LYS 299 Ca -0.11 0.15 0.20 0.00 -0.87 0.00 0.00 58.31 57.68 1gjq n LYS 299 Cb 0.43 -0.77 0.72 0.00 0.02 0.00 0.00 35.03 35.44 1gjq n LYS 299 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1gjq h GLU 300 N 0.00 0.00 0.00 1.64 3.07 -1.86 -0.29 114.58 117.14 1gjq h GLU 300 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1gjq h GLU 300 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1gjq h GLU 300 CO 0.00 0.00 -0.74 1.79 -1.40 0.00 0.00 179.01 178.66 1gjq h THR 301 N 0.00 0.00 -4.38 1.13 1.35 -1.90 -3.42 112.91 105.68 1gjq h THR 301 Ca 0.23 -0.63 -0.27 0.00 -0.55 0.00 0.00 66.41 65.19 1gjq h THR 301 Cb 1.00 1.17 0.10 0.00 -1.73 0.00 0.00 68.15 68.69 1gjq h THR 301 CO -0.00 0.00 -0.48 0.61 -0.25 0.00 0.00 175.52 175.40 1gjq n GLY 302 N 1.29 -0.09 3.43 5.82 0.00 -0.23 -0.63 105.19 114.79 1gjq n GLY 302 Ca 0.02 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1gjq n GLY 302 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gjq s LYS 303 N -5.84 2.83 -0.24 1.61 3.01 -0.77 -1.31 119.74 119.02 1gjq s LYS 303 Ca 0.38 -0.70 -0.05 0.00 -1.01 0.00 0.00 55.97 54.59 1gjq s LYS 303 Cb -0.17 -2.46 -0.01 0.00 -1.01 0.00 0.00 37.83 34.19 1gjq s LYS 303 CO 0.51 0.47 0.00 0.08 0.51 0.00 0.00 175.35 176.91 1gjq s VAL 304 N -0.32 3.62 -0.19 3.17 1.01 0.18 -0.53 120.40 127.35 1gjq s VAL 304 Ca 0.03 -0.52 -0.08 0.00 0.00 0.00 0.00 61.98 61.41 1gjq s VAL 304 Cb -0.13 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 1gjq s VAL 304 CO 0.03 0.32 0.07 -0.76 0.00 0.00 0.00 175.10 174.75 1gjq s LEU 305 N 1.49 3.85 -0.57 3.92 1.43 0.68 -0.73 118.68 128.76 1gjq s LEU 305 Ca 0.05 0.09 -0.13 0.00 -1.03 0.00 0.00 54.13 53.11 1gjq s LEU 305 Cb -0.15 -1.98 0.14 0.00 0.03 0.00 0.00 46.19 44.23 1gjq s LEU 305 CO -0.01 0.16 0.49 -0.76 0.23 0.00 0.00 176.35 176.46 1gjq s LEU 306 N 0.44 6.07 -0.46 1.79 1.43 -0.27 -0.53 118.68 127.15 1gjq s LEU 306 Ca 0.04 -2.04 -0.21 0.00 -1.03 0.00 0.00 54.13 50.88 1gjq s LEU 306 Cb -0.12 -2.12 0.03 0.00 0.03 0.00 0.00 46.19 44.00 1gjq s LEU 306 CO 0.00 -0.73 0.68 -0.69 0.23 0.00 0.00 176.35 175.84 1gjq s VAL 307 N 1.18 4.78 -0.01 -1.59 1.01 -0.05 -1.85 120.40 123.87 1gjq s VAL 307 Ca 0.07 0.10 -0.29 0.00 0.00 0.00 0.00 61.98 61.86 1gjq s VAL 307 Cb -0.25 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 31.84 1gjq s VAL 307 CO -0.01 -0.68 0.92 0.21 0.00 0.00 0.00 175.10 175.55 1gjq s ASN 308 N 2.16 7.29 -0.02 3.32 3.84 -0.37 -1.24 114.94 129.92 1gjq s ASN 308 Ca 0.23 1.56 0.13 0.00 0.21 0.00 0.00 52.86 55.00 1gjq s ASN 308 Cb -0.14 -2.54 0.39 0.00 -0.55 0.00 0.00 41.25 38.41 1gjq s ASN 308 CO 0.19 -0.22 1.33 0.00 -2.79 0.00 0.00 177.10 175.60 1gjq n TYR 309 N 3.85 0.62 0.09 0.43 0.18 -0.47 -4.23 117.16 117.63 1gjq n TYR 309 Ca 0.04 -0.54 0.05 0.00 1.88 0.00 0.00 57.90 59.33 1gjq n TYR 309 Cb 0.51 -0.06 0.48 0.00 -0.38 0.00 0.00 39.34 39.89 1gjq n TYR 309 CO 0.00 0.00 0.00 -0.22 -2.08 0.00 0.00 176.86 174.56 1gjq h LYS 310 N 2.41 0.34 -2.74 -3.48 3.64 -1.94 -3.34 116.57 111.46 1gjq h LYS 310 Ca 0.00 -0.03 -0.50 0.00 -1.27 0.00 0.00 60.65 58.85 1gjq h LYS 310 Cb 0.86 -0.07 -0.39 0.00 -0.41 0.00 0.00 32.23 32.22 1gjq h LYS 310 CO 0.03 0.26 -0.76 0.34 -2.27 0.00 0.00 179.45 177.05 1gjq s ASP 311 N -6.83 3.19 0.00 4.20 2.15 -1.26 -5.01 116.67 113.11 1gjq s ASP 311 Ca -0.07 -1.15 0.28 0.00 0.43 0.00 0.00 52.55 52.04 1gjq s ASP 311 Cb 0.17 -0.23 1.16 0.00 -0.30 0.00 0.00 42.92 43.71 1gjq s ASP 311 CO 0.71 -0.42 1.82 2.30 -0.17 0.00 0.00 175.17 179.41 1gjq n ILE 312 N 5.26 0.00 0.09 4.11 -5.35 -1.26 -3.68 119.36 118.54 1gjq n ILE 312 Ca -0.06 -0.07 -0.17 0.00 -0.27 0.00 0.00 62.75 62.19 1gjq n ILE 312 Cb 0.43 -0.03 -0.14 0.00 -1.74 0.00 0.00 39.64 38.16 1gjq n ILE 312 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1gjq h ASP 313 N 0.64 0.44 -3.32 7.28 3.32 -1.95 -3.39 116.42 119.44 1gjq h ASP 313 Ca 0.00 -0.51 -0.61 0.00 0.02 0.00 0.00 57.03 55.92 1gjq h ASP 313 Cb 0.38 -0.14 -0.40 0.00 0.22 0.00 0.00 39.33 39.38 1gjq h ASP 313 CO 0.00 1.41 -0.72 0.20 -1.72 0.00 0.00 179.24 178.41 1gjq s ASN 314 N -7.11 3.70 0.13 6.45 0.02 -1.24 -5.11 114.94 111.77 1gjq s ASN 314 Ca -0.06 -3.08 -0.31 0.00 -1.02 0.00 0.00 52.86 48.39 1gjq s ASN 314 Cb 0.07 -1.18 -0.08 0.00 0.02 0.00 0.00 41.25 40.08 1gjq s ASN 314 CO 0.88 -0.20 1.37 -0.22 0.02 0.00 0.00 177.10 178.95 1gjq s LEU 315 N -0.27 4.38 -0.19 0.60 2.96 -1.24 -4.78 118.68 120.14 1gjq s LEU 315 Ca 0.22 2.33 -0.04 0.00 -0.22 0.00 0.00 54.13 56.42 1gjq s LEU 315 Cb -0.15 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 42.94 1gjq s LEU 315 CO -0.08 -0.63 -0.04 -0.89 -1.32 0.00 0.00 176.35 173.40 1gjq s THR 316 N 0.94 3.63 -0.06 3.68 2.01 -1.26 -5.04 115.64 119.54 1gjq s THR 316 Ca 0.63 -0.43 0.04 0.00 0.31 0.00 0.00 61.69 62.24 1gjq s THR 316 Cb -0.37 -2.62 0.00 0.00 0.01 0.00 0.00 72.50 69.53 1gjq s THR 316 CO 0.31 0.45 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.84 1gjq s VAL 317 N 0.92 1.47 -0.23 3.82 1.01 -1.26 -1.24 120.40 124.89 1gjq s VAL 317 Ca -0.00 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 1gjq s VAL 317 Cb -0.15 -1.28 -0.01 0.00 0.00 0.00 0.00 36.38 34.95 1gjq s VAL 317 CO 0.01 0.42 -0.02 -0.89 0.00 0.00 0.00 175.10 174.63 1gjq s THR 318 N 0.23 3.54 -0.55 3.92 2.01 -0.77 -4.94 115.64 119.08 1gjq s THR 318 Ca -0.09 -0.46 -0.18 0.00 0.31 0.00 0.00 61.69 61.27 1gjq s THR 318 Cb -0.14 -2.64 0.09 0.00 0.01 0.00 0.00 72.50 69.83 1gjq s THR 318 CO 0.04 0.39 0.62 -0.55 -0.69 0.00 0.00 174.62 174.42 1gjq s SER 319 N 1.50 6.19 -0.14 3.53 0.15 -1.26 -1.12 113.70 122.55 1gjq s SER 319 Ca 0.06 -1.35 -0.16 0.00 0.70 0.00 0.00 55.95 55.20 1gjq s SER 319 Cb -0.15 -2.27 -0.04 0.00 -1.71 0.00 0.00 66.02 61.85 1gjq s SER 319 CO -0.02 -0.96 0.39 -0.63 1.20 0.00 0.00 173.24 173.22 1gjq s ILE 320 N 2.38 5.24 0.06 6.45 1.01 0.10 -4.96 121.20 131.48 1gjq s ILE 320 Ca 0.10 0.76 -0.23 0.00 0.00 0.00 0.00 60.65 61.28 1gjq s ILE 320 Cb -0.24 -3.73 -0.06 0.00 0.01 0.00 0.00 42.46 38.44 1gjq s ILE 320 CO 0.07 0.36 0.71 -0.83 0.00 0.00 0.00 174.94 175.24 1gjq s GLY 321 N 0.54 2.76 0.00 6.18 0.00 -1.26 -0.64 107.32 114.90 1gjq s GLY 321 Ca 0.21 0.21 0.00 0.00 0.00 0.00 0.00 44.72 45.14 1gjq s GLY 321 CO 0.07 0.90 0.00 0.00 0.00 0.00 0.00 173.10 174.08 1gjq n ALA 322 N 2.45 0.00 -3.22 3.20 0.00 -0.43 -4.86 120.51 117.66 1gjq n ALA 322 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.26 1gjq n ALA 322 Cb 0.50 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.86 1gjq n ALA 322 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gjq s ALA 323 N -2.00 -0.74 0.64 0.00 0.00 -1.22 -5.00 121.76 113.43 1gjq s ALA 323 Ca 0.00 0.43 -0.18 0.00 0.00 0.00 0.00 51.96 52.21 1gjq s ALA 323 Cb 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 1gjq s ALA 323 CO 0.00 -0.23 1.03 -2.30 0.00 0.00 0.00 175.76 174.26 1gjq n PRO 324 N 1.71 0.85 -3.15 0.00 -0.02 -1.26 -4.01 135.00 129.13 1gjq n PRO 324 Ca -0.19 0.34 -0.14 0.00 -2.02 0.00 0.00 63.50 61.48 1gjq n PRO 324 Cb 0.56 -2.25 0.06 0.00 -0.02 0.00 0.00 33.50 31.86 1gjq n PRO 324 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1gjq n PHE 325 N -1.94 -1.80 -1.98 6.00 3.72 -0.55 -4.24 117.46 116.68 1gjq n PHE 325 Ca 0.14 0.71 -0.42 0.00 -0.05 0.00 0.00 57.45 57.84 1gjq n PHE 325 Cb 0.48 -4.18 -0.03 0.00 -0.94 0.00 0.00 39.48 34.81 1gjq n PHE 325 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1gjq s LEU 326 N -5.38 4.38 0.00 4.37 1.43 -1.19 -2.43 118.68 119.86 1gjq s LEU 326 Ca 0.15 2.63 0.00 0.00 -1.03 0.00 0.00 54.13 55.88 1gjq s LEU 326 Cb -0.07 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.55 1gjq s LEU 326 CO 0.54 -0.76 0.00 1.57 0.23 0.00 0.00 176.35 177.93 1gjq n HIS 327 N 3.19 0.00 -3.29 0.29 -0.00 0.03 -4.09 115.22 111.35 1gjq n HIS 327 Ca 0.10 0.00 -0.18 0.00 0.46 0.00 0.00 57.72 58.10 1gjq n HIS 327 Cb 0.39 0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 30.26 1gjq n HIS 327 CO 0.00 0.00 0.00 0.16 0.46 0.00 0.00 176.34 176.96 1gjq s ASP 328 N 1.00 5.80 0.00 0.26 -4.77 -1.26 -2.27 116.67 115.42 1gjq s ASP 328 Ca 0.00 -0.31 0.00 0.00 -3.30 0.00 0.00 52.55 48.94 1gjq s ASP 328 Cb 0.00 -0.97 0.00 0.00 -1.09 0.00 0.00 42.92 40.86 1gjq s ASP 328 CO 0.00 -0.57 0.00 0.61 0.70 0.00 0.00 175.17 175.91 1gjq n GLY 329 N -1.72 -0.94 3.81 2.12 0.00 -0.45 -1.14 105.19 106.86 1gjq n GLY 329 Ca 0.03 -1.07 -0.04 0.00 0.00 0.00 0.00 46.02 44.94 1gjq n GLY 329 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gjq s GLY 330 N 0.00 -0.05 0.67 -0.02 0.00 -0.82 -4.19 107.32 102.91 1gjq s GLY 330 Ca 0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 44.72 44.43 1gjq s GLY 330 CO 0.00 0.60 1.10 -0.98 0.00 0.00 0.00 173.10 173.82 1gjq s TRP 331 N -2.93 2.65 0.70 1.90 0.23 -1.26 -1.46 118.94 118.77 1gjq s TRP 331 Ca 0.15 1.55 -0.11 0.00 -2.03 0.00 0.00 56.10 55.66 1gjq s TRP 331 Cb -0.03 -3.14 0.16 0.00 0.03 0.00 0.00 33.47 30.50 1gjq s TRP 331 CO 0.05 -1.66 0.95 -0.40 0.96 0.00 0.00 176.95 176.85 1gjq n ASP 332 N -2.56 0.17 0.06 2.95 5.75 -0.94 -4.89 116.55 117.09 1gjq n ASP 332 Ca 0.10 -1.40 0.05 0.00 -0.01 0.00 0.00 54.79 53.53 1gjq n ASP 332 Cb 0.52 -0.72 0.47 0.00 -1.03 0.00 0.00 41.12 40.37 1gjq n ASP 332 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1gjq h SER 333 N -1.20 0.36 0.60 -1.12 4.64 -1.88 -2.78 113.55 112.17 1gjq h SER 333 Ca -0.31 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1gjq h SER 333 Cb 0.87 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1gjq h SER 333 CO 0.23 0.26 -0.18 -1.54 -0.87 0.00 0.00 176.83 174.73 1gjq n SER 334 N -4.49 0.33 -2.87 4.97 3.41 -1.26 -4.96 113.62 108.75 1gjq n SER 334 Ca 0.02 -0.15 -0.17 0.00 -0.26 0.00 0.00 58.87 58.31 1gjq n SER 334 Cb 0.07 -0.12 0.06 0.00 -0.26 0.00 0.00 64.21 63.96 1gjq n SER 334 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1gjq n HIS 335 N -1.27 -2.08 0.00 7.33 8.25 -1.05 -4.94 115.22 121.45 1gjq n HIS 335 Ca 0.10 0.77 0.00 0.00 -0.26 0.00 0.00 57.72 58.32 1gjq n HIS 335 Cb 0.31 -4.17 0.00 0.00 1.12 0.00 0.00 29.99 27.25 1gjq n HIS 335 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1gjq n ARG 336 N -3.82 0.75 -3.63 -0.41 0.63 -1.26 -4.71 116.66 104.21 1gjq n ARG 336 Ca -0.05 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.49 1gjq n ARG 336 Cb 0.57 -0.85 -0.11 0.00 0.45 0.00 0.00 32.46 32.51 1gjq n ARG 336 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1gjq s TYR 337 N -1.70 3.19 -0.47 -0.14 2.02 -1.26 -1.00 117.35 117.99 1gjq s TYR 337 Ca 0.00 -0.49 -0.27 0.00 -0.37 0.00 0.00 57.07 55.94 1gjq s TYR 337 Cb 0.00 -2.38 0.03 0.00 -0.40 0.00 0.00 41.96 39.21 1gjq s TYR 337 CO 0.00 -0.43 1.01 0.12 -1.57 0.00 0.00 175.55 174.68 1gjq s PHE 338 N 1.64 2.88 -0.66 2.71 5.36 0.27 -2.22 117.98 127.96 1gjq s PHE 338 Ca 0.05 0.52 -0.17 0.00 -0.96 0.00 0.00 56.93 56.37 1gjq s PHE 338 Cb -0.17 -4.16 0.14 0.00 -0.34 0.00 0.00 43.02 38.48 1gjq s PHE 338 CO 0.07 -1.17 0.71 -1.64 -1.46 0.00 0.00 175.22 171.73 1gjq s MET 339 N 4.04 3.20 0.11 10.12 -1.94 -0.53 -0.78 119.30 133.52 1gjq s MET 339 Ca 0.42 -1.68 0.07 0.00 -1.71 0.00 0.00 55.69 52.78 1gjq s MET 339 Cb -0.09 -4.37 -0.04 0.00 2.01 0.00 0.00 34.83 32.34 1gjq s MET 339 CO 0.28 -1.47 -0.09 -0.08 -0.01 0.00 0.00 175.02 173.66 1gjq s THR 340 N 1.93 3.41 -0.19 2.05 -1.32 -0.38 -1.95 115.64 119.19 1gjq s THR 340 Ca 0.13 -1.29 -0.09 0.00 -1.21 0.00 0.00 61.69 59.23 1gjq s THR 340 Cb -0.21 -2.61 -0.05 0.00 -1.51 0.00 0.00 72.50 68.13 1gjq s THR 340 CO 0.01 0.09 0.10 0.00 -2.21 0.00 0.00 174.62 172.61 1gjq s ALA 341 N -1.27 3.56 -1.10 11.08 0.00 -0.29 0.52 121.76 134.26 1gjq s ALA 341 Ca 0.22 -0.73 -0.07 0.00 0.00 0.00 0.00 51.96 51.38 1gjq s ALA 341 Cb -0.11 -2.07 0.28 0.00 0.00 0.00 0.00 23.12 21.23 1gjq s ALA 341 CO 0.14 0.15 1.19 0.00 0.00 0.00 0.00 175.76 177.23 1gjq n ALA 342 N 3.58 4.44 -0.30 0.00 0.00 0.10 -0.79 120.51 127.53 1gjq n ALA 342 Ca -0.16 -4.70 -0.01 0.00 0.00 0.00 0.00 53.44 48.57 1gjq n ALA 342 Cb 0.52 -2.39 0.05 0.00 0.00 0.00 0.00 19.45 17.64 1gjq n ALA 342 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1gjq h ASN 343 N 6.31 -1.15 0.91 0.00 7.08 -1.68 -1.47 115.58 125.58 1gjq h ASN 343 Ca 0.18 0.27 0.00 0.00 -3.08 0.00 0.00 56.30 53.67 1gjq h ASN 343 Cb 0.81 0.63 0.00 0.00 -2.08 0.00 0.00 38.32 37.68 1gjq h ASN 343 CO 1.08 -0.29 0.00 0.59 -2.08 0.00 0.00 177.43 176.73 1gjq n ASN 344 N -5.49 0.00 -0.25 6.14 5.03 -1.26 -2.51 115.26 116.92 1gjq n ASN 344 Ca 0.09 0.45 0.12 0.00 0.87 0.00 0.00 54.58 56.11 1gjq n ASN 344 Cb 0.40 -0.48 0.18 0.00 -1.02 0.00 0.00 39.78 38.85 1gjq n ASN 344 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1gjq n SER 345 N -1.48 1.24 -3.74 6.41 7.64 -0.60 -4.97 113.62 118.11 1gjq n SER 345 Ca 0.07 -0.99 -0.26 0.00 1.01 0.00 0.00 58.87 58.70 1gjq n SER 345 Cb 0.31 0.37 0.05 0.00 -1.01 0.00 0.00 64.21 63.94 1gjq n SER 345 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1gjq n ASN 346 N -0.72 -5.24 -4.17 6.43 3.02 -0.92 -5.00 115.26 108.66 1gjq n ASN 346 Ca 0.09 -0.66 -0.11 0.00 -0.03 0.00 0.00 54.58 53.87 1gjq n ASN 346 Cb 0.38 -4.49 -0.10 0.00 -0.61 0.00 0.00 39.78 34.96 1gjq n ASN 346 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1gjq s LYS 347 N -6.39 0.89 -0.14 3.52 1.02 -1.15 -2.12 119.74 115.37 1gjq s LYS 347 Ca 0.57 -1.39 0.00 0.00 0.02 0.00 0.00 55.97 55.17 1gjq s LYS 347 Cb -0.27 -0.07 0.02 0.00 -0.52 0.00 0.00 37.83 36.99 1gjq s LYS 347 CO 0.78 -0.11 -0.14 0.08 -0.92 0.00 0.00 175.35 175.04 1gjq s VAL 348 N -3.76 1.54 0.05 3.17 1.01 0.24 -0.72 120.40 121.93 1gjq s VAL 348 Ca 0.17 -0.62 -0.17 0.00 0.00 0.00 0.00 61.98 61.36 1gjq s VAL 348 Cb 0.06 -1.44 -0.06 0.00 0.00 0.00 0.00 36.38 34.94 1gjq s VAL 348 CO -0.02 0.45 0.51 0.00 0.00 0.00 0.00 175.10 176.05 1gjq s ALA 349 N 1.45 3.63 -0.25 5.51 0.00 0.18 -0.33 121.76 131.96 1gjq s ALA 349 Ca 0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 51.96 51.92 1gjq s ALA 349 Cb -0.13 -2.54 0.02 0.00 0.00 0.00 0.00 23.12 20.47 1gjq s ALA 349 CO -0.10 0.43 -0.05 0.08 0.00 0.00 0.00 175.76 176.12 1gjq s VAL 350 N -1.12 2.99 -0.27 0.00 1.01 -0.32 -1.25 120.40 121.45 1gjq s VAL 350 Ca 0.28 -0.92 -0.07 0.00 0.00 0.00 0.00 61.98 61.26 1gjq s VAL 350 Cb -0.18 -2.49 -0.01 0.00 0.00 0.00 0.00 36.38 33.69 1gjq s VAL 350 CO 0.17 0.23 0.08 -0.63 0.00 0.00 0.00 175.10 174.96 1gjq s ILE 351 N 1.36 4.24 -0.48 2.22 -1.09 0.04 -0.46 121.20 127.04 1gjq s ILE 351 Ca 0.01 -0.36 -0.28 0.00 -2.23 0.00 0.00 60.65 57.79 1gjq s ILE 351 Cb -0.16 -3.07 0.03 0.00 -1.58 0.00 0.00 42.46 37.68 1gjq s ILE 351 CO -0.04 0.23 1.11 -0.62 -1.23 0.00 0.00 174.94 174.39 1gjq s ASP 352 N 1.58 6.61 0.38 3.58 -1.08 0.04 -0.56 116.67 127.23 1gjq s ASP 352 Ca 0.05 0.41 0.27 0.00 -0.52 0.00 0.00 52.55 52.76 1gjq s ASP 352 Cb -0.16 -2.54 0.91 0.00 -1.46 0.00 0.00 42.92 39.67 1gjq s ASP 352 CO 0.04 -1.23 1.78 0.77 0.52 0.00 0.00 175.17 177.05 1gjq h SER 353 N 9.22 0.00 0.00 -0.34 4.64 -1.37 -1.63 113.55 124.06 1gjq h SER 353 Ca -0.23 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.06 1gjq h SER 353 Cb 1.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1gjq h SER 353 CO 1.12 0.00 -0.36 0.50 -0.87 0.00 0.00 176.83 177.21 1gjq h LYS 354 N 0.00 0.00 -0.00 4.77 3.64 -1.91 -3.37 116.57 119.70 1gjq h LYS 354 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1gjq h LYS 354 Cb 0.65 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 1gjq h LYS 354 CO 0.00 0.24 -0.03 -0.25 -2.27 0.00 0.00 179.45 177.14 1gjq n ASP 355 N -4.65 0.20 -3.55 4.20 8.00 -1.25 -4.96 116.55 114.54 1gjq n ASP 355 Ca -0.08 -0.59 -0.26 0.00 0.71 0.00 0.00 54.79 54.57 1gjq n ASP 355 Cb 0.24 -0.13 0.05 0.00 -0.02 0.00 0.00 41.12 41.27 1gjq n ASP 355 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1gjq n ARG 356 N -1.04 -1.50 -3.90 -1.24 1.74 -0.63 -5.03 116.66 105.06 1gjq n ARG 356 Ca 0.18 0.60 -0.09 0.00 -0.77 0.00 0.00 57.85 57.77 1gjq n ARG 356 Cb 0.22 -4.61 -0.04 0.00 -1.02 0.00 0.00 32.46 27.00 1gjq n ARG 356 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1gjq s ARG 357 N -5.45 1.58 -0.35 5.56 1.70 -1.10 -5.00 118.95 115.89 1gjq s ARG 357 Ca 0.46 -1.08 -0.25 0.00 -0.47 0.00 0.00 55.73 54.38 1gjq s ARG 357 Cb -0.13 0.52 0.01 0.00 -0.57 0.00 0.00 34.95 34.78 1gjq s ARG 357 CO 0.83 -0.68 0.90 -1.17 -1.08 0.00 0.00 175.30 174.10 1gjq s LEU 358 N -2.95 4.02 0.10 -1.89 2.96 -1.26 -0.78 118.68 118.87 1gjq s LEU 358 Ca 0.16 0.63 -0.04 0.00 -0.22 0.00 0.00 54.13 54.65 1gjq s LEU 358 Cb -0.02 -3.24 -0.21 0.00 0.50 0.00 0.00 46.19 43.22 1gjq s LEU 358 CO 0.06 -0.80 1.20 0.28 -1.32 0.00 0.00 176.35 175.76 1gjq h SER 359 N 8.36 0.47 -5.84 3.68 0.02 -1.13 -3.48 113.55 115.63 1gjq h SER 359 Ca -0.23 -0.45 0.35 0.00 -0.84 0.00 0.00 61.79 60.62 1gjq h SER 359 Cb 1.08 -0.15 -0.12 0.00 0.14 0.00 0.00 62.40 63.35 1gjq h SER 359 CO 0.96 1.31 0.88 0.00 -1.14 0.00 0.00 176.83 178.84 1gjq s ALA 360 N -2.87 -2.34 -0.22 3.77 0.00 -1.23 -5.01 121.76 113.87 1gjq s ALA 360 Ca -0.05 0.74 -0.01 0.00 0.00 0.00 0.00 51.96 52.64 1gjq s ALA 360 Cb 0.08 0.35 0.06 0.00 0.00 0.00 0.00 23.12 23.61 1gjq s ALA 360 CO 0.88 -1.06 0.00 -0.51 0.00 0.00 0.00 175.76 175.07 1gjq s LEU 361 N -3.03 1.86 -0.25 0.00 1.43 -1.26 -1.17 118.68 116.26 1gjq s LEU 361 Ca 0.15 -1.04 -0.10 0.00 -1.03 0.00 0.00 54.13 52.11 1gjq s LEU 361 Cb 0.05 -0.86 -0.05 0.00 0.03 0.00 0.00 46.19 45.36 1gjq s LEU 361 CO -0.05 -0.29 0.16 -0.69 0.23 0.00 0.00 176.35 175.72 1gjq s VAL 362 N 1.64 5.26 0.08 -1.59 1.01 0.56 -4.91 120.40 122.45 1gjq s VAL 362 Ca -0.02 0.15 -0.31 0.00 0.00 0.00 0.00 61.98 61.80 1gjq s VAL 362 Cb -0.18 -3.46 -0.06 0.00 0.00 0.00 0.00 36.38 32.68 1gjq s VAL 362 CO -0.08 0.33 1.22 -1.81 0.00 0.00 0.00 175.10 174.76 1gjq s ASP 363 N 1.22 7.05 0.00 3.32 1.01 -1.26 -0.59 116.67 127.42 1gjq s ASP 363 Ca 0.07 2.08 0.00 0.00 0.71 0.00 0.00 52.55 55.41 1gjq s ASP 363 Cb -0.14 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.21 1gjq s ASP 363 CO 0.06 -0.48 0.00 1.33 0.21 0.00 0.00 175.17 176.28 1gjq n VAL 364 N 3.79 0.00 -1.09 -1.27 0.24 -0.90 -4.79 118.33 114.31 1gjq n VAL 364 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 1gjq n VAL 364 Cb 0.46 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.83 1gjq n VAL 364 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1gjq n GLY 365 N 3.20 0.27 3.68 7.63 0.00 -1.26 -4.89 105.19 113.83 1gjq n GLY 365 Ca 0.00 -1.81 -0.43 0.00 0.00 0.00 0.00 46.02 43.78 1gjq n GLY 365 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gjq s LYS 366 N 0.16 4.37 -0.68 1.61 3.01 -1.26 -4.34 119.74 122.61 1gjq s LYS 366 Ca 0.00 1.39 -0.06 0.00 -1.01 0.00 0.00 55.97 56.28 1gjq s LYS 366 Cb 0.00 -3.58 0.01 0.00 -1.01 0.00 0.00 37.83 33.25 1gjq s LYS 366 CO 0.00 -0.42 0.66 2.41 0.51 0.00 0.00 175.35 178.50 1gjq n THR 367 N 4.81 -8.15 -2.05 2.17 -1.04 -1.24 -1.10 114.28 107.68 1gjq n THR 367 Ca 0.10 0.05 -0.42 0.00 -2.04 0.00 0.00 64.05 61.74 1gjq n THR 367 Cb 0.48 -5.74 -0.03 0.00 -1.82 0.00 0.00 70.33 63.22 1gjq n THR 367 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1gjq s PRO 368 N -3.35 4.28 -0.41 -2.82 0.04 -1.26 -0.49 135.00 130.99 1gjq s PRO 368 Ca 0.08 2.23 0.02 0.00 0.04 0.00 0.00 61.00 63.37 1gjq s PRO 368 Cb -0.02 -3.17 0.14 0.00 0.04 0.00 0.00 34.50 31.49 1gjq s PRO 368 CO 0.80 -0.48 0.24 -1.58 0.04 0.00 0.00 177.00 176.03 1gjq s HIS 369 N 0.75 1.48 0.05 0.56 2.46 -0.77 -4.51 115.29 115.31 1gjq s HIS 369 Ca 0.65 -2.14 0.09 0.00 0.47 0.00 0.00 55.06 54.13 1gjq s HIS 369 Cb -0.41 -1.46 -0.19 0.00 -0.13 0.00 0.00 32.58 30.39 1gjq s HIS 369 CO 0.34 -0.80 1.11 -1.00 -2.47 0.00 0.00 174.74 171.93 1gjq h PRO 370 N 6.71 0.00 0.00 2.88 0.13 -1.78 -3.37 132.00 136.57 1gjq h PRO 370 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1gjq h PRO 370 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1gjq h PRO 370 CO 0.40 0.81 0.00 0.41 -0.23 0.00 0.00 178.00 179.38 1gjq n GLY 371 N 1.40 2.37 0.13 1.56 0.00 -1.26 -1.36 105.19 108.02 1gjq n GLY 371 Ca -0.05 -0.34 0.09 0.00 0.00 0.00 0.00 46.02 45.72 1gjq n GLY 371 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gjq n ARG 372 N 9.97 0.93 0.00 1.61 1.74 -1.26 -1.34 116.66 128.30 1gjq n ARG 372 Ca 0.00 -0.27 0.00 0.00 -0.77 0.00 0.00 57.85 56.81 1gjq n ARG 372 Cb 0.00 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 1gjq n ARG 372 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gjq n GLY 373 N 1.41 -3.28 2.71 -0.13 0.00 -0.47 -3.35 105.19 102.09 1gjq n GLY 373 Ca 0.05 -1.82 -0.23 0.00 0.00 0.00 0.00 46.02 44.02 1gjq n GLY 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gjq s ALA 374 N -1.01 0.58 -0.15 4.61 0.00 -1.10 -4.75 121.76 119.94 1gjq s ALA 374 Ca 0.00 -0.17 -0.06 0.00 0.00 0.00 0.00 51.96 51.73 1gjq s ALA 374 Cb 0.00 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 1gjq s ALA 374 CO 0.00 -0.71 0.07 -0.80 0.00 0.00 0.00 175.76 174.31 1gjq s ASN 375 N 2.04 5.73 0.18 0.00 0.01 -1.26 -0.62 114.94 121.02 1gjq s ASN 375 Ca 0.03 0.18 -0.22 0.00 -0.71 0.00 0.00 52.86 52.15 1gjq s ASN 375 Cb -0.14 -1.88 0.06 0.00 0.41 0.00 0.00 41.25 39.70 1gjq s ASN 375 CO -0.06 0.27 0.61 0.72 -1.51 0.00 0.00 177.10 177.13 1gjq s PHE 376 N -0.21 -0.44 -0.34 2.20 -0.12 -1.07 -4.76 117.98 113.25 1gjq s PHE 376 Ca 0.08 0.17 -0.17 0.00 -0.05 0.00 0.00 56.93 56.96 1gjq s PHE 376 Cb -0.12 0.56 -0.01 0.00 -0.63 0.00 0.00 43.02 42.82 1gjq s PHE 376 CO 0.01 -0.92 0.47 0.08 -0.05 0.00 0.00 175.22 174.82 1gjq s VAL 377 N -3.79 5.06 0.18 -2.49 1.01 -1.26 -1.25 120.40 117.86 1gjq s VAL 377 Ca 0.03 0.34 -0.30 0.00 0.00 0.00 0.00 61.98 62.05 1gjq s VAL 377 Cb -0.02 -3.91 -0.08 0.00 0.00 0.00 0.00 36.38 32.38 1gjq s VAL 377 CO -0.09 -0.14 1.01 -2.28 0.00 0.00 0.00 175.10 173.60 1gjq s HIS 378 N 2.29 3.78 0.48 5.22 2.46 0.18 -4.94 115.29 124.76 1gjq s HIS 378 Ca 0.17 1.77 0.13 0.00 0.47 0.00 0.00 55.06 57.60 1gjq s HIS 378 Cb -0.16 -3.12 1.11 0.00 -0.13 0.00 0.00 32.58 30.28 1gjq s HIS 378 CO 0.12 -0.02 2.11 -1.00 -2.47 0.00 0.00 174.74 173.48 1gjq h PRO 379 N 4.88 0.20 0.00 2.88 0.13 -1.90 -2.10 132.00 136.08 1gjq h PRO 379 Ca -0.44 -0.01 -0.38 0.00 -0.87 0.00 0.00 66.00 64.30 1gjq h PRO 379 Cb 1.21 -0.04 -0.07 0.00 0.13 0.00 0.00 31.00 32.22 1gjq h PRO 379 CO 0.70 0.14 -2.42 1.17 -0.23 0.00 0.00 178.00 177.37 1gjq n LYS 380 N -4.51 0.68 0.00 0.86 4.81 -1.26 -4.69 118.16 114.06 1gjq n LYS 380 Ca -0.01 0.08 0.10 0.00 -0.87 0.00 0.00 58.31 57.62 1gjq n LYS 380 Cb 0.08 -1.51 0.07 0.00 0.02 0.00 0.00 35.03 33.69 1gjq n LYS 380 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1gjq n TYR 381 N -3.03 0.00 -4.09 5.64 4.01 -1.24 -5.11 117.16 113.35 1gjq n TYR 381 Ca -0.40 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.34 1gjq n TYR 381 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.08 1gjq n TYR 381 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gjq n GLY 382 N 1.21 -1.04 3.68 2.72 0.00 -0.79 -4.85 105.19 106.12 1gjq n GLY 382 Ca 0.11 -1.22 -0.42 0.00 0.00 0.00 0.00 46.02 44.49 1gjq n GLY 382 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1gjq s PRO 383 N 0.00 4.14 0.22 1.61 0.02 -1.26 -0.64 135.00 139.08 1gjq s PRO 383 Ca 0.00 2.60 0.08 0.00 0.02 0.00 0.00 61.00 63.70 1gjq s PRO 383 Cb 0.00 -3.86 -0.05 0.00 0.02 0.00 0.00 34.50 30.61 1gjq s PRO 383 CO 0.00 -0.90 -0.13 0.14 -0.33 0.00 0.00 177.00 175.78 1gjq s VAL 384 N 3.54 1.73 -0.03 3.83 -7.23 -0.38 -0.78 120.40 121.09 1gjq s VAL 384 Ca 0.84 -2.20 0.06 0.00 -1.81 0.00 0.00 61.98 58.87 1gjq s VAL 384 Cb -0.44 -2.11 -0.01 0.00 0.56 0.00 0.00 36.38 34.38 1gjq s VAL 384 CO 0.39 -0.55 -0.21 0.86 -0.31 0.00 0.00 175.10 175.28 1gjq s TRP 385 N -2.97 1.95 0.19 2.82 -0.00 0.03 -2.59 118.94 118.37 1gjq s TRP 385 Ca 0.24 -0.47 0.10 0.00 -0.00 0.00 0.00 56.10 55.97 1gjq s TRP 385 Cb -0.00 -1.27 -0.04 0.00 -0.00 0.00 0.00 33.47 32.15 1gjq s TRP 385 CO 0.08 -0.11 -0.20 -1.54 -0.00 0.00 0.00 176.95 175.18 1gjq s SER 386 N -0.27 2.99 -0.07 5.86 1.04 0.21 -0.83 113.70 122.63 1gjq s SER 386 Ca 0.02 -0.90 -0.13 0.00 0.48 0.00 0.00 55.95 55.43 1gjq s SER 386 Cb -0.10 -0.20 0.03 0.00 0.10 0.00 0.00 66.02 65.84 1gjq s SER 386 CO 0.01 0.00 0.31 0.28 0.98 0.00 0.00 173.24 174.82 1gjq s THR 387 N -2.10 0.03 0.55 2.02 -1.32 -0.87 -2.69 115.64 111.26 1gjq s THR 387 Ca 0.20 -0.25 0.08 0.00 -1.21 0.00 0.00 61.69 60.51 1gjq s THR 387 Cb -0.06 -0.53 0.06 0.00 -1.51 0.00 0.00 72.50 70.47 1gjq s THR 387 CO 0.09 -0.14 0.62 -0.94 -2.21 0.00 0.00 174.62 172.04 1gjq s SER 388 N -0.59 4.94 0.15 8.08 1.04 -1.26 -0.52 113.70 125.55 1gjq s SER 388 Ca -0.07 -0.98 0.04 0.00 0.48 0.00 0.00 55.95 55.43 1gjq s SER 388 Cb -0.04 0.27 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 1gjq s SER 388 CO 0.02 -1.20 -0.10 -1.00 0.98 0.00 0.00 173.24 171.94 1gjq s HIS 389 N -2.69 1.27 -0.11 5.02 3.76 -1.21 -1.85 115.29 119.49 1gjq s HIS 389 Ca 0.51 -0.77 0.11 0.00 -0.15 0.00 0.00 55.06 54.76 1gjq s HIS 389 Cb -0.04 -0.65 -0.24 0.00 1.11 0.00 0.00 32.58 32.76 1gjq s HIS 389 CO 0.32 0.08 0.39 1.28 -0.85 0.00 0.00 174.74 175.95 1gjq n LEU 390 N -0.20 1.01 0.11 0.89 4.77 0.36 -1.95 117.00 121.98 1gjq n LEU 390 Ca -0.10 0.23 0.12 0.00 -0.03 0.00 0.00 56.01 56.23 1gjq n LEU 390 Cb 0.61 0.02 0.26 0.00 -2.33 0.00 0.00 43.42 41.98 1gjq n LEU 390 CO 0.32 0.52 0.64 1.23 -1.33 0.00 0.00 177.39 178.78 1gjq h GLY 391 N 3.23 0.00 -1.46 -0.72 0.00 -1.23 0.17 103.07 103.05 1gjq h GLY 391 Ca -0.40 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.82 1gjq h GLY 391 CO 0.05 0.00 0.08 0.51 0.00 0.00 0.00 176.54 177.18 1gjq s ASP 392 N -4.78 0.29 0.00 0.19 1.47 -1.24 -4.83 116.67 107.77 1gjq s ASP 392 Ca 0.08 -1.21 0.15 0.00 1.18 0.00 0.00 52.55 52.75 1gjq s ASP 392 Cb 0.11 0.76 0.47 0.00 -0.34 0.00 0.00 42.92 43.92 1gjq s ASP 392 CO 0.66 -1.49 1.37 0.61 0.68 0.00 0.00 175.17 177.00 1gjq n GLY 393 N -0.53 0.64 3.84 2.12 0.00 -1.25 -3.94 105.19 106.08 1gjq n GLY 393 Ca -0.04 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.24 1gjq n GLY 393 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gjq s SER 394 N -1.20 6.47 -0.17 1.61 1.04 -1.26 -0.12 113.70 120.08 1gjq s SER 394 Ca 0.28 1.57 0.00 0.00 0.48 0.00 0.00 55.95 58.28 1gjq s SER 394 Cb 0.15 -2.50 0.03 0.00 0.10 0.00 0.00 66.02 63.80 1gjq s SER 394 CO 0.21 -0.69 -0.10 -0.63 0.98 0.00 0.00 173.24 173.00 1gjq s ILE 395 N -2.71 1.44 -0.03 -1.02 1.09 0.09 -3.29 121.20 116.77 1gjq s ILE 395 Ca 0.59 -0.73 -0.20 0.00 -1.10 0.00 0.00 60.65 59.21 1gjq s ILE 395 Cb -0.11 -1.48 -0.05 0.00 -1.06 0.00 0.00 42.46 39.77 1gjq s ILE 395 CO 0.36 0.27 0.56 -0.44 -0.10 0.00 0.00 174.94 175.59 1gjq s SER 396 N 1.51 6.91 -0.21 3.58 0.01 0.32 -1.45 113.70 124.37 1gjq s SER 396 Ca 0.02 1.08 -0.03 0.00 1.31 0.00 0.00 55.95 58.32 1gjq s SER 396 Cb -0.15 -2.34 -0.01 0.00 0.21 0.00 0.00 66.02 63.73 1gjq s SER 396 CO -0.09 0.10 -0.05 -0.76 0.41 0.00 0.00 173.24 172.85 1gjq s LEU 397 N -0.10 2.90 -0.12 2.44 1.43 -0.57 -2.06 118.68 122.60 1gjq s LEU 397 Ca 0.30 -0.37 0.03 0.00 -1.03 0.00 0.00 54.13 53.05 1gjq s LEU 397 Cb -0.17 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.32 1gjq s LEU 397 CO 0.16 0.01 -0.22 -0.63 0.23 0.00 0.00 176.35 175.90 1gjq s ILE 398 N 1.31 2.18 0.08 -0.59 1.01 -0.01 -1.43 121.20 123.75 1gjq s ILE 398 Ca 0.04 -0.96 -0.31 0.00 0.00 0.00 0.00 60.65 59.42 1gjq s ILE 398 Cb -0.14 -1.86 -0.08 0.00 0.01 0.00 0.00 42.46 40.39 1gjq s ILE 398 CO -0.02 0.55 1.53 -0.83 0.00 0.00 0.00 174.94 176.17 1gjq s GLY 399 N 0.58 1.70 -0.27 6.18 0.00 -1.10 -0.79 107.32 113.62 1gjq s GLY 399 Ca -0.12 1.16 0.09 0.00 0.00 0.00 0.00 44.72 45.84 1gjq s GLY 399 CO 0.04 2.66 1.31 -1.30 0.00 0.00 0.00 173.10 175.80 1gjq n THR 400 N 4.42 2.45 -3.61 0.90 -2.24 0.04 -1.68 114.28 114.56 1gjq n THR 400 Ca 0.14 -3.40 -0.29 0.00 -2.27 0.00 0.00 64.05 58.24 1gjq n THR 400 Cb 0.41 -0.55 -0.12 0.00 -2.10 0.00 0.00 70.33 67.97 1gjq n THR 400 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1gjq s ASP 401 N -3.12 3.11 0.50 3.42 2.15 -1.26 -4.94 116.67 116.53 1gjq s ASP 401 Ca 0.44 -2.85 0.29 0.00 0.43 0.00 0.00 52.55 50.86 1gjq s ASP 401 Cb 0.40 -0.85 0.95 0.00 -0.30 0.00 0.00 42.92 43.11 1gjq s ASP 401 CO -0.02 -0.22 1.83 1.55 -0.17 0.00 0.00 175.17 178.14 1gjq h PRO 402 N 6.28 0.00 0.02 4.34 0.13 -1.91 -1.81 132.00 139.05 1gjq h PRO 402 Ca 0.10 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.11 1gjq h PRO 402 Cb 0.90 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.04 1gjq h PRO 402 CO 0.45 0.04 -0.47 0.87 -0.23 0.00 0.00 178.00 178.66 1gjq h LYS 403 N 0.00 0.28 -0.03 0.86 1.79 -1.99 -3.33 116.57 114.14 1gjq h LYS 403 Ca -0.00 -0.33 0.00 0.00 -2.18 0.00 0.00 60.65 58.14 1gjq h LYS 403 Cb 0.72 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 1gjq h LYS 403 CO 0.01 1.05 0.00 0.09 -1.08 0.00 0.00 179.45 179.52 1gjq n ASN 404 N -4.33 1.74 -2.88 0.86 3.02 -1.25 -4.76 115.26 107.65 1gjq n ASN 404 Ca -0.11 -1.39 -0.12 0.00 -0.03 0.00 0.00 54.58 52.93 1gjq n ASN 404 Cb 0.62 -0.02 0.03 0.00 -0.61 0.00 0.00 39.78 39.80 1gjq n ASN 404 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1gjq n HIS 405 N 0.40 -0.39 0.10 3.10 8.25 -0.68 -5.00 115.22 121.00 1gjq n HIS 405 Ca 0.05 -2.97 0.18 0.00 -0.26 0.00 0.00 57.72 54.71 1gjq n HIS 405 Cb 0.21 0.21 0.72 0.00 1.12 0.00 0.00 29.99 32.24 1gjq n HIS 405 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1gjq h PRO 406 N 2.87 0.00 0.00 -0.41 0.11 -1.67 -1.77 132.00 131.13 1gjq h PRO 406 Ca -0.05 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 1gjq h PRO 406 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1gjq h PRO 406 CO 0.36 0.00 -0.16 1.96 -0.21 0.00 0.00 178.00 179.95 1gjq h GLN 407 N 0.00 0.00 -0.00 1.05 7.50 -1.93 -3.16 115.11 118.57 1gjq h GLN 407 Ca 0.17 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.32 1gjq h GLN 407 Cb 0.73 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.26 1gjq h GLN 407 CO -0.00 0.16 -0.39 0.66 -1.50 0.00 0.00 178.83 177.76 1gjq n TYR 408 N -4.34 0.00 -1.66 2.96 4.01 -0.71 -4.95 117.16 112.48 1gjq n TYR 408 Ca -0.03 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.28 1gjq n TYR 408 Cb 0.23 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.22 1gjq n TYR 408 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1gjq n ALA 409 N -0.79 1.43 -2.31 -0.72 0.00 -0.94 -2.31 120.51 114.88 1gjq n ALA 409 Ca 0.03 0.20 -0.17 0.00 0.00 0.00 0.00 53.44 53.50 1gjq n ALA 409 Cb 0.20 -2.65 -0.01 0.00 0.00 0.00 0.00 19.45 16.99 1gjq n ALA 409 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1gjq n TRP 410 N 7.58 -0.80 -4.78 0.00 5.03 -0.68 -4.97 117.44 118.83 1gjq n TRP 410 Ca 0.21 0.00 -0.32 0.00 3.03 0.00 0.00 57.50 60.42 1gjq n TRP 410 Cb 0.38 -3.47 -0.13 0.00 -1.03 0.00 0.00 31.31 27.07 1gjq n TRP 410 CO 0.00 0.00 0.00 0.15 -0.03 0.00 0.00 177.69 177.81 1gjq s LYS 411 N -4.83 2.41 -1.16 -0.99 1.02 -0.98 -4.76 119.74 110.45 1gjq s LYS 411 Ca 0.00 -0.77 -0.20 0.00 0.02 0.00 0.00 55.97 55.02 1gjq s LYS 411 Cb 0.00 -2.35 0.06 0.00 -0.52 0.00 0.00 37.83 35.02 1gjq s LYS 411 CO 0.00 0.60 1.60 0.21 -0.92 0.00 0.00 175.35 176.84 1gjq s LYS 412 N -0.99 3.79 0.28 1.68 2.20 -1.26 -2.70 119.74 122.73 1gjq s LYS 412 Ca 0.13 -1.56 -0.04 0.00 -0.36 0.00 0.00 55.97 54.14 1gjq s LYS 412 Cb -0.11 -5.45 0.36 0.00 -1.51 0.00 0.00 37.83 31.13 1gjq s LYS 412 CO 0.03 -2.24 1.93 -0.24 -0.36 0.00 0.00 175.35 174.47 1gjq h VAL 413 N 6.18 1.23 -2.68 4.02 3.04 -1.58 -3.47 116.25 123.00 1gjq h VAL 413 Ca 0.33 -0.47 0.09 0.00 -1.01 0.00 0.00 66.70 65.64 1gjq h VAL 413 Cb 0.94 -0.00 -0.09 0.00 -2.01 0.00 0.00 31.29 30.13 1gjq h VAL 413 CO 1.44 0.24 0.35 0.00 -1.01 0.00 0.00 177.57 178.59 1gjq s ALA 414 N -5.91 -1.52 0.08 3.17 0.00 -1.22 -5.04 121.76 111.31 1gjq s ALA 414 Ca -0.12 0.18 0.05 0.00 0.00 0.00 0.00 51.96 52.07 1gjq s ALA 414 Cb 0.18 0.72 -0.03 0.00 0.00 0.00 0.00 23.12 23.99 1gjq s ALA 414 CO 0.81 -0.94 -0.14 -1.21 0.00 0.00 0.00 175.76 174.28 1gjq s GLU 415 N -3.56 0.83 0.14 0.00 2.02 -1.26 -1.51 118.70 115.37 1gjq s GLU 415 Ca 0.09 -0.99 0.07 0.00 0.02 0.00 0.00 54.97 54.16 1gjq s GLU 415 Cb -0.03 -0.81 -0.04 0.00 0.10 0.00 0.00 34.13 33.35 1gjq s GLU 415 CO -0.01 0.18 -0.16 -0.51 0.02 0.00 0.00 175.26 174.78 1gjq s LEU 416 N -1.83 2.42 -0.12 1.80 1.43 -0.53 -4.96 118.68 116.89 1gjq s LEU 416 Ca -0.01 -0.84 0.01 0.00 -1.03 0.00 0.00 54.13 52.26 1gjq s LEU 416 Cb -0.09 -0.67 -0.01 0.00 0.03 0.00 0.00 46.19 45.44 1gjq s LEU 416 CO 0.02 -0.10 -0.15 -1.10 0.23 0.00 0.00 176.35 175.25 1gjq s GLN 417 N -2.76 3.31 0.00 1.70 -1.52 -1.26 -0.73 119.66 118.40 1gjq s GLN 417 Ca 0.12 -0.73 0.00 0.00 -1.95 0.00 0.00 55.36 52.81 1gjq s GLN 417 Cb -0.05 -2.57 0.00 0.00 -0.22 0.00 0.00 33.01 30.17 1gjq s GLN 417 CO 0.05 0.20 0.00 0.41 -0.25 0.00 0.00 175.29 175.70 1gjq n GLY 418 N 3.54 2.01 0.23 3.09 0.00 0.83 -4.79 105.19 110.10 1gjq n GLY 418 Ca -0.18 -2.08 -0.00 0.00 0.00 0.00 0.00 46.02 43.75 1gjq n GLY 418 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1gjq h GLN 419 N 0.00 0.30 0.00 1.61 4.20 -1.95 -3.47 115.11 115.80 1gjq h GLN 419 Ca 0.00 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1gjq h GLN 419 Cb 0.00 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.75 1gjq h GLN 419 CO 0.00 0.51 0.00 0.41 -0.67 0.00 0.00 178.83 179.08 1gjq n GLY 420 N -0.59 -0.93 3.77 3.46 0.00 -1.26 -5.00 105.19 104.64 1gjq n GLY 420 Ca -0.01 -1.13 -0.30 0.00 0.00 0.00 0.00 46.02 44.59 1gjq n GLY 420 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gjq s GLY 421 N 0.00 1.65 0.00 -0.02 0.00 -1.25 -3.93 107.32 103.76 1gjq s GLY 421 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 44.72 43.82 1gjq s GLY 421 CO 0.00 -0.16 0.00 0.61 0.00 0.00 0.00 173.10 173.55 1gjq n GLY 422 N -2.34 0.47 3.78 0.20 0.00 0.05 -4.10 105.19 103.25 1gjq n GLY 422 Ca 0.12 -0.94 -0.37 0.00 0.00 0.00 0.00 46.02 44.82 1gjq n GLY 422 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gjq s SER 423 N -2.85 7.32 -0.01 1.61 0.15 -0.82 -1.58 113.70 117.52 1gjq s SER 423 Ca 0.00 1.75 -0.00 0.00 0.70 0.00 0.00 55.95 58.40 1gjq s SER 423 Cb 0.00 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.76 1gjq s SER 423 CO 0.00 0.00 -0.01 -0.11 1.20 0.00 0.00 173.24 174.32 1gjq n LEU 424 N 0.78 2.11 -3.95 3.45 7.94 -1.26 -3.81 117.00 122.27 1gjq n LEU 424 Ca 0.00 0.00 -0.17 0.00 -1.11 0.00 0.00 56.01 54.73 1gjq n LEU 424 Cb 0.50 -0.03 -0.15 0.00 0.53 0.00 0.00 43.42 44.27 1gjq n LEU 424 CO 0.45 0.36 -0.41 -0.36 -1.11 0.00 0.00 177.39 176.32 1gjq s PHE 425 N -2.02 0.60 0.01 1.96 0.08 -1.26 -4.31 117.98 113.04 1gjq s PHE 425 Ca -0.01 -0.12 0.05 0.00 0.12 0.00 0.00 56.93 56.97 1gjq s PHE 425 Cb 0.00 -0.44 -0.03 0.00 -0.57 0.00 0.00 43.02 41.98 1gjq s PHE 425 CO 0.02 -0.06 -0.15 -1.50 -0.10 0.00 0.00 175.22 173.43 1gjq s ILE 426 N 0.16 3.02 -0.02 0.64 2.07 -1.26 -2.31 121.20 123.50 1gjq s ILE 426 Ca -0.02 -0.98 -0.15 0.00 -1.41 0.00 0.00 60.65 58.09 1gjq s ILE 426 Cb -0.06 -2.26 0.03 0.00 0.13 0.00 0.00 42.46 40.30 1gjq s ILE 426 CO -0.00 0.42 0.33 -0.75 -1.91 0.00 0.00 174.94 173.02 1gjq s LYS 427 N -1.24 0.67 0.34 3.50 2.47 -0.19 -4.49 119.74 120.80 1gjq s LYS 427 Ca 0.14 -0.14 -0.15 0.00 -1.56 0.00 0.00 55.97 54.27 1gjq s LYS 427 Cb -0.11 0.30 0.03 0.00 -1.46 0.00 0.00 37.83 36.60 1gjq s LYS 427 CO 0.04 -0.18 0.70 -0.08 0.16 0.00 0.00 175.35 175.99 1gjq s THR 428 N -1.24 0.00 -0.01 3.43 -1.32 -1.26 -0.91 115.64 114.33 1gjq s THR 428 Ca -0.13 -1.13 -0.11 0.00 -1.21 0.00 0.00 61.69 59.11 1gjq s THR 428 Cb -0.05 -2.58 0.01 0.00 -1.51 0.00 0.00 72.50 68.37 1gjq s THR 428 CO 0.04 0.00 0.23 -2.28 -2.21 0.00 0.00 174.62 170.40 1gjq s HIS 429 N -2.95 -0.08 0.39 9.09 2.46 -1.26 -4.66 115.29 118.28 1gjq s HIS 429 Ca 0.17 0.10 0.12 0.00 0.47 0.00 0.00 55.06 55.93 1gjq s HIS 429 Cb -0.04 0.03 0.94 0.00 -0.13 0.00 0.00 32.58 33.38 1gjq s HIS 429 CO 0.11 -0.34 1.89 -1.35 -2.47 0.00 0.00 174.74 172.59 1gjq h PRO 430 N 4.10 0.54 -0.23 2.88 0.11 -1.93 -1.79 132.00 135.68 1gjq h PRO 430 Ca -0.30 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1gjq h PRO 430 Cb 1.18 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1gjq h PRO 430 CO 0.40 0.36 0.00 1.63 -0.21 0.00 0.00 178.00 180.18 1gjq n LYS 431 N -4.52 1.84 -4.48 1.05 5.02 -1.26 -4.91 118.16 110.90 1gjq n LYS 431 Ca 0.16 -1.27 -0.30 0.00 -2.02 0.00 0.00 58.31 54.88 1gjq n LYS 431 Cb 0.51 -1.39 -0.12 0.00 -0.02 0.00 0.00 35.03 34.01 1gjq n LYS 431 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1gjq s SER 432 N -1.45 3.88 -0.27 4.39 0.15 -0.67 -4.98 113.70 114.75 1gjq s SER 432 Ca 0.32 -0.48 0.12 0.00 0.70 0.00 0.00 55.95 56.61 1gjq s SER 432 Cb 0.17 -0.60 0.58 0.00 -1.71 0.00 0.00 66.02 64.46 1gjq s SER 432 CO 0.25 0.22 1.56 -1.54 1.20 0.00 0.00 173.24 174.93 1gjq n SER 433 N 1.18 3.62 -4.31 5.45 3.41 -1.26 -4.60 113.62 117.11 1gjq n SER 433 Ca -0.16 -3.36 -0.24 0.00 -0.26 0.00 0.00 58.87 54.85 1gjq n SER 433 Cb 0.52 -0.64 -0.12 0.00 -0.26 0.00 0.00 64.21 63.71 1gjq n SER 433 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1gjq s HIS 434 N -3.04 1.87 -0.17 7.33 3.76 -1.26 -1.28 115.29 122.50 1gjq s HIS 434 Ca 0.47 -0.42 -0.00 0.00 -0.15 0.00 0.00 55.06 54.95 1gjq s HIS 434 Cb 0.40 -1.00 0.04 0.00 1.11 0.00 0.00 32.58 33.13 1gjq s HIS 434 CO 0.07 0.25 -0.05 -1.17 -0.85 0.00 0.00 174.74 172.99 1gjq s LEU 435 N -2.09 1.62 -0.08 0.89 2.96 -0.89 -4.51 118.68 116.59 1gjq s LEU 435 Ca 0.09 -0.67 -0.07 0.00 -0.22 0.00 0.00 54.13 53.26 1gjq s LEU 435 Cb -0.09 -0.91 -0.04 0.00 0.50 0.00 0.00 46.19 45.65 1gjq s LEU 435 CO 0.05 -0.19 0.17 -0.31 -1.32 0.00 0.00 176.35 174.75 1gjq s TYR 436 N 1.63 3.60 -0.04 5.38 1.51 -0.08 -0.41 117.35 128.93 1gjq s TYR 436 Ca 0.01 0.53 -0.01 0.00 -1.01 0.00 0.00 57.07 56.58 1gjq s TYR 436 Cb -0.15 -1.94 0.03 0.00 -0.11 0.00 0.00 41.96 39.78 1gjq s TYR 436 CO -0.08 0.71 0.04 0.08 -1.11 0.00 0.00 175.55 175.19 1gjq s VAL 437 N -1.10 0.02 0.77 0.71 1.01 0.38 -1.03 120.40 121.17 1gjq s VAL 437 Ca 0.19 0.30 -0.05 0.00 0.00 0.00 0.00 61.98 62.42 1gjq s VAL 437 Cb -0.12 -0.23 0.14 0.00 0.00 0.00 0.00 36.38 36.17 1gjq s VAL 437 CO 0.08 0.18 1.07 1.51 0.00 0.00 0.00 175.10 177.94 1gjq s ASP 438 N 1.86 4.09 -0.31 3.32 1.47 -0.98 -0.22 116.67 125.91 1gjq s ASP 438 Ca 0.02 -0.17 0.17 0.00 1.18 0.00 0.00 52.55 53.74 1gjq s ASP 438 Cb -0.12 -0.15 0.45 0.00 -0.34 0.00 0.00 42.92 42.76 1gjq s ASP 438 CO -0.03 -2.04 1.34 0.35 0.68 0.00 0.00 175.17 175.47 1gjq n THR 439 N -3.05 0.55 -0.30 2.11 -2.24 -1.26 -4.26 114.28 105.83 1gjq n THR 439 Ca 0.15 -1.87 0.04 0.00 -2.27 0.00 0.00 64.05 60.09 1gjq n THR 439 Cb 0.60 1.11 0.10 0.00 -2.10 0.00 0.00 70.33 70.04 1gjq n THR 439 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1gjq n THR 440 N -1.08 -0.36 -0.75 4.28 -1.04 -1.10 -1.59 114.28 112.64 1gjq n THR 440 Ca -0.06 1.88 0.07 0.00 -2.04 0.00 0.00 64.05 63.90 1gjq n THR 440 Cb 0.84 -2.58 0.38 0.00 -1.82 0.00 0.00 70.33 67.15 1gjq n THR 440 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1gjq n PHE 441 N -5.31 1.91 -2.37 -1.42 3.72 -0.62 -4.76 117.46 108.61 1gjq n PHE 441 Ca 0.12 -0.67 -0.42 0.00 -0.05 0.00 0.00 57.45 56.43 1gjq n PHE 441 Cb 0.39 -0.46 -0.03 0.00 -0.94 0.00 0.00 39.48 38.44 1gjq n PHE 441 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1gjq s ASN 442 N -0.75 7.05 0.54 4.37 3.84 -0.62 -4.70 114.94 124.66 1gjq s ASN 442 Ca 0.51 2.12 0.35 0.00 0.21 0.00 0.00 52.86 56.06 1gjq s ASN 442 Cb 0.38 -2.59 1.90 0.00 -0.55 0.00 0.00 41.25 40.40 1gjq s ASN 442 CO 0.16 -0.46 2.07 1.55 -2.79 0.00 0.00 177.10 177.63 1gjq h PRO 443 N 6.33 0.00 -6.08 0.43 0.13 -1.90 -3.41 132.00 127.49 1gjq h PRO 443 Ca -0.43 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.14 1gjq h PRO 443 Cb 1.21 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 1gjq h PRO 443 CO 0.80 0.00 0.03 0.34 -0.23 0.00 0.00 178.00 178.94 1gjq s ASP 444 N -4.66 7.00 0.07 1.44 2.15 -1.26 -4.99 116.67 116.41 1gjq s ASP 444 Ca -0.04 1.19 -0.24 0.00 0.43 0.00 0.00 52.55 53.90 1gjq s ASP 444 Cb 0.10 -2.39 -0.16 0.00 -0.30 0.00 0.00 42.92 40.17 1gjq s ASP 444 CO 0.32 0.04 1.64 0.00 -0.17 0.00 0.00 175.17 176.99 1gjq h ALA 445 N 5.95 -0.02 -0.73 3.66 0.00 -1.96 -2.26 119.26 123.90 1gjq h ALA 445 Ca -0.44 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.45 1gjq h ALA 445 Cb 1.20 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 1gjq h ALA 445 CO 0.71 -0.46 0.46 -0.09 0.00 0.00 0.00 179.25 179.87 1gjq h ARG 446 N -0.12 0.86 -0.34 0.00 2.43 -1.95 -0.95 114.38 114.31 1gjq h ARG 446 Ca -0.00 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.03 1gjq h ARG 446 Cb 0.11 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1gjq h ARG 446 CO 0.00 0.57 -0.13 0.82 -1.51 0.00 0.00 179.97 179.73 1gjq h ILE 447 N 0.89 1.28 0.00 1.20 2.04 -1.92 -2.95 117.51 118.06 1gjq h ILE 447 Ca 0.29 -1.22 -0.00 0.00 1.00 0.00 0.00 64.86 64.94 1gjq h ILE 447 Cb 0.03 1.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1gjq h ILE 447 CO -0.11 0.40 -0.00 0.77 0.00 0.00 0.00 178.15 179.20 1gjq h SER 448 N 0.47 0.00 -0.44 1.72 4.64 -1.06 -2.53 113.55 116.36 1gjq h SER 448 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1gjq h SER 448 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1gjq h SER 448 CO 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 1gjq n GLN 449 N -3.09 2.28 -4.24 4.77 6.02 -0.39 -1.14 117.38 121.58 1gjq n GLN 449 Ca 0.01 -1.95 -0.14 0.00 -0.01 0.00 0.00 57.00 54.91 1gjq n GLN 449 Cb 0.32 -1.46 -0.10 0.00 1.02 0.00 0.00 30.24 30.02 1gjq n GLN 449 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1gjq s SER 450 N -1.27 0.83 0.12 1.08 1.04 -0.95 -1.96 113.70 112.59 1gjq s SER 450 Ca 0.37 -1.30 0.07 0.00 0.48 0.00 0.00 55.95 55.57 1gjq s SER 450 Cb 0.20 0.22 -0.04 0.00 0.10 0.00 0.00 66.02 66.51 1gjq s SER 450 CO 0.28 -0.71 -0.17 0.68 0.98 0.00 0.00 173.24 174.30 1gjq s VAL 451 N -3.86 1.51 -0.15 5.02 -7.23 -0.93 -4.15 120.40 110.61 1gjq s VAL 451 Ca 0.32 -1.65 -0.08 0.00 -1.81 0.00 0.00 61.98 58.76 1gjq s VAL 451 Cb 0.07 -1.54 -0.04 0.00 0.56 0.00 0.00 36.38 35.43 1gjq s VAL 451 CO 0.09 -0.27 0.14 0.00 -0.31 0.00 0.00 175.10 174.74 1gjq s ALA 452 N -1.73 3.81 -0.12 1.32 0.00 0.69 -1.40 121.76 124.34 1gjq s ALA 452 Ca 0.08 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.40 1gjq s ALA 452 Cb -0.07 -2.04 0.02 0.00 0.00 0.00 0.00 23.12 21.02 1gjq s ALA 452 CO 0.04 0.46 -0.16 0.08 0.00 0.00 0.00 175.76 176.17 1gjq s VAL 453 N -0.53 1.61 0.17 0.00 1.01 -0.70 -0.47 120.40 121.49 1gjq s VAL 453 Ca 0.12 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.45 1gjq s VAL 453 Cb -0.12 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 1gjq s VAL 453 CO 0.02 0.46 0.23 -0.36 0.00 0.00 0.00 175.10 175.46 1gjq s PHE 454 N 1.06 3.33 -0.31 5.22 0.40 0.45 -1.53 117.98 126.60 1gjq s PHE 454 Ca -0.04 0.03 -0.11 0.00 -0.60 0.00 0.00 56.93 56.21 1gjq s PHE 454 Cb -0.15 -1.58 -0.03 0.00 0.51 0.00 0.00 43.02 41.78 1gjq s PHE 454 CO -0.04 0.51 0.20 0.34 0.70 0.00 0.00 175.22 176.93 1gjq s ASP 455 N -3.34 5.89 0.49 1.36 -1.08 -1.26 -2.08 116.67 116.65 1gjq s ASP 455 Ca 0.33 -0.32 0.31 0.00 -0.52 0.00 0.00 52.55 52.36 1gjq s ASP 455 Cb -0.10 -2.09 1.23 0.00 -1.46 0.00 0.00 42.92 40.50 1gjq s ASP 455 CO 0.26 -0.16 1.91 -0.07 0.52 0.00 0.00 175.17 177.63 1gjq h LEU 456 N 8.41 0.00 -0.81 -1.34 3.38 -1.54 -2.33 115.31 121.08 1gjq h LEU 456 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1gjq h LEU 456 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1gjq h LEU 456 CO 0.60 0.00 -0.05 0.29 0.09 0.00 0.00 178.44 179.37 1gjq n LYS 457 N -2.93 1.45 -2.75 1.13 5.02 -1.26 -4.47 118.16 114.34 1gjq n LYS 457 Ca 0.01 -0.81 -0.06 0.00 -2.02 0.00 0.00 58.31 55.43 1gjq n LYS 457 Cb 0.31 -1.48 0.03 0.00 -0.02 0.00 0.00 35.03 33.87 1gjq n LYS 457 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1gjq n ASN 458 N -0.07 -3.11 0.00 4.39 5.15 -0.90 -5.03 115.26 115.69 1gjq n ASN 458 Ca 0.18 -3.08 0.11 0.00 -0.60 0.00 0.00 54.58 51.18 1gjq n ASN 458 Cb 0.34 1.77 0.55 0.00 -0.53 0.00 0.00 39.78 41.92 1gjq n ASN 458 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1gjq n LEU 459 N 2.23 0.00 0.10 1.20 4.77 -1.11 -3.06 117.00 121.13 1gjq n LEU 459 Ca 0.13 0.26 -0.02 0.00 -0.03 0.00 0.00 56.01 56.35 1gjq n LEU 459 Cb 0.60 -0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 41.39 1gjq n LEU 459 CO 0.01 -0.07 0.26 0.44 -1.33 0.00 0.00 177.39 176.70 1gjq h ASP 460 N 0.00 0.00 -3.93 -1.43 3.32 -1.96 -3.46 116.42 108.97 1gjq h ASP 460 Ca 0.00 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.58 1gjq h ASP 460 Cb 0.18 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 1gjq h ASP 460 CO 0.00 0.72 0.38 0.00 -1.72 0.00 0.00 179.24 178.62 1gjq s ALA 461 N -2.85 3.15 0.81 3.45 0.00 -1.17 -5.04 121.76 120.10 1gjq s ALA 461 Ca 0.02 0.61 -0.11 0.00 0.00 0.00 0.00 51.96 52.49 1gjq s ALA 461 Cb 0.09 -3.23 0.08 0.00 0.00 0.00 0.00 23.12 20.06 1gjq s ALA 461 CO 0.78 -0.02 1.11 0.21 0.00 0.00 0.00 175.76 177.84 1gjq s LYS 462 N -2.31 1.92 1.07 0.00 2.20 -1.26 -4.83 119.74 116.53 1gjq s LYS 462 Ca 0.54 1.29 -0.14 0.00 -0.36 0.00 0.00 55.97 57.30 1gjq s LYS 462 Cb -0.20 -1.85 0.22 0.00 -1.51 0.00 0.00 37.83 34.50 1gjq s LYS 462 CO 0.25 -1.92 1.09 1.52 -0.36 0.00 0.00 175.35 175.94 1gjq s TYR 463 N -2.81 1.67 -0.12 4.03 -0.85 -1.26 -4.88 117.35 113.12 1gjq s TYR 463 Ca 0.63 0.88 0.02 0.00 -0.52 0.00 0.00 57.07 58.07 1gjq s TYR 463 Cb -0.19 -3.29 -0.01 0.00 0.38 0.00 0.00 41.96 38.85 1gjq s TYR 463 CO 0.56 -3.25 -0.18 -0.65 -1.52 0.00 0.00 175.55 170.52 1gjq s GLN 464 N -5.02 3.22 -0.10 -3.49 -0.21 -0.58 -4.89 119.66 108.59 1gjq s GLN 464 Ca 0.67 -0.77 -0.28 0.00 0.02 0.00 0.00 55.36 55.00 1gjq s GLN 464 Cb -0.17 -2.50 -0.02 0.00 1.00 0.00 0.00 33.01 31.32 1gjq s GLN 464 CO 0.58 0.16 0.91 0.08 -2.12 0.00 0.00 175.29 174.90 1gjq s VAL 465 N 0.44 4.86 -0.28 1.09 1.01 -1.26 -1.72 120.40 124.54 1gjq s VAL 465 Ca -0.13 1.84 -0.06 0.00 0.00 0.00 0.00 61.98 63.63 1gjq s VAL 465 Cb -0.17 -4.23 0.01 0.00 0.00 0.00 0.00 36.38 32.00 1gjq s VAL 465 CO 0.06 0.07 0.06 -0.76 0.00 0.00 0.00 175.10 174.53 1gjq s LEU 466 N 1.70 3.72 -1.32 3.92 1.02 -0.49 -4.99 118.68 122.23 1gjq s LEU 466 Ca 0.45 -0.67 -0.15 0.00 0.02 0.00 0.00 54.13 53.77 1gjq s LEU 466 Cb -0.18 -1.86 -0.01 0.00 0.02 0.00 0.00 46.19 44.16 1gjq s LEU 466 CO 0.18 -0.17 2.22 -0.81 0.02 0.00 0.00 176.35 177.79 1gjq n PRO 467 N 4.85 2.63 0.07 1.29 -0.04 -1.26 -2.19 135.00 140.34 1gjq n PRO 467 Ca -0.15 -2.40 -0.11 0.00 -0.04 0.00 0.00 63.50 60.80 1gjq n PRO 467 Cb 0.48 -3.16 -0.05 0.00 -0.04 0.00 0.00 33.50 30.73 1gjq n PRO 467 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1gjq h ILE 468 N 4.01 0.45 -0.41 0.52 1.08 -1.93 -1.24 117.51 120.00 1gjq h ILE 468 Ca 0.56 0.00 -0.08 0.00 -0.39 0.00 0.00 64.86 64.96 1gjq h ILE 468 Cb 0.61 0.45 -0.02 0.00 -3.07 0.00 0.00 36.82 34.79 1gjq h ILE 468 CO 1.89 0.00 -0.06 0.00 -0.69 0.00 0.00 178.15 179.29 1gjq h ALA 469 N 0.45 1.13 -0.54 1.87 0.00 -1.70 -2.63 119.26 117.83 1gjq h ALA 469 Ca 0.06 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 1gjq h ALA 469 Cb 0.46 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1gjq h ALA 469 CO -0.20 0.55 -0.02 1.49 0.00 0.00 0.00 179.25 181.06 1gjq h GLU 470 N 0.64 0.95 0.00 0.00 4.81 -1.75 -2.59 114.58 116.64 1gjq h GLU 470 Ca 0.12 -0.29 -0.07 0.00 -0.13 0.00 0.00 59.36 58.99 1gjq h GLU 470 Cb 0.49 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1gjq h GLU 470 CO 0.03 0.95 -0.32 -1.49 -0.73 0.00 0.00 179.01 177.45 1gjq h TRP 471 N 0.87 0.00 0.00 0.92 6.55 -0.98 -2.74 115.95 120.57 1gjq h TRP 471 Ca 0.16 0.00 -0.06 0.00 0.95 0.00 0.00 58.89 59.94 1gjq h TRP 471 Cb 0.54 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.84 1gjq h TRP 471 CO 0.03 0.32 -0.28 0.00 -1.05 0.00 0.00 178.44 177.47 1gjq h ALA 472 N 1.68 1.21 -5.84 1.49 0.00 -1.10 -3.48 119.26 113.22 1gjq h ALA 472 Ca -0.00 -0.25 -0.21 0.00 0.00 0.00 0.00 54.91 54.45 1gjq h ALA 472 Cb 0.59 -0.04 0.04 0.00 0.00 0.00 0.00 17.79 18.37 1gjq h ALA 472 CO 0.04 0.34 -0.50 -3.47 0.00 0.00 0.00 179.25 175.66 1gjq n ASP 473 N -3.73 -6.60 -0.01 0.00 2.03 -1.03 -4.99 116.55 102.22 1gjq n ASP 473 Ca -0.01 -0.50 0.06 0.00 0.52 0.00 0.00 54.79 54.85 1gjq n ASP 473 Cb 0.38 -4.15 -0.11 0.00 -0.72 0.00 0.00 41.12 36.52 1gjq n ASP 473 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1gjq n LEU 474 N -2.53 0.00 0.00 -2.67 4.77 -1.26 -5.12 117.00 110.19 1gjq n LEU 474 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 1gjq n LEU 474 Cb 0.57 0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1gjq n LEU 474 CO 0.58 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 1gjq n GLY 475 N 1.75 0.86 3.87 -0.72 0.00 -1.26 -4.76 105.19 104.93 1gjq n GLY 475 Ca -0.04 -1.26 -0.31 0.00 0.00 0.00 0.00 46.02 44.41 1gjq n GLY 475 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1gjq s GLU 476 N 0.00 3.79 0.00 1.61 -1.05 -1.26 -5.01 118.70 116.77 1gjq s GLU 476 Ca 0.00 0.61 0.00 0.00 -0.15 0.00 0.00 54.97 55.43 1gjq s GLU 476 Cb 0.00 -2.28 0.00 0.00 -0.44 0.00 0.00 34.13 31.41 1gjq s GLU 476 CO 0.00 -0.18 0.00 0.41 0.95 0.00 0.00 175.26 176.44 1gjq n GLY 477 N -1.63 3.32 0.32 -3.83 0.00 -1.26 -4.68 105.19 97.43 1gjq n GLY 477 Ca 0.04 -1.93 0.09 0.00 0.00 0.00 0.00 46.02 44.22 1gjq n GLY 477 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gjq h ALA 478 N 0.00 1.97 -6.74 4.61 0.00 -1.95 -3.47 119.26 113.69 1gjq h ALA 478 Ca 0.00 -0.01 -0.55 0.00 0.00 0.00 0.00 54.91 54.35 1gjq h ALA 478 Cb 0.00 -0.08 -0.19 0.00 0.00 0.00 0.00 17.79 17.52 1gjq h ALA 478 CO 0.00 -0.04 -0.85 1.63 0.00 0.00 0.00 179.25 179.99 1gjq n LYS 479 N -4.48 -3.04 -1.88 0.00 5.02 -1.26 -4.83 118.16 107.69 1gjq n LYS 479 Ca 0.05 0.36 -0.42 0.00 -2.02 0.00 0.00 58.31 56.28 1gjq n LYS 479 Cb 0.23 -4.94 -0.03 0.00 -0.02 0.00 0.00 35.03 30.27 1gjq n LYS 479 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1gjq s ARG 480 N -6.90 4.19 -0.12 1.97 0.52 -1.09 -4.49 118.95 113.02 1gjq s ARG 480 Ca 0.60 2.43 -0.13 0.00 -0.52 0.00 0.00 55.73 58.11 1gjq s ARG 480 Cb -0.33 -3.12 -0.05 0.00 0.52 0.00 0.00 34.95 31.98 1gjq s ARG 480 CO 0.93 -0.61 0.30 0.08 0.02 0.00 0.00 175.30 176.01 1gjq s VAL 481 N 0.85 5.28 -0.01 3.52 1.01 -0.29 -0.09 120.40 130.67 1gjq s VAL 481 Ca 0.69 0.57 -0.03 0.00 0.00 0.00 0.00 61.98 63.20 1gjq s VAL 481 Cb -0.45 -3.62 -0.00 0.00 0.00 0.00 0.00 36.38 32.31 1gjq s VAL 481 CO 0.35 0.46 0.07 0.54 0.00 0.00 0.00 175.10 176.51 1gjq s VAL 482 N -0.04 0.05 -0.13 2.92 0.11 -0.42 -3.60 120.40 119.29 1gjq s VAL 482 Ca 0.18 -0.42 -0.09 0.00 -2.93 0.00 0.00 61.98 58.72 1gjq s VAL 482 Cb -0.14 -0.24 0.03 0.00 -1.53 0.00 0.00 36.38 34.51 1gjq s VAL 482 CO 0.06 -0.23 0.18 1.67 -3.33 0.00 0.00 175.10 173.45 1gjq n GLN 483 N 2.25 -3.81 -2.72 1.54 7.27 -1.26 -1.88 117.38 118.77 1gjq n GLN 483 Ca -0.18 2.92 -0.42 0.00 0.07 0.00 0.00 57.00 59.39 1gjq n GLN 483 Cb 0.57 -3.99 -0.04 0.00 2.41 0.00 0.00 30.24 29.20 1gjq n GLN 483 CO 0.00 0.00 0.00 -2.14 0.07 0.00 0.00 177.06 174.99 1gjq s PRO 484 N -0.49 4.61 -0.06 3.69 0.02 -1.26 -4.26 135.00 137.26 1gjq s PRO 484 Ca -0.21 1.43 -0.02 0.00 0.02 0.00 0.00 61.00 62.22 1gjq s PRO 484 Cb 0.01 -3.43 0.04 0.00 0.02 0.00 0.00 34.50 31.14 1gjq s PRO 484 CO 0.57 0.06 0.12 -2.00 -0.33 0.00 0.00 177.00 175.41 1gjq s GLU 485 N 0.61 0.06 0.70 5.54 2.56 -0.17 -4.82 118.70 123.18 1gjq s GLU 485 Ca 0.50 0.33 -0.06 0.00 0.00 0.00 0.00 54.97 55.74 1gjq s GLU 485 Cb -0.22 -0.20 0.07 0.00 2.00 0.00 0.00 34.13 35.78 1gjq s GLU 485 CO 0.29 -0.17 1.00 0.71 -0.56 0.00 0.00 175.26 176.53 1gjq s TYR 486 N 1.16 2.77 0.62 5.30 1.51 -1.26 0.72 117.35 128.16 1gjq s TYR 486 Ca -0.09 0.35 0.08 0.00 -1.01 0.00 0.00 57.07 56.40 1gjq s TYR 486 Cb -0.12 -3.18 0.11 0.00 -0.11 0.00 0.00 41.96 38.65 1gjq s TYR 486 CO -0.05 -1.43 0.86 0.54 -1.11 0.00 0.00 175.55 174.35 1gjq s ASN 487 N -4.54 4.89 0.24 2.29 4.22 -1.04 -4.66 114.94 116.34 1gjq s ASN 487 Ca 0.61 -0.83 -0.05 0.00 -2.14 0.00 0.00 52.86 50.45 1gjq s ASN 487 Cb -0.10 0.38 0.45 0.00 1.28 0.00 0.00 41.25 43.26 1gjq s ASN 487 CO 0.44 -1.51 1.69 0.50 -2.04 0.00 0.00 177.10 176.18 1gjq h LYS 488 N -0.01 0.26 -0.17 3.55 3.64 -1.90 -2.15 116.57 119.79 1gjq h LYS 488 Ca -0.30 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 1gjq h LYS 488 Cb 1.28 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1gjq h LYS 488 CO 0.40 0.17 0.00 2.89 -2.27 0.00 0.00 179.45 180.64 1gjq n ARG 489 N -5.16 2.17 -2.00 1.90 1.85 -1.26 -4.95 116.66 109.21 1gjq n ARG 489 Ca 0.14 -1.73 -0.17 0.00 -1.00 0.00 0.00 57.85 55.09 1gjq n ARG 489 Cb 0.45 -1.47 -0.03 0.00 -1.05 0.00 0.00 32.46 30.36 1gjq n ARG 489 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1gjq n GLY 490 N 1.33 0.45 0.64 2.89 0.00 -0.81 -4.92 105.19 104.77 1gjq n GLY 490 Ca 0.17 -0.18 0.10 0.00 0.00 0.00 0.00 46.02 46.11 1gjq n GLY 490 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gjq n ASP 491 N -1.06 2.30 -3.82 1.61 5.68 -1.26 -4.60 116.55 115.40 1gjq n ASP 491 Ca -0.19 -1.65 -0.12 0.00 -0.50 0.00 0.00 54.79 52.33 1gjq n ASP 491 Cb 0.62 0.26 -0.12 0.00 -1.14 0.00 0.00 41.12 40.74 1gjq n ASP 491 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 1gjq s GLU 492 N -2.05 0.26 -0.11 0.11 -1.05 -1.26 -1.57 118.70 113.04 1gjq s GLU 492 Ca 0.20 0.13 0.01 0.00 -0.15 0.00 0.00 54.97 55.16 1gjq s GLU 492 Cb 0.17 0.12 -0.01 0.00 -0.44 0.00 0.00 34.13 33.97 1gjq s GLU 492 CO 0.40 -0.04 -0.16 0.08 0.95 0.00 0.00 175.26 176.49 1gjq s VAL 493 N -0.19 2.79 -0.02 1.83 1.01 -0.24 -2.49 120.40 123.09 1gjq s VAL 493 Ca -0.03 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 1gjq s VAL 493 Cb -0.02 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 1gjq s VAL 493 CO 0.01 0.54 0.09 0.26 0.00 0.00 0.00 175.10 176.00 1gjq s TRP 494 N 0.22 3.34 0.04 5.22 0.52 0.22 -0.56 118.94 127.94 1gjq s TRP 494 Ca -0.10 0.26 0.03 0.00 0.02 0.00 0.00 56.10 56.30 1gjq s TRP 494 Cb -0.16 -1.77 -0.02 0.00 -1.15 0.00 0.00 33.47 30.37 1gjq s TRP 494 CO 0.06 0.58 -0.09 -0.06 0.02 0.00 0.00 176.95 177.45 1gjq s PHE 495 N -1.17 0.76 -0.20 -1.98 0.40 0.01 -1.00 117.98 114.80 1gjq s PHE 495 Ca 0.22 -0.43 -0.07 0.00 -0.60 0.00 0.00 56.93 56.05 1gjq s PHE 495 Cb -0.12 -0.45 -0.04 0.00 0.51 0.00 0.00 43.02 42.92 1gjq s PHE 495 CO 0.13 -0.04 0.05 -1.12 0.70 0.00 0.00 175.22 174.93 1gjq s SER 496 N -1.38 5.35 -0.76 1.36 0.01 -0.79 -1.10 113.70 116.39 1gjq s SER 496 Ca -0.06 -0.04 -0.15 0.00 1.31 0.00 0.00 55.95 57.01 1gjq s SER 496 Cb -0.09 -1.92 0.20 0.00 0.21 0.00 0.00 66.02 64.42 1gjq s SER 496 CO 0.01 0.11 0.72 -0.69 0.41 0.00 0.00 173.24 173.80 1gjq s VAL 497 N 0.72 5.49 -0.88 3.43 1.01 0.10 -1.30 120.40 128.96 1gjq s VAL 497 Ca 0.02 -2.21 -0.25 0.00 0.00 0.00 0.00 61.98 59.55 1gjq s VAL 497 Cb -0.14 -4.45 0.04 0.00 0.00 0.00 0.00 36.38 31.83 1gjq s VAL 497 CO 0.02 -1.01 1.41 0.86 0.00 0.00 0.00 175.10 176.38 1gjq s TRP 498 N 0.60 2.37 0.36 5.22 -0.00 0.88 -3.33 118.94 125.03 1gjq s TRP 498 Ca 0.15 -0.39 0.07 0.00 -0.00 0.00 0.00 56.10 55.93 1gjq s TRP 498 Cb -0.15 -4.62 -0.02 0.00 -0.00 0.00 0.00 33.47 28.68 1gjq s TRP 498 CO -0.06 -2.00 0.36 1.21 -0.00 0.00 0.00 176.95 176.45 1gjq s ASN 499 N 4.67 5.35 0.93 5.86 2.47 -1.26 -2.68 114.94 130.27 1gjq s ASN 499 Ca 0.43 -0.51 -0.10 0.00 0.42 0.00 0.00 52.86 53.10 1gjq s ASN 499 Cb -0.04 -0.88 0.15 0.00 -1.45 0.00 0.00 41.25 39.03 1gjq s ASN 499 CO 0.02 -0.47 1.14 -0.83 -3.72 0.00 0.00 177.10 173.24 1gjq s GLY 500 N -4.08 1.68 0.25 1.21 0.00 -1.26 -4.31 107.32 100.81 1gjq s GLY 500 Ca 0.44 0.55 -0.03 0.00 0.00 0.00 0.00 44.72 45.68 1gjq s GLY 500 CO 0.28 0.98 1.81 1.70 0.00 0.00 0.00 173.10 177.88 1gjq h LYS 501 N -1.91 0.80 -0.01 2.90 3.64 -1.99 -2.35 116.57 117.65 1gjq h LYS 501 Ca -0.44 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1gjq h LYS 501 Cb 1.27 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1gjq h LYS 501 CO 0.42 0.53 -0.11 0.09 -2.27 0.00 0.00 179.45 178.11 1gjq n ASN 502 N -4.73 0.90 -4.40 4.20 5.03 -1.26 -4.86 115.26 110.14 1gjq n ASN 502 Ca 0.14 -0.99 -0.18 0.00 0.87 0.00 0.00 54.58 54.42 1gjq n ASN 502 Cb 0.29 0.02 0.04 0.00 -1.02 0.00 0.00 39.78 39.10 1gjq n ASN 502 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1gjq n ASP 503 N -0.52 2.00 -4.79 6.41 8.00 -0.88 -5.12 116.55 121.65 1gjq n ASP 503 Ca 0.16 -2.38 -0.36 0.00 0.71 0.00 0.00 54.79 52.93 1gjq n ASP 503 Cb 0.30 -0.24 -0.07 0.00 -0.02 0.00 0.00 41.12 41.09 1gjq n ASP 503 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1gjq s SER 504 N -3.86 6.19 0.38 -2.24 0.01 -1.26 -4.82 113.70 108.09 1gjq s SER 504 Ca 0.41 0.33 0.07 0.00 1.31 0.00 0.00 55.95 58.07 1gjq s SER 504 Cb -0.03 -2.03 -0.07 0.00 0.21 0.00 0.00 66.02 64.09 1gjq s SER 504 CO 0.26 0.30 -0.01 -0.44 0.41 0.00 0.00 173.24 173.76 1gjq s SER 505 N -0.38 3.68 0.19 2.44 0.01 -1.26 -4.74 113.70 113.64 1gjq s SER 505 Ca 0.11 -1.32 -0.22 0.00 1.31 0.00 0.00 55.95 55.83 1gjq s SER 505 Cb -0.12 -0.35 0.05 0.00 0.21 0.00 0.00 66.02 65.81 1gjq s SER 505 CO 0.01 -0.40 0.61 0.00 0.41 0.00 0.00 173.24 173.88 1gjq s ALA 506 N -2.74 -1.42 -0.16 1.44 0.00 -1.21 -4.68 121.76 112.98 1gjq s ALA 506 Ca 0.34 0.21 -0.01 0.00 0.00 0.00 0.00 51.96 52.50 1gjq s ALA 506 Cb 0.08 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 24.06 1gjq s ALA 506 CO 0.17 -0.83 -0.13 -0.51 0.00 0.00 0.00 175.76 174.46 1gjq s LEU 507 N -2.81 2.62 -0.19 0.00 1.43 -0.67 -0.73 118.68 118.35 1gjq s LEU 507 Ca 0.04 -0.41 -0.05 0.00 -1.03 0.00 0.00 54.13 52.67 1gjq s LEU 507 Cb -0.02 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.56 1gjq s LEU 507 CO -0.07 0.09 0.01 -0.69 0.23 0.00 0.00 176.35 175.92 1gjq s VAL 508 N 0.81 4.20 -0.18 -1.59 1.01 -0.26 -0.09 120.40 124.29 1gjq s VAL 508 Ca -0.04 -0.24 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 1gjq s VAL 508 Cb -0.15 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 1gjq s VAL 508 CO 0.01 0.45 0.00 -0.69 0.00 0.00 0.00 175.10 174.87 1gjq s VAL 509 N 0.70 4.13 -0.06 2.92 1.01 -0.10 -0.81 120.40 128.19 1gjq s VAL 509 Ca 0.01 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.76 1gjq s VAL 509 Cb -0.14 -2.85 -0.02 0.00 0.00 0.00 0.00 36.38 33.37 1gjq s VAL 509 CO 0.02 0.45 -0.15 -0.69 0.00 0.00 0.00 175.10 174.74 1gjq s VAL 510 N 0.67 3.00 -0.52 2.92 1.01 0.28 -1.17 120.40 126.59 1gjq s VAL 510 Ca 0.00 -0.74 -0.28 0.00 0.00 0.00 0.00 61.98 60.96 1gjq s VAL 510 Cb -0.14 -2.18 0.02 0.00 0.00 0.00 0.00 36.38 34.08 1gjq s VAL 510 CO 0.02 0.58 1.29 -0.62 0.00 0.00 0.00 175.10 176.38 1gjq s ASP 511 N -0.57 6.36 0.40 3.32 -1.08 -0.31 -1.08 116.67 123.71 1gjq s ASP 511 Ca 0.08 0.36 0.10 0.00 -0.52 0.00 0.00 52.55 52.57 1gjq s ASP 511 Cb -0.11 -2.55 0.89 0.00 -1.46 0.00 0.00 42.92 39.68 1gjq s ASP 511 CO 0.01 -1.50 1.96 -0.78 0.52 0.00 0.00 175.17 175.38 1gjq h ASP 512 N 10.18 0.52 -0.11 -0.34 3.58 -1.61 0.30 116.42 128.94 1gjq h ASP 512 Ca -0.26 0.01 -0.13 0.00 0.42 0.00 0.00 57.03 57.07 1gjq h ASP 512 Cb 1.08 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 42.02 1gjq h ASP 512 CO 1.15 0.32 -0.37 0.50 -2.88 0.00 0.00 179.24 177.97 1gjq h LYS 513 N 0.58 0.63 0.00 0.28 3.64 -1.92 -3.35 116.57 116.43 1gjq h LYS 513 Ca 0.30 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1gjq h LYS 513 Cb 0.42 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1gjq h LYS 513 CO -0.10 0.90 -0.71 0.25 -2.27 0.00 0.00 179.45 177.52 1gjq n THR 514 N -4.05 0.00 -1.85 1.00 -2.24 -1.02 -5.01 114.28 101.11 1gjq n THR 514 Ca -0.01 -0.25 -0.17 0.00 -2.27 0.00 0.00 64.05 61.35 1gjq n THR 514 Cb 0.50 0.86 -0.05 0.00 -2.10 0.00 0.00 70.33 69.54 1gjq n THR 514 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1gjq n LEU 515 N -1.38 -1.49 -4.88 3.22 4.77 0.10 -5.01 117.00 112.34 1gjq n LEU 515 Ca 0.01 0.24 -0.25 0.00 -0.03 0.00 0.00 56.01 55.98 1gjq n LEU 515 Cb 0.19 -2.49 -0.04 0.00 -2.33 0.00 0.00 43.42 38.76 1gjq n LEU 515 CO 0.22 -0.60 -0.14 -0.54 -1.33 0.00 0.00 177.39 175.00 1gjq s LYS 516 N -4.06 3.17 -0.12 3.23 1.02 -1.23 -4.89 119.74 116.85 1gjq s LYS 516 Ca 0.00 -0.79 -0.29 0.00 0.02 0.00 0.00 55.97 54.91 1gjq s LYS 516 Cb 0.00 -2.78 -0.04 0.00 -0.52 0.00 0.00 37.83 34.49 1gjq s LYS 516 CO 0.00 0.48 1.62 -1.17 -0.92 0.00 0.00 175.35 175.35 1gjq s LEU 517 N -3.38 4.15 -0.23 3.17 2.96 -1.26 -1.16 118.68 122.93 1gjq s LEU 517 Ca 0.33 1.98 -0.14 0.00 -0.22 0.00 0.00 54.13 56.08 1gjq s LEU 517 Cb -0.10 -3.53 -0.17 0.00 0.50 0.00 0.00 46.19 42.89 1gjq s LEU 517 CO 0.26 -1.04 -0.05 1.17 -1.32 0.00 0.00 176.35 175.37 1gjq n LYS 518 N 7.29 0.60 -3.52 1.98 4.81 -0.31 -4.88 118.16 124.13 1gjq n LYS 518 Ca 0.18 0.37 -0.11 0.00 -0.87 0.00 0.00 58.31 57.87 1gjq n LYS 518 Cb 0.44 -1.61 -0.03 0.00 0.02 0.00 0.00 35.03 33.84 1gjq n LYS 518 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1gjq s ALA 519 N -2.46 -1.32 -0.08 3.14 0.00 -0.97 -5.02 121.76 115.05 1gjq s ALA 519 Ca -0.33 0.24 -0.00 0.00 0.00 0.00 0.00 51.96 51.87 1gjq s ALA 519 Cb 0.10 0.82 0.03 0.00 0.00 0.00 0.00 23.12 24.06 1gjq s ALA 519 CO 0.57 -0.73 -0.04 0.08 0.00 0.00 0.00 175.76 175.64 1gjq s VAL 520 N -3.78 0.64 -0.34 0.00 1.01 -1.26 -0.92 120.40 115.75 1gjq s VAL 520 Ca 0.02 -0.07 -0.14 0.00 0.00 0.00 0.00 61.98 61.79 1gjq s VAL 520 Cb -0.00 -0.72 -0.02 0.00 0.00 0.00 0.00 36.38 35.65 1gjq s VAL 520 CO -0.12 0.29 0.32 -0.69 0.00 0.00 0.00 175.10 174.91 1gjq s VAL 521 N 1.65 5.20 0.02 2.92 1.01 0.87 -4.95 120.40 127.12 1gjq s VAL 521 Ca 0.01 -0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.05 1gjq s VAL 521 Cb -0.13 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 1gjq s VAL 521 CO -0.05 -0.05 -0.19 -0.54 0.00 0.00 0.00 175.10 174.27 1gjq s LYS 522 N 1.93 1.35 -0.27 2.72 1.02 -1.26 -1.67 119.74 123.56 1gjq s LYS 522 Ca 0.10 -0.80 -0.25 0.00 0.02 0.00 0.00 55.97 55.04 1gjq s LYS 522 Cb -0.17 -1.39 0.11 0.00 -0.52 0.00 0.00 37.83 35.87 1gjq s LYS 522 CO 0.11 0.36 0.98 0.34 -0.92 0.00 0.00 175.35 176.22 1gjq s ASP 523 N -0.89 -0.50 0.45 2.83 -1.08 -1.26 -5.04 116.67 111.19 1gjq s ASP 523 Ca 0.06 0.95 0.31 0.00 -0.52 0.00 0.00 52.55 53.35 1gjq s ASP 523 Cb -0.08 0.96 1.53 0.00 -1.46 0.00 0.00 42.92 43.87 1gjq s ASP 523 CO 0.01 -0.18 1.93 1.55 0.52 0.00 0.00 175.17 179.01 1gjq h PRO 524 N 4.28 0.00 0.00 4.34 0.13 -2.01 -1.85 132.00 136.89 1gjq h PRO 524 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1gjq h PRO 524 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1gjq h PRO 524 CO 0.10 0.00 -0.55 0.54 -0.23 0.00 0.00 178.00 177.86 1gjq n ARG 525 N -2.64 0.29 -1.93 0.86 1.74 -1.26 -4.59 116.66 109.12 1gjq n ARG 525 Ca -0.01 0.10 -0.42 0.00 -0.77 0.00 0.00 57.85 56.76 1gjq n ARG 525 Cb 0.14 -1.70 -0.01 0.00 -1.02 0.00 0.00 32.46 29.87 1gjq n ARG 525 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1gjq n LEU 526 N -2.12 5.82 -4.69 0.55 7.94 -0.70 -4.92 117.00 118.88 1gjq n LEU 526 Ca 0.04 -3.89 -0.38 0.00 -1.11 0.00 0.00 56.01 50.66 1gjq n LEU 526 Cb 0.44 -1.63 -0.07 0.00 0.53 0.00 0.00 43.42 42.69 1gjq n LEU 526 CO 0.36 0.52 0.12 -0.63 -1.11 0.00 0.00 177.39 176.65 1gjq s ILE 527 N 4.10 5.20 -1.03 1.96 1.01 -1.26 -4.41 121.20 126.76 1gjq s ILE 527 Ca 0.51 0.78 -0.18 0.00 0.00 0.00 0.00 60.65 61.77 1gjq s ILE 527 Cb 0.10 -3.75 0.02 0.00 0.01 0.00 0.00 42.46 38.84 1gjq s ILE 527 CO -0.01 0.28 0.67 0.35 0.00 0.00 0.00 174.94 176.23 1gjq n THR 528 N 4.10 -3.82 -2.38 2.92 -2.24 -1.26 -3.66 114.28 107.94 1gjq n THR 528 Ca -0.08 -0.41 -0.42 0.00 -2.27 0.00 0.00 64.05 60.87 1gjq n THR 528 Cb 0.51 -3.09 -0.03 0.00 -2.10 0.00 0.00 70.33 65.63 1gjq n THR 528 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1gjq s PRO 529 N -6.05 4.33 0.00 -0.78 0.04 -1.26 -1.88 135.00 129.40 1gjq s PRO 529 Ca 0.28 1.77 0.00 0.00 0.04 0.00 0.00 61.00 63.09 1gjq s PRO 529 Cb -0.14 -3.55 0.00 0.00 0.04 0.00 0.00 34.50 30.85 1gjq s PRO 529 CO 0.92 -0.48 0.00 0.25 0.04 0.00 0.00 177.00 177.73 1gjq n THR 530 N 4.60 0.00 -2.32 1.26 -2.24 -0.97 -4.08 114.28 110.52 1gjq n THR 530 Ca 0.12 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.49 1gjq n THR 530 Cb 0.45 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.65 1gjq n THR 530 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1gjq s GLY 531 N 0.00 2.92 -0.09 3.38 0.00 -1.26 -4.74 107.32 107.53 1gjq s GLY 531 Ca 0.00 1.04 0.02 0.00 0.00 0.00 0.00 44.72 45.78 1gjq s GLY 531 CO 0.00 1.74 -0.15 0.54 0.00 0.00 0.00 173.10 175.23 1gjq s LYS 532 N -1.22 2.08 -0.21 2.90 1.02 -1.26 -0.56 119.74 122.49 1gjq s LYS 532 Ca 0.48 -0.52 0.00 0.00 0.02 0.00 0.00 55.97 55.95 1gjq s LYS 532 Cb -0.35 -1.74 0.06 0.00 -0.52 0.00 0.00 37.83 35.28 1gjq s LYS 532 CO 0.44 -0.02 -0.05 -0.06 -0.92 0.00 0.00 175.35 174.74 1gjq s PHE 533 N 0.84 2.12 -0.03 3.18 0.08 -0.06 -4.92 117.98 119.19 1gjq s PHE 533 Ca -0.10 -1.52 -0.30 0.00 0.12 0.00 0.00 56.93 55.12 1gjq s PHE 533 Cb -0.15 -1.48 -0.05 0.00 -0.57 0.00 0.00 43.02 40.77 1gjq s PHE 533 CO 0.01 -0.73 1.34 1.21 -0.10 0.00 0.00 175.22 176.96 1gjq s ASN 534 N 1.49 6.91 0.17 1.36 3.84 -1.26 -0.69 114.94 126.76 1gjq s ASN 534 Ca -0.04 2.00 -0.22 0.00 0.21 0.00 0.00 52.86 54.81 1gjq s ASN 534 Cb -0.18 -2.56 0.09 0.00 -0.55 0.00 0.00 41.25 38.05 1gjq s ASN 534 CO -0.07 -0.69 1.60 0.58 -2.79 0.00 0.00 177.10 175.73 1gjq h VAL 535 N 5.02 0.23 0.41 -5.21 2.07 -1.41 -1.06 116.25 116.30 1gjq h VAL 535 Ca -0.36 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 1gjq h VAL 535 Cb 1.17 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1gjq h VAL 535 CO 0.90 0.00 -0.20 0.22 0.02 0.00 0.00 177.57 178.52 1gjq h TYR 536 N -0.21 -0.51 0.00 1.57 3.20 -1.60 -1.58 116.97 117.84 1gjq h TYR 536 Ca 0.20 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 1gjq h TYR 536 Cb 0.53 0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.97 1gjq h TYR 536 CO -0.56 -0.25 -0.01 -0.91 -1.64 0.00 0.00 178.16 174.79 1gjq h ASN 537 N -0.66 0.00 0.07 -2.11 2.35 -1.79 -1.38 115.58 112.05 1gjq h ASN 537 Ca -0.06 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.50 1gjq h ASN 537 Cb 0.48 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 1gjq h ASN 537 CO 0.09 0.01 -0.99 0.74 -1.65 0.00 0.00 177.43 175.64 1gjq h THR 538 N 0.00 1.24 -0.83 2.81 2.02 -1.11 -0.80 112.91 116.24 1gjq h THR 538 Ca -0.00 -2.36 -0.03 0.00 0.77 0.00 0.00 66.41 64.80 1gjq h THR 538 Cb 0.04 2.82 -0.04 0.00 -1.74 0.00 0.00 68.15 69.23 1gjq h THR 538 CO 0.00 0.60 0.42 -0.61 0.37 0.00 0.00 175.52 176.30 1gjq h GLN 539 N -0.62 1.18 -0.55 6.66 4.15 -1.01 -3.08 115.11 121.83 1gjq h GLN 539 Ca -0.23 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.03 1gjq h GLN 539 Cb 1.48 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 28.95 1gjq h GLN 539 CO -0.00 0.89 0.00 0.72 -1.93 0.00 0.00 178.83 178.51 1gjq n HIS 540 N -4.35 1.21 -3.97 3.99 8.25 -0.54 -4.97 115.22 114.83 1gjq n HIS 540 Ca 0.08 -0.62 -0.29 0.00 -0.26 0.00 0.00 57.72 56.63 1gjq n HIS 540 Cb 0.12 -0.20 -0.02 0.00 1.12 0.00 0.00 29.99 31.01 1gjq n HIS 540 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1gjq n ASP 541 N 0.84 -1.17 -4.45 0.41 8.00 -1.16 -4.90 116.55 114.12 1gjq n ASP 541 Ca 0.23 -1.07 -0.44 0.00 0.71 0.00 0.00 54.79 54.22 1gjq n ASP 541 Cb 0.80 -2.78 -0.03 0.00 -0.02 0.00 0.00 41.12 39.09 1gjq n ASP 541 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1gjq s VAL 542 N -3.92 4.70 0.00 2.53 1.01 -0.32 -5.02 120.40 119.39 1gjq s VAL 542 Ca 0.11 -1.51 0.00 0.00 0.00 0.00 0.00 61.98 60.58 1gjq s VAL 542 Cb -0.05 -4.78 0.00 0.00 0.00 0.00 0.00 36.38 31.55 1gjq s VAL 542 CO 0.91 -1.51 0.00 0.00 0.00 0.00 0.00 175.10 174.50