#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 6rsa s GLU 2 N 0.00 4.12 0.74 1.64 2.12 -1.26 -4.95 118.70 121.10 6rsa s GLU 2 Ca 0.00 2.60 -0.11 0.00 0.36 0.00 0.00 54.97 57.82 6rsa s GLU 2 Cb 0.00 -3.04 0.04 0.00 0.26 0.00 0.00 34.13 31.39 6rsa s GLU 2 CO 0.00 -0.69 1.09 0.95 -0.54 0.00 0.00 175.26 176.07 6rsa s THR 3 N 0.45 3.43 0.19 -1.70 -4.23 -1.26 -4.84 115.64 107.68 6rsa s THR 3 Ca 0.68 0.50 -0.09 0.00 -1.18 0.00 0.00 61.69 61.59 6rsa s THR 3 Cb -0.49 -3.03 0.10 0.00 1.34 0.00 0.00 72.50 70.43 6rsa s THR 3 CO 0.42 -0.58 1.71 0.00 -0.54 0.00 0.00 174.62 175.64 6rsa h ALA 4 N -0.87 0.90 -0.64 3.99 0.00 -1.94 0.83 119.26 121.54 6rsa h ALA 4 Ca -0.44 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.14 6rsa h ALA 4 Cb 1.23 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 6rsa h ALA 4 CO 0.53 0.61 0.04 0.00 0.00 0.00 0.00 179.25 180.43 6rsa h ALA 5 N 1.08 0.85 -0.17 0.00 0.00 -1.89 -1.88 119.26 117.25 6rsa h ALA 5 Ca 0.22 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 6rsa h ALA 5 Cb 0.35 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 6rsa h ALA 5 CO -0.00 0.67 -0.51 0.00 0.00 0.00 0.00 179.25 179.40 6rsa h ALA 6 N 1.01 0.80 -0.64 0.00 0.00 -1.84 -2.90 119.26 115.70 6rsa h ALA 6 Ca 0.19 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 6rsa h ALA 6 Cb 0.51 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 6rsa h ALA 6 CO 0.02 0.68 0.26 -0.22 0.00 0.00 0.00 179.25 179.99 6rsa h LYS 7 N 0.36 0.93 -0.23 0.00 3.64 -0.58 -2.51 116.57 118.19 6rsa h LYS 7 Ca 0.01 -0.15 0.02 0.00 -1.27 0.00 0.00 60.65 59.27 6rsa h LYS 7 Cb 1.02 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.66 6rsa h LYS 7 CO 0.09 0.76 0.08 0.35 -2.27 0.00 0.00 179.45 178.46 6rsa h PHE 8 N 0.92 0.14 -0.72 1.91 3.57 -1.15 -1.64 116.94 119.98 6rsa h PHE 8 Ca 0.22 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.66 6rsa h PHE 8 Cb 0.17 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.85 6rsa h PHE 8 CO 0.01 0.07 0.19 0.93 -2.23 0.00 0.00 178.31 177.28 6rsa h GLU 9 N 0.19 1.13 -0.24 1.11 5.08 -1.43 -0.78 114.58 119.64 6rsa h GLU 9 Ca 0.10 -0.26 -0.13 0.00 -1.00 0.00 0.00 59.36 58.07 6rsa h GLU 9 Cb 0.07 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 6rsa h GLU 9 CO -0.10 0.99 -0.34 -0.09 -1.00 0.00 0.00 179.01 178.46 6rsa h ARG 10 N 1.08 0.65 0.06 2.33 2.43 -1.23 -2.15 114.38 117.54 6rsa h ARG 10 Ca 0.23 -0.38 -0.24 0.00 -0.81 0.00 0.00 59.98 58.78 6rsa h ARG 10 Cb 0.36 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 6rsa h ARG 10 CO -0.00 1.00 -1.07 1.96 -1.51 0.00 0.00 179.97 180.35 6rsa h GLN 11 N 0.36 0.21 0.00 0.20 4.20 -1.29 -3.42 115.11 115.38 6rsa h GLN 11 Ca 0.02 -0.31 0.00 0.00 0.06 0.00 0.00 58.65 58.43 6rsa h GLN 11 Cb 0.93 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.81 6rsa h GLN 11 CO 0.08 1.09 0.00 0.72 -0.67 0.00 0.00 178.83 180.05 6rsa n HIS 12 N -3.56 0.00 -4.28 2.96 8.25 -0.30 -4.65 115.22 113.64 6rsa n HIS 12 Ca -0.05 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.07 6rsa n HIS 12 Cb 0.93 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.93 6rsa n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 6rsa s MET 13 N -0.03 3.71 -0.43 -0.41 -1.94 -0.81 -1.31 119.30 118.09 6rsa s MET 13 Ca 0.00 -0.46 0.05 0.00 -1.71 0.00 0.00 55.69 53.58 6rsa s MET 13 Cb 0.00 -2.99 0.20 0.00 2.01 0.00 0.00 34.83 34.05 6rsa s MET 13 CO 0.00 0.29 0.43 -3.47 -0.01 0.00 0.00 175.02 172.26 6rsa n ASP 14 N 3.42 0.13 0.02 3.03 2.03 0.34 -4.83 116.55 120.68 6rsa n ASP 14 Ca -0.17 -2.57 0.06 0.00 0.52 0.00 0.00 54.79 52.63 6rsa n ASP 14 Cb 0.52 -0.60 0.28 0.00 -0.72 0.00 0.00 41.12 40.61 6rsa n ASP 14 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 6rsa n SER 15 N 2.24 0.09 -0.04 1.67 7.64 -1.25 -3.07 113.62 120.89 6rsa n SER 15 Ca 0.26 0.53 0.13 0.00 1.01 0.00 0.00 58.87 60.80 6rsa n SER 15 Cb 0.48 -0.54 0.48 0.00 -1.01 0.00 0.00 64.21 63.62 6rsa n SER 15 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 6rsa n SER 16 N -1.60 0.35 -4.03 6.43 2.88 -1.26 -4.81 113.62 111.57 6rsa n SER 16 Ca 0.03 -0.12 -0.13 0.00 -1.33 0.00 0.00 58.87 57.32 6rsa n SER 16 Cb 0.14 -0.10 -0.12 0.00 -0.75 0.00 0.00 64.21 63.39 6rsa n SER 16 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 6rsa s THR 17 N -2.83 0.45 -0.04 2.46 -1.32 -1.17 -5.06 115.64 108.13 6rsa s THR 17 Ca 0.18 -0.93 0.13 0.00 -1.21 0.00 0.00 61.69 59.86 6rsa s THR 17 Cb 0.19 -0.51 -0.13 0.00 -1.51 0.00 0.00 72.50 70.53 6rsa s THR 17 CO 0.57 -0.33 1.05 0.28 -2.21 0.00 0.00 174.62 173.98 6rsa h SER 18 N 4.74 0.00 -5.05 8.08 0.02 -1.87 -3.43 113.55 116.04 6rsa h SER 18 Ca -0.34 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 60.70 6rsa h SER 18 Cb 1.20 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.69 6rsa h SER 18 CO 0.42 0.78 0.27 0.00 -1.14 0.00 0.00 176.83 177.16 6rsa s ALA 19 N -2.80 -1.29 0.19 3.77 0.00 -1.26 -4.83 121.76 115.54 6rsa s ALA 19 Ca -0.01 -0.24 -0.30 0.00 0.00 0.00 0.00 51.96 51.41 6rsa s ALA 19 Cb 0.09 0.82 -0.08 0.00 0.00 0.00 0.00 23.12 23.94 6rsa s ALA 19 CO 0.80 -1.04 1.14 0.00 0.00 0.00 0.00 175.76 176.67 6rsa s ALA 20 N -3.82 3.40 -1.35 0.00 0.00 -1.26 -4.95 121.76 113.78 6rsa s ALA 20 Ca 0.11 0.88 0.21 0.00 0.00 0.00 0.00 51.96 53.16 6rsa s ALA 20 Cb -0.05 -3.38 -0.14 0.00 0.00 0.00 0.00 23.12 19.55 6rsa s ALA 20 CO 0.06 -0.28 0.94 -1.13 0.00 0.00 0.00 175.76 175.35 6rsa n SER 21 N 2.32 1.36 -3.86 0.00 3.41 -1.26 -5.00 113.62 110.59 6rsa n SER 21 Ca 0.03 -1.18 -0.09 0.00 -0.26 0.00 0.00 58.87 57.37 6rsa n SER 21 Cb 0.45 0.79 -0.05 0.00 -0.26 0.00 0.00 64.21 65.15 6rsa n SER 21 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 6rsa s SER 22 N -2.71 -0.16 0.14 4.04 1.04 -1.26 -5.04 113.70 109.75 6rsa s SER 22 Ca 0.12 -0.69 0.18 0.00 0.48 0.00 0.00 55.95 56.04 6rsa s SER 22 Cb 0.16 0.57 0.77 0.00 0.10 0.00 0.00 66.02 67.62 6rsa s SER 22 CO 0.72 -1.08 1.55 -1.54 0.98 0.00 0.00 173.24 173.88 6rsa n SER 23 N -0.34 0.34 -0.05 7.02 3.41 -1.26 -2.38 113.62 120.35 6rsa n SER 23 Ca -0.07 0.59 0.13 0.00 -0.26 0.00 0.00 58.87 59.27 6rsa n SER 23 Cb 0.62 -0.66 0.51 0.00 -0.26 0.00 0.00 64.21 64.42 6rsa n SER 23 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 6rsa n ASN 24 N -1.88 0.35 -0.32 4.04 3.02 -1.26 -4.41 115.26 114.80 6rsa n ASN 24 Ca 0.02 -0.17 -0.03 0.00 -0.03 0.00 0.00 54.58 54.37 6rsa n ASN 24 Cb 0.17 -0.11 0.02 0.00 -0.61 0.00 0.00 39.78 39.25 6rsa n ASN 24 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 6rsa h TYR 25 N 0.25 -1.10 -0.14 3.10 3.20 -1.89 -2.28 116.97 118.12 6rsa h TYR 25 Ca 0.00 0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 6rsa h TYR 25 Cb 0.44 0.60 -0.01 0.00 1.54 0.00 0.00 36.73 39.31 6rsa h TYR 25 CO 0.00 -0.40 0.06 0.00 -1.64 0.00 0.00 178.16 176.18 6rsa h ASN 27 N 0.09 0.85 0.07 0.00 2.35 -1.78 0.27 115.58 117.42 6rsa h ASN 27 Ca 0.05 -0.12 -0.00 0.00 -0.55 0.00 0.00 56.30 55.67 6rsa h ASN 27 Cb 0.14 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.29 6rsa h ASN 27 CO -0.01 0.77 -0.03 1.56 -1.65 0.00 0.00 177.43 178.07 6rsa h GLN 28 N 0.90 -0.08 -0.12 0.81 4.20 -0.84 -3.02 115.11 116.95 6rsa h GLN 28 Ca 0.21 0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.89 6rsa h GLN 28 Cb 0.19 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.99 6rsa h GLN 28 CO -0.02 0.31 -0.08 0.52 -0.67 0.00 0.00 178.83 178.89 6rsa h MET 29 N -0.50 0.28 -0.81 1.46 2.86 0.29 -1.27 114.93 117.24 6rsa h MET 29 Ca -0.01 -0.13 0.09 0.00 -2.06 0.00 0.00 59.70 57.59 6rsa h MET 29 Cb 0.43 -0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.04 6rsa h MET 29 CO 0.01 0.64 0.53 0.52 1.06 0.00 0.00 176.91 179.67 6rsa h MET 30 N -0.09 0.74 0.17 1.72 2.86 -0.58 -1.64 114.93 118.11 6rsa h MET 30 Ca 0.02 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 6rsa h MET 30 Cb 0.57 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.07 6rsa h MET 30 CO 0.02 0.49 -0.08 -0.22 1.06 0.00 0.00 176.91 178.18 6rsa h LYS 31 N 0.76 -0.22 0.00 1.72 1.63 -1.47 0.14 116.57 119.12 6rsa h LYS 31 Ca 0.37 0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 60.18 6rsa h LYS 31 Cb 0.43 0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.10 6rsa h LYS 31 CO -0.14 0.20 -0.04 0.66 -3.45 0.00 0.00 179.45 176.67 6rsa h SER 32 N -0.84 0.00 -0.14 4.20 4.64 -0.88 -1.23 113.55 119.30 6rsa h SER 32 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 6rsa h SER 32 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 6rsa h SER 32 CO 0.04 0.04 0.00 0.54 -0.87 0.00 0.00 176.83 176.58 6rsa n ARG 33 N -3.23 1.66 -1.79 4.77 5.12 -0.65 -4.94 116.66 117.60 6rsa n ARG 33 Ca -0.01 -0.99 -0.13 0.00 -1.93 0.00 0.00 57.85 54.80 6rsa n ARG 33 Cb 0.24 -1.40 -0.03 0.00 -1.16 0.00 0.00 32.46 30.11 6rsa n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 6rsa n ASN 34 N 0.21 -4.28 -0.07 0.55 4.13 -0.47 -4.86 115.26 110.48 6rsa n ASN 34 Ca 0.16 0.16 0.15 0.00 1.68 0.00 0.00 54.58 56.73 6rsa n ASN 34 Cb 0.31 -3.17 0.76 0.00 -1.54 0.00 0.00 39.78 36.13 6rsa n ASN 34 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 6rsa n LEU 35 N -1.63 0.25 -0.62 3.41 4.77 0.04 -3.72 117.00 119.49 6rsa n LEU 35 Ca -0.14 0.06 0.05 0.00 -0.03 0.00 0.00 56.01 55.95 6rsa n LEU 35 Cb 0.51 -0.15 0.19 0.00 -2.33 0.00 0.00 43.42 41.65 6rsa n LEU 35 CO 0.18 0.04 0.52 0.35 -1.33 0.00 0.00 177.39 177.16 6rsa n THR 36 N -1.00 2.21 -0.03 -5.08 -2.24 -1.23 -3.29 114.28 103.62 6rsa n THR 36 Ca 0.18 -2.77 -0.11 0.00 -2.27 0.00 0.00 64.05 59.08 6rsa n THR 36 Cb 0.22 -0.26 -0.09 0.00 -2.10 0.00 0.00 70.33 68.10 6rsa n THR 36 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 6rsa h LYS 37 N 0.82 -0.05 0.00 -0.78 6.56 -1.91 -3.38 116.57 117.83 6rsa h LYS 37 Ca 0.05 0.00 -0.24 0.00 -1.06 0.00 0.00 60.65 59.41 6rsa h LYS 37 Cb 1.19 0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 32.82 6rsa h LYS 37 CO 0.11 0.61 -1.99 -0.25 -2.06 0.00 0.00 179.45 175.86 6rsa n ASP 38 N -4.74 0.31 -3.20 0.86 10.43 -1.26 -5.03 116.55 113.92 6rsa n ASP 38 Ca -0.08 0.14 -0.05 0.00 2.57 0.00 0.00 54.79 57.37 6rsa n ASP 38 Cb 0.33 0.87 0.02 0.00 1.84 0.00 0.00 41.12 44.19 6rsa n ASP 38 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 6rsa s ARG 39 N -2.82 1.61 -0.39 -1.24 1.70 -1.26 -5.11 118.95 111.44 6rsa s ARG 39 Ca -0.07 -1.04 -0.16 0.00 -0.47 0.00 0.00 55.73 53.99 6rsa s ARG 39 Cb 0.08 0.45 0.01 0.00 -0.57 0.00 0.00 34.95 34.92 6rsa s ARG 39 CO 0.84 -0.75 0.37 0.00 -1.08 0.00 0.00 175.30 174.68 6rsa s LYS 41 N 1.98 4.18 0.09 0.00 2.20 -1.21 -4.90 119.74 122.09 6rsa s LYS 41 Ca 0.10 2.42 -0.18 0.00 -0.36 0.00 0.00 55.97 57.95 6rsa s LYS 41 Cb -0.17 -3.54 -0.07 0.00 -1.51 0.00 0.00 37.83 32.54 6rsa s LYS 41 CO 0.12 -0.75 1.56 -1.00 -0.36 0.00 0.00 175.35 174.92 6rsa h PRO 42 N 8.20 0.45 -4.24 4.03 0.13 -1.94 -3.45 132.00 135.19 6rsa h PRO 42 Ca -0.44 -0.12 -0.42 0.00 -0.87 0.00 0.00 66.00 64.15 6rsa h PRO 42 Cb 1.21 -0.05 -0.33 0.00 0.13 0.00 0.00 31.00 31.96 6rsa h PRO 42 CO 0.93 0.57 -0.78 0.08 -0.23 0.00 0.00 178.00 178.58 6rsa s VAL 43 N -5.15 0.67 -0.13 1.56 1.01 -1.26 -1.73 120.40 115.37 6rsa s VAL 43 Ca -0.14 -0.23 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 6rsa s VAL 43 Cb 0.08 -0.65 0.05 0.00 0.00 0.00 0.00 36.38 35.86 6rsa s VAL 43 CO 0.74 0.24 0.32 0.21 0.00 0.00 0.00 175.10 176.61 6rsa s ASN 44 N 0.65 -0.37 -0.17 3.32 2.47 -0.46 -5.02 114.94 115.37 6rsa s ASN 44 Ca -0.10 0.68 -0.08 0.00 0.42 0.00 0.00 52.86 53.78 6rsa s ASN 44 Cb -0.13 0.59 -0.04 0.00 -1.45 0.00 0.00 41.25 40.22 6rsa s ASN 44 CO 0.01 -0.16 0.09 -0.89 -3.72 0.00 0.00 177.10 172.42 6rsa s THR 45 N 1.04 5.03 -0.09 -5.21 2.01 -1.26 -1.25 115.64 115.91 6rsa s THR 45 Ca -0.07 0.05 -0.04 0.00 0.31 0.00 0.00 61.69 61.94 6rsa s THR 45 Cb -0.08 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 6rsa s THR 45 CO -0.08 0.49 0.06 -0.36 -0.69 0.00 0.00 174.62 174.05 6rsa s PHE 46 N 0.06 3.35 -0.14 4.92 0.08 -0.28 -4.20 117.98 121.76 6rsa s PHE 46 Ca 0.07 0.33 0.00 0.00 0.12 0.00 0.00 56.93 57.45 6rsa s PHE 46 Cb -0.12 -1.84 0.02 0.00 -0.57 0.00 0.00 43.02 40.51 6rsa s PHE 46 CO 0.00 0.58 -0.12 0.08 -0.10 0.00 0.00 175.22 175.66 6rsa s VAL 47 N -0.97 1.42 -0.97 -0.44 1.01 -0.42 -0.52 120.40 119.51 6rsa s VAL 47 Ca 0.15 -0.53 -0.01 0.00 0.00 0.00 0.00 61.98 61.58 6rsa s VAL 47 Cb -0.12 -1.35 0.33 0.00 0.00 0.00 0.00 36.38 35.24 6rsa s VAL 47 CO 0.04 0.43 1.89 1.41 0.00 0.00 0.00 175.10 178.87 6rsa n HIS 48 N 4.82 2.84 -4.22 5.22 -0.00 -0.87 0.13 115.22 123.13 6rsa n HIS 48 Ca -0.16 -2.49 -0.13 0.00 -0.00 0.00 0.00 57.72 54.95 6rsa n HIS 48 Cb 0.50 -1.19 -0.10 0.00 -0.00 0.00 0.00 29.99 29.20 6rsa n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 6rsa s GLU 49 N -4.25 1.14 0.54 -0.41 0.41 -1.26 -4.67 118.70 110.20 6rsa s GLU 49 Ca 0.43 -1.58 -0.19 0.00 -0.41 0.00 0.00 54.97 53.23 6rsa s GLU 49 Cb 0.27 -0.01 -0.06 0.00 -1.78 0.00 0.00 34.13 32.55 6rsa s GLU 49 CO -0.22 -0.25 1.08 -1.54 -0.49 0.00 0.00 175.26 173.83 6rsa s SER 50 N -3.17 5.91 0.21 -0.19 1.04 -1.26 -4.27 113.70 111.98 6rsa s SER 50 Ca 0.30 2.01 -0.10 0.00 0.48 0.00 0.00 55.95 58.65 6rsa s SER 50 Cb 0.07 -2.56 0.16 0.00 0.10 0.00 0.00 66.02 63.79 6rsa s SER 50 CO 0.07 -1.08 1.87 0.25 0.98 0.00 0.00 173.24 175.32 6rsa h LEU 51 N 1.12 0.92 -1.75 2.42 5.85 -1.98 -1.85 115.31 120.03 6rsa h LEU 51 Ca -0.49 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.22 6rsa h LEU 51 Cb 1.24 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 6rsa h LEU 51 CO 0.57 0.69 0.24 0.00 -0.34 0.00 0.00 178.44 179.61 6rsa h ALA 52 N 1.26 1.93 0.01 1.25 0.00 -1.98 0.13 119.26 121.87 6rsa h ALA 52 Ca 0.28 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.96 6rsa h ALA 52 Cb -0.08 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 6rsa h ALA 52 CO -0.06 0.01 -0.94 -0.44 0.00 0.00 0.00 179.25 177.83 6rsa h ASP 53 N 0.32 0.42 0.26 0.00 3.32 -1.85 -2.01 116.42 116.88 6rsa h ASP 53 Ca 0.15 -0.35 -0.34 0.00 0.02 0.00 0.00 57.03 56.52 6rsa h ASP 53 Cb 0.20 -0.13 0.04 0.00 0.22 0.00 0.00 39.33 39.66 6rsa h ASP 53 CO -0.03 1.16 -1.48 0.58 -1.72 0.00 0.00 179.24 177.74 6rsa h VAL 54 N 0.17 1.28 -0.06 -1.35 2.07 -0.48 -3.28 116.25 114.60 6rsa h VAL 54 Ca -0.07 -2.69 -0.03 0.00 0.82 0.00 0.00 66.70 64.73 6rsa h VAL 54 Cb 1.58 3.05 -0.01 0.00 -1.52 0.00 0.00 31.29 34.39 6rsa h VAL 54 CO 0.15 0.81 -0.12 1.56 0.02 0.00 0.00 177.57 180.00 6rsa h GLN 55 N 0.14 0.08 0.00 1.57 4.20 -0.80 -2.64 115.11 117.66 6rsa h GLN 55 Ca -0.26 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.41 6rsa h GLN 55 Cb 2.17 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 29.93 6rsa h GLN 55 CO 0.27 0.21 -0.12 0.00 -0.67 0.00 0.00 178.83 178.53 6rsa h ALA 56 N 1.80 1.10 0.00 3.87 0.00 -1.42 -2.87 119.26 121.74 6rsa h ALA 56 Ca 0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 6rsa h ALA 56 Cb 0.27 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 6rsa h ALA 56 CO 0.02 0.14 -0.01 0.28 0.00 0.00 0.00 179.25 179.69 6rsa h VAL 57 N 0.00 0.35 0.00 0.00 2.07 -1.54 -2.03 116.25 115.10 6rsa h VAL 57 Ca -0.00 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.49 6rsa h VAL 57 Cb 0.49 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 6rsa h VAL 57 CO 0.02 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.61 6rsa n SER 59 N -0.62 0.86 -0.03 0.00 3.41 -0.76 -5.03 113.62 111.44 6rsa n SER 59 Ca 0.02 -1.75 0.00 0.00 -0.26 0.00 0.00 58.87 56.88 6rsa n SER 59 Cb 0.01 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 6rsa n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 6rsa n GLN 60 N -0.33 3.28 -2.18 4.33 6.02 0.01 -5.00 117.38 123.51 6rsa n GLN 60 Ca 0.02 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.59 6rsa n GLN 60 Cb 0.49 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.73 6rsa n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 6rsa s LYS 61 N 4.55 4.01 -0.12 -1.09 2.47 -0.94 -4.86 119.74 123.76 6rsa s LYS 61 Ca 0.00 1.77 -0.29 0.00 -1.56 0.00 0.00 55.97 55.88 6rsa s LYS 61 Cb 0.00 -3.95 -0.01 0.00 -1.46 0.00 0.00 37.83 32.41 6rsa s LYS 61 CO 0.00 -1.03 1.06 1.21 0.16 0.00 0.00 175.35 176.75 6rsa s ASN 62 N 3.35 7.17 0.02 1.43 3.04 -1.26 0.44 114.94 129.12 6rsa s ASN 62 Ca 0.67 1.56 0.02 0.00 0.04 0.00 0.00 52.86 55.14 6rsa s ASN 62 Cb -0.26 -2.55 -0.01 0.00 -1.54 0.00 0.00 41.25 36.89 6rsa s ASN 62 CO 0.25 -0.53 -0.06 0.68 -3.04 0.00 0.00 177.10 174.41 6rsa s VAL 63 N 2.35 0.42 0.39 -5.21 -7.23 -0.27 -4.95 120.40 105.91 6rsa s VAL 63 Ca 0.49 -0.61 -0.27 0.00 -1.81 0.00 0.00 61.98 59.78 6rsa s VAL 63 Cb -0.19 -0.43 -0.10 0.00 0.56 0.00 0.00 36.38 36.21 6rsa s VAL 63 CO 0.16 -0.13 1.48 0.00 -0.31 0.00 0.00 175.10 176.30 6rsa s ALA 64 N -0.72 3.51 0.85 1.32 0.00 -1.26 -2.99 121.76 122.47 6rsa s ALA 64 Ca -0.04 1.56 -0.11 0.00 0.00 0.00 0.00 51.96 53.37 6rsa s ALA 64 Cb -0.06 -3.61 0.10 0.00 0.00 0.00 0.00 23.12 19.55 6rsa s ALA 64 CO 0.00 -1.10 1.09 0.00 0.00 0.00 0.00 175.76 175.75 6rsa h LYS 66 N -1.36 0.41 0.00 0.00 1.57 -1.93 0.11 116.57 115.37 6rsa h LYS 66 Ca -0.48 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 6rsa h LYS 66 Cb 1.27 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.48 6rsa h LYS 66 CO 0.55 0.27 0.00 0.27 -0.57 0.00 0.00 179.45 179.97 6rsa n ASN 67 N -5.03 0.00 0.00 0.86 6.94 -1.26 -4.91 115.26 111.86 6rsa n ASN 67 Ca 0.18 0.10 0.00 0.00 -0.02 0.00 0.00 54.58 54.84 6rsa n ASN 67 Cb 0.52 -0.32 0.00 0.00 -2.36 0.00 0.00 39.78 37.62 6rsa n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 6rsa n GLY 68 N 0.27 0.49 3.78 4.83 0.00 0.39 -5.08 105.19 109.87 6rsa n GLY 68 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 6rsa n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 6rsa s GLN 69 N -0.70 3.80 0.00 1.61 -0.21 -1.26 -4.67 119.66 118.24 6rsa s GLN 69 Ca 0.00 1.62 0.22 0.00 0.02 0.00 0.00 55.36 57.22 6rsa s GLN 69 Cb 0.00 -2.33 0.07 0.00 1.00 0.00 0.00 33.01 31.75 6rsa s GLN 69 CO 0.00 -0.48 1.13 -2.37 -2.12 0.00 0.00 175.29 171.45 6rsa n THR 70 N -0.59 0.00 -1.04 -0.19 5.66 -1.26 0.85 114.28 117.71 6rsa n THR 70 Ca 0.08 -0.36 -0.23 0.00 -3.05 0.00 0.00 64.05 60.48 6rsa n THR 70 Cb 0.50 1.34 0.06 0.00 -1.55 0.00 0.00 70.33 70.68 6rsa n THR 70 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 6rsa n ASN 71 N 0.50 6.82 -4.59 1.09 6.94 -1.26 -4.75 115.26 120.01 6rsa n ASN 71 Ca 0.11 -3.33 -0.28 0.00 -0.02 0.00 0.00 54.58 51.05 6rsa n ASN 71 Cb 0.51 -1.02 -0.09 0.00 -2.36 0.00 0.00 39.78 36.82 6rsa n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 6rsa s TYR 73 N -1.46 0.02 -0.12 0.00 2.02 -0.49 -1.11 117.35 116.21 6rsa s TYR 73 Ca 0.23 0.08 -0.03 0.00 -0.37 0.00 0.00 57.07 56.99 6rsa s TYR 73 Cb -0.10 -0.15 -0.03 0.00 -0.40 0.00 0.00 41.96 41.28 6rsa s TYR 73 CO 0.15 -0.06 -0.01 -1.14 -1.57 0.00 0.00 175.55 172.92 6rsa s GLN 74 N 0.67 3.32 0.30 -0.62 0.74 0.17 -2.71 119.66 121.54 6rsa s GLN 74 Ca -0.06 -0.44 -0.29 0.00 0.05 0.00 0.00 55.36 54.62 6rsa s GLN 74 Cb -0.08 -2.87 -0.10 0.00 1.10 0.00 0.00 33.01 31.05 6rsa s GLN 74 CO -0.02 0.49 1.34 -1.54 -0.55 0.00 0.00 175.29 175.02 6rsa s SER 75 N -0.31 6.75 0.35 6.67 1.04 -0.71 -2.20 113.70 125.28 6rsa s SER 75 Ca 0.06 2.66 0.11 0.00 0.48 0.00 0.00 55.95 59.26 6rsa s SER 75 Cb -0.12 -2.64 0.63 0.00 0.10 0.00 0.00 66.02 63.99 6rsa s SER 75 CO 0.02 -0.58 1.79 1.88 0.98 0.00 0.00 173.24 177.33 6rsa h TYR 76 N 3.96 0.09 -2.03 5.02 0.05 -1.94 -3.44 116.97 118.68 6rsa h TYR 76 Ca -0.48 -0.02 -0.55 0.00 0.05 0.00 0.00 58.73 57.73 6rsa h TYR 76 Cb 1.22 -0.02 -0.09 0.00 1.01 0.00 0.00 36.73 38.85 6rsa h TYR 76 CO 0.57 0.45 -0.59 0.45 -1.05 0.00 0.00 178.16 177.99 6rsa s SER 77 N -6.91 4.58 0.42 3.88 0.15 -1.26 -5.08 113.70 109.48 6rsa s SER 77 Ca -0.03 -0.73 -0.22 0.00 0.70 0.00 0.00 55.95 55.66 6rsa s SER 77 Cb 0.14 -0.77 -0.09 0.00 -1.71 0.00 0.00 66.02 63.59 6rsa s SER 77 CO 0.74 -0.15 1.01 0.42 1.20 0.00 0.00 173.24 176.45 6rsa s THR 78 N -2.39 3.98 0.13 6.45 -4.23 -1.26 -4.51 115.64 113.81 6rsa s THR 78 Ca 0.34 1.36 0.07 0.00 -1.18 0.00 0.00 61.69 62.29 6rsa s THR 78 Cb -0.04 -3.63 -0.04 0.00 1.34 0.00 0.00 72.50 70.13 6rsa s THR 78 CO 0.21 -0.14 -0.16 -0.04 -0.54 0.00 0.00 174.62 173.95 6rsa s MET 79 N -2.85 1.10 -0.28 3.99 -1.94 0.84 -4.83 119.30 115.33 6rsa s MET 79 Ca 0.61 -1.27 -0.29 0.00 -1.71 0.00 0.00 55.69 53.03 6rsa s MET 79 Cb -0.16 -1.08 0.01 0.00 2.01 0.00 0.00 34.83 35.61 6rsa s MET 79 CO 0.21 0.22 1.06 0.45 -0.01 0.00 0.00 175.02 176.95 6rsa s SER 80 N -2.42 7.01 0.13 3.03 0.15 -1.26 -1.65 113.70 118.68 6rsa s SER 80 Ca 0.10 1.21 0.04 0.00 0.70 0.00 0.00 55.95 58.01 6rsa s SER 80 Cb -0.06 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.67 6rsa s SER 80 CO 0.04 -0.78 -0.10 0.27 1.20 0.00 0.00 173.24 173.86 6rsa s ILE 81 N 3.45 1.11 -0.13 6.45 -4.36 0.77 -2.06 121.20 126.43 6rsa s ILE 81 Ca 0.45 -1.90 -0.00 0.00 -0.26 0.00 0.00 60.65 58.94 6rsa s ILE 81 Cb -0.14 -1.67 0.03 0.00 1.25 0.00 0.00 42.46 41.93 6rsa s ILE 81 CO 0.11 -0.66 -0.09 -0.89 0.24 0.00 0.00 174.94 173.65 6rsa s THR 82 N -2.96 1.20 -0.12 8.37 2.01 0.32 -0.80 115.64 123.67 6rsa s THR 82 Ca 0.12 -0.46 -0.16 0.00 0.31 0.00 0.00 61.69 61.51 6rsa s THR 82 Cb 0.00 -1.22 -0.05 0.00 0.01 0.00 0.00 72.50 71.25 6rsa s THR 82 CO 0.00 0.34 0.38 -1.81 -0.69 0.00 0.00 174.62 172.85 6rsa s ASP 83 N 1.63 6.59 -0.26 3.53 -0.00 0.39 -1.13 116.67 127.42 6rsa s ASP 83 Ca 0.04 0.70 -0.04 0.00 -0.00 0.00 0.00 52.55 53.24 6rsa s ASP 83 Cb -0.13 -2.23 0.01 0.00 -0.00 0.00 0.00 42.92 40.56 6rsa s ASP 83 CO -0.09 0.09 0.00 0.00 -0.00 0.00 0.00 175.17 175.18 6rsa s ARG 85 N 1.45 1.96 0.26 0.00 6.06 -0.59 -1.35 118.95 126.72 6rsa s ARG 85 Ca 0.03 -0.73 -0.30 0.00 -2.50 0.00 0.00 55.73 52.23 6rsa s ARG 85 Cb -0.16 -1.74 -0.10 0.00 0.06 0.00 0.00 34.95 33.01 6rsa s ARG 85 CO -0.01 0.34 1.49 -2.00 -2.50 0.00 0.00 175.30 172.62 6rsa s GLU 86 N -0.17 4.22 0.36 5.12 2.12 -0.70 0.62 118.70 130.27 6rsa s GLU 86 Ca -0.00 2.38 -0.05 0.00 0.36 0.00 0.00 54.97 57.66 6rsa s GLU 86 Cb -0.11 -3.09 -0.05 0.00 0.26 0.00 0.00 34.13 31.14 6rsa s GLU 86 CO 0.02 -0.49 0.64 0.99 -0.54 0.00 0.00 175.26 175.88 6rsa s THR 87 N 0.05 4.97 -0.49 -1.70 2.01 -1.03 -4.81 115.64 114.64 6rsa s THR 87 Ca 0.61 0.11 0.21 0.00 0.31 0.00 0.00 61.69 62.93 6rsa s THR 87 Cb -0.44 -3.78 0.21 0.00 0.01 0.00 0.00 72.50 68.51 6rsa s THR 87 CO 0.44 -0.50 1.63 0.61 -0.69 0.00 0.00 174.62 176.11 6rsa n GLY 88 N -1.40 -1.09 0.28 4.40 0.00 -1.26 -1.27 105.19 104.84 6rsa n GLY 88 Ca -0.01 0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.24 6rsa n GLY 88 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 6rsa n SER 89 N -2.13 1.09 -4.67 1.61 7.64 -1.26 -4.92 113.62 110.98 6rsa n SER 89 Ca 0.01 -0.98 -0.43 0.00 1.01 0.00 0.00 58.87 58.48 6rsa n SER 89 Cb 0.16 0.11 -0.02 0.00 -1.01 0.00 0.00 64.21 63.44 6rsa n SER 89 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 6rsa s SER 90 N -2.42 6.96 -0.28 6.43 0.15 -0.40 -4.77 113.70 119.37 6rsa s SER 90 Ca 0.27 1.78 -0.02 0.00 0.70 0.00 0.00 55.95 58.68 6rsa s SER 90 Cb 0.20 -2.54 0.12 0.00 -1.71 0.00 0.00 66.02 62.08 6rsa s SER 90 CO 0.49 -0.72 0.25 -0.75 1.20 0.00 0.00 173.24 173.71 6rsa s LYS 91 N 3.09 0.27 0.11 5.44 2.47 -0.55 -4.90 119.74 125.68 6rsa s LYS 91 Ca 0.56 -0.20 -0.36 0.00 -1.56 0.00 0.00 55.97 54.42 6rsa s LYS 91 Cb -0.24 -0.84 -0.16 0.00 -1.46 0.00 0.00 37.83 35.13 6rsa s LYS 91 CO 0.18 -0.99 1.28 0.98 0.16 0.00 0.00 175.35 176.96 6rsa n TYR 92 N 5.30 1.42 1.89 4.03 9.36 -1.26 0.01 117.16 137.91 6rsa n TYR 92 Ca -0.03 0.66 0.16 0.00 3.32 0.00 0.00 57.90 62.00 6rsa n TYR 92 Cb 0.46 -2.31 0.88 0.00 -0.63 0.00 0.00 39.34 37.74 6rsa n TYR 92 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 6rsa n PRO 93 N 2.26 1.02 -3.05 2.98 -0.04 -1.26 -4.98 135.00 131.93 6rsa n PRO 93 Ca 0.17 -0.11 -0.44 0.00 -0.04 0.00 0.00 63.50 63.08 6rsa n PRO 93 Cb 0.21 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.16 6rsa n PRO 93 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 6rsa s ASN 94 N -2.05 7.03 0.45 3.54 0.01 0.10 -5.01 114.94 119.02 6rsa s ASN 94 Ca 0.45 -2.95 -0.23 0.00 -0.71 0.00 0.00 52.86 49.43 6rsa s ASN 94 Cb 0.22 -2.35 -0.08 0.00 0.41 0.00 0.00 41.25 39.45 6rsa s ASN 94 CO 0.38 -0.69 1.11 0.00 -1.51 0.00 0.00 177.10 176.39 6rsa s ALA 96 N -1.63 0.42 0.06 0.00 0.00 -1.26 -4.88 121.76 114.47 6rsa s ALA 96 Ca 0.63 -0.16 0.02 0.00 0.00 0.00 0.00 51.96 52.45 6rsa s ALA 96 Cb -0.25 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.69 6rsa s ALA 96 CO 0.31 0.08 -0.08 0.71 0.00 0.00 0.00 175.76 176.78 6rsa s TYR 97 N 0.07 0.77 -0.17 0.00 2.02 -1.26 -2.46 117.35 116.32 6rsa s TYR 97 Ca -0.00 -0.66 -0.11 0.00 -0.37 0.00 0.00 57.07 55.93 6rsa s TYR 97 Cb -0.04 -0.45 -0.05 0.00 -0.40 0.00 0.00 41.96 41.02 6rsa s TYR 97 CO -0.00 -0.10 0.20 0.21 -1.57 0.00 0.00 175.55 174.28 6rsa s LYS 98 N -2.46 4.10 -0.30 -0.62 2.47 0.20 -4.69 119.74 118.45 6rsa s LYS 98 Ca -0.01 -0.07 -0.15 0.00 -1.56 0.00 0.00 55.97 54.18 6rsa s LYS 98 Cb -0.04 -3.38 -0.03 0.00 -1.46 0.00 0.00 37.83 32.92 6rsa s LYS 98 CO -0.02 0.36 0.36 0.99 0.16 0.00 0.00 175.35 177.20 6rsa s THR 99 N 0.16 5.18 -0.17 3.43 2.01 -1.26 -1.55 115.64 123.43 6rsa s THR 99 Ca 0.13 0.31 0.00 0.00 0.31 0.00 0.00 61.69 62.44 6rsa s THR 99 Cb -0.12 -3.75 0.01 0.00 0.01 0.00 0.00 72.50 68.65 6rsa s THR 99 CO 0.01 0.04 -0.17 -0.89 -0.69 0.00 0.00 174.62 172.93 6rsa s THR 100 N 2.04 2.36 -0.15 -0.82 2.01 -0.42 -4.99 115.64 115.66 6rsa s THR 100 Ca 0.13 -0.85 -0.14 0.00 0.31 0.00 0.00 61.69 61.14 6rsa s THR 100 Cb -0.16 -2.00 -0.05 0.00 0.01 0.00 0.00 72.50 70.30 6rsa s THR 100 CO 0.11 0.52 0.31 -1.58 -0.69 0.00 0.00 174.62 173.29 6rsa s GLN 101 N 1.14 4.25 0.29 4.92 2.00 -1.26 -0.46 119.66 130.53 6rsa s GLN 101 Ca 0.01 0.13 -0.13 0.00 -2.00 0.00 0.00 55.36 53.36 6rsa s GLN 101 Cb -0.14 -3.42 0.01 0.00 0.80 0.00 0.00 33.01 30.26 6rsa s GLN 101 CO -0.07 0.25 0.57 0.00 -0.50 0.00 0.00 175.29 175.54 6rsa s ALA 102 N 0.43 -0.36 -0.24 1.58 0.00 0.02 -4.99 121.76 118.20 6rsa s ALA 102 Ca 0.17 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.30 6rsa s ALA 102 Cb -0.13 0.98 0.06 0.00 0.00 0.00 0.00 23.12 24.03 6rsa s ALA 102 CO 0.04 -0.90 -0.06 -0.80 0.00 0.00 0.00 175.76 174.04 6rsa s ASN 103 N -3.04 3.99 0.16 0.00 -0.87 -1.25 -0.16 114.94 113.76 6rsa s ASN 103 Ca 0.20 -1.25 -0.16 0.00 -1.57 0.00 0.00 52.86 50.09 6rsa s ASN 103 Cb -0.02 -1.25 0.03 0.00 -0.02 0.00 0.00 41.25 39.98 6rsa s ASN 103 CO 0.11 -0.23 0.44 -0.54 -2.57 0.00 0.00 177.10 174.30 6rsa s LYS 104 N 1.33 1.21 0.43 -0.60 -0.14 -0.66 -4.79 119.74 116.51 6rsa s LYS 104 Ca -0.06 -0.82 -0.21 0.00 -1.36 0.00 0.00 55.97 53.51 6rsa s LYS 104 Cb -0.19 0.48 -0.11 0.00 -1.68 0.00 0.00 37.83 36.34 6rsa s LYS 104 CO -0.06 -0.49 0.96 -1.01 -0.76 0.00 0.00 175.35 173.99 6rsa s HIS 105 N -3.85 3.31 0.20 3.18 3.76 -1.26 -0.11 115.29 120.51 6rsa s HIS 105 Ca 0.07 1.62 0.09 0.00 -0.15 0.00 0.00 55.06 56.70 6rsa s HIS 105 Cb 0.01 -2.89 -0.04 0.00 1.11 0.00 0.00 32.58 30.76 6rsa s HIS 105 CO -0.07 -0.19 -0.09 0.96 -0.85 0.00 0.00 174.74 174.50 6rsa s ILE 106 N -2.08 3.18 -0.13 0.60 -4.36 -1.26 0.51 121.20 117.65 6rsa s ILE 106 Ca 0.61 -1.74 -0.00 0.00 -0.26 0.00 0.00 60.65 59.26 6rsa s ILE 106 Cb -0.11 -2.60 0.03 0.00 1.25 0.00 0.00 42.46 41.03 6rsa s ILE 106 CO 0.15 -0.17 -0.08 -0.63 0.24 0.00 0.00 174.94 174.46 6rsa s ILE 107 N -1.84 1.12 0.15 8.37 1.01 0.47 -1.74 121.20 128.74 6rsa s ILE 107 Ca 0.26 -0.42 0.08 0.00 0.00 0.00 0.00 60.65 60.57 6rsa s ILE 107 Cb -0.08 -1.16 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 6rsa s ILE 107 CO 0.16 0.32 -0.18 0.68 0.00 0.00 0.00 174.94 175.92 6rsa s VAL 108 N 1.66 1.71 -0.16 2.92 -7.23 -1.10 0.37 120.40 118.57 6rsa s VAL 108 Ca 0.04 -1.83 -0.06 0.00 -1.81 0.00 0.00 61.98 58.33 6rsa s VAL 108 Cb -0.13 -1.74 -0.04 0.00 0.56 0.00 0.00 36.38 35.03 6rsa s VAL 108 CO -0.08 -0.30 0.04 0.00 -0.31 0.00 0.00 175.10 174.44 6rsa s ALA 109 N -1.94 3.34 0.21 1.32 0.00 0.21 -1.40 121.76 123.50 6rsa s ALA 109 Ca 0.13 -0.76 0.11 0.00 0.00 0.00 0.00 51.96 51.44 6rsa s ALA 109 Cb -0.06 -1.78 -0.04 0.00 0.00 0.00 0.00 23.12 21.23 6rsa s ALA 109 CO 0.06 0.29 -0.17 0.00 0.00 0.00 0.00 175.76 175.94 6rsa s GLU 111 N -2.96 0.79 0.17 0.00 2.02 -0.49 -4.91 118.70 113.32 6rsa s GLU 111 Ca 0.25 -0.16 0.00 0.00 0.02 0.00 0.00 54.97 55.08 6rsa s GLU 111 Cb -0.07 0.37 0.00 0.00 0.10 0.00 0.00 34.13 34.52 6rsa s GLU 111 CO 0.13 -0.32 0.00 0.41 0.02 0.00 0.00 175.26 175.50 6rsa n GLY 112 N 0.07 -2.21 2.68 -1.39 0.00 -1.26 -2.63 105.19 100.44 6rsa n GLY 112 Ca -0.10 -1.94 -0.28 0.00 0.00 0.00 0.00 46.02 43.70 6rsa n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 6rsa s ASN 113 N -3.28 3.14 0.60 1.61 3.84 -1.26 -2.89 114.94 116.70 6rsa s ASN 113 Ca 0.00 -1.02 -0.19 0.00 0.21 0.00 0.00 52.86 51.86 6rsa s ASN 113 Cb 0.00 -0.54 -0.03 0.00 -0.55 0.00 0.00 41.25 40.12 6rsa s ASN 113 CO 0.00 -0.36 1.24 -2.16 -2.79 0.00 0.00 177.10 173.03 6rsa s PRO 114 N 1.90 2.92 -0.63 0.43 0.04 -1.26 -5.08 135.00 133.32 6rsa s PRO 114 Ca 0.03 1.92 -0.27 0.00 0.04 0.00 0.00 61.00 62.71 6rsa s PRO 114 Cb -0.17 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.44 6rsa s PRO 114 CO -0.17 -1.27 1.37 -0.47 0.04 0.00 0.00 177.00 176.50 6rsa s TYR 115 N -1.52 2.28 0.32 0.56 5.04 -1.14 -4.93 117.35 117.97 6rsa s TYR 115 Ca 0.78 0.30 0.05 0.00 -2.44 0.00 0.00 57.07 55.76 6rsa s TYR 115 Cb -0.33 -4.47 -0.06 0.00 0.35 0.00 0.00 41.96 37.44 6rsa s TYR 115 CO 0.36 -1.97 0.00 0.14 -1.34 0.00 0.00 175.55 172.74 6rsa s VAL 116 N 6.02 1.51 0.38 3.14 -7.23 -1.08 -4.83 120.40 118.31 6rsa s VAL 116 Ca 0.46 -2.05 -0.27 0.00 -1.81 0.00 0.00 61.98 58.31 6rsa s VAL 116 Cb -0.09 -2.70 -0.09 0.00 0.56 0.00 0.00 36.38 34.06 6rsa s VAL 116 CO 0.21 -0.12 1.31 -2.84 -0.31 0.00 0.00 175.10 173.35 6rsa s PRO 117 N -3.80 4.09 0.00 4.82 0.02 -1.26 -1.39 135.00 137.48 6rsa s PRO 117 Ca 0.34 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.54 6rsa s PRO 117 Cb 0.07 -2.86 0.00 0.00 0.02 0.00 0.00 34.50 31.73 6rsa s PRO 117 CO 0.15 -0.40 0.00 1.55 -0.33 0.00 0.00 177.00 177.96 6rsa n VAL 118 N 0.34 0.00 -3.70 3.83 3.14 0.21 -4.54 118.33 117.62 6rsa n VAL 118 Ca 0.02 -0.08 -0.13 0.00 -2.96 0.00 0.00 64.34 61.19 6rsa n VAL 118 Cb 0.43 0.50 -0.09 0.00 -1.06 0.00 0.00 33.84 33.61 6rsa n VAL 118 CO 0.00 0.00 0.00 -2.28 -6.46 0.00 0.00 176.83 168.09 6rsa s HIS 119 N -0.98 -0.58 -0.27 1.45 5.65 -1.18 -4.65 115.29 114.72 6rsa s HIS 119 Ca 0.00 1.37 -0.18 0.00 0.25 0.00 0.00 55.06 56.50 6rsa s HIS 119 Cb 0.00 0.22 -0.02 0.00 -1.18 0.00 0.00 32.58 31.60 6rsa s HIS 119 CO 0.00 -0.29 0.53 0.12 -0.65 0.00 0.00 174.74 174.45 6rsa s PHE 120 N 0.48 3.26 -0.26 3.88 2.19 -1.26 -0.62 117.98 125.64 6rsa s PHE 120 Ca -0.02 0.62 -0.12 0.00 0.33 0.00 0.00 56.93 57.74 6rsa s PHE 120 Cb -0.04 -2.76 -0.14 0.00 -1.31 0.00 0.00 43.02 38.77 6rsa s PHE 120 CO -0.02 -0.31 -0.24 -3.47 1.83 0.00 0.00 175.22 173.00 6rsa n ASP 121 N 5.59 1.96 -3.65 6.13 2.03 0.16 -4.98 116.55 123.78 6rsa n ASP 121 Ca -0.04 0.27 -0.02 0.00 0.52 0.00 0.00 54.79 55.52 6rsa n ASP 121 Cb 0.50 -0.77 -0.01 0.00 -0.72 0.00 0.00 41.12 40.11 6rsa n ASP 121 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 6rsa s ALA 122 N -2.49 -2.00 0.06 -1.67 0.00 -1.01 -4.98 121.76 109.67 6rsa s ALA 122 Ca -0.37 0.65 0.08 0.00 0.00 0.00 0.00 51.96 52.32 6rsa s ALA 122 Cb 0.13 0.39 -0.03 0.00 0.00 0.00 0.00 23.12 23.61 6rsa s ALA 122 CO 0.53 -0.97 -0.21 -1.54 0.00 0.00 0.00 175.76 173.57 6rsa s SER 123 N -2.83 2.55 0.00 0.00 1.04 -1.26 -0.40 113.70 112.80 6rsa s SER 123 Ca 0.12 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 55.98 6rsa s SER 123 Cb 0.02 -0.19 0.00 0.00 0.10 0.00 0.00 66.02 65.94 6rsa s SER 123 CO -0.02 0.14 0.00 0.55 0.98 0.00 0.00 173.24 174.89