#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dyp n ARG 14 N 0.00 -1.81 0.29 -0.14 1.74 -1.26 -4.79 116.66 110.69 3dyp n ARG 14 Ca 0.00 0.23 0.19 0.00 -0.77 0.00 0.00 57.85 57.50 3dyp n ARG 14 Cb 0.00 -3.88 0.99 0.00 -1.02 0.00 0.00 32.46 28.55 3dyp n ARG 14 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3dyp h ASP 15 N -1.89 0.00 -0.02 0.55 3.32 -1.95 -0.74 116.42 115.70 3dyp h ASP 15 Ca -0.65 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.40 3dyp h ASP 15 Cb 1.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.94 3dyp h ASP 15 CO 0.65 0.00 0.00 -2.67 -1.72 0.00 0.00 179.24 175.50 3dyp n TRP 16 N -3.36 0.02 -2.30 4.55 2.14 -1.26 -3.21 117.44 114.02 3dyp n TRP 16 Ca -0.01 -0.01 -0.14 0.00 2.07 0.00 0.00 57.50 59.40 3dyp n TRP 16 Cb 0.21 0.00 0.04 0.00 -0.81 0.00 0.00 31.31 30.75 3dyp n TRP 16 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 3dyp n GLU 17 N -0.62 2.85 -3.26 -2.67 1.02 -0.28 -0.78 120.64 116.89 3dyp n GLU 17 Ca 0.10 -3.88 -0.04 0.00 -0.02 0.00 0.00 57.16 53.32 3dyp n GLU 17 Cb 0.06 -1.99 -0.04 0.00 -0.02 0.00 0.00 31.44 29.45 3dyp n GLU 17 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3dyp s ASN 18 N -3.63 -0.35 0.00 1.62 3.84 -1.20 -4.76 114.94 110.47 3dyp s ASN 18 Ca 0.42 0.10 0.14 0.00 0.21 0.00 0.00 52.86 53.73 3dyp s ASN 18 Cb 0.38 1.47 0.71 0.00 -0.55 0.00 0.00 41.25 43.26 3dyp s ASN 18 CO 0.01 -0.31 1.36 -0.81 -2.79 0.00 0.00 177.10 174.55 3dyp n PRO 19 N 5.38 0.21 0.09 0.43 -0.04 -1.26 -1.38 135.00 138.43 3dyp n PRO 19 Ca 0.00 0.14 0.13 0.00 -0.04 0.00 0.00 63.50 63.74 3dyp n PRO 19 Cb 0.51 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.89 3dyp n PRO 19 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dyp n GLY 20 N -0.11 -1.67 2.91 0.55 0.00 -1.26 -4.26 105.19 101.34 3dyp n GLY 20 Ca 0.07 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3dyp n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dyp s VAL 21 N -3.09 1.69 -1.52 1.61 1.01 -0.48 -4.92 120.40 114.71 3dyp s VAL 21 Ca 0.11 -1.90 0.14 0.00 0.00 0.00 0.00 61.98 60.34 3dyp s VAL 21 Cb 0.13 -2.23 0.04 0.00 0.00 0.00 0.00 36.38 34.32 3dyp s VAL 21 CO 0.59 -0.58 0.86 0.35 0.00 0.00 0.00 175.10 176.32 3dyp n THR 22 N 4.51 0.00 -3.55 3.92 -2.24 -1.26 -4.81 114.28 110.84 3dyp n THR 22 Ca 0.00 -0.41 -0.06 0.00 -2.27 0.00 0.00 64.05 61.31 3dyp n THR 22 Cb 0.42 1.22 -0.02 0.00 -2.10 0.00 0.00 70.33 69.86 3dyp n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dyp s GLN 23 N -1.54 0.61 -0.06 -0.78 1.03 -1.26 -1.74 119.66 115.92 3dyp s GLN 23 Ca 0.14 -0.24 -0.03 0.00 0.04 0.00 0.00 55.36 55.28 3dyp s GLN 23 Cb 0.12 0.28 0.04 0.00 0.03 0.00 0.00 33.01 33.47 3dyp s GLN 23 CO 0.29 -0.27 0.13 -0.51 -2.54 0.00 0.00 175.29 172.39 3dyp s LEU 24 N -2.39 0.50 -1.59 2.60 1.43 -0.22 -4.85 118.68 114.16 3dyp s LEU 24 Ca 0.07 0.26 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 3dyp s LEU 24 Cb -0.01 0.25 0.00 0.00 0.03 0.00 0.00 46.19 46.46 3dyp s LEU 24 CO -0.07 -0.18 0.00 0.59 0.23 0.00 0.00 176.35 176.92 3dyp n ASN 25 N 4.60 -4.95 -4.82 2.29 3.02 -1.26 -1.66 115.26 112.48 3dyp n ASN 25 Ca -0.19 0.37 -0.34 0.00 -0.03 0.00 0.00 54.58 54.39 3dyp n ASN 25 Cb 0.51 -3.77 -0.07 0.00 -0.61 0.00 0.00 39.78 35.84 3dyp n ASN 25 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3dyp s ARG 26 N -3.24 4.27 0.56 3.52 3.52 -1.26 -4.62 118.95 121.71 3dyp s ARG 26 Ca 0.00 1.05 -0.10 0.00 -0.13 0.00 0.00 55.73 56.55 3dyp s ARG 26 Cb 0.00 -2.47 -0.04 0.00 -1.56 0.00 0.00 34.95 30.88 3dyp s ARG 26 CO 0.00 0.14 0.95 -0.51 -0.81 0.00 0.00 175.30 175.06 3dyp s LEU 27 N -2.71 3.40 0.68 -0.88 1.43 0.83 -5.00 118.68 116.43 3dyp s LEU 27 Ca 0.55 1.28 -0.17 0.00 -1.03 0.00 0.00 54.13 54.76 3dyp s LEU 27 Cb -0.13 -4.29 -0.00 0.00 0.03 0.00 0.00 46.19 41.80 3dyp s LEU 27 CO 0.17 -0.75 1.08 0.00 0.23 0.00 0.00 176.35 177.08 3dyp n ALA 28 N -2.46 0.25 -1.86 4.21 0.00 -1.26 -4.66 120.51 114.72 3dyp n ALA 28 Ca 0.04 -0.11 -0.31 0.00 0.00 0.00 0.00 53.44 53.07 3dyp n ALA 28 Cb 0.54 -2.18 0.02 0.00 0.00 0.00 0.00 19.45 17.82 3dyp n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dyp s ALA 29 N -1.66 3.07 -0.06 0.00 0.00 -1.26 -4.98 121.76 116.87 3dyp s ALA 29 Ca 0.77 -0.12 -0.31 0.00 0.00 0.00 0.00 51.96 52.30 3dyp s ALA 29 Cb -0.36 -3.08 0.12 0.00 0.00 0.00 0.00 23.12 19.80 3dyp s ALA 29 CO 0.47 -0.76 1.23 -3.38 0.00 0.00 0.00 175.76 173.32 3dyp s HIS 30 N -3.20 -0.08 0.93 0.00 -3.43 -1.26 -4.87 115.29 103.38 3dyp s HIS 30 Ca 0.55 -0.02 -0.12 0.00 -0.80 0.00 0.00 55.06 54.68 3dyp s HIS 30 Cb -0.11 0.54 0.15 0.00 -1.43 0.00 0.00 32.58 31.73 3dyp s HIS 30 CO 0.54 -0.30 1.10 -2.14 -2.00 0.00 0.00 174.74 171.94 3dyp s PRO 31 N -2.50 1.02 -0.08 -0.38 0.02 -1.16 -4.30 135.00 127.61 3dyp s PRO 31 Ca 0.12 0.57 -0.36 0.00 0.02 0.00 0.00 61.00 61.35 3dyp s PRO 31 Cb 0.02 -1.80 -0.14 0.00 0.02 0.00 0.00 34.50 32.60 3dyp s PRO 31 CO -0.04 -2.34 1.71 -2.30 -0.33 0.00 0.00 177.00 173.70 3dyp n PRO 32 N -3.91 1.70 -4.36 5.54 -0.02 -1.26 -4.98 135.00 127.71 3dyp n PRO 32 Ca 0.06 0.62 -0.24 0.00 -2.02 0.00 0.00 63.50 61.93 3dyp n PRO 32 Cb 0.57 -2.37 -0.08 0.00 -0.02 0.00 0.00 33.50 31.59 3dyp n PRO 32 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3dyp s PHE 33 N 2.86 2.53 0.00 6.00 2.99 -1.26 -4.78 117.98 126.31 3dyp s PHE 33 Ca 0.91 -0.31 0.00 0.00 0.00 0.00 0.00 56.93 57.53 3dyp s PHE 33 Cb -0.85 -1.21 0.00 0.00 0.00 0.00 0.00 43.02 40.97 3dyp s PHE 33 CO 0.53 0.61 0.00 0.00 -0.00 0.00 0.00 175.22 176.36 3dyp n ALA 34 N -0.83 0.00 -3.91 5.36 0.00 -1.26 -5.03 120.51 114.85 3dyp n ALA 34 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.04 3dyp n ALA 34 Cb 0.60 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.06 3dyp n ALA 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3dyp n SER 35 N 0.00 -3.45 -4.76 0.00 2.88 -1.26 -4.07 113.62 102.96 3dyp n SER 35 Ca 0.00 -1.13 -0.37 0.00 -1.33 0.00 0.00 58.87 56.04 3dyp n SER 35 Cb 0.01 -2.64 0.02 0.00 -0.75 0.00 0.00 64.21 60.85 3dyp n SER 35 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 3dyp s TRP 36 N -3.66 2.49 -0.53 0.66 0.51 -0.26 -4.60 118.94 113.55 3dyp s TRP 36 Ca 0.35 1.45 0.10 0.00 -2.12 0.00 0.00 56.10 55.89 3dyp s TRP 36 Cb -0.15 -3.61 0.29 0.00 -0.81 0.00 0.00 33.47 29.19 3dyp s TRP 36 CO 0.91 -2.33 1.23 0.54 -0.51 0.00 0.00 176.95 176.80 3dyp n ARG 37 N -0.97 2.80 -3.71 4.98 5.12 -1.26 -0.28 116.66 123.35 3dyp n ARG 37 Ca 0.10 -2.14 -0.20 0.00 -1.93 0.00 0.00 57.85 53.68 3dyp n ARG 37 Cb 0.47 -1.35 -0.18 0.00 -1.16 0.00 0.00 32.46 30.24 3dyp n ARG 37 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 3dyp s ASN 38 N -1.32 1.07 0.32 0.55 3.84 -1.26 -4.99 114.94 113.14 3dyp s ASN 38 Ca 0.23 0.05 0.07 0.00 0.21 0.00 0.00 52.86 53.41 3dyp s ASN 38 Cb 0.15 -0.18 0.55 0.00 -0.55 0.00 0.00 41.25 41.22 3dyp s ASN 38 CO 0.10 -0.22 1.77 0.28 -2.79 0.00 0.00 177.10 176.24 3dyp h SER 39 N 8.25 0.29 -0.27 -4.21 0.02 -1.98 -2.91 113.55 112.74 3dyp h SER 39 Ca -0.18 -0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 60.61 3dyp h SER 39 Cb 1.12 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.56 3dyp h SER 39 CO 0.22 0.58 -0.04 -0.08 -1.14 0.00 0.00 176.83 176.36 3dyp h GLU 40 N 0.25 0.63 -0.59 3.45 4.57 -1.99 -1.12 114.58 119.78 3dyp h GLU 40 Ca 0.04 -0.16 -0.07 0.00 -1.18 0.00 0.00 59.36 57.99 3dyp h GLU 40 Cb 0.65 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.14 3dyp h GLU 40 CO 0.05 0.68 0.11 0.93 -1.18 0.00 0.00 179.01 179.60 3dyp h GLU 41 N 0.59 0.95 -0.50 1.92 5.08 -1.91 -2.00 114.58 118.71 3dyp h GLU 41 Ca 0.12 -0.23 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 3dyp h GLU 41 Cb 0.44 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 3dyp h GLU 41 CO 0.02 0.87 0.05 0.00 -1.00 0.00 0.00 179.01 178.95 3dyp h ALA 42 N 1.21 1.15 -0.60 3.43 0.00 -1.29 0.02 119.26 123.18 3dyp h ALA 42 Ca 0.19 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3dyp h ALA 42 Cb 0.38 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3dyp h ALA 42 CO 0.01 0.56 0.29 -0.09 0.00 0.00 0.00 179.25 180.01 3dyp h ARG 43 N 0.76 0.87 -0.32 0.00 2.43 -0.79 -2.82 114.38 114.51 3dyp h ARG 43 Ca 0.15 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3dyp h ARG 43 Cb 0.39 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 3dyp h ARG 43 CO 0.01 0.70 0.00 0.25 -1.51 0.00 0.00 179.97 179.43 3dyp n THR 44 N -4.52 0.42 -3.24 0.20 -2.24 -0.79 -4.94 114.28 99.17 3dyp n THR 44 Ca 0.04 -0.60 -0.20 0.00 -2.27 0.00 0.00 64.05 61.01 3dyp n THR 44 Cb 0.12 0.72 0.05 0.00 -2.10 0.00 0.00 70.33 69.13 3dyp n THR 44 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3dyp n ASP 45 N 1.06 -5.71 -4.89 3.42 2.03 -0.17 -4.99 116.55 107.30 3dyp n ASP 45 Ca 0.18 -0.38 -0.29 0.00 0.52 0.00 0.00 54.79 54.82 3dyp n ASP 45 Cb 0.50 -4.40 0.02 0.00 -0.72 0.00 0.00 41.12 36.51 3dyp n ASP 45 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3dyp s ARG 46 N -5.90 3.27 0.47 -0.67 0.52 -0.26 -5.00 118.95 111.38 3dyp s ARG 46 Ca 0.41 0.40 -0.23 0.00 -0.52 0.00 0.00 55.73 55.79 3dyp s ARG 46 Cb -0.18 -2.18 -0.09 0.00 0.52 0.00 0.00 34.95 33.02 3dyp s ARG 46 CO 0.51 -0.62 1.02 -2.30 0.02 0.00 0.00 175.30 173.93 3dyp n PRO 47 N -2.66 1.29 -4.42 3.54 -0.02 -1.26 -4.84 135.00 126.63 3dyp n PRO 47 Ca 0.05 0.47 -0.34 0.00 -2.02 0.00 0.00 63.50 61.66 3dyp n PRO 47 Cb 0.56 -2.11 -0.12 0.00 -0.02 0.00 0.00 33.50 31.81 3dyp n PRO 47 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3dyp s SER 48 N -0.85 4.83 0.54 2.55 0.15 -1.26 -4.98 113.70 114.68 3dyp s SER 48 Ca 0.66 -0.09 0.36 0.00 0.70 0.00 0.00 55.95 57.58 3dyp s SER 48 Cb -0.51 -1.70 1.76 0.00 -1.71 0.00 0.00 66.02 63.86 3dyp s SER 48 CO 0.54 0.20 2.08 1.56 1.20 0.00 0.00 173.24 178.83 3dyp h GLN 49 N 6.44 0.00 -0.00 5.44 1.08 -1.91 -2.00 115.11 124.15 3dyp h GLN 49 Ca -0.34 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.86 3dyp h GLN 49 Cb 1.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.62 3dyp h GLN 49 CO 0.61 0.00 -0.14 1.04 -0.95 0.00 0.00 178.83 179.39 3dyp n GLN 50 N -2.88 0.54 -4.00 1.46 3.00 -1.26 -4.63 117.38 109.62 3dyp n GLN 50 Ca -0.01 -0.19 -0.31 0.00 -0.01 0.00 0.00 57.00 56.48 3dyp n GLN 50 Cb 0.16 -1.50 -0.15 0.00 0.00 0.00 0.00 30.24 28.75 3dyp n GLN 50 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 3dyp s LEU 51 N -2.59 4.13 0.00 1.08 2.96 -0.75 -0.96 118.68 122.55 3dyp s LEU 51 Ca 0.25 -1.90 0.01 0.00 -0.22 0.00 0.00 54.13 52.27 3dyp s LEU 51 Cb 0.20 -1.51 -0.04 0.00 0.50 0.00 0.00 46.19 45.34 3dyp s LEU 51 CO 0.51 -0.34 0.02 -0.13 -1.32 0.00 0.00 176.35 175.09 3dyp s ARG 52 N 1.04 2.83 -0.06 1.98 0.52 0.30 -4.70 118.95 120.87 3dyp s ARG 52 Ca 0.06 -0.60 -0.13 0.00 -0.52 0.00 0.00 55.73 54.54 3dyp s ARG 52 Cb -0.19 -2.70 -0.05 0.00 0.52 0.00 0.00 34.95 32.53 3dyp s ARG 52 CO -0.09 0.62 0.35 0.45 0.02 0.00 0.00 175.30 176.65 3dyp s SER 53 N -1.65 6.66 0.00 0.23 0.15 -1.26 -0.12 113.70 117.70 3dyp s SER 53 Ca 0.21 0.78 0.14 0.00 0.70 0.00 0.00 55.95 57.78 3dyp s SER 53 Cb -0.12 -2.21 0.40 0.00 -1.71 0.00 0.00 66.02 62.38 3dyp s SER 53 CO 0.12 0.27 1.32 0.18 1.20 0.00 0.00 173.24 176.33 3dyp n LEU 54 N 2.32 3.20 -4.72 3.45 4.77 0.35 -4.93 117.00 121.44 3dyp n LEU 54 Ca -0.14 -1.95 -0.32 0.00 -0.03 0.00 0.00 56.01 53.57 3dyp n LEU 54 Cb 0.53 -0.30 0.11 0.00 -2.33 0.00 0.00 43.42 41.43 3dyp n LEU 54 CO 0.37 0.79 0.72 0.20 -1.33 0.00 0.00 177.39 178.15 3dyp s ASN 55 N -1.01 3.95 0.00 -1.43 -0.87 -1.22 -4.82 114.94 109.53 3dyp s ASN 55 Ca 0.31 2.11 0.00 0.00 -1.57 0.00 0.00 52.86 53.70 3dyp s ASN 55 Cb 0.16 -2.56 0.00 0.00 -0.02 0.00 0.00 41.25 38.83 3dyp s ASN 55 CO 0.21 -2.41 0.00 0.61 -2.57 0.00 0.00 177.10 172.94 3dyp n GLY 56 N -0.23 0.38 3.69 0.66 0.00 0.15 -4.99 105.19 104.85 3dyp n GLY 56 Ca 0.11 -1.67 -0.39 0.00 0.00 0.00 0.00 46.02 44.07 3dyp n GLY 56 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dyp s GLU 57 N -1.08 4.31 0.43 1.61 2.02 -1.26 -0.95 118.70 123.77 3dyp s GLU 57 Ca 0.00 0.63 0.04 0.00 0.02 0.00 0.00 54.97 55.66 3dyp s GLU 57 Cb 0.00 -3.50 -0.05 0.00 0.10 0.00 0.00 34.13 30.68 3dyp s GLU 57 CO 0.00 -0.03 0.03 -1.58 0.02 0.00 0.00 175.26 173.69 3dyp s TRP 58 N 1.21 2.16 -0.11 1.61 0.52 -0.16 -4.94 118.94 119.23 3dyp s TRP 58 Ca 0.30 -0.86 -0.06 0.00 0.02 0.00 0.00 56.10 55.50 3dyp s TRP 58 Cb -0.16 -1.59 -0.04 0.00 -1.15 0.00 0.00 33.47 30.53 3dyp s TRP 58 CO 0.12 0.24 0.12 1.03 0.02 0.00 0.00 176.95 178.49 3dyp s ARG 59 N -3.79 3.37 -0.08 4.98 1.81 0.11 -0.60 118.95 124.74 3dyp s ARG 59 Ca 0.25 -0.17 -0.07 0.00 -1.72 0.00 0.00 55.73 54.02 3dyp s ARG 59 Cb 0.07 -3.13 0.03 0.00 -0.45 0.00 0.00 34.95 31.46 3dyp s ARG 59 CO 0.13 0.77 0.22 0.12 -0.68 0.00 0.00 175.30 175.85 3dyp s PHE 60 N -1.01 -0.25 0.01 -0.53 5.36 -0.36 -0.53 117.98 120.66 3dyp s PHE 60 Ca 0.15 0.61 0.02 0.00 -0.96 0.00 0.00 56.93 56.75 3dyp s PHE 60 Cb -0.12 0.06 -0.01 0.00 -0.34 0.00 0.00 43.02 42.62 3dyp s PHE 60 CO 0.04 -0.14 -0.06 0.00 -1.46 0.00 0.00 175.22 173.60 3dyp s ALA 61 N 0.39 0.51 -0.07 11.12 0.00 -0.36 -1.46 121.76 131.90 3dyp s ALA 61 Ca -0.02 -0.37 -0.02 0.00 0.00 0.00 0.00 51.96 51.55 3dyp s ALA 61 Cb -0.04 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.96 3dyp s ALA 61 CO -0.02 0.09 0.04 -0.46 0.00 0.00 0.00 175.76 175.42 3dyp s TRP 62 N -0.41 3.26 0.08 0.00 -0.00 -1.26 -0.51 118.94 120.09 3dyp s TRP 62 Ca -0.00 0.25 0.02 0.00 -0.00 0.00 0.00 56.10 56.36 3dyp s TRP 62 Cb -0.04 -1.79 -0.03 0.00 -0.00 0.00 0.00 33.47 31.60 3dyp s TRP 62 CO -0.00 0.54 -0.07 -0.06 -0.00 0.00 0.00 176.95 177.35 3dyp s PHE 63 N -1.00 0.82 -0.70 5.86 0.40 -0.06 -5.00 117.98 118.30 3dyp s PHE 63 Ca 0.16 -0.72 0.26 0.00 -0.60 0.00 0.00 56.93 56.03 3dyp s PHE 63 Cb -0.12 -0.48 0.73 0.00 0.51 0.00 0.00 43.02 43.67 3dyp s PHE 63 CO 0.06 -0.11 1.73 -1.00 0.70 0.00 0.00 175.22 176.60 3dyp h PRO 64 N 3.64 0.00 -2.21 0.24 0.13 -1.85 -0.37 132.00 131.58 3dyp h PRO 64 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3dyp h PRO 64 Cb 1.18 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.14 3dyp h PRO 64 CO 0.54 0.00 0.31 0.00 -0.23 0.00 0.00 178.00 178.62 3dyp s ALA 65 N -3.12 -1.77 0.51 -0.56 0.00 -1.21 -0.03 121.76 115.59 3dyp s ALA 65 Ca 0.10 1.12 0.18 0.00 0.00 0.00 0.00 51.96 53.36 3dyp s ALA 65 Cb 0.12 0.15 1.27 0.00 0.00 0.00 0.00 23.12 24.65 3dyp s ALA 65 CO 0.61 -0.51 2.08 -1.00 0.00 0.00 0.00 175.76 176.95 3dyp h PRO 66 N 2.51 0.06 0.00 0.00 0.13 -1.87 0.45 132.00 133.28 3dyp h PRO 66 Ca -0.26 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3dyp h PRO 66 Cb 1.20 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3dyp h PRO 66 CO 0.36 0.04 0.00 0.93 -0.23 0.00 0.00 178.00 179.10 3dyp h GLU 67 N 0.06 0.00 -0.02 0.86 3.07 -1.95 -2.26 114.58 114.35 3dyp h GLU 67 Ca 0.11 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.97 3dyp h GLU 67 Cb 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 3dyp h GLU 67 CO -0.01 0.00 -0.09 0.00 -1.40 0.00 0.00 179.01 177.51 3dyp n ALA 68 N -2.04 2.74 -2.65 3.43 0.00 0.15 -4.88 120.51 117.26 3dyp n ALA 68 Ca -0.01 -0.49 -0.42 0.00 0.00 0.00 0.00 53.44 52.51 3dyp n ALA 68 Cb 0.15 -1.07 -0.03 0.00 0.00 0.00 0.00 19.45 18.50 3dyp n ALA 68 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3dyp s VAL 69 N -2.15 4.71 0.28 0.00 1.01 -0.85 -4.99 120.40 118.40 3dyp s VAL 69 Ca 0.32 1.94 -0.29 0.00 0.00 0.00 0.00 61.98 63.95 3dyp s VAL 69 Cb 0.20 -4.25 -0.10 0.00 0.00 0.00 0.00 36.38 32.24 3dyp s VAL 69 CO 0.39 0.14 1.18 -2.16 0.00 0.00 0.00 175.10 174.65 3dyp s PRO 70 N 1.07 4.53 0.49 2.72 0.04 -1.26 -4.91 135.00 137.68 3dyp s PRO 70 Ca 0.53 1.94 0.16 0.00 0.04 0.00 0.00 61.00 63.68 3dyp s PRO 70 Cb -0.23 -3.16 1.20 0.00 0.04 0.00 0.00 34.50 32.36 3dyp s PRO 70 CO 0.28 0.05 2.08 0.93 0.04 0.00 0.00 177.00 180.37 3dyp h GLU 71 N 3.89 0.14 -0.89 4.56 3.07 -1.99 -1.95 114.58 121.42 3dyp h GLU 71 Ca -0.47 -0.01 0.21 0.00 -0.50 0.00 0.00 59.36 58.59 3dyp h GLU 71 Cb 1.22 -0.03 -0.06 0.00 -0.84 0.00 0.00 28.75 29.04 3dyp h GLU 71 CO 0.68 0.09 0.60 0.66 -1.40 0.00 0.00 179.01 179.64 3dyp h SER 72 N 0.15 0.31 0.11 1.42 4.64 -1.93 -0.37 113.55 117.88 3dyp h SER 72 Ca 0.12 0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.46 3dyp h SER 72 Cb 0.30 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3dyp h SER 72 CO -0.02 0.12 -0.09 -0.25 -0.87 0.00 0.00 176.83 175.73 3dyp h TRP 73 N 0.31 0.00 -0.67 4.77 7.01 -1.48 -0.75 115.95 125.13 3dyp h TRP 73 Ca 0.45 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.43 3dyp h TRP 73 Cb 1.27 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 28.30 3dyp h TRP 73 CO -0.00 0.09 0.34 -0.07 -2.79 0.00 0.00 178.44 176.01 3dyp h LEU 74 N 0.00 0.85 0.00 0.65 3.38 -1.23 -3.21 115.31 115.74 3dyp h LEU 74 Ca -0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3dyp h LEU 74 Cb 0.16 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3dyp h LEU 74 CO 0.01 0.71 -1.66 1.21 0.09 0.00 0.00 178.44 178.79 3dyp n GLU 75 N -4.35 0.60 -3.81 1.13 4.07 -0.84 -3.72 120.64 113.71 3dyp n GLU 75 Ca 0.06 -0.14 -0.12 0.00 -0.06 0.00 0.00 57.16 56.91 3dyp n GLU 75 Cb 0.12 -1.46 -0.10 0.00 -0.06 0.00 0.00 31.44 29.94 3dyp n GLU 75 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3dyp n ASP 77 N 1.61 2.17 -4.71 0.00 2.03 -1.26 -3.98 116.55 112.40 3dyp n ASP 77 Ca -0.21 1.12 -0.40 0.00 0.52 0.00 0.00 54.79 55.81 3dyp n ASP 77 Cb 0.56 -1.44 -0.04 0.00 -0.72 0.00 0.00 41.12 39.48 3dyp n ASP 77 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3dyp s LEU 78 N -1.09 4.33 0.41 -2.67 1.43 -1.26 -4.94 118.68 114.89 3dyp s LEU 78 Ca 0.60 1.34 0.08 0.00 -1.03 0.00 0.00 54.13 55.12 3dyp s LEU 78 Cb -0.55 -3.24 0.86 0.00 0.03 0.00 0.00 46.19 43.29 3dyp s LEU 78 CO 0.59 -0.17 2.04 -0.65 0.23 0.00 0.00 176.35 178.39 3dyp h PRO 79 N 6.79 0.48 0.00 1.29 0.11 -2.02 -0.29 132.00 138.35 3dyp h PRO 79 Ca -0.41 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3dyp h PRO 79 Cb 1.20 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3dyp h PRO 79 CO 0.76 0.35 0.00 0.39 -0.21 0.00 0.00 178.00 179.28 3dyp n GLU 80 N -4.45 0.13 -0.77 1.05 4.71 -1.26 -4.83 120.64 115.23 3dyp n GLU 80 Ca 0.02 0.31 -0.31 0.00 -0.01 0.00 0.00 57.16 57.17 3dyp n GLU 80 Cb 0.09 -1.73 0.16 0.00 -1.01 0.00 0.00 31.44 28.95 3dyp n GLU 80 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3dyp s ALA 81 N -3.17 1.54 0.39 0.62 0.00 -0.12 -4.97 121.76 116.04 3dyp s ALA 81 Ca 0.07 0.64 0.08 0.00 0.00 0.00 0.00 51.96 52.74 3dyp s ALA 81 Cb 0.11 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 3dyp s ALA 81 CO 0.40 -2.69 0.30 -0.51 0.00 0.00 0.00 175.76 173.26 3dyp s ASP 82 N -2.58 4.94 -0.19 0.00 1.01 -0.53 -4.88 116.67 114.45 3dyp s ASP 82 Ca 0.68 -0.76 -0.13 0.00 0.71 0.00 0.00 52.55 53.05 3dyp s ASP 82 Cb -0.24 -0.64 -0.05 0.00 1.01 0.00 0.00 42.92 43.00 3dyp s ASP 82 CO 0.57 -0.54 0.27 -0.89 0.21 0.00 0.00 175.17 174.78 3dyp s THR 83 N -2.46 5.31 0.15 -1.27 2.01 -1.26 -1.22 115.64 116.90 3dyp s THR 83 Ca 0.44 0.47 -0.01 0.00 0.31 0.00 0.00 61.69 62.91 3dyp s THR 83 Cb -0.02 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 3dyp s THR 83 CO 0.26 0.37 0.06 0.68 -0.69 0.00 0.00 174.62 175.30 3dyp s VAL 84 N 0.69 0.14 0.24 3.82 -7.23 0.23 -4.95 120.40 113.35 3dyp s VAL 84 Ca 0.14 -1.93 -0.22 0.00 -1.81 0.00 0.00 61.98 58.16 3dyp s VAL 84 Cb -0.13 -2.14 -0.09 0.00 0.56 0.00 0.00 36.38 34.59 3dyp s VAL 84 CO 0.04 -0.38 0.78 -0.69 -0.31 0.00 0.00 175.10 174.54 3dyp s VAL 85 N -4.03 4.47 -0.04 1.32 1.01 -1.26 -0.99 120.40 120.88 3dyp s VAL 85 Ca 0.27 1.44 0.03 0.00 0.00 0.00 0.00 61.98 63.72 3dyp s VAL 85 Cb 0.07 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.54 3dyp s VAL 85 CO 0.04 0.22 -0.11 -0.69 0.00 0.00 0.00 175.10 174.56 3dyp s VAL 86 N -1.51 0.95 0.55 2.92 1.01 -0.12 -4.11 120.40 120.08 3dyp s VAL 86 Ca 0.44 -0.44 -0.18 0.00 0.00 0.00 0.00 61.98 61.80 3dyp s VAL 86 Cb -0.18 -0.85 -0.06 0.00 0.00 0.00 0.00 36.38 35.30 3dyp s VAL 86 CO 0.22 0.29 1.07 -2.16 0.00 0.00 0.00 175.10 174.53 3dyp s PRO 87 N 0.27 3.45 0.05 2.72 0.04 -1.26 -0.68 135.00 139.59 3dyp s PRO 87 Ca -0.05 1.38 -0.28 0.00 0.04 0.00 0.00 61.00 62.09 3dyp s PRO 87 Cb -0.11 -2.04 0.09 0.00 0.04 0.00 0.00 34.50 32.48 3dyp s PRO 87 CO 0.01 -0.73 0.95 -1.54 0.04 0.00 0.00 177.00 175.73 3dyp s SER 88 N -2.22 -0.26 -0.21 6.66 1.04 0.19 -4.93 113.70 113.97 3dyp s SER 88 Ca 0.68 -0.18 -0.07 0.00 0.48 0.00 0.00 55.95 56.86 3dyp s SER 88 Cb -0.19 0.41 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 3dyp s SER 88 CO 0.29 -0.70 0.06 0.20 0.98 0.00 0.00 173.24 174.06 3dyp s ASN 89 N -2.69 5.37 0.59 7.02 -0.87 -1.26 -3.23 114.94 119.86 3dyp s ASN 89 Ca 0.09 -0.05 0.28 0.00 -1.57 0.00 0.00 52.86 51.61 3dyp s ASN 89 Cb -0.01 -1.94 1.73 0.00 -0.02 0.00 0.00 41.25 41.02 3dyp s ASN 89 CO -0.04 0.09 2.20 4.11 -2.57 0.00 0.00 177.10 180.89 3dyp h TRP 90 N 7.32 0.00 -0.31 2.20 0.09 -1.78 0.64 115.95 124.11 3dyp h TRP 90 Ca -0.36 0.00 -0.03 0.00 0.09 0.00 0.00 58.89 58.58 3dyp h TRP 90 Cb 1.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 30.40 3dyp h TRP 90 CO 0.61 0.00 0.05 1.96 0.09 0.00 0.00 178.44 181.14 3dyp h GLN 91 N 0.00 0.45 0.00 0.12 7.50 -1.80 -2.18 115.11 119.21 3dyp h GLN 91 Ca 0.03 -0.08 0.00 0.00 0.50 0.00 0.00 58.65 59.10 3dyp h GLN 91 Cb 0.17 -0.08 0.00 0.00 0.05 0.00 0.00 27.48 27.62 3dyp h GLN 91 CO -0.00 0.45 0.00 0.52 -1.50 0.00 0.00 178.83 178.30 3dyp h MET 92 N 0.45 0.00 -0.03 1.46 2.86 -1.16 -1.85 114.93 116.66 3dyp h MET 92 Ca 0.10 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 3dyp h MET 92 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 3dyp h MET 92 CO 0.00 0.00 -0.01 0.72 1.06 0.00 0.00 176.91 178.68 3dyp n HIS 93 N -2.62 0.00 -0.60 -0.22 8.25 -0.85 -4.97 115.22 114.21 3dyp n HIS 93 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 3dyp n HIS 93 Cb 0.27 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.38 3dyp n HIS 93 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dyp n GLY 94 N 1.34 0.72 0.15 -1.41 0.00 -0.70 -4.95 105.19 100.34 3dyp n GLY 94 Ca 0.14 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.18 3dyp n GLY 94 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3dyp h TYR 95 N 0.00 0.00 -3.20 1.61 -1.99 -1.71 -3.46 116.97 108.21 3dyp h TYR 95 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3dyp h TYR 95 Cb 0.00 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 38.68 3dyp h TYR 95 CO 0.00 0.55 0.14 0.16 -0.00 0.00 0.00 178.16 179.01 3dyp s ASP 96 N -6.63 -0.09 0.12 3.88 1.47 -1.26 -5.02 116.67 109.14 3dyp s ASP 96 Ca 0.00 -0.86 -0.18 0.00 1.18 0.00 0.00 52.55 52.69 3dyp s ASP 96 Cb 0.11 0.73 -0.07 0.00 -0.34 0.00 0.00 42.92 43.35 3dyp s ASP 96 CO 0.74 -1.39 0.59 0.00 0.68 0.00 0.00 175.17 175.79 3dyp s ALA 97 N -3.50 3.56 0.53 2.11 0.00 -1.26 -4.33 121.76 118.87 3dyp s ALA 97 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 51.96 51.94 3dyp s ALA 97 Cb -0.04 -2.63 -0.06 0.00 0.00 0.00 0.00 23.12 20.38 3dyp s ALA 97 CO 0.09 0.41 1.04 -1.25 0.00 0.00 0.00 175.76 176.05 3dyp s PRO 98 N -1.53 3.61 -0.10 0.00 0.04 -1.26 -4.98 135.00 130.78 3dyp s PRO 98 Ca 0.34 1.25 0.03 0.00 0.04 0.00 0.00 61.00 62.66 3dyp s PRO 98 Cb -0.18 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.30 3dyp s PRO 98 CO 0.20 -0.57 -0.21 0.42 0.04 0.00 0.00 177.00 176.87 3dyp s ILE 99 N -2.25 1.82 -0.42 0.56 1.01 -1.06 -4.67 121.20 116.20 3dyp s ILE 99 Ca 0.65 -0.88 -0.07 0.00 0.00 0.00 0.00 60.65 60.35 3dyp s ILE 99 Cb -0.15 -1.60 0.09 0.00 0.01 0.00 0.00 42.46 40.81 3dyp s ILE 99 CO 0.28 0.51 0.24 -0.47 0.00 0.00 0.00 174.94 175.50 3dyp s TYR 100 N 0.49 3.41 -0.03 3.97 5.04 -1.26 -0.03 117.35 128.94 3dyp s TYR 100 Ca -0.16 -1.83 0.04 0.00 -2.44 0.00 0.00 57.07 52.67 3dyp s TYR 100 Cb -0.17 -3.05 -0.00 0.00 0.35 0.00 0.00 41.96 39.08 3dyp s TYR 100 CO 0.06 -0.90 -0.13 -0.08 -1.34 0.00 0.00 175.55 173.16 3dyp s THR 101 N 1.33 1.11 0.00 4.34 -1.32 -1.26 -1.43 115.64 118.41 3dyp s THR 101 Ca 0.04 -0.56 0.00 0.00 -1.21 0.00 0.00 61.69 59.96 3dyp s THR 101 Cb -0.23 -0.95 0.00 0.00 -1.51 0.00 0.00 72.50 69.81 3dyp s THR 101 CO -0.00 0.32 0.00 -3.20 -2.21 0.00 0.00 174.62 169.53 3dyp n ASN 102 N 3.05 0.00 -0.10 8.08 2.85 -1.26 -4.12 115.26 123.77 3dyp n ASN 102 Ca -0.17 0.15 -0.23 0.00 -0.11 0.00 0.00 54.58 54.22 3dyp n ASN 102 Cb 0.54 -0.17 -0.12 0.00 1.24 0.00 0.00 39.78 41.27 3dyp n ASN 102 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 3dyp n VAL 103 N -1.10 1.57 -1.98 3.44 0.31 -1.26 -4.00 118.33 115.31 3dyp n VAL 103 Ca 0.00 -0.42 -0.41 0.00 -0.01 0.00 0.00 64.34 63.49 3dyp n VAL 103 Cb 0.00 -1.75 -0.02 0.00 -0.91 0.00 0.00 33.84 31.16 3dyp n VAL 103 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3dyp s THR 104 N -2.49 2.52 0.51 2.52 2.01 -1.26 -3.23 115.64 116.22 3dyp s THR 104 Ca -0.32 0.46 -0.23 0.00 0.31 0.00 0.00 61.69 61.91 3dyp s THR 104 Cb 0.10 -3.29 -0.06 0.00 0.01 0.00 0.00 72.50 69.25 3dyp s THR 104 CO 0.60 0.08 1.32 -0.31 -0.69 0.00 0.00 174.62 175.63 3dyp s TYR 105 N -0.34 2.45 -1.45 4.92 1.51 -1.26 -4.86 117.35 118.31 3dyp s TYR 105 Ca 0.57 1.40 0.21 0.00 -1.01 0.00 0.00 57.07 58.24 3dyp s TYR 105 Cb -0.43 -3.72 1.06 0.00 -0.11 0.00 0.00 41.96 38.76 3dyp s TYR 105 CO 0.48 -2.58 1.66 -0.35 -1.11 0.00 0.00 175.55 173.65 3dyp n PRO 106 N -0.77 0.31 -4.26 -1.71 -0.04 -1.26 -4.73 135.00 122.54 3dyp n PRO 106 Ca 0.09 0.09 -0.16 0.00 -0.04 0.00 0.00 63.50 63.47 3dyp n PRO 106 Cb 0.45 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.31 3dyp n PRO 106 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3dyp s ILE 107 N -2.55 1.31 0.37 0.52 -4.36 -1.26 -5.07 121.20 110.16 3dyp s ILE 107 Ca 0.20 -1.98 -0.27 0.00 -0.26 0.00 0.00 60.65 58.34 3dyp s ILE 107 Cb 0.14 -1.78 -0.11 0.00 1.25 0.00 0.00 42.46 41.96 3dyp s ILE 107 CO 0.31 -0.62 1.31 0.41 0.24 0.00 0.00 174.94 176.59 3dyp n THR 108 N 0.00 2.15 -2.59 8.37 -1.04 -1.26 -4.88 114.28 115.04 3dyp n THR 108 Ca -0.11 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.05 60.97 3dyp n THR 108 Cb 0.59 -1.62 -0.03 0.00 -1.82 0.00 0.00 70.33 67.46 3dyp n THR 108 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3dyp s VAL 109 N -1.13 4.00 -0.46 12.58 1.01 -1.26 -4.77 120.40 130.37 3dyp s VAL 109 Ca 0.57 0.83 0.07 0.00 0.00 0.00 0.00 61.98 63.44 3dyp s VAL 109 Cb -0.54 -4.74 0.30 0.00 0.00 0.00 0.00 36.38 31.40 3dyp s VAL 109 CO 0.61 -1.39 1.03 -3.20 0.00 0.00 0.00 175.10 172.15 3dyp n ASN 110 N 8.51 -2.16 -4.75 3.32 5.15 -1.26 -5.11 115.26 118.96 3dyp n ASN 110 Ca 0.08 -3.54 -0.40 0.00 -0.60 0.00 0.00 54.58 50.11 3dyp n ASN 110 Cb 0.49 1.65 0.02 0.00 -0.53 0.00 0.00 39.78 41.41 3dyp n ASN 110 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 3dyp n PRO 111 N 0.66 2.13 -0.99 1.20 -0.04 -1.26 0.30 135.00 137.00 3dyp n PRO 111 Ca 0.09 0.76 -0.06 0.00 -0.04 0.00 0.00 63.50 64.24 3dyp n PRO 111 Cb 0.68 -2.56 0.29 0.00 -0.04 0.00 0.00 33.50 31.87 3dyp n PRO 111 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3dyp n PRO 112 N -0.19 3.62 -2.22 0.54 -0.04 -1.26 -5.10 135.00 130.35 3dyp n PRO 112 Ca 0.06 -2.93 -0.30 0.00 -0.04 0.00 0.00 63.50 60.29 3dyp n PRO 112 Cb 0.41 -2.18 0.00 0.00 -0.04 0.00 0.00 33.50 31.69 3dyp n PRO 112 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3dyp s PHE 113 N -2.87 3.59 0.26 0.54 0.40 0.15 -4.32 117.98 115.72 3dyp s PHE 113 Ca 0.53 1.13 0.02 0.00 -0.60 0.00 0.00 56.93 58.02 3dyp s PHE 113 Cb 0.42 -2.57 -0.05 0.00 0.51 0.00 0.00 43.02 41.32 3dyp s PHE 113 CO 0.13 -0.50 0.05 0.14 0.70 0.00 0.00 175.22 175.74 3dyp s VAL 114 N -2.95 0.84 0.66 -0.44 -7.23 -1.26 -4.57 120.40 105.45 3dyp s VAL 114 Ca 0.53 -2.01 -0.17 0.00 -1.81 0.00 0.00 61.98 58.51 3dyp s VAL 114 Cb -0.11 -2.53 -0.01 0.00 0.56 0.00 0.00 36.38 34.29 3dyp s VAL 114 CO 0.48 -0.14 1.20 -2.65 -0.31 0.00 0.00 175.10 173.68 3dyp n PRO 115 N -0.47 0.93 0.09 4.82 -0.02 -1.26 -4.90 135.00 134.18 3dyp n PRO 115 Ca -0.03 0.37 -0.05 0.00 -2.02 0.00 0.00 63.50 61.78 3dyp n PRO 115 Cb 0.65 -2.44 0.10 0.00 -0.02 0.00 0.00 33.50 31.80 3dyp n PRO 115 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3dyp h THR 116 N 0.30 1.42 -2.94 3.45 1.35 -1.99 -3.35 112.91 111.14 3dyp h THR 116 Ca -0.50 -2.13 -0.60 0.00 -0.55 0.00 0.00 66.41 62.64 3dyp h THR 116 Cb 1.34 2.11 -0.12 0.00 -1.73 0.00 0.00 68.15 69.75 3dyp h THR 116 CO 0.51 0.62 0.68 -1.61 -0.25 0.00 0.00 175.52 175.48 3dyp s GLU 117 N -3.63 3.28 -0.27 4.72 2.02 -1.26 -4.73 118.70 118.82 3dyp s GLU 117 Ca -0.03 -0.34 -0.01 0.00 0.02 0.00 0.00 54.97 54.60 3dyp s GLU 117 Cb 0.12 -4.11 0.08 0.00 0.10 0.00 0.00 34.13 30.32 3dyp s GLU 117 CO 0.80 -1.69 0.06 1.21 0.02 0.00 0.00 175.26 175.67 3dyp s ASN 118 N 3.20 3.72 -0.06 -0.19 2.47 0.96 -4.96 114.94 120.08 3dyp s ASN 118 Ca 0.30 -1.38 -0.38 0.00 0.42 0.00 0.00 52.86 51.83 3dyp s ASN 118 Cb -0.12 -0.83 -0.16 0.00 -1.45 0.00 0.00 41.25 38.68 3dyp s ASN 118 CO 0.17 -0.37 1.52 -2.65 -3.72 0.00 0.00 177.10 172.06 3dyp n PRO 119 N 4.88 1.22 -4.42 0.43 -0.02 -1.20 -3.29 135.00 132.59 3dyp n PRO 119 Ca -0.05 0.44 -0.29 0.00 -2.02 0.00 0.00 63.50 61.58 3dyp n PRO 119 Cb 0.44 -2.11 -0.17 0.00 -0.02 0.00 0.00 33.50 31.64 3dyp n PRO 119 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3dyp s THR 120 N 1.79 1.57 -0.24 3.45 2.01 -0.15 -1.12 115.64 122.95 3dyp s THR 120 Ca 0.90 -0.68 -0.06 0.00 0.31 0.00 0.00 61.69 62.15 3dyp s THR 120 Cb -0.98 -1.44 -0.02 0.00 0.01 0.00 0.00 72.50 70.07 3dyp s THR 120 CO 0.54 0.46 0.04 -0.83 -0.69 0.00 0.00 174.62 174.14 3dyp s GLY 121 N 1.04 1.72 -0.50 4.40 0.00 0.47 -0.88 107.32 113.57 3dyp s GLY 121 Ca -0.05 -1.14 -0.16 0.00 0.00 0.00 0.00 44.72 43.37 3dyp s GLY 121 CO -0.03 0.51 0.46 0.00 0.00 0.00 0.00 173.10 174.04 3dyp s TYR 123 N 1.71 3.23 0.08 0.00 1.51 0.67 -1.22 117.35 123.32 3dyp s TYR 123 Ca 0.04 0.15 -0.11 0.00 -1.01 0.00 0.00 57.07 56.14 3dyp s TYR 123 Cb -0.26 -1.69 0.01 0.00 -0.11 0.00 0.00 41.96 39.91 3dyp s TYR 123 CO 0.05 0.53 0.25 -1.54 -1.11 0.00 0.00 175.55 173.74 3dyp s SER 124 N -1.94 -0.01 -0.17 2.29 1.04 0.31 0.20 113.70 115.42 3dyp s SER 124 Ca 0.25 -0.45 -0.09 0.00 0.48 0.00 0.00 55.95 56.13 3dyp s SER 124 Cb -0.12 0.36 0.06 0.00 0.10 0.00 0.00 66.02 66.42 3dyp s SER 124 CO 0.16 -0.70 0.40 -0.22 0.98 0.00 0.00 173.24 173.87 3dyp s LEU 125 N -2.56 -0.05 -0.21 2.42 2.96 -1.04 -0.72 118.68 119.48 3dyp s LEU 125 Ca 0.01 0.87 -0.09 0.00 -0.22 0.00 0.00 54.13 54.71 3dyp s LEU 125 Cb 0.02 1.33 -0.04 0.00 0.50 0.00 0.00 46.19 48.00 3dyp s LEU 125 CO -0.08 -0.19 0.10 -0.89 -1.32 0.00 0.00 176.35 173.97 3dyp s THR 126 N 1.34 4.97 0.10 3.68 2.01 -1.26 -0.86 115.64 125.62 3dyp s THR 126 Ca -0.09 0.04 -0.11 0.00 0.31 0.00 0.00 61.69 61.84 3dyp s THR 126 Cb -0.08 -3.28 0.01 0.00 0.01 0.00 0.00 72.50 69.16 3dyp s THR 126 CO -0.12 0.40 0.26 0.72 -0.69 0.00 0.00 174.62 175.19 3dyp s PHE 127 N 0.80 0.03 0.14 4.92 -0.12 0.12 -4.92 117.98 118.95 3dyp s PHE 127 Ca 0.05 -0.42 -0.10 0.00 -0.05 0.00 0.00 56.93 56.41 3dyp s PHE 127 Cb -0.13 0.05 -0.06 0.00 -0.63 0.00 0.00 43.02 42.24 3dyp s PHE 127 CO 0.02 -0.59 0.46 1.21 -0.05 0.00 0.00 175.22 176.27 3dyp s ASN 128 N -2.83 6.65 -0.09 1.98 2.47 -1.26 -0.43 114.94 121.43 3dyp s ASN 128 Ca 0.04 0.85 0.02 0.00 0.42 0.00 0.00 52.86 54.19 3dyp s ASN 128 Cb 0.04 -2.20 0.01 0.00 -1.45 0.00 0.00 41.25 37.65 3dyp s ASN 128 CO -0.11 0.08 -0.15 -0.69 -3.72 0.00 0.00 177.10 172.52 3dyp s VAL 129 N -1.55 1.40 0.47 -5.21 1.01 0.78 -4.95 120.40 112.35 3dyp s VAL 129 Ca 0.39 -0.60 -0.22 0.00 0.00 0.00 0.00 61.98 61.55 3dyp s VAL 129 Cb -0.13 -1.28 -0.08 0.00 0.00 0.00 0.00 36.38 34.89 3dyp s VAL 129 CO 0.20 0.42 1.09 -0.62 0.00 0.00 0.00 175.10 176.19 3dyp s ASP 130 N 0.87 6.30 0.51 3.32 2.15 -1.26 -1.32 116.67 127.24 3dyp s ASP 130 Ca -0.10 2.10 0.16 0.00 0.43 0.00 0.00 52.55 55.14 3dyp s ASP 130 Cb -0.15 -2.58 1.23 0.00 -0.30 0.00 0.00 42.92 41.12 3dyp s ASP 130 CO 0.01 -0.81 2.12 -0.08 -0.17 0.00 0.00 175.17 176.23 3dyp h GLU 131 N 1.87 0.07 -0.39 4.34 4.57 -1.95 -1.30 114.58 121.79 3dyp h GLU 131 Ca -0.49 -0.00 0.06 0.00 -1.18 0.00 0.00 59.36 57.74 3dyp h GLU 131 Cb 1.23 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.79 3dyp h GLU 131 CO 0.60 0.05 0.26 0.66 -1.18 0.00 0.00 179.01 179.40 3dyp h SER 132 N 0.07 0.24 0.81 1.04 4.64 -1.98 0.23 113.55 118.60 3dyp h SER 132 Ca 0.05 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.32 3dyp h SER 132 Cb 0.11 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 3dyp h SER 132 CO -0.01 0.16 -0.24 -0.50 -0.87 0.00 0.00 176.83 175.37 3dyp h TRP 133 N 0.27 0.00 0.00 4.77 4.06 -1.54 -3.24 115.95 120.27 3dyp h TRP 133 Ca 0.17 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.12 3dyp h TRP 133 Cb 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.50 3dyp h TRP 133 CO -0.00 0.24 -1.63 1.28 -3.56 0.00 0.00 178.44 174.77 3dyp n LEU 134 N -3.47 0.33 0.16 -4.49 4.77 0.06 -4.27 117.00 110.09 3dyp n LEU 134 Ca -0.00 -0.11 0.02 0.00 -0.03 0.00 0.00 56.01 55.90 3dyp n LEU 134 Cb 0.41 -0.01 0.25 0.00 -2.33 0.00 0.00 43.42 41.75 3dyp n LEU 134 CO 0.34 0.05 0.59 -0.61 -1.33 0.00 0.00 177.39 176.43 3dyp h GLN 135 N 0.00 0.00 -3.87 3.23 5.75 -0.69 -3.46 115.11 116.08 3dyp h GLN 135 Ca 0.00 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.41 3dyp h GLN 135 Cb 0.86 0.00 -0.14 0.00 1.07 0.00 0.00 27.48 29.26 3dyp h GLN 135 CO 0.00 0.49 -0.42 -1.21 -2.65 0.00 0.00 178.83 175.04 3dyp s GLU 136 N -3.59 0.80 0.49 1.69 0.41 -1.26 -5.12 118.70 112.12 3dyp s GLU 136 Ca -0.00 -0.99 0.00 0.00 -0.41 0.00 0.00 54.97 53.57 3dyp s GLU 136 Cb 0.12 0.32 0.00 0.00 -1.78 0.00 0.00 34.13 32.78 3dyp s GLU 136 CO 0.72 -0.24 0.00 0.41 -0.49 0.00 0.00 175.26 175.66 3dyp n GLY 137 N 0.00 -2.16 3.20 -1.39 0.00 -1.26 -4.80 105.19 98.79 3dyp n GLY 137 Ca -0.15 -1.47 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 3dyp n GLY 137 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dyp s GLN 138 N -0.58 2.44 -0.25 1.61 0.74 0.11 -4.82 119.66 118.91 3dyp s GLN 138 Ca 0.00 -0.79 -0.04 0.00 0.05 0.00 0.00 55.36 54.59 3dyp s GLN 138 Cb 0.00 -1.99 0.01 0.00 1.10 0.00 0.00 33.01 32.13 3dyp s GLN 138 CO 0.00 0.26 -0.01 0.99 -0.55 0.00 0.00 175.29 175.98 3dyp s THR 139 N 0.10 3.36 0.22 -0.34 2.01 -1.26 -0.10 115.64 119.63 3dyp s THR 139 Ca -0.09 -0.77 0.10 0.00 0.31 0.00 0.00 61.69 61.24 3dyp s THR 139 Cb -0.15 -2.67 -0.04 0.00 0.01 0.00 0.00 72.50 69.65 3dyp s THR 139 CO 0.05 0.22 -0.14 0.00 -0.69 0.00 0.00 174.62 174.06 3dyp s ARG 140 N 1.42 1.86 0.03 4.92 1.70 -0.47 0.49 118.95 128.91 3dyp s ARG 140 Ca 0.02 -1.47 0.01 0.00 -0.47 0.00 0.00 55.73 53.83 3dyp s ARG 140 Cb -0.16 -1.99 -0.04 0.00 -0.57 0.00 0.00 34.95 32.19 3dyp s ARG 140 CO -0.02 0.39 0.05 -1.50 -1.08 0.00 0.00 175.30 173.14 3dyp s ILE 141 N -1.95 4.44 -0.10 4.99 2.07 0.39 -1.33 121.20 129.72 3dyp s ILE 141 Ca 0.26 -0.61 -0.00 0.00 -1.41 0.00 0.00 60.65 58.89 3dyp s ILE 141 Cb -0.07 -3.05 0.02 0.00 0.13 0.00 0.00 42.46 39.49 3dyp s ILE 141 CO 0.14 0.28 -0.07 -0.63 -1.91 0.00 0.00 174.94 172.75 3dyp s ILE 142 N -1.22 0.92 -0.42 2.00 1.01 0.45 -1.82 121.20 122.11 3dyp s ILE 142 Ca 0.24 -0.25 -0.09 0.00 0.00 0.00 0.00 60.65 60.54 3dyp s ILE 142 Cb -0.12 -0.94 0.08 0.00 0.01 0.00 0.00 42.46 41.49 3dyp s ILE 142 CO 0.15 0.34 0.27 -0.36 0.00 0.00 0.00 174.94 175.35 3dyp s PHE 143 N 1.53 3.34 0.27 3.97 0.40 -0.42 -0.93 117.98 126.15 3dyp s PHE 143 Ca 0.01 -1.52 0.36 0.00 -0.60 0.00 0.00 56.93 55.18 3dyp s PHE 143 Cb -0.13 -3.00 1.62 0.00 0.51 0.00 0.00 43.02 42.02 3dyp s PHE 143 CO -0.06 -0.85 2.08 -0.44 0.70 0.00 0.00 175.22 176.65 3dyp h ASP 144 N 8.42 0.00 -1.03 1.36 3.32 -0.86 -1.04 116.42 126.61 3dyp h ASP 144 Ca -0.23 0.00 0.15 0.00 0.02 0.00 0.00 57.03 56.97 3dyp h ASP 144 Cb 1.08 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.42 3dyp h ASP 144 CO 0.77 0.02 0.00 -0.83 -1.72 0.00 0.00 179.24 177.48 3dyp s GLY 145 N -4.18 -0.55 -0.07 2.75 0.00 -1.26 -3.49 107.32 100.52 3dyp s GLY 145 Ca -0.01 2.52 0.00 0.00 0.00 0.00 0.00 44.72 47.24 3dyp s GLY 145 CO 0.52 3.38 -0.05 0.14 0.00 0.00 0.00 173.10 177.09 3dyp s VAL 146 N 2.77 0.68 -0.24 1.40 1.01 -1.24 -1.62 120.40 123.15 3dyp s VAL 146 Ca 0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 3dyp s VAL 146 Cb -0.11 -0.72 0.02 0.00 0.00 0.00 0.00 36.38 35.57 3dyp s VAL 146 CO -0.17 0.28 -0.07 0.21 0.00 0.00 0.00 175.10 175.35 3dyp s ASN 147 N 1.36 4.20 -0.00 3.32 3.84 0.15 -4.08 114.94 123.73 3dyp s ASN 147 Ca -0.03 -0.78 0.05 0.00 0.21 0.00 0.00 52.86 52.30 3dyp s ASN 147 Cb -0.14 -1.66 -0.06 0.00 -0.55 0.00 0.00 41.25 38.85 3dyp s ASN 147 CO -0.03 -0.10 0.19 -1.54 -2.79 0.00 0.00 177.10 172.83 3dyp n SER 148 N 4.68 1.17 -3.56 -4.21 3.41 -0.09 -1.14 113.62 113.87 3dyp n SER 148 Ca -0.17 -0.46 -0.12 0.00 -0.26 0.00 0.00 58.87 57.87 3dyp n SER 148 Cb 0.48 1.06 -0.04 0.00 -0.26 0.00 0.00 64.21 65.45 3dyp n SER 148 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyp s ALA 149 N -1.70 -1.20 0.11 7.33 0.00 -1.17 -3.79 121.76 121.34 3dyp s ALA 149 Ca 0.01 0.24 -0.25 0.00 0.00 0.00 0.00 51.96 51.96 3dyp s ALA 149 Cb 0.04 0.67 0.08 0.00 0.00 0.00 0.00 23.12 23.90 3dyp s ALA 149 CO 0.21 -0.64 0.73 -0.59 0.00 0.00 0.00 175.76 175.46 3dyp s PHE 150 N -3.45 -0.43 0.05 0.00 -0.12 -0.25 -1.09 117.98 112.68 3dyp s PHE 150 Ca 0.00 0.23 0.05 0.00 -0.05 0.00 0.00 56.93 57.16 3dyp s PHE 150 Cb 0.00 0.57 -0.04 0.00 -0.63 0.00 0.00 43.02 42.92 3dyp s PHE 150 CO -0.10 -0.76 -0.09 -1.01 -0.05 0.00 0.00 175.22 173.21 3dyp s HIS 151 N -3.51 2.79 -0.03 3.49 3.76 -0.86 -1.07 115.29 119.85 3dyp s HIS 151 Ca 0.04 -0.11 0.04 0.00 -0.15 0.00 0.00 55.06 54.87 3dyp s HIS 151 Cb -0.01 -1.52 -0.00 0.00 1.11 0.00 0.00 32.58 32.15 3dyp s HIS 151 CO -0.10 0.38 -0.16 -1.17 -0.85 0.00 0.00 174.74 172.84 3dyp s LEU 152 N -1.73 1.91 0.15 0.89 2.96 -0.23 -1.17 118.68 121.46 3dyp s LEU 152 Ca 0.19 -0.32 0.08 0.00 -0.22 0.00 0.00 54.13 53.86 3dyp s LEU 152 Cb -0.11 -0.88 -0.04 0.00 0.50 0.00 0.00 46.19 45.66 3dyp s LEU 152 CO 0.10 0.15 -0.18 0.26 -1.32 0.00 0.00 176.35 175.36 3dyp s TRP 153 N -0.01 1.76 -0.04 5.38 0.51 0.31 -0.10 118.94 126.75 3dyp s TRP 153 Ca -0.02 -0.47 -0.00 0.00 -2.12 0.00 0.00 56.10 53.48 3dyp s TRP 153 Cb -0.10 -0.89 0.03 0.00 -0.81 0.00 0.00 33.47 31.69 3dyp s TRP 153 CO 0.01 0.29 0.00 0.00 -0.51 0.00 0.00 176.95 176.75 3dyp n ASN 155 N 4.49 -3.55 0.00 0.00 3.02 0.69 -1.30 115.26 118.62 3dyp n ASN 155 Ca -0.19 -0.93 0.00 0.00 -0.03 0.00 0.00 54.58 53.43 3dyp n ASN 155 Cb 0.50 -3.17 0.00 0.00 -0.61 0.00 0.00 39.78 36.50 3dyp n ASN 155 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyp n GLY 156 N -1.54 2.11 3.75 7.41 0.00 -1.24 -5.02 105.19 110.65 3dyp n GLY 156 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 3dyp n GLY 156 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dyp s ARG 157 N -0.11 3.47 0.20 1.61 0.52 -0.42 -4.92 118.95 119.31 3dyp s ARG 157 Ca 0.00 -0.27 -0.30 0.00 -0.52 0.00 0.00 55.73 54.64 3dyp s ARG 157 Cb 0.00 -3.08 -0.08 0.00 0.52 0.00 0.00 34.95 32.30 3dyp s ARG 157 CO 0.00 0.61 1.22 -0.46 0.02 0.00 0.00 175.30 176.69 3dyp s TRP 158 N -0.57 3.38 -0.16 -0.53 -0.00 -1.26 -0.62 118.94 119.17 3dyp s TRP 158 Ca 0.11 1.40 -0.08 0.00 -0.00 0.00 0.00 56.10 57.54 3dyp s TRP 158 Cb -0.12 -3.47 -0.07 0.00 -0.00 0.00 0.00 33.47 29.81 3dyp s TRP 158 CO 0.02 -1.33 -0.21 0.28 -0.00 0.00 0.00 176.95 175.71 3dyp n VAL 159 N 2.32 0.89 -3.05 5.86 0.31 0.86 -4.90 118.33 120.62 3dyp n VAL 159 Ca 0.04 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 3dyp n VAL 159 Cb 0.44 -1.69 0.00 0.00 -0.91 0.00 0.00 33.84 31.68 3dyp n VAL 159 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3dyp n GLY 160 N 2.02 -1.04 3.19 2.92 0.00 -1.12 -4.74 105.19 106.41 3dyp n GLY 160 Ca -0.32 -0.76 -0.12 0.00 0.00 0.00 0.00 46.02 44.82 3dyp n GLY 160 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3dyp s TYR 161 N -3.00 -0.06 0.02 1.61 5.04 -0.66 -1.07 117.35 119.23 3dyp s TYR 161 Ca 0.00 0.01 -0.16 0.00 -2.44 0.00 0.00 57.07 54.48 3dyp s TYR 161 Cb 0.00 0.03 0.03 0.00 0.35 0.00 0.00 41.96 42.37 3dyp s TYR 161 CO 0.00 -0.38 0.36 0.20 -1.34 0.00 0.00 175.55 174.39 3dyp s GLY 162 N -1.56 -0.20 0.38 8.97 0.00 -0.23 -1.05 107.32 113.62 3dyp s GLY 162 Ca -0.12 0.26 0.05 0.00 0.00 0.00 0.00 44.72 44.91 3dyp s GLY 162 CO 0.01 0.02 0.17 1.20 0.00 0.00 0.00 173.10 174.50 3dyp s GLN 163 N -2.14 1.87 0.00 2.90 -0.21 -0.71 -1.09 119.66 120.28 3dyp s GLN 163 Ca -0.08 -2.12 0.00 0.00 0.02 0.00 0.00 55.36 53.18 3dyp s GLN 163 Cb -0.02 -0.34 0.00 0.00 1.00 0.00 0.00 33.01 33.65 3dyp s GLN 163 CO -0.00 -0.52 0.00 -3.47 -2.12 0.00 0.00 175.29 169.17 3dyp n ASP 164 N -1.35 -1.96 0.00 5.90 -0.08 -1.25 -4.94 116.55 112.87 3dyp n ASP 164 Ca -0.02 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.30 3dyp n ASP 164 Cb 0.64 -0.98 0.21 0.00 2.34 0.00 0.00 41.12 43.33 3dyp n ASP 164 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 3dyp n SER 165 N 0.00 0.00 -0.03 1.67 7.64 -1.26 -3.51 113.62 118.13 3dyp n SER 165 Ca 0.00 0.31 0.04 0.00 1.01 0.00 0.00 58.87 60.23 3dyp n SER 165 Cb 0.00 -0.38 0.06 0.00 -1.01 0.00 0.00 64.21 62.88 3dyp n SER 165 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3dyp n ARG 166 N -1.38 2.21 -4.16 1.43 5.12 -1.26 -3.72 116.66 114.89 3dyp n ARG 166 Ca 0.03 -1.93 -0.15 0.00 -1.93 0.00 0.00 57.85 53.87 3dyp n ARG 166 Cb 0.08 -1.20 -0.11 0.00 -1.16 0.00 0.00 32.46 30.08 3dyp n ARG 166 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3dyp s LEU 167 N -1.76 2.36 0.32 0.55 1.43 -1.23 -4.44 118.68 115.91 3dyp s LEU 167 Ca 0.13 -0.74 -0.29 0.00 -1.03 0.00 0.00 54.13 52.21 3dyp s LEU 167 Cb 0.12 -0.32 -0.10 0.00 0.03 0.00 0.00 46.19 45.91 3dyp s LEU 167 CO 0.01 -0.22 1.31 -2.16 0.23 0.00 0.00 176.35 175.52 3dyp s PRO 168 N -2.43 4.36 -0.21 1.29 0.04 -1.23 -4.50 135.00 132.33 3dyp s PRO 168 Ca 0.02 2.20 -0.03 0.00 0.04 0.00 0.00 61.00 63.23 3dyp s PRO 168 Cb -0.05 -3.08 -0.00 0.00 0.04 0.00 0.00 34.50 31.40 3dyp s PRO 168 CO 0.00 -0.19 -0.07 -1.12 0.04 0.00 0.00 177.00 175.66 3dyp s SER 169 N -0.43 4.09 -0.00 6.66 0.01 -0.39 -4.96 113.70 118.68 3dyp s SER 169 Ca 0.49 -0.43 0.07 0.00 1.31 0.00 0.00 55.95 57.40 3dyp s SER 169 Cb -0.39 -1.69 -0.02 0.00 0.21 0.00 0.00 66.02 64.12 3dyp s SER 169 CO 0.52 -0.00 -0.23 -1.61 0.41 0.00 0.00 173.24 172.32 3dyp s GLU 170 N 1.36 2.11 0.01 12.44 2.02 -1.26 -1.30 118.70 134.09 3dyp s GLU 170 Ca 0.04 -0.93 0.03 0.00 0.02 0.00 0.00 54.97 54.13 3dyp s GLU 170 Cb -0.14 -2.11 -0.01 0.00 0.10 0.00 0.00 34.13 31.97 3dyp s GLU 170 CO -0.04 0.56 -0.09 -0.06 0.02 0.00 0.00 175.26 175.65 3dyp s PHE 171 N -0.71 0.75 -0.31 1.61 0.40 -0.76 -0.12 117.98 118.84 3dyp s PHE 171 Ca 0.11 -0.26 -0.29 0.00 -0.60 0.00 0.00 56.93 55.90 3dyp s PHE 171 Cb -0.10 -0.46 0.01 0.00 0.51 0.00 0.00 43.02 42.97 3dyp s PHE 171 CO 0.01 -0.02 1.26 0.34 0.70 0.00 0.00 175.22 177.51 3dyp s ASP 172 N -0.70 6.70 0.00 1.36 -1.08 -1.26 -0.46 116.67 121.23 3dyp s ASP 172 Ca -0.01 1.14 0.18 0.00 -0.52 0.00 0.00 52.55 53.35 3dyp s ASP 172 Cb -0.05 -2.54 0.45 0.00 -1.46 0.00 0.00 42.92 39.31 3dyp s ASP 172 CO 0.00 -1.06 1.37 0.18 0.52 0.00 0.00 175.17 176.17 3dyp n LEU 173 N 7.54 3.38 -0.29 -1.34 4.77 0.18 -4.65 117.00 126.59 3dyp n LEU 173 Ca 0.14 -1.80 0.12 0.00 -0.03 0.00 0.00 56.01 54.44 3dyp n LEU 173 Cb 0.47 -0.31 0.27 0.00 -2.33 0.00 0.00 43.42 41.51 3dyp n LEU 173 CO 0.63 0.80 0.92 0.28 -1.33 0.00 0.00 177.39 178.70 3dyp h SER 174 N 3.51 -0.06 -0.12 -1.43 0.02 -1.77 0.24 113.55 113.94 3dyp h SER 174 Ca 0.00 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 3dyp h SER 174 Cb 0.87 0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.69 3dyp h SER 174 CO 0.00 -0.16 0.00 0.00 -1.14 0.00 0.00 176.83 175.53 3dyp n ALA 175 N -2.75 2.54 0.25 3.77 0.00 -1.26 -3.95 120.51 119.11 3dyp n ALA 175 Ca 0.20 -0.46 0.04 0.00 0.00 0.00 0.00 53.44 53.22 3dyp n ALA 175 Cb 0.65 -1.13 -0.06 0.00 0.00 0.00 0.00 19.45 18.91 3dyp n ALA 175 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3dyp n PHE 176 N 0.15 0.00 -3.28 0.00 3.01 0.82 -5.03 117.46 113.13 3dyp n PHE 176 Ca 0.17 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.44 3dyp n PHE 176 Cb 0.30 -0.08 -0.00 0.00 -0.01 0.00 0.00 39.48 39.69 3dyp n PHE 176 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3dyp s LEU 177 N -2.89 3.67 0.06 4.37 1.43 -1.00 -4.70 118.68 119.62 3dyp s LEU 177 Ca 0.01 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.67 3dyp s LEU 177 Cb 0.06 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.72 3dyp s LEU 177 CO 0.37 -0.64 -0.04 0.00 0.23 0.00 0.00 176.35 176.27 3dyp s ARG 178 N -4.24 0.63 0.45 1.70 1.70 -1.26 -5.04 118.95 112.89 3dyp s ARG 178 Ca 0.50 -1.15 -0.25 0.00 -0.47 0.00 0.00 55.73 54.36 3dyp s ARG 178 Cb -0.08 0.05 -0.08 0.00 -0.57 0.00 0.00 34.95 34.27 3dyp s ARG 178 CO 0.31 -0.07 1.42 0.00 -1.08 0.00 0.00 175.30 175.88 3dyp s ALA 179 N -3.38 3.22 0.00 7.88 0.00 -1.26 -4.55 121.76 123.67 3dyp s ALA 179 Ca 0.05 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.46 3dyp s ALA 179 Cb 0.04 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.57 3dyp s ALA 179 CO -0.07 -1.19 0.00 0.41 0.00 0.00 0.00 175.76 174.92 3dyp n GLY 180 N 0.59 0.50 3.74 0.00 0.00 -0.43 -4.90 105.19 104.68 3dyp n GLY 180 Ca 0.05 -1.33 -0.41 0.00 0.00 0.00 0.00 46.02 44.33 3dyp n GLY 180 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dyp s GLU 181 N 0.00 4.39 0.05 1.61 0.41 -1.26 -0.15 118.70 123.74 3dyp s GLU 181 Ca 0.00 2.08 0.00 0.00 -0.41 0.00 0.00 54.97 56.64 3dyp s GLU 181 Cb 0.00 -3.18 -0.03 0.00 -1.78 0.00 0.00 34.13 29.14 3dyp s GLU 181 CO 0.00 -0.24 -0.04 -0.80 -0.49 0.00 0.00 175.26 173.69 3dyp s ASN 182 N 0.21 0.60 -0.07 -0.19 0.01 0.43 -4.83 114.94 111.09 3dyp s ASN 182 Ca 0.56 -0.77 0.01 0.00 -0.71 0.00 0.00 52.86 51.95 3dyp s ASN 182 Cb -0.37 0.12 0.02 0.00 0.41 0.00 0.00 41.25 41.43 3dyp s ASN 182 CO 0.40 -0.42 -0.10 -0.60 -1.51 0.00 0.00 177.10 174.87 3dyp s ARG 183 N -2.77 1.54 0.09 -0.60 3.52 -1.26 0.12 118.95 119.60 3dyp s ARG 183 Ca -0.02 -0.33 -0.01 0.00 -0.13 0.00 0.00 55.73 55.24 3dyp s ARG 183 Cb -0.01 -1.37 -0.04 0.00 -1.56 0.00 0.00 34.95 31.97 3dyp s ARG 183 CO -0.05 -0.05 0.26 -0.51 -0.81 0.00 0.00 175.30 174.14 3dyp s LEU 184 N 0.93 4.33 -0.04 -0.88 1.43 -0.04 -0.22 118.68 124.20 3dyp s LEU 184 Ca -0.10 0.34 -0.00 0.00 -1.03 0.00 0.00 54.13 53.34 3dyp s LEU 184 Cb -0.15 -3.05 0.03 0.00 0.03 0.00 0.00 46.19 43.05 3dyp s LEU 184 CO 0.01 0.13 0.00 0.00 0.23 0.00 0.00 176.35 176.71 3dyp s ALA 185 N -1.57 0.40 -0.13 4.21 0.00 -0.33 -2.48 121.76 121.86 3dyp s ALA 185 Ca 0.36 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.43 3dyp s ALA 185 Cb -0.13 -0.43 0.02 0.00 0.00 0.00 0.00 23.12 22.59 3dyp s ALA 185 CO 0.27 -0.17 -0.13 0.08 0.00 0.00 0.00 175.76 175.81 3dyp s VAL 186 N 1.29 1.43 -0.36 0.00 1.01 0.13 -0.53 120.40 123.36 3dyp s VAL 186 Ca -0.06 -0.55 -0.12 0.00 0.00 0.00 0.00 61.98 61.25 3dyp s VAL 186 Cb -0.13 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 34.90 3dyp s VAL 186 CO -0.02 0.43 0.22 -0.32 0.00 0.00 0.00 175.10 175.42 3dyp s MET 187 N 1.48 3.16 -0.22 2.72 1.75 -0.32 -0.24 119.30 127.63 3dyp s MET 187 Ca 0.04 -0.87 -0.07 0.00 -1.25 0.00 0.00 55.69 53.54 3dyp s MET 187 Cb -0.13 -3.77 -0.03 0.00 2.84 0.00 0.00 34.83 33.74 3dyp s MET 187 CO -0.09 -0.58 0.06 0.08 -0.65 0.00 0.00 175.02 173.84 3dyp s VAL 188 N 1.64 4.48 -0.09 10.11 1.01 0.44 -2.03 120.40 135.96 3dyp s VAL 188 Ca 0.04 -0.13 -0.17 0.00 0.00 0.00 0.00 61.98 61.73 3dyp s VAL 188 Cb -0.18 -3.06 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 3dyp s VAL 188 CO 0.08 0.39 0.44 -0.76 0.00 0.00 0.00 175.10 175.25 3dyp s LEU 189 N 1.08 4.33 0.06 3.92 1.43 -0.25 -0.39 118.68 128.85 3dyp s LEU 189 Ca 0.04 0.82 -0.18 0.00 -1.03 0.00 0.00 54.13 53.78 3dyp s LEU 189 Cb -0.14 -2.63 -0.13 0.00 0.03 0.00 0.00 46.19 43.32 3dyp s LEU 189 CO 0.03 0.10 1.35 -0.09 0.23 0.00 0.00 176.35 177.97 3dyp h ARG 190 N 6.17 0.47 -6.64 1.70 2.43 -1.38 -0.19 114.38 116.94 3dyp h ARG 190 Ca -0.44 -0.26 -0.68 0.00 -0.81 0.00 0.00 59.98 57.78 3dyp h ARG 190 Cb 1.19 0.02 -0.22 0.00 -0.42 0.00 0.00 29.97 30.54 3dyp h ARG 190 CO 0.72 0.84 -0.82 -1.58 -1.51 0.00 0.00 179.97 177.63 3dyp s TRP 191 N -4.25 2.52 0.33 2.20 0.52 -1.26 -3.89 118.94 115.10 3dyp s TRP 191 Ca -0.13 -0.28 -0.17 0.00 0.02 0.00 0.00 56.10 55.53 3dyp s TRP 191 Cb 0.06 -1.42 0.04 0.00 -1.15 0.00 0.00 33.47 31.00 3dyp s TRP 191 CO 0.78 0.27 0.74 -1.54 0.02 0.00 0.00 176.95 177.23 3dyp s SER 192 N -1.61 -0.08 0.61 2.95 1.04 -1.26 -4.91 113.70 110.43 3dyp s SER 192 Ca 0.15 -0.92 0.37 0.00 0.48 0.00 0.00 55.95 56.03 3dyp s SER 192 Cb -0.10 0.79 1.97 0.00 0.10 0.00 0.00 66.02 68.77 3dyp s SER 192 CO 0.06 -1.51 2.24 -2.24 0.98 0.00 0.00 173.24 172.77 3dyp h ASP 193 N 2.01 0.00 0.35 7.02 3.04 -1.15 0.38 116.42 128.07 3dyp h ASP 193 Ca -0.26 0.00 -0.03 0.00 -3.24 0.00 0.00 57.03 53.50 3dyp h ASP 193 Cb 1.25 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.54 3dyp h ASP 193 CO 0.33 0.02 -0.12 1.23 -2.04 0.00 0.00 179.24 178.66 3dyp h GLY 194 N 0.43 0.00 2.00 7.15 0.00 -1.90 -1.98 103.07 108.76 3dyp h GLY 194 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3dyp h GLY 194 CO 0.00 0.00 -0.08 1.76 0.00 0.00 0.00 176.54 178.23 3dyp h SER 195 N 0.00 0.00 0.48 0.19 0.02 -0.59 0.34 113.55 113.99 3dyp h SER 195 Ca -0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 3dyp h SER 195 Cb 0.33 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 3dyp h SER 195 CO 0.02 0.08 -0.08 1.88 -1.14 0.00 0.00 176.83 177.58 3dyp h TYR 196 N 0.00 0.00 -0.39 3.45 -1.99 -1.47 -1.77 116.97 114.79 3dyp h TYR 196 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3dyp h TYR 196 Cb 0.19 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.92 3dyp h TYR 196 CO 0.00 0.08 0.00 1.28 -0.00 0.00 0.00 178.16 179.52 3dyp n LEU 197 N -3.41 3.29 -2.48 3.88 4.77 0.09 -4.47 117.00 118.67 3dyp n LEU 197 Ca -0.01 -1.43 -0.22 0.00 -0.03 0.00 0.00 56.01 54.31 3dyp n LEU 197 Cb 0.24 -0.25 0.01 0.00 -2.33 0.00 0.00 43.42 41.08 3dyp n LEU 197 CO 0.28 0.72 0.12 -0.62 -1.33 0.00 0.00 177.39 176.55 3dyp n GLU 198 N 1.37 2.91 -0.91 3.23 1.02 -0.66 -0.61 120.64 126.99 3dyp n GLU 198 Ca 0.19 -4.18 -0.19 0.00 -0.02 0.00 0.00 57.16 52.97 3dyp n GLU 198 Cb 0.57 -2.02 0.09 0.00 -0.02 0.00 0.00 31.44 30.06 3dyp n GLU 198 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3dyp n ASP 199 N -0.42 5.06 -4.76 1.62 2.03 -0.49 -4.98 116.55 114.61 3dyp n ASP 199 Ca 0.32 -3.17 -0.35 0.00 0.52 0.00 0.00 54.79 52.11 3dyp n ASP 199 Cb 0.73 -0.86 0.04 0.00 -0.72 0.00 0.00 41.12 40.31 3dyp n ASP 199 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3dyp s GLN 200 N -2.32 2.84 -1.13 -0.67 1.11 -1.26 -4.56 119.66 113.67 3dyp s GLN 200 Ca 0.40 1.66 -0.22 0.00 0.01 0.00 0.00 55.36 57.20 3dyp s GLN 200 Cb 0.32 -1.93 -0.02 0.00 -1.01 0.00 0.00 33.01 30.37 3dyp s GLN 200 CO 0.04 -1.27 1.81 0.34 0.01 0.00 0.00 175.29 176.22 3dyp s ASP 201 N -1.97 5.74 0.15 5.90 2.15 -1.26 -4.83 116.67 122.56 3dyp s ASP 201 Ca 0.73 -1.63 -0.25 0.00 0.43 0.00 0.00 52.55 51.84 3dyp s ASP 201 Cb -0.26 -2.58 0.07 0.00 -0.30 0.00 0.00 42.92 39.85 3dyp s ASP 201 CO 0.36 -2.28 0.97 0.00 -0.17 0.00 0.00 175.17 174.06 3dyp s MET 202 N 5.78 1.18 0.45 4.34 0.23 -1.26 -5.02 119.30 125.01 3dyp s MET 202 Ca 0.62 -0.66 -0.25 0.00 -1.03 0.00 0.00 55.69 54.37 3dyp s MET 202 Cb -0.01 0.40 -0.08 0.00 -1.53 0.00 0.00 34.83 33.61 3dyp s MET 202 CO 0.05 -0.54 1.42 -1.58 -2.03 0.00 0.00 175.02 172.34 3dyp s TRP 203 N -3.21 2.47 -0.42 3.16 0.52 -1.26 -4.29 118.94 115.91 3dyp s TRP 203 Ca 0.13 1.27 -0.15 0.00 0.02 0.00 0.00 56.10 57.37 3dyp s TRP 203 Cb -0.01 -3.91 0.03 0.00 -1.15 0.00 0.00 33.47 28.43 3dyp s TRP 203 CO 0.02 -2.90 0.32 1.03 0.02 0.00 0.00 176.95 175.44 3dyp s ARG 204 N -2.45 2.96 0.00 4.98 1.81 0.96 -4.93 118.95 122.28 3dyp s ARG 204 Ca 0.61 -1.09 0.00 0.00 -1.72 0.00 0.00 55.73 53.53 3dyp s ARG 204 Cb -0.43 -4.00 0.00 0.00 -0.45 0.00 0.00 34.95 30.07 3dyp s ARG 204 CO 0.56 -0.80 0.00 -1.33 -0.68 0.00 0.00 175.30 173.04 3dyp n MET 205 N 5.16 1.62 -3.74 3.54 2.81 -1.26 -2.55 117.12 122.70 3dyp n MET 205 Ca -0.11 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.74 3dyp n MET 205 Cb 0.46 0.00 -0.01 0.00 -0.71 0.00 0.00 33.22 32.96 3dyp n MET 205 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3dyp s SER 206 N -0.95 -0.19 0.00 7.83 1.04 -1.26 -4.80 113.70 115.37 3dyp s SER 206 Ca 0.00 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.05 3dyp s SER 206 Cb 0.00 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.60 3dyp s SER 206 CO 0.00 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 173.94 3dyp n GLY 207 N -0.46 0.85 3.41 7.32 0.00 -0.29 -1.93 105.19 114.09 3dyp n GLY 207 Ca -0.06 -2.14 -0.45 0.00 0.00 0.00 0.00 46.02 43.37 3dyp n GLY 207 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dyp s ILE 208 N -0.99 5.26 -2.59 -0.61 1.01 -1.20 -0.68 121.20 121.40 3dyp s ILE 208 Ca 0.00 -2.47 0.22 0.00 0.00 0.00 0.00 60.65 58.41 3dyp s ILE 208 Cb 0.00 -4.73 0.12 0.00 0.01 0.00 0.00 42.46 37.87 3dyp s ILE 208 CO 0.00 -1.39 1.17 2.22 0.00 0.00 0.00 174.94 176.95 3dyp n PHE 209 N 4.98 0.00 -4.57 3.97 1.16 -0.64 -0.64 117.46 121.73 3dyp n PHE 209 Ca 0.26 0.00 -0.26 0.00 -1.87 0.00 0.00 57.45 55.58 3dyp n PHE 209 Cb 0.45 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.21 3dyp n PHE 209 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 3dyp s ARG 210 N -2.05 1.88 0.71 3.97 0.52 -1.08 -4.35 118.95 118.55 3dyp s ARG 210 Ca 0.24 -2.08 -0.16 0.00 -0.52 0.00 0.00 55.73 53.21 3dyp s ARG 210 Cb 0.19 -1.27 0.00 0.00 0.52 0.00 0.00 34.95 34.39 3dyp s ARG 210 CO 0.36 -0.17 0.99 -0.25 0.02 0.00 0.00 175.30 176.25 3dyp n ASP 211 N -0.93 0.61 -4.17 0.23 8.00 -1.26 -4.43 116.55 114.60 3dyp n ASP 211 Ca -0.06 0.69 -0.28 0.00 0.71 0.00 0.00 54.79 55.85 3dyp n ASP 211 Cb 0.67 -1.42 -0.16 0.00 -0.02 0.00 0.00 41.12 40.19 3dyp n ASP 211 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3dyp s VAL 212 N -1.77 1.61 0.22 2.53 1.01 -1.26 -0.24 120.40 122.50 3dyp s VAL 212 Ca 0.74 -0.81 -0.08 0.00 0.00 0.00 0.00 61.98 61.83 3dyp s VAL 212 Cb -0.35 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 3dyp s VAL 212 CO 0.49 0.46 0.33 -0.94 0.00 0.00 0.00 175.10 175.44 3dyp s SER 213 N 0.02 0.01 -0.06 3.32 1.04 -0.10 -0.50 113.70 117.42 3dyp s SER 213 Ca -0.05 -1.10 0.03 0.00 0.48 0.00 0.00 55.95 55.31 3dyp s SER 213 Cb -0.12 0.50 0.01 0.00 0.10 0.00 0.00 66.02 66.50 3dyp s SER 213 CO 0.03 -1.01 -0.15 -0.22 0.98 0.00 0.00 173.24 172.87 3dyp s LEU 214 N -3.07 1.78 -0.09 2.42 2.96 0.82 -0.41 118.68 123.09 3dyp s LEU 214 Ca 0.28 -0.34 0.03 0.00 -0.22 0.00 0.00 54.13 53.88 3dyp s LEU 214 Cb 0.03 -0.93 0.01 0.00 0.50 0.00 0.00 46.19 45.79 3dyp s LEU 214 CO 0.10 0.08 -0.18 -0.22 -1.32 0.00 0.00 176.35 174.81 3dyp s LEU 215 N 0.45 1.85 -0.19 -0.68 2.96 -0.44 -0.54 118.68 122.09 3dyp s LEU 215 Ca -0.12 -0.43 -0.09 0.00 -0.22 0.00 0.00 54.13 53.27 3dyp s LEU 215 Cb -0.15 -1.11 -0.05 0.00 0.50 0.00 0.00 46.19 45.39 3dyp s LEU 215 CO 0.04 0.08 0.10 -2.28 -1.32 0.00 0.00 176.35 172.97 3dyp s HIS 216 N 0.57 3.34 0.11 5.38 5.65 -0.14 -1.37 115.29 128.83 3dyp s HIS 216 Ca -0.15 0.21 0.08 0.00 0.25 0.00 0.00 55.06 55.45 3dyp s HIS 216 Cb -0.17 -2.12 -0.04 0.00 -1.18 0.00 0.00 32.58 29.08 3dyp s HIS 216 CO 0.05 0.23 -0.20 0.15 -0.65 0.00 0.00 174.74 174.32 3dyp s LYS 217 N 0.36 1.13 0.79 2.88 -0.14 0.85 -4.72 119.74 120.90 3dyp s LYS 217 Ca 0.06 -1.20 -0.11 0.00 -1.36 0.00 0.00 55.97 53.35 3dyp s LYS 217 Cb -0.12 -1.33 0.07 0.00 -1.68 0.00 0.00 37.83 34.77 3dyp s LYS 217 CO -0.01 0.30 1.09 -2.14 -0.76 0.00 0.00 175.35 173.83 3dyp s PRO 218 N -2.09 2.14 0.19 -1.68 0.02 -1.26 0.06 135.00 132.37 3dyp s PRO 218 Ca 0.08 0.72 -0.12 0.00 0.02 0.00 0.00 61.00 61.70 3dyp s PRO 218 Cb -0.09 -1.92 0.12 0.00 0.02 0.00 0.00 34.50 32.63 3dyp s PRO 218 CO 0.05 -1.60 1.83 1.15 -0.33 0.00 0.00 177.00 178.09 3dyp h THR 219 N -1.08 1.19 -3.56 0.99 2.02 -1.92 -3.36 112.91 107.19 3dyp h THR 219 Ca -0.47 -0.44 -0.61 0.00 0.77 0.00 0.00 66.41 65.66 3dyp h THR 219 Cb 1.26 0.28 -0.12 0.00 -1.74 0.00 0.00 68.15 67.83 3dyp h THR 219 CO 0.58 0.20 -0.06 -0.89 0.37 0.00 0.00 175.52 175.72 3dyp s THR 220 N -5.97 5.10 0.18 3.16 2.01 -1.26 -3.88 115.64 114.99 3dyp s THR 220 Ca -0.13 0.85 -0.15 0.00 0.31 0.00 0.00 61.69 62.56 3dyp s THR 220 Cb 0.14 -3.81 0.02 0.00 0.01 0.00 0.00 72.50 68.86 3dyp s THR 220 CO 0.78 0.13 0.46 0.00 -0.69 0.00 0.00 174.62 175.30 3dyp s GLN 221 N 2.05 1.31 -0.26 4.92 -2.07 -0.27 -4.90 119.66 120.44 3dyp s GLN 221 Ca 0.21 -0.93 -0.29 0.00 -1.82 0.00 0.00 55.36 52.53 3dyp s GLN 221 Cb -0.15 0.48 0.00 0.00 -1.09 0.00 0.00 33.01 32.25 3dyp s GLN 221 CO 0.09 -0.54 1.22 0.42 -1.32 0.00 0.00 175.29 175.16 3dyp s ILE 222 N -3.89 4.30 -0.39 3.63 1.01 -1.26 -0.94 121.20 123.65 3dyp s ILE 222 Ca 0.11 1.52 0.20 0.00 0.00 0.00 0.00 60.65 62.48 3dyp s ILE 222 Cb 0.00 -4.18 -0.27 0.00 0.01 0.00 0.00 42.46 38.02 3dyp s ILE 222 CO -0.03 -0.36 0.60 -1.54 0.00 0.00 0.00 174.94 173.62 3dyp n SER 223 N 7.07 0.61 -3.54 3.58 3.41 0.11 -4.90 113.62 119.96 3dyp n SER 223 Ca 0.14 -0.39 -0.08 0.00 -0.26 0.00 0.00 58.87 58.28 3dyp n SER 223 Cb 0.46 1.55 -0.03 0.00 -0.26 0.00 0.00 64.21 65.93 3dyp n SER 223 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dyp s ASP 224 N -3.72 -0.30 -0.26 4.04 -1.08 -1.16 -4.88 116.67 109.31 3dyp s ASP 224 Ca -0.01 0.07 -0.23 0.00 -0.52 0.00 0.00 52.55 51.86 3dyp s ASP 224 Cb 0.14 0.30 0.07 0.00 -1.46 0.00 0.00 42.92 41.96 3dyp s ASP 224 CO 0.82 -0.46 0.68 0.72 0.52 0.00 0.00 175.17 177.45 3dyp s PHE 225 N -2.55 -0.79 -0.03 -5.34 -0.12 -1.26 -0.87 117.98 107.02 3dyp s PHE 225 Ca 0.05 1.86 0.04 0.00 -0.05 0.00 0.00 56.93 58.83 3dyp s PHE 225 Cb -0.01 0.30 -0.01 0.00 -0.63 0.00 0.00 43.02 42.68 3dyp s PHE 225 CO -0.06 -0.38 -0.16 -1.01 -0.05 0.00 0.00 175.22 173.56 3dyp s HIS 226 N 0.54 1.51 -0.13 3.49 3.76 -0.11 -4.83 115.29 119.52 3dyp s HIS 226 Ca -0.01 -0.37 0.01 0.00 -0.15 0.00 0.00 55.06 54.53 3dyp s HIS 226 Cb -0.05 -1.01 -0.01 0.00 1.11 0.00 0.00 32.58 32.63 3dyp s HIS 226 CO -0.02 -0.10 -0.15 0.08 -0.85 0.00 0.00 174.74 173.69 3dyp s VAL 227 N -0.09 2.82 0.12 -0.90 1.01 -1.26 -1.17 120.40 120.92 3dyp s VAL 227 Ca 0.00 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 61.32 3dyp s VAL 227 Cb -0.09 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 3dyp s VAL 227 CO 0.01 0.53 -0.20 0.00 0.00 0.00 0.00 175.10 175.44 3dyp s ALA 228 N 0.38 1.83 -0.09 5.51 0.00 0.14 -4.84 121.76 124.69 3dyp s ALA 228 Ca -0.12 -1.30 0.01 0.00 0.00 0.00 0.00 51.96 50.55 3dyp s ALA 228 Cb -0.16 -0.22 0.02 0.00 0.00 0.00 0.00 23.12 22.75 3dyp s ALA 228 CO 0.06 0.32 -0.09 0.95 0.00 0.00 0.00 175.76 177.01 3dyp s THR 229 N -1.39 1.00 0.11 0.00 -4.23 -1.26 -1.29 115.64 108.59 3dyp s THR 229 Ca 0.08 -0.33 0.10 0.00 -1.18 0.00 0.00 61.69 60.37 3dyp s THR 229 Cb -0.09 -0.99 -0.04 0.00 1.34 0.00 0.00 72.50 72.73 3dyp s THR 229 CO 0.05 0.35 -0.25 0.00 -0.54 0.00 0.00 174.62 174.22 3dyp s ARG 230 N 1.29 1.35 0.26 3.99 1.70 -0.49 -4.84 118.95 122.21 3dyp s ARG 230 Ca -0.03 -1.27 0.06 0.00 -0.47 0.00 0.00 55.73 54.02 3dyp s ARG 230 Cb -0.14 -1.75 -0.06 0.00 -0.57 0.00 0.00 34.95 32.44 3dyp s ARG 230 CO -0.03 0.42 -0.05 -0.06 -1.08 0.00 0.00 175.30 174.49 3dyp s PHE 231 N -1.06 1.85 0.85 5.89 0.40 -1.26 -0.99 117.98 123.65 3dyp s PHE 231 Ca 0.11 -0.75 -0.09 0.00 -0.60 0.00 0.00 56.93 55.61 3dyp s PHE 231 Cb -0.10 -1.05 0.16 0.00 0.51 0.00 0.00 43.02 42.54 3dyp s PHE 231 CO 0.05 0.21 1.17 0.54 0.70 0.00 0.00 175.22 177.89 3dyp s ASN 232 N -3.41 3.72 0.37 1.36 4.22 -0.83 -4.94 114.94 115.43 3dyp s ASN 232 Ca 0.29 -0.01 0.06 0.00 -2.14 0.00 0.00 52.86 51.06 3dyp s ASN 232 Cb 0.04 -0.20 0.74 0.00 1.28 0.00 0.00 41.25 43.11 3dyp s ASN 232 CO 0.11 -2.31 1.98 -2.24 -2.04 0.00 0.00 177.10 172.59 3dyp h ASP 233 N -1.11 0.65 -0.50 3.54 3.04 -2.01 -2.26 116.42 117.77 3dyp h ASP 233 Ca -0.41 -0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.38 3dyp h ASP 233 Cb 1.25 -0.14 0.00 0.00 -1.04 0.00 0.00 39.33 39.40 3dyp h ASP 233 CO 0.40 0.43 0.00 -0.90 -2.04 0.00 0.00 179.24 177.13 3dyp n ASP 234 N -4.47 3.37 -1.00 4.15 5.75 -1.26 -4.95 116.55 118.13 3dyp n ASP 234 Ca 0.09 -2.02 -0.12 0.00 -0.01 0.00 0.00 54.79 52.72 3dyp n ASP 234 Cb 0.19 -0.34 -0.05 0.00 -1.03 0.00 0.00 41.12 39.89 3dyp n ASP 234 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 3dyp n PHE 235 N 0.93 -0.07 1.08 2.11 3.01 -0.85 -4.88 117.46 118.79 3dyp n PHE 235 Ca 0.17 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.75 3dyp n PHE 235 Cb 0.52 -2.33 0.29 0.00 -0.01 0.00 0.00 39.48 37.95 3dyp n PHE 235 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3dyp n SER 236 N -0.04 0.68 -3.86 4.37 3.41 -1.26 -4.60 113.62 112.32 3dyp n SER 236 Ca -0.13 -0.48 -0.12 0.00 -0.26 0.00 0.00 58.87 57.89 3dyp n SER 236 Cb 0.43 0.22 -0.13 0.00 -0.26 0.00 0.00 64.21 64.48 3dyp n SER 236 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dyp s ARG 237 N -2.83 0.13 0.13 4.33 0.52 -1.26 0.37 118.95 120.34 3dyp s ARG 237 Ca 0.15 0.02 0.02 0.00 -0.52 0.00 0.00 55.73 55.40 3dyp s ARG 237 Cb 0.18 0.06 -0.04 0.00 0.52 0.00 0.00 34.95 35.67 3dyp s ARG 237 CO 0.64 -0.02 -0.03 0.00 0.02 0.00 0.00 175.30 175.91 3dyp s ALA 238 N -0.17 1.13 -0.10 2.13 0.00 -0.36 -1.96 121.76 122.42 3dyp s ALA 238 Ca -0.02 -1.46 0.02 0.00 0.00 0.00 0.00 51.96 50.50 3dyp s ALA 238 Cb -0.02 0.36 0.01 0.00 0.00 0.00 0.00 23.12 23.47 3dyp s ALA 238 CO 0.00 -0.28 -0.15 0.08 0.00 0.00 0.00 175.76 175.41 3dyp s VAL 239 N -3.66 1.46 -0.24 0.00 1.01 -0.16 -0.21 120.40 118.59 3dyp s VAL 239 Ca 0.18 -0.63 -0.17 0.00 0.00 0.00 0.00 61.98 61.36 3dyp s VAL 239 Cb 0.06 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.07 3dyp s VAL 239 CO -0.01 0.43 0.45 -0.22 0.00 0.00 0.00 175.10 175.76 3dyp s LEU 240 N 0.93 4.09 -0.18 3.92 0.20 0.26 -1.39 118.68 126.50 3dyp s LEU 240 Ca -0.08 0.48 -0.02 0.00 0.69 0.00 0.00 54.13 55.21 3dyp s LEU 240 Cb -0.15 -2.57 -0.00 0.00 -0.43 0.00 0.00 46.19 43.03 3dyp s LEU 240 CO -0.00 -0.20 -0.10 -0.70 -0.29 0.00 0.00 176.35 175.05 3dyp s GLU 241 N 1.92 3.30 -0.23 1.98 2.12 -0.41 -0.13 118.70 127.25 3dyp s GLU 241 Ca 0.20 -0.69 0.01 0.00 0.36 0.00 0.00 54.97 54.85 3dyp s GLU 241 Cb -0.15 -2.79 0.05 0.00 0.26 0.00 0.00 34.13 31.50 3dyp s GLU 241 CO 0.09 -0.06 -0.09 0.00 -0.54 0.00 0.00 175.26 174.66 3dyp s ALA 242 N 1.07 2.15 -0.17 6.30 0.00 0.08 -0.68 121.76 130.50 3dyp s ALA 242 Ca -0.00 -1.42 -0.18 0.00 0.00 0.00 0.00 51.96 50.36 3dyp s ALA 242 Cb -0.15 -1.42 -0.03 0.00 0.00 0.00 0.00 23.12 21.52 3dyp s ALA 242 CO -0.02 -1.06 0.51 -2.00 0.00 0.00 0.00 175.76 173.19 3dyp s GLU 243 N 1.31 4.24 -0.08 0.00 2.12 -0.32 -0.95 118.70 125.03 3dyp s GLU 243 Ca -0.05 0.43 0.04 0.00 0.36 0.00 0.00 54.97 55.75 3dyp s GLU 243 Cb -0.18 -3.52 -0.00 0.00 0.26 0.00 0.00 34.13 30.68 3dyp s GLU 243 CO -0.07 -0.06 -0.22 0.08 -0.54 0.00 0.00 175.26 174.46 3dyp s VAL 244 N 1.33 1.88 0.04 3.70 1.01 0.12 -0.93 120.40 127.55 3dyp s VAL 244 Ca 0.25 -0.94 0.07 0.00 0.00 0.00 0.00 61.98 61.36 3dyp s VAL 244 Cb -0.15 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 3dyp s VAL 244 CO 0.10 0.52 -0.17 -1.10 0.00 0.00 0.00 175.10 174.45 3dyp s GLN 245 N 0.22 2.12 0.23 2.72 -0.21 -0.05 -1.01 119.66 123.67 3dyp s GLN 245 Ca -0.13 -0.96 0.10 0.00 0.02 0.00 0.00 55.36 54.39 3dyp s GLN 245 Cb -0.16 -2.22 -0.05 0.00 1.00 0.00 0.00 33.01 31.58 3dyp s GLN 245 CO 0.06 0.54 -0.18 0.00 -2.12 0.00 0.00 175.29 173.60 3dyp s MET 246 N -1.46 1.47 0.21 2.91 0.23 -0.67 0.05 119.30 122.05 3dyp s MET 246 Ca 0.15 -1.62 0.11 0.00 -1.03 0.00 0.00 55.69 53.30 3dyp s MET 246 Cb -0.11 -1.46 -0.05 0.00 -1.53 0.00 0.00 34.83 31.69 3dyp s MET 246 CO 0.06 0.27 -0.22 0.00 -2.03 0.00 0.00 175.02 173.10 3dyp n GLY 248 N 0.05 -0.78 3.66 0.00 0.00 -1.25 -1.11 105.19 105.75 3dyp n GLY 248 Ca -0.11 -2.18 -0.41 0.00 0.00 0.00 0.00 46.02 43.32 3dyp n GLY 248 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3dyp s GLU 249 N -0.02 4.23 0.18 1.61 2.12 -1.26 -5.00 118.70 120.57 3dyp s GLU 249 Ca 0.00 0.88 -0.30 0.00 0.36 0.00 0.00 54.97 55.91 3dyp s GLU 249 Cb 0.00 -3.60 -0.09 0.00 0.26 0.00 0.00 34.13 30.70 3dyp s GLU 249 CO 0.00 -0.38 1.38 -0.51 -0.54 0.00 0.00 175.26 175.21 3dyp s LEU 250 N 2.36 4.39 -0.01 2.70 1.43 -1.26 -5.01 118.68 123.29 3dyp s LEU 250 Ca 0.34 2.46 -0.02 0.00 -1.03 0.00 0.00 54.13 55.88 3dyp s LEU 250 Cb -0.16 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.45 3dyp s LEU 250 CO 0.10 -0.62 0.03 -0.13 0.23 0.00 0.00 176.35 175.96 3dyp s ARG 251 N 0.25 0.15 0.60 1.70 1.81 -1.26 -5.01 118.95 117.20 3dyp s ARG 251 Ca 0.60 -0.14 0.32 0.00 -1.72 0.00 0.00 55.73 54.79 3dyp s ARG 251 Cb -0.38 0.06 1.88 0.00 -0.45 0.00 0.00 34.95 36.06 3dyp s ARG 251 CO 0.37 -0.03 2.24 -0.44 -0.68 0.00 0.00 175.30 176.76 3dyp h ASP 252 N 5.58 0.00 0.32 0.23 3.32 -2.00 -1.08 116.42 122.78 3dyp h ASP 252 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3dyp h ASP 252 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 3dyp h ASP 252 CO 0.46 0.00 -0.02 0.00 -1.72 0.00 0.00 179.24 177.96 3dyp n TYR 253 N -3.70 0.00 -2.33 4.55 0.18 -1.26 -4.84 117.16 109.77 3dyp n TYR 253 Ca -0.02 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.42 3dyp n TYR 253 Cb 0.13 -0.16 -0.02 0.00 -0.38 0.00 0.00 39.34 38.92 3dyp n TYR 253 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3dyp s LEU 254 N -2.34 3.69 0.11 -3.48 1.43 -0.41 -0.44 118.68 117.25 3dyp s LEU 254 Ca 0.36 1.87 -0.09 0.00 -1.03 0.00 0.00 54.13 55.24 3dyp s LEU 254 Cb 0.21 -4.55 -0.00 0.00 0.03 0.00 0.00 46.19 41.88 3dyp s LEU 254 CO 0.43 -0.94 0.23 -0.13 0.23 0.00 0.00 176.35 176.17 3dyp s ARG 255 N -3.62 0.95 -0.06 1.70 1.81 0.31 -4.09 118.95 115.95 3dyp s ARG 255 Ca 0.66 -1.00 0.04 0.00 -1.72 0.00 0.00 55.73 53.71 3dyp s ARG 255 Cb -0.16 0.36 -0.00 0.00 -0.45 0.00 0.00 34.95 34.70 3dyp s ARG 255 CO 0.28 -0.32 -0.20 0.08 -0.68 0.00 0.00 175.30 174.45 3dyp s VAL 256 N -3.89 1.68 -0.13 3.52 1.01 0.58 -0.83 120.40 122.34 3dyp s VAL 256 Ca 0.08 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.25 3dyp s VAL 256 Cb 0.04 -1.45 -0.00 0.00 0.00 0.00 0.00 36.38 34.97 3dyp s VAL 256 CO -0.08 0.48 -0.20 -0.89 0.00 0.00 0.00 175.10 174.41 3dyp s THR 257 N 0.16 2.38 -0.16 3.92 2.01 0.48 -1.19 115.64 123.23 3dyp s THR 257 Ca -0.09 -0.89 0.00 0.00 0.31 0.00 0.00 61.69 61.02 3dyp s THR 257 Cb -0.14 -1.96 -0.00 0.00 0.01 0.00 0.00 72.50 70.41 3dyp s THR 257 CO 0.04 0.54 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.67 3dyp s VAL 258 N 0.55 2.65 0.09 3.82 1.01 -0.04 -0.35 120.40 128.13 3dyp s VAL 258 Ca -0.12 -0.77 0.09 0.00 0.00 0.00 0.00 61.98 61.18 3dyp s VAL 258 Cb -0.16 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 3dyp s VAL 258 CO 0.04 0.51 -0.23 -0.94 0.00 0.00 0.00 175.10 174.49 3dyp s SER 259 N 0.91 2.74 -0.06 3.32 1.04 -0.65 -1.10 113.70 119.89 3dyp s SER 259 Ca -0.04 -0.67 0.05 0.00 0.48 0.00 0.00 55.95 55.78 3dyp s SER 259 Cb -0.15 -0.18 -0.01 0.00 0.10 0.00 0.00 66.02 65.79 3dyp s SER 259 CO -0.02 0.12 -0.23 -0.22 0.98 0.00 0.00 173.24 173.87 3dyp s LEU 260 N -1.77 2.04 0.02 2.42 2.96 0.79 -1.37 118.68 123.77 3dyp s LEU 260 Ca 0.09 -0.49 0.07 0.00 -0.22 0.00 0.00 54.13 53.57 3dyp s LEU 260 Cb -0.10 -1.30 -0.02 0.00 0.50 0.00 0.00 46.19 45.27 3dyp s LEU 260 CO 0.04 0.21 -0.20 0.26 -1.32 0.00 0.00 176.35 175.35 3dyp s TRP 261 N -0.04 1.72 -0.34 5.38 0.52 -0.17 -0.75 118.94 125.26 3dyp s TRP 261 Ca -0.06 -0.35 0.02 0.00 0.02 0.00 0.00 56.10 55.72 3dyp s TRP 261 Cb -0.14 -1.06 0.09 0.00 -1.15 0.00 0.00 33.47 31.22 3dyp s TRP 261 CO 0.04 0.04 0.06 -1.14 0.02 0.00 0.00 176.95 175.98 3dyp s GLN 262 N -0.92 1.79 7.42 4.98 -0.44 0.13 -0.99 119.66 131.63 3dyp s GLN 262 Ca 0.07 -1.74 0.00 0.00 -2.50 0.00 0.00 55.36 51.19 3dyp s GLN 262 Cb -0.08 -3.25 0.00 0.00 -1.64 0.00 0.00 33.01 28.04 3dyp s GLN 262 CO 0.01 -0.89 0.00 0.41 0.50 0.00 0.00 175.29 175.32 3dyp n GLY 263 N 4.39 2.65 0.60 2.59 0.00 -1.26 -1.59 105.19 112.56 3dyp n GLY 263 Ca -0.02 -0.27 0.13 0.00 0.00 0.00 0.00 46.02 45.86 3dyp n GLY 263 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dyp n GLU 264 N 13.40 1.81 -3.64 1.61 -0.58 -1.26 -4.86 120.64 127.13 3dyp n GLU 264 Ca 0.00 -1.19 -0.36 0.00 -0.42 0.00 0.00 57.16 55.19 3dyp n GLU 264 Cb 0.00 -1.46 -0.07 0.00 -0.57 0.00 0.00 31.44 29.34 3dyp n GLU 264 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 3dyp s THR 265 N -1.92 5.34 -0.20 2.62 2.01 -0.62 -5.07 115.64 117.79 3dyp s THR 265 Ca 0.35 0.42 -0.21 0.00 0.31 0.00 0.00 61.69 62.57 3dyp s THR 265 Cb 0.20 -3.56 -0.03 0.00 0.01 0.00 0.00 72.50 69.13 3dyp s THR 265 CO 0.31 0.46 0.62 -1.58 -0.69 0.00 0.00 174.62 173.74 3dyp s GLN 266 N 0.08 4.20 -0.14 4.92 0.74 -1.26 0.22 119.66 128.42 3dyp s GLN 266 Ca 0.14 0.59 -0.04 0.00 0.05 0.00 0.00 55.36 56.10 3dyp s GLN 266 Cb -0.13 -3.58 -0.25 0.00 1.10 0.00 0.00 33.01 30.16 3dyp s GLN 266 CO 0.03 -0.24 0.27 0.28 -0.55 0.00 0.00 175.29 175.08 3dyp n VAL 267 N 4.71 1.73 -3.67 1.34 0.31 0.07 -4.94 118.33 117.88 3dyp n VAL 267 Ca -0.02 -0.65 -0.08 0.00 -0.01 0.00 0.00 64.34 63.59 3dyp n VAL 267 Cb 0.50 -1.65 -0.02 0.00 -0.91 0.00 0.00 33.84 31.76 3dyp n VAL 267 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3dyp s ALA 268 N -2.55 -1.50 -0.15 3.52 0.00 -1.11 -4.98 121.76 114.98 3dyp s ALA 268 Ca -0.24 0.19 -0.29 0.00 0.00 0.00 0.00 51.96 51.63 3dyp s ALA 268 Cb 0.07 0.75 0.09 0.00 0.00 0.00 0.00 23.12 24.03 3dyp s ALA 268 CO 0.74 -0.92 0.78 0.45 0.00 0.00 0.00 175.76 176.82 3dyp s SER 269 N -2.82 -0.61 -0.05 0.00 0.15 -1.26 -0.15 113.70 108.97 3dyp s SER 269 Ca 0.08 0.86 -0.13 0.00 0.70 0.00 0.00 55.95 57.45 3dyp s SER 269 Cb -0.03 0.76 0.02 0.00 -1.71 0.00 0.00 66.02 65.06 3dyp s SER 269 CO -0.02 -0.43 0.30 -0.83 1.20 0.00 0.00 173.24 173.47 3dyp s GLY 270 N -0.65 -0.17 0.03 9.45 0.00 -0.25 -4.98 107.32 110.75 3dyp s GLY 270 Ca -0.05 0.49 0.04 0.00 0.00 0.00 0.00 44.72 45.20 3dyp s GLY 270 CO 0.05 0.31 -0.13 -1.59 0.00 0.00 0.00 173.10 171.74 3dyp s THR 271 N -0.84 0.99 0.05 0.90 2.01 -1.26 -0.86 115.64 116.63 3dyp s THR 271 Ca -0.09 -0.86 -0.21 0.00 0.31 0.00 0.00 61.69 60.84 3dyp s THR 271 Cb -0.04 -0.89 0.05 0.00 0.01 0.00 0.00 72.50 71.62 3dyp s THR 271 CO 0.03 0.04 0.48 0.00 -0.69 0.00 0.00 174.62 174.47 3dyp s ALA 272 N -0.73 -1.20 0.65 7.40 0.00 -0.33 -4.99 121.76 122.57 3dyp s ALA 272 Ca 0.01 0.48 -0.09 0.00 0.00 0.00 0.00 51.96 52.37 3dyp s ALA 272 Cb -0.07 0.37 0.01 0.00 0.00 0.00 0.00 23.12 23.43 3dyp s ALA 272 CO 0.01 -0.49 1.00 -1.25 0.00 0.00 0.00 175.76 175.04 3dyp s PRO 273 N -2.46 2.87 0.71 0.00 0.04 -1.26 -0.31 135.00 134.60 3dyp s PRO 273 Ca -0.05 0.23 -0.11 0.00 0.04 0.00 0.00 61.00 61.11 3dyp s PRO 273 Cb -0.01 -2.14 0.02 0.00 0.04 0.00 0.00 34.50 32.41 3dyp s PRO 273 CO -0.02 -0.88 1.07 -0.06 0.04 0.00 0.00 177.00 177.15 3dyp s PHE 274 N -3.19 2.90 0.00 0.56 0.40 -1.26 -4.86 117.98 112.55 3dyp s PHE 274 Ca 0.56 1.48 0.00 0.00 -0.60 0.00 0.00 56.93 58.37 3dyp s PHE 274 Cb -0.11 -2.96 0.00 0.00 0.51 0.00 0.00 43.02 40.47 3dyp s PHE 274 CO 0.48 -1.43 0.00 0.41 0.70 0.00 0.00 175.22 175.38 3dyp n GLY 275 N -1.60 2.13 3.93 4.36 0.00 0.52 -4.96 105.19 109.58 3dyp n GLY 275 Ca 0.08 -0.34 -0.26 0.00 0.00 0.00 0.00 46.02 45.50 3dyp n GLY 275 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dyp s GLY 276 N 0.00 1.66 0.77 -0.02 0.00 0.44 -4.81 107.32 105.37 3dyp s GLY 276 Ca 0.00 -0.86 -0.14 0.00 0.00 0.00 0.00 44.72 43.72 3dyp s GLY 276 CO 0.00 -0.52 1.21 -1.83 0.00 0.00 0.00 173.10 171.95 3dyp s GLU 277 N -5.08 1.85 0.18 2.90 -1.05 -1.26 -4.36 118.70 111.88 3dyp s GLU 277 Ca 0.57 1.76 -0.33 0.00 -0.15 0.00 0.00 54.97 56.82 3dyp s GLU 277 Cb -0.11 -1.80 -0.13 0.00 -0.44 0.00 0.00 34.13 31.65 3dyp s GLU 277 CO 0.44 -2.05 1.62 -0.89 0.95 0.00 0.00 175.26 175.32 3dyp n ILE 278 N -3.05 0.08 -0.11 1.83 2.08 -1.26 -4.25 119.36 114.67 3dyp n ILE 278 Ca 0.13 -0.02 -0.16 0.00 0.56 0.00 0.00 62.75 63.27 3dyp n ILE 278 Cb 0.50 -1.69 -0.10 0.00 -0.75 0.00 0.00 39.64 37.60 3dyp n ILE 278 CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73 3dyp n ILE 279 N 3.48 1.28 -2.69 1.39 2.08 0.22 -4.87 119.36 120.25 3dyp n ILE 279 Ca 0.16 -0.49 0.00 0.00 0.56 0.00 0.00 62.75 62.98 3dyp n ILE 279 Cb 0.31 -1.30 0.00 0.00 -0.75 0.00 0.00 39.64 37.90 3dyp n ILE 279 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 3dyp n ASP 280 N -3.17 0.00 0.27 4.38 5.68 -0.45 -4.99 116.55 118.27 3dyp n ASP 280 Ca -0.40 -0.57 0.18 0.00 -0.50 0.00 0.00 54.79 53.50 3dyp n ASP 280 Cb 0.92 0.00 0.94 0.00 -1.14 0.00 0.00 41.12 41.84 3dyp n ASP 280 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3dyp h GLU 281 N 0.00 0.00 -0.01 0.11 3.07 -2.05 -0.60 114.58 115.10 3dyp h GLU 281 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3dyp h GLU 281 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3dyp h GLU 281 CO 0.00 0.00 -0.15 0.54 -1.40 0.00 0.00 179.01 178.00 3dyp n ARG 282 N -3.51 1.31 0.00 2.33 5.12 -1.26 -5.06 116.66 115.59 3dyp n ARG 282 Ca -0.01 -0.83 0.00 0.00 -1.93 0.00 0.00 57.85 55.09 3dyp n ARG 282 Cb 0.23 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.05 3dyp n ARG 282 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3dyp n GLY 283 N 1.28 0.24 0.60 -0.13 0.00 -0.23 -5.05 105.19 101.89 3dyp n GLY 283 Ca 0.15 -1.91 -0.05 0.00 0.00 0.00 0.00 46.02 44.21 3dyp n GLY 283 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 284 N 0.00 4.00 3.50 -0.02 0.00 -1.26 0.71 105.19 112.12 3dyp n GLY 284 Ca 0.00 -2.04 -0.43 0.00 0.00 0.00 0.00 46.02 43.55 3dyp n GLY 284 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dyp s TYR 285 N -1.66 2.98 -0.04 1.61 1.51 -1.26 -4.89 117.35 115.59 3dyp s TYR 285 Ca 0.03 -0.13 0.31 0.00 -1.01 0.00 0.00 57.07 56.27 3dyp s TYR 285 Cb 0.00 -3.65 1.24 0.00 -0.11 0.00 0.00 41.96 39.44 3dyp s TYR 285 CO 0.02 -1.06 1.91 0.00 -1.11 0.00 0.00 175.55 175.31 3dyp h ALA 286 N 9.04 1.00 -0.52 3.71 0.00 -1.94 0.13 119.26 130.67 3dyp h ALA 286 Ca -0.26 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3dyp h ALA 286 Cb 1.09 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3dyp h ALA 286 CO 0.97 0.00 0.01 -0.40 0.00 0.00 0.00 179.25 179.84 3dyp n ASP 287 N -2.93 5.22 -4.09 0.00 5.75 -1.26 -3.22 116.55 116.03 3dyp n ASP 287 Ca 0.01 -2.85 -0.08 0.00 -0.01 0.00 0.00 54.79 51.87 3dyp n ASP 287 Cb 0.31 -0.67 -0.10 0.00 -1.03 0.00 0.00 41.12 39.63 3dyp n ASP 287 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3dyp s ARG 288 N -2.59 0.68 -0.06 0.11 0.52 -1.11 -1.66 118.95 114.83 3dyp s ARG 288 Ca 0.49 -1.24 -0.17 0.00 -0.52 0.00 0.00 55.73 54.29 3dyp s ARG 288 Cb 0.37 0.22 0.04 0.00 0.52 0.00 0.00 34.95 36.10 3dyp s ARG 288 CO 0.14 -0.15 0.40 0.54 0.02 0.00 0.00 175.30 176.25 3dyp s VAL 289 N -3.94 0.03 -0.17 3.52 0.11 -0.18 -0.35 120.40 119.42 3dyp s VAL 289 Ca 0.10 -0.27 0.01 0.00 -2.93 0.00 0.00 61.98 58.89 3dyp s VAL 289 Cb 0.08 -0.67 0.02 0.00 -1.53 0.00 0.00 36.38 34.28 3dyp s VAL 289 CO -0.08 -0.15 -0.20 -0.89 -3.33 0.00 0.00 175.10 170.45 3dyp s THR 290 N -0.87 2.08 -0.06 5.04 2.01 -1.26 0.16 115.64 122.74 3dyp s THR 290 Ca -0.09 -0.95 -0.04 0.00 0.31 0.00 0.00 61.69 60.92 3dyp s THR 290 Cb -0.04 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.58 3dyp s THR 290 CO 0.04 0.54 0.13 -0.76 -0.69 0.00 0.00 174.62 173.88 3dyp s LEU 291 N 1.13 4.21 -0.14 4.42 2.01 -0.12 -4.91 118.68 125.27 3dyp s LEU 291 Ca 0.01 0.34 0.01 0.00 0.01 0.00 0.00 54.13 54.50 3dyp s LEU 291 Cb -0.14 -2.25 0.02 0.00 0.01 0.00 0.00 46.19 43.83 3dyp s LEU 291 CO -0.09 0.34 -0.15 -0.13 1.01 0.00 0.00 176.35 177.32 3dyp s ARG 292 N -1.42 2.37 -0.11 1.70 0.52 -1.26 -0.74 118.95 120.01 3dyp s ARG 292 Ca 0.20 -0.60 0.03 0.00 -0.52 0.00 0.00 55.73 54.84 3dyp s ARG 292 Cb -0.12 -2.10 -0.00 0.00 0.52 0.00 0.00 34.95 33.25 3dyp s ARG 292 CO 0.10 -0.17 -0.21 -0.51 0.02 0.00 0.00 175.30 174.53 3dyp s LEU 293 N 1.28 2.24 0.18 2.53 1.43 0.82 -4.95 118.68 122.21 3dyp s LEU 293 Ca 0.01 -0.51 -0.29 0.00 -1.03 0.00 0.00 54.13 52.31 3dyp s LEU 293 Cb -0.14 -1.46 -0.08 0.00 0.03 0.00 0.00 46.19 44.55 3dyp s LEU 293 CO -0.08 0.15 0.91 0.20 0.23 0.00 0.00 176.35 177.77 3dyp s ASN 294 N 0.40 7.54 -0.10 2.29 -0.87 -1.26 -0.57 114.94 122.37 3dyp s ASN 294 Ca -0.16 1.82 -0.01 0.00 -1.57 0.00 0.00 52.86 52.95 3dyp s ASN 294 Cb -0.17 -2.58 0.03 0.00 -0.02 0.00 0.00 41.25 38.51 3dyp s ASN 294 CO 0.07 0.09 -0.04 -0.69 -2.57 0.00 0.00 177.10 173.96 3dyp s VAL 295 N -0.74 0.72 -0.01 1.60 1.01 0.70 -4.88 120.40 118.80 3dyp s VAL 295 Ca 0.42 -0.10 -0.12 0.00 0.00 0.00 0.00 61.98 62.17 3dyp s VAL 295 Cb -0.24 -0.81 -0.05 0.00 0.00 0.00 0.00 36.38 35.27 3dyp s VAL 295 CO 0.30 0.31 0.35 -1.61 0.00 0.00 0.00 175.10 174.45 3dyp s GLU 296 N 1.83 3.79 -1.43 2.72 0.41 -1.26 -1.22 118.70 123.54 3dyp s GLU 296 Ca 0.05 0.26 -0.03 0.00 -0.41 0.00 0.00 54.97 54.83 3dyp s GLU 296 Cb -0.12 -3.18 0.03 0.00 -1.78 0.00 0.00 34.13 29.08 3dyp s GLU 296 CO -0.07 0.69 0.59 0.09 -0.49 0.00 0.00 175.26 176.07 3dyp n ASN 297 N 1.68 -1.33 -4.68 -0.19 4.13 0.16 -4.88 115.26 110.15 3dyp n ASN 297 Ca -0.14 -0.93 -0.40 0.00 1.68 0.00 0.00 54.58 54.79 3dyp n ASN 297 Cb 0.53 -3.38 0.03 0.00 -1.54 0.00 0.00 39.78 35.42 3dyp n ASN 297 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 3dyp n PRO 298 N -4.40 1.56 -2.73 3.52 -0.04 -1.26 -4.91 135.00 126.74 3dyp n PRO 298 Ca -0.23 0.57 -0.43 0.00 -0.04 0.00 0.00 63.50 63.37 3dyp n PRO 298 Cb 0.65 -2.35 -0.03 0.00 -0.04 0.00 0.00 33.50 31.73 3dyp n PRO 298 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3dyp s LYS 299 N -2.50 4.11 0.39 0.54 1.02 -1.26 -4.99 119.74 117.05 3dyp s LYS 299 Ca 0.68 1.04 -0.23 0.00 0.02 0.00 0.00 55.97 57.47 3dyp s LYS 299 Cb -0.47 -3.70 -0.10 0.00 -0.52 0.00 0.00 37.83 33.04 3dyp s LYS 299 CO 0.53 -0.75 0.98 -0.51 -0.92 0.00 0.00 175.35 174.68 3dyp s LEU 300 N 3.32 4.10 0.05 3.17 1.43 -1.26 -4.49 118.68 125.00 3dyp s LEU 300 Ca 0.41 1.84 -0.14 0.00 -1.03 0.00 0.00 54.13 55.22 3dyp s LEU 300 Cb -0.14 -4.30 -0.06 0.00 0.03 0.00 0.00 46.19 41.73 3dyp s LEU 300 CO 0.12 -0.34 0.43 0.86 0.23 0.00 0.00 176.35 177.65 3dyp s TRP 301 N -1.86 3.68 0.26 0.29 -0.00 0.31 -4.00 118.94 117.61 3dyp s TRP 301 Ca 0.58 0.96 -0.20 0.00 -0.00 0.00 0.00 56.10 57.43 3dyp s TRP 301 Cb -0.16 -2.27 0.02 0.00 -0.00 0.00 0.00 33.47 31.06 3dyp s TRP 301 CO 0.20 0.58 0.68 -1.54 -0.00 0.00 0.00 176.95 176.87 3dyp s SER 302 N -1.36 -0.27 0.45 5.86 1.04 -0.88 -4.65 113.70 113.88 3dyp s SER 302 Ca 0.28 -0.58 0.24 0.00 0.48 0.00 0.00 55.95 56.38 3dyp s SER 302 Cb -0.16 0.70 1.00 0.00 0.10 0.00 0.00 66.02 67.66 3dyp s SER 302 CO 0.16 -1.29 1.87 0.00 0.98 0.00 0.00 173.24 174.96 3dyp h ALA 303 N 2.03 1.08 -0.13 5.32 0.00 -1.90 -2.06 119.26 123.60 3dyp h ALA 303 Ca -0.21 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.35 3dyp h ALA 303 Cb 1.26 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.01 3dyp h ALA 303 CO 0.26 0.29 -0.47 0.93 0.00 0.00 0.00 179.25 180.25 3dyp h GLU 304 N 0.00 0.55 -2.51 0.00 5.08 -1.94 -3.42 114.58 112.34 3dyp h GLU 304 Ca -0.00 -0.42 -0.49 0.00 -1.00 0.00 0.00 59.36 57.45 3dyp h GLU 304 Cb 0.67 0.08 -0.37 0.00 0.50 0.00 0.00 28.75 29.63 3dyp h GLU 304 CO 0.03 1.04 -0.77 0.42 -1.00 0.00 0.00 179.01 178.73 3dyp s ILE 305 N -3.79 -0.09 -1.30 3.13 1.01 -1.15 -4.99 121.20 114.02 3dyp s ILE 305 Ca -0.13 -1.05 -0.08 0.00 0.00 0.00 0.00 60.65 59.39 3dyp s ILE 305 Cb 0.06 -0.98 -0.07 0.00 0.01 0.00 0.00 42.46 41.47 3dyp s ILE 305 CO 0.83 -0.75 2.56 -0.81 0.00 0.00 0.00 174.94 176.76 3dyp n PRO 306 N 4.74 2.94 -2.00 2.79 -0.04 -0.79 -2.07 135.00 140.58 3dyp n PRO 306 Ca 0.03 -1.87 -0.42 0.00 -0.04 0.00 0.00 63.50 61.20 3dyp n PRO 306 Cb 0.41 -2.65 -0.02 0.00 -0.04 0.00 0.00 33.50 31.20 3dyp n PRO 306 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3dyp s ASN 307 N 2.78 6.64 0.05 3.54 0.01 -1.26 -4.88 114.94 121.83 3dyp s ASN 307 Ca 0.56 2.64 0.05 0.00 -0.71 0.00 0.00 52.86 55.40 3dyp s ASN 307 Cb 0.14 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 39.16 3dyp s ASN 307 CO -0.05 -0.73 -0.14 -0.76 -1.51 0.00 0.00 177.10 173.91 3dyp s LEU 308 N 0.01 2.21 0.46 0.60 1.43 -1.26 -4.16 118.68 117.96 3dyp s LEU 308 Ca 0.62 -0.52 0.06 0.00 -1.03 0.00 0.00 54.13 53.26 3dyp s LEU 308 Cb -0.42 -0.56 -0.03 0.00 0.03 0.00 0.00 46.19 45.21 3dyp s LEU 308 CO 0.40 -0.01 0.19 -0.31 0.23 0.00 0.00 176.35 176.85 3dyp s TYR 309 N -1.01 2.28 -0.15 0.29 1.51 0.12 -4.55 117.35 115.83 3dyp s TYR 309 Ca 0.00 -0.70 0.01 0.00 -1.01 0.00 0.00 57.07 55.37 3dyp s TYR 309 Cb -0.09 -1.89 0.02 0.00 -0.11 0.00 0.00 41.96 39.89 3dyp s TYR 309 CO 0.02 0.06 -0.18 0.50 -1.11 0.00 0.00 175.55 174.85 3dyp s ARG 310 N -3.97 2.64 -0.21 -0.62 6.06 -0.16 0.11 118.95 122.80 3dyp s ARG 310 Ca 0.34 -0.70 -0.13 0.00 -2.50 0.00 0.00 55.73 52.74 3dyp s ARG 310 Cb 0.02 -2.28 -0.04 0.00 0.06 0.00 0.00 34.95 32.71 3dyp s ARG 310 CO 0.19 -0.17 0.28 0.00 -2.50 0.00 0.00 175.30 173.10 3dyp s ALA 311 N 1.25 3.59 -0.13 6.12 0.00 0.10 -1.00 121.76 131.68 3dyp s ALA 311 Ca 0.02 -0.65 0.01 0.00 0.00 0.00 0.00 51.96 51.33 3dyp s ALA 311 Cb -0.14 -2.46 -0.01 0.00 0.00 0.00 0.00 23.12 20.52 3dyp s ALA 311 CO -0.09 -0.17 -0.17 0.08 0.00 0.00 0.00 175.76 175.42 3dyp s VAL 312 N 1.02 2.63 -0.25 0.00 1.01 -0.47 -1.29 120.40 123.05 3dyp s VAL 312 Ca 0.14 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 3dyp s VAL 312 Cb -0.14 -2.09 0.02 0.00 0.00 0.00 0.00 36.38 34.17 3dyp s VAL 312 CO 0.05 0.53 -0.03 -0.69 0.00 0.00 0.00 175.10 174.97 3dyp s VAL 313 N 0.56 3.19 -0.10 2.92 1.01 0.17 -1.64 120.40 126.50 3dyp s VAL 313 Ca -0.10 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.00 3dyp s VAL 313 Cb -0.16 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 3dyp s VAL 313 CO 0.04 0.20 -0.07 -1.61 0.00 0.00 0.00 175.10 173.66 3dyp s GLU 314 N 1.39 3.11 -0.22 2.72 2.02 0.52 -1.06 118.70 127.18 3dyp s GLU 314 Ca 0.02 -0.56 -0.07 0.00 0.02 0.00 0.00 54.97 54.37 3dyp s GLU 314 Cb -0.16 -2.69 -0.03 0.00 0.10 0.00 0.00 34.13 31.35 3dyp s GLU 314 CO -0.03 0.47 0.05 -1.17 0.02 0.00 0.00 175.26 174.60 3dyp s LEU 315 N -0.29 3.48 0.00 1.80 2.96 0.31 -0.39 118.68 126.55 3dyp s LEU 315 Ca 0.04 -0.13 -0.10 0.00 -0.22 0.00 0.00 54.13 53.72 3dyp s LEU 315 Cb -0.13 -1.91 0.04 0.00 0.50 0.00 0.00 46.19 44.70 3dyp s LEU 315 CO 0.02 0.05 0.66 0.00 -1.32 0.00 0.00 176.35 175.76 3dyp n HIS 316 N 4.38 -2.01 -3.52 5.38 1.44 -0.01 -1.15 115.22 119.72 3dyp n HIS 316 Ca -0.16 -1.98 -0.20 0.00 -2.01 0.00 0.00 57.72 53.37 3dyp n HIS 316 Cb 0.52 0.77 -0.01 0.00 0.12 0.00 0.00 29.99 31.39 3dyp n HIS 316 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 3dyp s THR 317 N -2.37 4.38 0.43 0.61 -4.23 -0.39 -0.53 115.64 113.53 3dyp s THR 317 Ca 0.20 -0.92 0.12 0.00 -1.18 0.00 0.00 61.69 59.91 3dyp s THR 317 Cb -0.03 -3.54 0.19 0.00 1.34 0.00 0.00 72.50 70.46 3dyp s THR 317 CO 0.15 -0.23 1.99 0.00 -0.54 0.00 0.00 174.62 175.98 3dyp h ALA 318 N 0.89 1.66 0.00 3.99 0.00 -1.08 0.20 119.26 124.92 3dyp h ALA 318 Ca -0.47 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.29 3dyp h ALA 318 Cb 1.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3dyp h ALA 318 CO 0.55 0.25 0.00 -0.40 0.00 0.00 0.00 179.25 179.66 3dyp n ASP 319 N -4.35 0.00 0.00 0.00 5.68 -1.26 -4.86 116.55 111.76 3dyp n ASP 319 Ca -0.01 0.18 0.00 0.00 -0.50 0.00 0.00 54.79 54.46 3dyp n ASP 319 Cb 0.21 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 39.85 3dyp n ASP 319 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dyp n GLY 320 N 0.06 0.95 3.75 6.12 0.00 0.69 -5.07 105.19 111.69 3dyp n GLY 320 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 3dyp n GLY 320 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyp s THR 321 N -2.00 4.87 0.18 2.61 2.01 -1.25 -4.81 115.64 117.26 3dyp s THR 321 Ca 0.00 1.40 -0.30 0.00 0.31 0.00 0.00 61.69 63.10 3dyp s THR 321 Cb 0.00 -4.01 -0.07 0.00 0.01 0.00 0.00 72.50 68.43 3dyp s THR 321 CO 0.00 0.37 0.97 -0.22 -0.69 0.00 0.00 174.62 175.06 3dyp s LEU 322 N 0.02 4.56 -0.20 4.42 2.96 -1.26 -1.26 118.68 127.93 3dyp s LEU 322 Ca 0.34 1.91 -0.16 0.00 -0.22 0.00 0.00 54.13 56.00 3dyp s LEU 322 Cb -0.19 -3.60 -0.11 0.00 0.50 0.00 0.00 46.19 42.79 3dyp s LEU 322 CO 0.19 0.01 -0.08 -0.38 -1.32 0.00 0.00 176.35 174.77 3dyp n ILE 323 N 2.13 1.49 -3.66 6.68 5.41 -0.30 -4.96 119.36 126.15 3dyp n ILE 323 Ca 0.00 0.01 -0.03 0.00 1.00 0.00 0.00 62.75 63.73 3dyp n ILE 323 Cb 0.48 -2.16 -0.01 0.00 -0.71 0.00 0.00 39.64 37.23 3dyp n ILE 323 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 3dyp s GLU 324 N -2.42 0.88 0.01 0.38 -1.05 -1.07 -4.88 118.70 110.56 3dyp s GLU 324 Ca -0.26 -0.45 0.03 0.00 -0.15 0.00 0.00 54.97 54.14 3dyp s GLU 324 Cb 0.06 0.32 -0.01 0.00 -0.44 0.00 0.00 34.13 34.06 3dyp s GLU 324 CO 0.44 -0.40 -0.11 0.00 0.95 0.00 0.00 175.26 176.14 3dyp s ALA 325 N -3.00 0.89 0.43 -0.84 0.00 0.62 -0.53 121.76 119.33 3dyp s ALA 325 Ca 0.11 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 51.52 3dyp s ALA 325 Cb 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 3dyp s ALA 325 CO -0.02 0.18 0.05 -1.21 0.00 0.00 0.00 175.76 174.76 3dyp s GLU 326 N -0.66 1.99 0.03 0.00 0.41 -0.22 -1.10 118.70 119.15 3dyp s GLU 326 Ca 0.02 -2.21 -0.29 0.00 -0.41 0.00 0.00 54.97 52.08 3dyp s GLU 326 Cb -0.06 -1.16 0.10 0.00 -1.78 0.00 0.00 34.13 31.24 3dyp s GLU 326 CO 0.00 -0.32 1.19 0.00 -0.49 0.00 0.00 175.26 175.64 3dyp s ALA 327 N -3.02 -2.06 0.18 5.21 0.00 -1.26 -0.66 121.76 120.15 3dyp s ALA 327 Ca 0.21 0.55 -0.19 0.00 0.00 0.00 0.00 51.96 52.53 3dyp s ALA 327 Cb 0.04 0.43 0.04 0.00 0.00 0.00 0.00 23.12 23.63 3dyp s ALA 327 CO 0.11 -1.04 0.54 0.00 0.00 0.00 0.00 175.76 175.37 3dyp s ASP 329 N -2.84 7.50 -0.06 0.00 1.01 -1.26 -0.72 116.67 120.29 3dyp s ASP 329 Ca 0.07 1.78 0.04 0.00 0.71 0.00 0.00 52.55 55.15 3dyp s ASP 329 Cb -0.01 -2.55 -0.00 0.00 1.01 0.00 0.00 42.92 41.37 3dyp s ASP 329 CO -0.06 0.18 -0.20 -0.69 0.21 0.00 0.00 175.17 174.61 3dyp s VAL 330 N -1.19 1.67 -0.22 -1.27 1.01 0.31 -4.70 120.40 116.01 3dyp s VAL 330 Ca 0.39 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 3dyp s VAL 330 Cb -0.24 -1.44 0.02 0.00 0.00 0.00 0.00 36.38 34.72 3dyp s VAL 330 CO 0.29 0.47 -0.11 -0.83 0.00 0.00 0.00 175.10 174.92 3dyp s GLY 331 N 0.15 1.55 -0.57 4.51 0.00 -1.26 0.15 107.32 111.85 3dyp s GLY 331 Ca -0.09 -1.38 -0.28 0.00 0.00 0.00 0.00 44.72 42.98 3dyp s GLY 331 CO 0.04 0.44 1.37 -1.36 0.00 0.00 0.00 173.10 173.60 3dyp s PHE 332 N 1.31 2.33 -0.05 1.90 0.40 -1.26 -4.80 117.98 117.82 3dyp s PHE 332 Ca 0.02 0.43 -0.28 0.00 -0.60 0.00 0.00 56.93 56.50 3dyp s PHE 332 Cb -0.15 -4.42 0.06 0.00 0.51 0.00 0.00 43.02 39.01 3dyp s PHE 332 CO -0.07 -1.92 0.62 -0.98 0.70 0.00 0.00 175.22 173.57 3dyp s ARG 333 N 5.44 0.99 -0.05 0.44 3.03 -1.26 -0.53 118.95 127.00 3dyp s ARG 333 Ca 0.50 0.20 0.04 0.00 2.03 0.00 0.00 55.73 58.51 3dyp s ARG 333 Cb -0.10 0.47 -0.02 0.00 -1.03 0.00 0.00 34.95 34.26 3dyp s ARG 333 CO 0.24 -0.30 -0.18 -2.00 -1.13 0.00 0.00 175.30 171.93 3dyp s GLU 334 N -1.18 2.54 -0.14 3.89 2.12 -1.26 -4.84 118.70 119.84 3dyp s GLU 334 Ca -0.11 -0.77 0.02 0.00 0.36 0.00 0.00 54.97 54.47 3dyp s GLU 334 Cb -0.01 -2.31 0.00 0.00 0.26 0.00 0.00 34.13 32.07 3dyp s GLU 334 CO 0.09 0.53 -0.20 0.08 -0.54 0.00 0.00 175.26 175.22 3dyp s VAL 335 N -0.50 2.33 0.05 3.70 1.01 -1.26 -1.06 120.40 124.68 3dyp s VAL 335 Ca 0.06 -0.90 -0.23 0.00 0.00 0.00 0.00 61.98 60.91 3dyp s VAL 335 Cb -0.12 -1.95 0.06 0.00 0.00 0.00 0.00 36.38 34.37 3dyp s VAL 335 CO 0.01 0.54 0.55 0.00 0.00 0.00 0.00 175.10 176.20 3dyp s ARG 336 N 0.68 1.07 -0.16 2.72 1.70 -0.64 -4.61 118.95 119.71 3dyp s ARG 336 Ca -0.09 -0.22 -0.02 0.00 -0.47 0.00 0.00 55.73 54.93 3dyp s ARG 336 Cb -0.16 0.49 -0.02 0.00 -0.57 0.00 0.00 34.95 34.69 3dyp s ARG 336 CO 0.02 -0.39 -0.08 0.42 -1.08 0.00 0.00 175.30 174.18 3dyp s ILE 337 N -2.50 3.40 -0.04 4.99 1.01 -1.26 -0.08 121.20 126.73 3dyp s ILE 337 Ca -0.05 -0.52 -0.02 0.00 0.00 0.00 0.00 60.65 60.06 3dyp s ILE 337 Cb -0.01 -2.48 0.03 0.00 0.01 0.00 0.00 42.46 40.01 3dyp s ILE 337 CO -0.02 0.49 0.09 -0.70 0.00 0.00 0.00 174.94 174.79 3dyp s GLU 338 N 0.66 0.05 -1.24 2.79 2.12 0.27 -4.84 118.70 118.51 3dyp s GLU 338 Ca -0.04 0.22 -0.01 0.00 0.36 0.00 0.00 54.97 55.50 3dyp s GLU 338 Cb -0.15 -0.13 0.01 0.00 0.26 0.00 0.00 34.13 34.12 3dyp s GLU 338 CO 0.02 -0.11 0.10 -1.71 -0.54 0.00 0.00 175.26 173.02 3dyp n ASN 339 N 3.81 -4.39 0.00 -1.70 5.15 -1.26 -1.10 115.26 115.77 3dyp n ASN 339 Ca -0.22 0.06 0.00 0.00 -0.60 0.00 0.00 54.58 53.82 3dyp n ASN 339 Cb 0.54 -3.69 0.00 0.00 -0.53 0.00 0.00 39.78 36.10 3dyp n ASN 339 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3dyp n GLY 340 N -0.93 0.72 3.25 8.20 0.00 -1.26 -5.05 105.19 110.12 3dyp n GLY 340 Ca -0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.62 3dyp n GLY 340 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyp s LEU 341 N 0.00 2.15 -0.28 0.99 1.43 -0.25 -2.65 118.68 120.06 3dyp s LEU 341 Ca 0.00 -0.50 -0.24 0.00 -1.03 0.00 0.00 54.13 52.35 3dyp s LEU 341 Cb 0.00 -0.99 0.00 0.00 0.03 0.00 0.00 46.19 45.23 3dyp s LEU 341 CO 0.00 0.17 0.83 -0.22 0.23 0.00 0.00 176.35 177.37 3dyp s LEU 342 N -1.08 4.07 -0.06 1.79 2.96 -1.26 -0.56 118.68 124.54 3dyp s LEU 342 Ca 0.08 0.85 0.02 0.00 -0.22 0.00 0.00 54.13 54.86 3dyp s LEU 342 Cb -0.09 -3.17 -0.03 0.00 0.50 0.00 0.00 46.19 43.41 3dyp s LEU 342 CO 0.01 -0.60 -0.11 -0.76 -1.32 0.00 0.00 176.35 173.58 3dyp s LEU 343 N 2.98 2.95 -0.18 -0.68 1.43 0.89 -1.76 118.68 124.31 3dyp s LEU 343 Ca 0.35 -0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.35 3dyp s LEU 343 Cb -0.14 -1.62 0.02 0.00 0.03 0.00 0.00 46.19 44.48 3dyp s LEU 343 CO 0.11 0.35 -0.17 -0.22 0.23 0.00 0.00 176.35 176.64 3dyp s LEU 344 N -0.78 2.13 -1.46 1.79 2.96 0.23 -1.62 118.68 121.93 3dyp s LEU 344 Ca 0.12 -0.68 -0.08 0.00 -0.22 0.00 0.00 54.13 53.26 3dyp s LEU 344 Cb -0.11 -1.40 0.04 0.00 0.50 0.00 0.00 46.19 45.21 3dyp s LEU 344 CO 0.01 -0.03 0.80 0.59 -1.32 0.00 0.00 176.35 176.40 3dyp n ASN 345 N 4.64 -5.51 0.00 3.68 3.02 -0.22 -1.52 115.26 119.36 3dyp n ASN 345 Ca -0.19 -0.47 0.00 0.00 -0.03 0.00 0.00 54.58 53.89 3dyp n ASN 345 Cb 0.49 -4.42 0.00 0.00 -0.61 0.00 0.00 39.78 35.24 3dyp n ASN 345 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyp n GLY 346 N -1.61 1.73 3.41 7.41 0.00 -1.26 -5.01 105.19 109.86 3dyp n GLY 346 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 3dyp n GLY 346 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyp s LYS 347 N -0.07 1.92 -0.06 1.61 -0.14 -0.57 -4.97 119.74 117.46 3dyp s LYS 347 Ca 0.00 -1.06 -0.30 0.00 -1.36 0.00 0.00 55.97 53.25 3dyp s LYS 347 Cb 0.00 -2.09 -0.04 0.00 -1.68 0.00 0.00 37.83 34.02 3dyp s LYS 347 CO 0.00 0.52 1.27 -1.25 -0.76 0.00 0.00 175.35 175.13 3dyp s PRO 348 N -1.43 4.32 0.67 -1.68 0.04 -1.26 0.77 135.00 136.43 3dyp s PRO 348 Ca 0.14 1.75 -0.13 0.00 0.04 0.00 0.00 61.00 62.80 3dyp s PRO 348 Cb -0.10 -3.60 0.00 0.00 0.04 0.00 0.00 34.50 30.84 3dyp s PRO 348 CO 0.04 -0.52 1.07 -0.51 0.04 0.00 0.00 177.00 177.12 3dyp s LEU 349 N 2.47 3.26 -0.36 -3.56 1.43 -0.72 -4.93 118.68 116.26 3dyp s LEU 349 Ca 0.58 1.77 0.00 0.00 -1.03 0.00 0.00 54.13 55.45 3dyp s LEU 349 Cb -0.26 -4.52 0.12 0.00 0.03 0.00 0.00 46.19 41.56 3dyp s LEU 349 CO 0.22 -1.50 0.16 -0.22 0.23 0.00 0.00 176.35 175.25 3dyp s LEU 350 N -5.21 2.05 -0.32 1.79 2.96 -1.26 -4.77 118.68 113.91 3dyp s LEU 350 Ca 0.61 -2.02 -0.29 0.00 -0.22 0.00 0.00 54.13 52.21 3dyp s LEU 350 Cb -0.16 -0.80 -0.00 0.00 0.50 0.00 0.00 46.19 45.72 3dyp s LEU 350 CO 0.48 -0.35 1.38 -0.63 -1.32 0.00 0.00 176.35 175.91 3dyp s ILE 351 N 1.16 4.00 -1.03 6.68 -1.09 0.93 -4.93 121.20 126.92 3dyp s ILE 351 Ca 0.14 1.10 -0.07 0.00 -2.23 0.00 0.00 60.65 59.58 3dyp s ILE 351 Cb -0.20 -4.10 0.26 0.00 -1.58 0.00 0.00 42.46 36.83 3dyp s ILE 351 CO -0.13 -0.53 1.00 -0.13 -1.23 0.00 0.00 174.94 173.91 3dyp s ARG 352 N 4.48 3.91 0.39 2.79 0.52 -1.26 -2.26 118.95 127.52 3dyp s ARG 352 Ca 0.60 -3.19 0.08 0.00 -0.52 0.00 0.00 55.73 52.70 3dyp s ARG 352 Cb -0.17 -4.38 -0.02 0.00 0.52 0.00 0.00 34.95 30.90 3dyp s ARG 352 CO 0.27 -1.25 0.36 0.20 0.02 0.00 0.00 175.30 174.90 3dyp s GLY 353 N 0.98 2.04 -0.04 -3.53 0.00 0.08 -0.55 107.32 106.29 3dyp s GLY 353 Ca 0.29 -1.82 -0.09 0.00 0.00 0.00 0.00 44.72 43.10 3dyp s GLY 353 CO -0.09 -1.66 0.20 0.54 0.00 0.00 0.00 173.10 172.09 3dyp s VAL 354 N -2.42 0.04 0.25 1.40 0.11 -0.47 -0.89 120.40 118.42 3dyp s VAL 354 Ca 0.46 -0.34 -0.30 0.00 -2.93 0.00 0.00 61.98 58.88 3dyp s VAL 354 Cb -0.04 -0.41 -0.09 0.00 -1.53 0.00 0.00 36.38 34.31 3dyp s VAL 354 CO 0.28 -0.19 0.96 0.20 -3.33 0.00 0.00 175.10 173.02 3dyp s ASN 355 N -0.70 7.57 -0.08 3.54 0.01 0.16 -1.14 114.94 124.31 3dyp s ASN 355 Ca -0.08 1.98 -0.03 0.00 -0.71 0.00 0.00 52.86 54.02 3dyp s ASN 355 Cb -0.04 -2.61 0.04 0.00 0.41 0.00 0.00 41.25 39.05 3dyp s ASN 355 CO 0.01 0.10 0.09 -0.60 -1.51 0.00 0.00 177.10 175.20 3dyp s ARG 356 N -1.29 -0.02 0.57 -0.60 3.52 -1.01 -0.37 118.95 119.74 3dyp s ARG 356 Ca 0.42 0.32 -0.07 0.00 -0.13 0.00 0.00 55.73 56.28 3dyp s ARG 356 Cb -0.26 -0.74 -0.01 0.00 -1.56 0.00 0.00 34.95 32.38 3dyp s ARG 356 CO 0.32 -0.40 0.91 -1.01 -0.81 0.00 0.00 175.30 174.31 3dyp s HIS 357 N 2.20 3.41 -0.60 5.12 3.76 -1.26 -3.89 115.29 124.03 3dyp s HIS 357 Ca 0.04 0.83 -0.21 0.00 -0.15 0.00 0.00 55.06 55.57 3dyp s HIS 357 Cb -0.13 -2.64 0.07 0.00 1.11 0.00 0.00 32.58 30.99 3dyp s HIS 357 CO -0.05 -0.68 0.84 -1.21 -0.85 0.00 0.00 174.74 172.79 3dyp s GLU 358 N -4.98 3.13 -0.10 1.40 2.02 -1.26 -4.93 118.70 113.98 3dyp s GLU 358 Ca 0.52 -0.86 -0.08 0.00 0.02 0.00 0.00 54.97 54.57 3dyp s GLU 358 Cb -0.11 -4.19 0.03 0.00 0.10 0.00 0.00 34.13 29.97 3dyp s GLU 358 CO 0.47 -1.60 0.26 -1.58 0.02 0.00 0.00 175.26 172.83 3dyp s HIS 359 N 3.48 -0.30 -0.04 1.61 2.46 -1.26 -4.50 115.29 116.74 3dyp s HIS 359 Ca 0.20 0.72 0.01 0.00 0.47 0.00 0.00 55.06 56.46 3dyp s HIS 359 Cb -0.18 0.09 0.02 0.00 -0.13 0.00 0.00 32.58 32.38 3dyp s HIS 359 CO 0.11 -0.16 -0.02 -1.58 -2.47 0.00 0.00 174.74 170.62 3dyp s HIS 360 N 0.41 0.51 0.57 3.88 5.04 0.44 -4.99 115.29 121.16 3dyp s HIS 360 Ca -0.02 -0.09 0.27 0.00 -1.54 0.00 0.00 55.06 53.67 3dyp s HIS 360 Cb -0.04 -0.53 1.62 0.00 0.04 0.00 0.00 32.58 33.67 3dyp s HIS 360 CO -0.02 -0.16 2.13 -1.00 -2.34 0.00 0.00 174.74 173.35 3dyp h PRO 361 N 7.26 0.00 0.00 2.88 0.13 -1.78 0.71 132.00 141.19 3dyp h PRO 361 Ca -0.40 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.42 3dyp h PRO 361 Cb 1.14 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.21 3dyp h PRO 361 CO 0.46 0.00 -2.20 1.28 -0.23 0.00 0.00 178.00 177.32 3dyp n LEU 362 N -3.97 2.54 -0.84 1.56 4.77 -1.26 -1.51 117.00 118.29 3dyp n LEU 362 Ca 0.01 -0.10 0.12 0.00 -0.03 0.00 0.00 56.01 56.00 3dyp n LEU 362 Cb 0.26 -0.57 0.29 0.00 -2.33 0.00 0.00 43.42 41.06 3dyp n LEU 362 CO 0.29 0.79 0.73 1.41 -1.33 0.00 0.00 177.39 179.29 3dyp n HIS 363 N -3.04 0.26 0.00 -1.77 8.25 -1.15 -4.95 115.22 112.81 3dyp n HIS 363 Ca -0.36 -0.13 0.00 0.00 -0.26 0.00 0.00 57.72 56.97 3dyp n HIS 363 Cb 0.92 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.03 3dyp n HIS 363 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dyp n GLY 364 N 1.31 2.46 0.73 -1.41 0.00 0.23 -2.87 105.19 105.65 3dyp n GLY 364 Ca 0.17 -0.30 0.06 0.00 0.00 0.00 0.00 46.02 45.95 3dyp n GLY 364 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dyp n GLN 365 N 9.98 2.87 -2.66 1.61 6.02 -1.26 -0.42 117.38 133.53 3dyp n GLN 365 Ca 0.00 -2.15 -0.42 0.00 -0.01 0.00 0.00 57.00 54.42 3dyp n GLN 365 Cb 0.00 -1.32 -0.03 0.00 1.02 0.00 0.00 30.24 29.91 3dyp n GLN 365 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3dyp s VAL 366 N -1.08 4.72 0.04 5.09 1.01 -1.14 -4.84 120.40 124.20 3dyp s VAL 366 Ca 0.27 1.99 0.02 0.00 0.00 0.00 0.00 61.98 64.26 3dyp s VAL 366 Cb 0.14 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 3dyp s VAL 366 CO 0.17 -0.00 0.03 -0.04 0.00 0.00 0.00 175.10 175.26 3dyp s MET 367 N 2.06 2.78 0.17 2.72 -1.94 -1.26 -4.71 119.30 119.13 3dyp s MET 367 Ca 0.49 -0.67 0.08 0.00 -1.71 0.00 0.00 55.69 53.88 3dyp s MET 367 Cb -0.19 -2.67 -0.04 0.00 2.01 0.00 0.00 34.83 33.93 3dyp s MET 367 CO 0.18 0.59 -0.16 0.16 -0.01 0.00 0.00 175.02 175.78 3dyp s ASP 368 N -1.93 2.56 0.34 3.03 -4.77 -1.26 -5.04 116.67 109.59 3dyp s ASP 368 Ca 0.23 -0.91 0.03 0.00 -3.30 0.00 0.00 52.55 48.60 3dyp s ASP 368 Cb -0.12 -0.14 0.63 0.00 -1.09 0.00 0.00 42.92 42.21 3dyp s ASP 368 CO 0.15 -0.10 1.97 -0.08 0.70 0.00 0.00 175.17 177.82 3dyp h GLU 369 N 3.03 0.86 -0.33 2.11 4.81 -1.99 -1.58 114.58 121.49 3dyp h GLU 369 Ca -0.40 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.77 3dyp h GLU 369 Cb 1.21 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.38 3dyp h GLU 369 CO 0.55 0.57 0.18 0.37 -0.73 0.00 0.00 179.01 179.95 3dyp h GLN 370 N 0.88 0.45 -0.55 1.92 4.15 -1.99 -0.47 115.11 119.50 3dyp h GLN 370 Ca 0.29 -0.05 -0.11 0.00 0.77 0.00 0.00 58.65 59.56 3dyp h GLN 370 Cb 0.07 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.65 3dyp h GLN 370 CO -0.08 0.37 -0.08 1.15 -1.93 0.00 0.00 178.83 178.26 3dyp h THR 371 N 0.41 1.27 -0.13 2.39 2.02 -1.91 0.11 112.91 117.06 3dyp h THR 371 Ca 0.12 -1.22 0.03 0.00 0.77 0.00 0.00 66.41 66.10 3dyp h THR 371 Cb 0.05 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 3dyp h THR 371 CO -0.02 0.43 -0.04 0.24 0.37 0.00 0.00 175.52 176.50 3dyp h MET 372 N 0.90 -0.01 -0.51 6.66 2.86 -0.94 0.06 114.93 123.94 3dyp h MET 372 Ca 0.15 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.75 3dyp h MET 372 Cb 0.63 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.27 3dyp h MET 372 CO 0.04 -0.01 0.18 0.28 1.06 0.00 0.00 176.91 178.46 3dyp h VAL 373 N -0.01 1.23 -0.67 -2.22 2.07 -0.85 -0.96 116.25 114.84 3dyp h VAL 373 Ca 0.07 -0.74 0.06 0.00 0.82 0.00 0.00 66.70 66.91 3dyp h VAL 373 Cb 0.11 0.75 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 3dyp h VAL 373 CO -0.15 0.27 0.37 -0.61 0.02 0.00 0.00 177.57 177.48 3dyp h GLN 374 N 0.69 0.67 -0.60 1.57 4.15 -0.51 0.20 115.11 121.28 3dyp h GLN 374 Ca 0.17 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.50 3dyp h GLN 374 Cb 0.25 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 3dyp h GLN 374 CO -0.01 0.45 0.19 -0.44 -1.93 0.00 0.00 178.83 177.09 3dyp h ASP 375 N 0.69 0.87 -0.61 -0.69 3.32 -0.31 -1.86 116.42 117.84 3dyp h ASP 375 Ca 0.30 -0.20 -0.07 0.00 0.02 0.00 0.00 57.03 57.08 3dyp h ASP 375 Cb 0.18 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3dyp h ASP 375 CO -0.18 0.84 0.11 0.40 -1.72 0.00 0.00 179.24 178.70 3dyp h ILE 376 N 0.86 1.26 -0.56 0.35 2.04 -0.49 -0.79 117.51 120.17 3dyp h ILE 376 Ca 0.20 -0.98 -0.03 0.00 1.00 0.00 0.00 64.86 65.04 3dyp h ILE 376 Cb 0.28 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 3dyp h ILE 376 CO -0.01 0.36 0.22 -0.07 0.00 0.00 0.00 178.15 178.65 3dyp h LEU 377 N 0.91 0.78 -0.77 1.44 3.38 -0.84 -1.28 115.31 118.92 3dyp h LEU 377 Ca 0.19 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 3dyp h LEU 377 Cb 0.41 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3dyp h LEU 377 CO 0.01 0.74 0.12 -0.07 0.09 0.00 0.00 178.44 179.33 3dyp h LEU 378 N 0.77 1.00 0.19 1.67 3.38 -1.10 0.57 115.31 121.78 3dyp h LEU 378 Ca 0.19 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3dyp h LEU 378 Cb 0.21 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3dyp h LEU 378 CO -0.01 0.99 -0.09 0.24 0.09 0.00 0.00 178.44 179.65 3dyp h MET 379 N 0.99 -0.25 -0.41 1.13 2.86 -0.88 -0.49 114.93 117.88 3dyp h MET 379 Ca 0.20 0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.79 3dyp h MET 379 Cb 0.41 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 3dyp h MET 379 CO 0.01 -0.15 -0.03 0.87 1.06 0.00 0.00 176.91 178.67 3dyp h LYS 380 N -0.27 0.68 0.00 1.72 1.57 -1.05 -0.37 116.57 118.85 3dyp h LYS 380 Ca -0.03 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.55 3dyp h LYS 380 Cb 0.21 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 3dyp h LYS 380 CO 0.04 0.71 -0.10 1.96 -0.57 0.00 0.00 179.45 181.49 3dyp h GLN 381 N 0.63 0.00 -0.58 3.15 4.20 -0.68 -2.04 115.11 119.79 3dyp h GLN 381 Ca 0.12 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.66 3dyp h GLN 381 Cb 0.44 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 28.11 3dyp h GLN 381 CO 0.02 0.10 0.17 0.09 -0.67 0.00 0.00 178.83 178.54 3dyp n ASN 382 N -3.38 4.18 -1.34 1.46 3.02 -0.21 -4.95 115.26 114.05 3dyp n ASN 382 Ca -0.01 -3.29 -0.14 0.00 -0.03 0.00 0.00 54.58 51.10 3dyp n ASN 382 Cb 0.28 -0.69 -0.04 0.00 -0.61 0.00 0.00 39.78 38.73 3dyp n ASN 382 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3dyp n ASN 383 N -0.45 -4.59 -4.85 6.41 3.02 -0.77 -3.92 115.26 110.12 3dyp n ASN 383 Ca 0.36 0.20 -0.34 0.00 -0.03 0.00 0.00 54.58 54.77 3dyp n ASN 383 Cb 1.23 -3.53 -0.06 0.00 -0.61 0.00 0.00 39.78 36.82 3dyp n ASN 383 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3dyp s PHE 384 N -2.62 3.54 0.00 3.10 0.40 -0.39 -4.82 117.98 117.19 3dyp s PHE 384 Ca 0.00 1.07 0.00 0.00 -0.60 0.00 0.00 56.93 57.40 3dyp s PHE 384 Cb 0.00 -2.39 0.00 0.00 0.51 0.00 0.00 43.02 41.14 3dyp s PHE 384 CO 0.00 0.34 0.62 0.27 0.70 0.00 0.00 175.22 177.15 3dyp n ASN 385 N 0.44 0.89 -3.63 1.36 0.23 0.29 -4.28 115.26 110.56 3dyp n ASN 385 Ca -0.03 -1.37 -0.16 0.00 -0.53 0.00 0.00 54.58 52.50 3dyp n ASN 385 Cb 0.52 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.15 3dyp n ASN 385 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3dyp s ALA 386 N -0.37 -1.35 0.01 -2.53 0.00 -1.11 -0.71 121.76 115.70 3dyp s ALA 386 Ca 0.00 0.92 0.01 0.00 0.00 0.00 0.00 51.96 52.89 3dyp s ALA 386 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.10 3dyp s ALA 386 CO 0.00 -0.32 -0.03 0.54 0.00 0.00 0.00 175.76 175.95 3dyp s VAL 387 N -1.18 0.19 -0.18 0.00 0.11 0.91 -1.37 120.40 118.89 3dyp s VAL 387 Ca -0.12 -0.29 -0.06 0.00 -2.93 0.00 0.00 61.98 58.59 3dyp s VAL 387 Cb -0.02 -0.20 -0.03 0.00 -1.53 0.00 0.00 36.38 34.59 3dyp s VAL 387 CO 0.07 -0.06 0.01 -0.60 -3.33 0.00 0.00 175.10 171.19 3dyp s ARG 388 N -0.38 3.79 -1.22 1.54 3.52 -0.29 -1.07 118.95 124.84 3dyp s ARG 388 Ca -0.02 -0.45 -0.18 0.00 -0.13 0.00 0.00 55.73 54.95 3dyp s ARG 388 Cb -0.03 -3.07 -0.02 0.00 -1.56 0.00 0.00 34.95 30.26 3dyp s ARG 388 CO -0.00 0.20 2.04 0.00 -0.81 0.00 0.00 175.30 176.73 3dyp s SER 390 N 4.17 6.74 -0.42 0.00 1.04 -1.25 -1.25 113.70 122.73 3dyp s SER 390 Ca 0.53 1.59 0.09 0.00 0.48 0.00 0.00 55.95 58.64 3dyp s SER 390 Cb 0.11 -2.54 0.28 0.00 0.10 0.00 0.00 66.02 63.98 3dyp s SER 390 CO 0.02 -0.96 0.62 1.41 0.98 0.00 0.00 173.24 175.31 3dyp n HIS 391 N 7.28 0.41 -3.61 5.02 -0.00 -1.26 -4.10 115.22 118.96 3dyp n HIS 391 Ca 0.15 -3.72 -0.02 0.00 -0.00 0.00 0.00 57.72 54.14 3dyp n HIS 391 Cb 0.45 -0.40 -0.01 0.00 -0.00 0.00 0.00 29.99 30.03 3dyp n HIS 391 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 3dyp s TYR 392 N -1.79 -0.08 0.47 4.41 -0.85 -0.38 -4.22 117.35 114.91 3dyp s TYR 392 Ca 0.38 0.02 -0.24 0.00 -0.52 0.00 0.00 57.07 56.71 3dyp s TYR 392 Cb 0.23 0.52 -0.07 0.00 0.38 0.00 0.00 41.96 43.02 3dyp s TYR 392 CO -0.09 -0.20 1.28 -2.14 -1.52 0.00 0.00 175.55 172.88 3dyp s PRO 393 N -2.36 3.65 0.59 -3.49 0.02 -0.92 -4.55 135.00 127.94 3dyp s PRO 393 Ca 0.12 2.06 0.05 0.00 0.02 0.00 0.00 61.00 63.24 3dyp s PRO 393 Cb 0.02 -2.49 0.08 0.00 0.02 0.00 0.00 34.50 32.13 3dyp s PRO 393 CO -0.04 -0.73 0.82 -0.80 -0.33 0.00 0.00 177.00 175.92 3dyp s ASN 394 N -1.00 4.98 0.30 2.53 0.02 -1.26 -4.84 114.94 115.66 3dyp s ASN 394 Ca 0.64 -0.52 -0.29 0.00 -1.02 0.00 0.00 52.86 51.67 3dyp s ASN 394 Cb -0.36 -0.11 -0.13 0.00 0.02 0.00 0.00 41.25 40.68 3dyp s ASN 394 CO 0.44 -1.38 1.37 1.57 0.02 0.00 0.00 177.10 179.12 3dyp n HIS 395 N -2.38 2.32 0.05 2.20 -0.00 -1.26 -4.85 115.22 111.30 3dyp n HIS 395 Ca 0.13 0.47 0.18 0.00 -0.00 0.00 0.00 57.72 58.51 3dyp n HIS 395 Cb 0.61 -2.46 0.69 0.00 -0.00 0.00 0.00 29.99 28.83 3dyp n HIS 395 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3dyp h PRO 396 N 3.41 0.00 0.00 1.57 0.13 -1.96 -1.42 132.00 133.72 3dyp h PRO 396 Ca -0.46 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.64 3dyp h PRO 396 Cb 1.27 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 3dyp h PRO 396 CO 0.69 0.00 -0.16 1.25 -0.23 0.00 0.00 178.00 179.55 3dyp h LEU 397 N 0.00 0.00 -0.83 1.56 5.85 -2.01 -2.72 115.31 117.16 3dyp h LEU 397 Ca 0.21 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.98 3dyp h LEU 397 Cb 0.84 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.81 3dyp h LEU 397 CO -0.00 0.16 0.52 -0.25 -0.34 0.00 0.00 178.44 178.53 3dyp h TRP 398 N 0.00 0.96 -0.41 1.25 2.91 -1.60 -1.05 115.95 118.01 3dyp h TRP 398 Ca -0.00 0.03 -0.07 0.00 1.13 0.00 0.00 58.89 59.98 3dyp h TRP 398 Cb 0.57 -0.31 -0.01 0.00 -0.51 0.00 0.00 29.16 28.89 3dyp h TRP 398 CO 0.00 0.51 -0.01 1.88 -1.03 0.00 0.00 178.44 179.79 3dyp h TYR 399 N 0.97 0.79 -0.74 2.65 -1.99 -1.64 -0.71 116.97 116.29 3dyp h TYR 399 Ca 0.35 -0.14 0.03 0.00 2.00 0.00 0.00 58.73 60.97 3dyp h TYR 399 Cb 0.12 -0.21 -0.04 0.00 2.00 0.00 0.00 36.73 38.60 3dyp h TYR 399 CO -0.03 0.80 0.47 1.15 -0.00 0.00 0.00 178.16 180.55 3dyp h THR 400 N 0.55 1.11 -0.42 -2.88 2.02 -1.44 -0.11 112.91 111.74 3dyp h THR 400 Ca 0.11 -0.32 -0.05 0.00 0.77 0.00 0.00 66.41 66.92 3dyp h THR 400 Cb 0.49 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 3dyp h THR 400 CO 0.02 0.17 0.05 -0.07 0.37 0.00 0.00 175.52 176.06 3dyp h LEU 401 N 0.92 0.69 -0.91 2.58 3.38 -0.89 -1.23 115.31 119.85 3dyp h LEU 401 Ca 0.30 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3dyp h LEU 401 Cb 0.00 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 3dyp h LEU 401 CO -0.11 0.79 0.42 0.00 0.09 0.00 0.00 178.44 179.63 3dyp h ASP 403 N 1.20 -0.13 0.44 0.00 3.32 -0.79 0.15 116.42 120.61 3dyp h ASP 403 Ca 0.29 0.04 -0.29 0.00 0.02 0.00 0.00 57.03 57.10 3dyp h ASP 403 Cb 0.09 0.09 0.02 0.00 0.22 0.00 0.00 39.33 39.74 3dyp h ASP 403 CO -0.04 -0.04 -1.26 0.03 -1.72 0.00 0.00 179.24 176.20 3dyp h ARG 404 N 0.00 0.41 0.00 3.56 3.08 -0.74 -3.30 114.38 117.39 3dyp h ARG 404 Ca 0.07 -0.63 -0.20 0.00 0.07 0.00 0.00 59.98 59.29 3dyp h ARG 404 Cb 0.10 0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.35 3dyp h ARG 404 CO -0.15 1.28 -1.14 1.88 -1.07 0.00 0.00 179.97 180.77 3dyp h TYR 405 N 0.14 0.00 -0.94 3.04 -1.99 -0.38 -3.46 116.97 113.39 3dyp h TYR 405 Ca -0.17 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.56 3dyp h TYR 405 Cb 1.96 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.69 3dyp h TYR 405 CO 0.09 0.83 0.00 0.41 -0.00 0.00 0.00 178.16 179.49 3dyp n GLY 406 N 1.38 -0.44 3.01 3.88 0.00 0.45 -4.79 105.19 108.69 3dyp n GLY 406 Ca -0.05 -0.54 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 3dyp n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyp s LEU 407 N -0.14 1.53 0.14 0.99 1.43 -0.76 -4.66 118.68 117.20 3dyp s LEU 407 Ca 0.00 0.23 -0.30 0.00 -1.03 0.00 0.00 54.13 53.03 3dyp s LEU 407 Cb 0.00 0.44 -0.07 0.00 0.03 0.00 0.00 46.19 46.59 3dyp s LEU 407 CO 0.00 -0.06 1.07 -0.31 0.23 0.00 0.00 176.35 177.28 3dyp s TYR 408 N -0.00 3.64 0.03 0.29 4.12 0.11 -4.68 117.35 120.86 3dyp s TYR 408 Ca -0.01 1.63 0.08 0.00 0.02 0.00 0.00 57.07 58.79 3dyp s TYR 408 Cb -0.01 -3.22 -0.02 0.00 -1.52 0.00 0.00 41.96 37.18 3dyp s TYR 408 CO 0.00 -0.42 -0.23 0.08 0.02 0.00 0.00 175.55 175.01 3dyp s VAL 409 N 0.05 1.82 -0.40 0.71 1.01 0.14 -0.06 120.40 123.66 3dyp s VAL 409 Ca 0.50 -1.18 -0.12 0.00 0.00 0.00 0.00 61.98 61.17 3dyp s VAL 409 Cb -0.27 -1.55 0.04 0.00 0.00 0.00 0.00 36.38 34.59 3dyp s VAL 409 CO 0.32 0.33 0.27 -0.69 0.00 0.00 0.00 175.10 175.33 3dyp s VAL 410 N -0.72 4.81 -0.21 2.92 1.01 -0.23 -1.26 120.40 126.71 3dyp s VAL 410 Ca 0.09 -0.91 -0.17 0.00 0.00 0.00 0.00 61.98 60.99 3dyp s VAL 410 Cb -0.09 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 3dyp s VAL 410 CO 0.01 -0.34 0.47 -0.62 0.00 0.00 0.00 175.10 174.62 3dyp s ASP 411 N 1.80 6.49 -0.08 3.32 2.15 -0.68 -0.81 116.67 128.86 3dyp s ASP 411 Ca 0.03 0.59 0.03 0.00 0.43 0.00 0.00 52.55 53.63 3dyp s ASP 411 Cb -0.20 -2.26 0.01 0.00 -0.30 0.00 0.00 42.92 40.16 3dyp s ASP 411 CO 0.07 -0.14 -0.19 -0.70 -0.17 0.00 0.00 175.17 174.04 3dyp s GLU 412 N 1.55 2.47 0.57 4.34 2.12 -1.26 -0.02 118.70 128.47 3dyp s GLU 412 Ca 0.22 -0.68 -0.21 0.00 0.36 0.00 0.00 54.97 54.65 3dyp s GLU 412 Cb -0.15 -1.92 -0.04 0.00 0.26 0.00 0.00 34.13 32.28 3dyp s GLU 412 CO 0.09 0.12 1.35 0.00 -0.54 0.00 0.00 175.26 176.28 3dyp n ALA 413 N 3.64 1.53 -1.82 6.30 0.00 -0.42 -2.16 120.51 127.59 3dyp n ALA 413 Ca -0.21 0.10 -0.42 0.00 0.00 0.00 0.00 53.44 52.92 3dyp n ALA 413 Cb 0.52 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.62 3dyp n ALA 413 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3dyp n ASN 414 N -1.18 4.03 -3.66 0.00 5.15 -1.26 -4.05 115.26 114.29 3dyp n ASN 414 Ca 0.11 -2.87 -0.26 0.00 -0.60 0.00 0.00 54.58 50.96 3dyp n ASN 414 Cb 0.45 -1.64 -0.17 0.00 -0.53 0.00 0.00 39.78 37.90 3dyp n ASN 414 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3dyp s ILE 415 N 2.86 0.14 -0.12 -1.44 1.01 -1.24 -4.74 121.20 117.66 3dyp s ILE 415 Ca 0.46 -0.27 -0.04 0.00 0.00 0.00 0.00 60.65 60.80 3dyp s ILE 415 Cb 0.13 -0.72 0.06 0.00 0.01 0.00 0.00 42.46 41.95 3dyp s ILE 415 CO -0.08 -0.22 0.23 -0.70 0.00 0.00 0.00 174.94 174.18 3dyp s GLU 416 N 2.04 0.12 -0.33 2.79 2.12 0.22 -1.13 118.70 124.52 3dyp s GLU 416 Ca 0.01 0.68 0.09 0.00 0.36 0.00 0.00 54.97 56.12 3dyp s GLU 416 Cb -0.16 -0.13 0.45 0.00 0.26 0.00 0.00 34.13 34.55 3dyp s GLU 416 CO -0.08 -0.30 1.13 0.25 -0.54 0.00 0.00 175.26 175.72 3dyp n THR 417 N 5.34 2.18 -0.27 -1.70 -2.24 -1.01 -1.39 114.28 115.19 3dyp n THR 417 Ca -0.06 -4.17 0.20 0.00 -2.27 0.00 0.00 64.05 57.76 3dyp n THR 417 Cb 0.50 -0.70 0.51 0.00 -2.10 0.00 0.00 70.33 68.54 3dyp n THR 417 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 3dyp h ASN 418 N 2.43 0.42 0.47 3.42 -0.73 -1.43 -1.98 115.58 118.18 3dyp h ASN 418 Ca 0.24 0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.46 3dyp h ASN 418 Cb 1.28 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 39.85 3dyp h ASN 418 CO 0.69 0.14 0.00 0.61 -0.37 0.00 0.00 177.43 178.50 3dyp n GLY 419 N -1.51 -1.17 3.77 1.57 0.00 -1.20 -4.81 105.19 101.85 3dyp n GLY 419 Ca 0.21 -0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 3dyp n GLY 419 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dyp s MET 420 N -2.51 2.41 -0.14 1.61 -1.94 -0.75 -4.77 119.30 113.21 3dyp s MET 420 Ca 0.28 1.18 -0.01 0.00 -1.71 0.00 0.00 55.69 55.43 3dyp s MET 420 Cb 0.19 -1.91 0.04 0.00 2.01 0.00 0.00 34.83 35.15 3dyp s MET 420 CO 0.41 -1.53 -0.05 0.08 -0.01 0.00 0.00 175.02 173.92 3dyp s VAL 421 N -2.83 1.00 1.15 -6.03 1.01 -1.26 -3.27 120.40 110.17 3dyp s VAL 421 Ca 0.62 -0.46 -0.17 0.00 0.00 0.00 0.00 61.98 61.97 3dyp s VAL 421 Cb -0.17 -1.14 0.26 0.00 0.00 0.00 0.00 36.38 35.33 3dyp s VAL 421 CO 0.54 0.20 1.09 -2.16 0.00 0.00 0.00 175.10 174.77 3dyp s PRO 422 N 1.69 -0.80 0.50 2.72 0.04 -1.26 -4.83 135.00 133.07 3dyp s PRO 422 Ca 0.02 0.16 0.18 0.00 0.04 0.00 0.00 61.00 61.40 3dyp s PRO 422 Cb -0.14 -1.63 1.24 0.00 0.04 0.00 0.00 34.50 34.01 3dyp s PRO 422 CO -0.08 -3.48 2.09 1.98 0.04 0.00 0.00 177.00 177.56 3dyp h MET 423 N -2.42 0.00 -0.75 4.56 4.05 -1.86 -2.27 114.93 116.24 3dyp h MET 423 Ca -0.49 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 58.91 3dyp h MET 423 Cb 1.31 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.10 3dyp h MET 423 CO 0.42 0.08 0.02 0.27 0.23 0.00 0.00 176.91 177.94 3dyp n ASN 424 N -4.30 4.01 -0.28 1.39 6.94 -1.25 -3.93 115.26 117.84 3dyp n ASN 424 Ca -0.03 -2.62 0.03 0.00 -0.02 0.00 0.00 54.58 51.94 3dyp n ASN 424 Cb 0.16 -0.63 0.24 0.00 -2.36 0.00 0.00 39.78 37.20 3dyp n ASN 424 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 3dyp h ARG 425 N 2.45 1.00 0.14 -3.83 2.43 -1.71 0.24 114.38 115.09 3dyp h ARG 425 Ca 0.02 -0.06 -0.33 0.00 -0.81 0.00 0.00 59.98 58.80 3dyp h ARG 425 Cb 1.49 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 30.81 3dyp h ARG 425 CO 0.34 0.66 -1.72 -0.07 -1.51 0.00 0.00 179.97 177.67 3dyp h LEU 426 N 1.02 0.47 -0.51 3.80 3.38 -1.86 -3.34 115.31 118.28 3dyp h LEU 426 Ca 0.36 -0.74 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3dyp h LEU 426 Cb 0.12 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3dyp h LEU 426 CO -0.12 1.63 0.00 0.35 0.09 0.00 0.00 178.44 180.39 3dyp n THR 427 N -3.49 0.76 1.12 0.22 -2.24 -0.92 -1.59 114.28 108.14 3dyp n THR 427 Ca -0.23 0.10 0.12 0.00 -2.27 0.00 0.00 64.05 61.78 3dyp n THR 427 Cb 1.06 -1.01 0.20 0.00 -2.10 0.00 0.00 70.33 68.49 3dyp n THR 427 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3dyp n ASP 428 N -2.23 2.63 -4.57 3.42 2.03 0.03 -1.55 116.55 116.31 3dyp n ASP 428 Ca 0.03 -1.88 -0.40 0.00 0.52 0.00 0.00 54.79 53.06 3dyp n ASP 428 Cb 0.28 -0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.59 3dyp n ASP 428 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3dyp s ASP 429 N -2.00 6.28 0.62 1.67 -1.08 -0.62 -4.57 116.67 116.97 3dyp s ASP 429 Ca 0.30 0.05 0.40 0.00 -0.52 0.00 0.00 52.55 52.78 3dyp s ASP 429 Cb 0.20 -2.24 2.03 0.00 -1.46 0.00 0.00 42.92 41.46 3dyp s ASP 429 CO 0.31 -0.35 2.24 1.55 0.52 0.00 0.00 175.17 179.43 3dyp h PRO 430 N 8.35 0.00 0.00 4.34 0.13 -1.90 0.17 132.00 143.09 3dyp h PRO 430 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3dyp h PRO 430 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3dyp h PRO 430 CO 0.72 0.01 0.00 0.54 -0.23 0.00 0.00 178.00 179.03 3dyp n ARG 431 N -3.15 0.14 0.00 0.86 1.74 -1.26 -1.78 116.66 113.22 3dyp n ARG 431 Ca -0.02 0.40 0.11 0.00 -0.77 0.00 0.00 57.85 57.57 3dyp n ARG 431 Cb 0.15 -1.78 0.02 0.00 -1.02 0.00 0.00 32.46 29.83 3dyp n ARG 431 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3dyp n TRP 432 N -2.05 0.00 -0.24 -1.55 7.02 0.60 -4.49 117.44 116.73 3dyp n TRP 432 Ca 0.02 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.48 3dyp n TRP 432 Cb 0.20 0.00 0.09 0.00 -2.42 0.00 0.00 31.31 29.18 3dyp n TRP 432 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 3dyp h LEU 433 N 2.97 0.63 0.13 -0.99 5.85 -1.29 -1.63 115.31 120.97 3dyp h LEU 433 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3dyp h LEU 433 Cb 0.80 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 3dyp h LEU 433 CO 0.00 0.42 -0.12 -0.65 -0.34 0.00 0.00 178.44 177.75 3dyp h PRO 434 N 0.76 -0.26 -0.92 5.25 0.11 -1.79 1.15 132.00 136.31 3dyp h PRO 434 Ca 0.29 0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.43 3dyp h PRO 434 Cb 0.11 0.06 -0.05 0.00 0.11 0.00 0.00 31.00 31.24 3dyp h PRO 434 CO -0.15 -0.17 0.61 0.00 -0.21 0.00 0.00 178.00 178.07 3dyp h ALA 435 N 0.58 1.16 -0.36 -0.75 0.00 -1.72 -1.61 119.26 116.56 3dyp h ALA 435 Ca 0.00 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 3dyp h ALA 435 Cb 0.25 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3dyp h ALA 435 CO -0.03 0.56 -0.36 0.52 0.00 0.00 0.00 179.25 179.94 3dyp h MET 436 N 1.24 0.84 -0.83 0.00 2.86 -0.75 -2.97 114.93 115.32 3dyp h MET 436 Ca 0.34 -0.42 0.08 0.00 -2.06 0.00 0.00 59.70 57.63 3dyp h MET 436 Cb -0.14 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.45 3dyp h MET 436 CO -0.07 1.06 0.49 0.66 1.06 0.00 0.00 176.91 180.11 3dyp h SER 437 N 0.69 0.74 0.26 1.22 4.64 0.21 -1.90 113.55 119.41 3dyp h SER 437 Ca 0.06 0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 61.36 3dyp h SER 437 Cb 0.93 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 3dyp h SER 437 CO 0.09 0.45 -0.27 -0.33 -0.87 0.00 0.00 176.83 175.90 3dyp h GLU 438 N 0.86 0.01 -0.16 4.77 5.08 -1.16 0.40 114.58 124.39 3dyp h GLU 438 Ca 0.38 -0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.61 3dyp h GLU 438 Cb 0.27 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3dyp h GLU 438 CO -0.21 0.28 -0.46 0.00 -1.00 0.00 0.00 179.01 177.62 3dyp h ARG 439 N 0.01 0.39 0.03 2.33 3.08 -1.31 -1.89 114.38 117.03 3dyp h ARG 439 Ca -0.00 -0.21 -0.09 0.00 0.07 0.00 0.00 59.98 59.74 3dyp h ARG 439 Cb 0.48 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 3dyp h ARG 439 CO 0.04 0.78 -0.47 0.28 -1.07 0.00 0.00 179.97 179.53 3dyp h VAL 440 N 0.32 1.52 -0.58 2.04 2.07 -0.84 -3.32 116.25 117.46 3dyp h VAL 440 Ca 0.02 -2.34 -0.09 0.00 0.82 0.00 0.00 66.70 65.11 3dyp h VAL 440 Cb 0.94 3.08 -0.02 0.00 -1.52 0.00 0.00 31.29 33.76 3dyp h VAL 440 CO 0.08 0.57 0.01 0.71 0.02 0.00 0.00 177.57 178.96 3dyp h THR 441 N -0.87 1.26 0.00 2.57 1.35 -0.27 -2.68 112.91 114.27 3dyp h THR 441 Ca -0.11 -1.11 -0.07 0.00 -0.55 0.00 0.00 66.41 64.56 3dyp h THR 441 Cb 1.20 0.80 -0.01 0.00 -1.73 0.00 0.00 68.15 68.41 3dyp h THR 441 CO -0.02 0.40 -0.34 0.03 -0.25 0.00 0.00 175.52 175.34 3dyp h ARG 442 N 0.93 0.00 -0.20 4.72 3.08 -1.55 -0.57 114.38 120.79 3dyp h ARG 442 Ca 0.17 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.12 3dyp h ARG 442 Cb 0.52 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 3dyp h ARG 442 CO 0.03 0.34 -0.28 1.98 -1.07 0.00 0.00 179.97 180.97 3dyp h MET 443 N 0.00 0.54 -0.50 0.04 4.05 -1.59 -1.98 114.93 115.48 3dyp h MET 443 Ca -0.00 -0.32 -0.08 0.00 -0.28 0.00 0.00 59.70 59.01 3dyp h MET 443 Cb 0.67 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.48 3dyp h MET 443 CO 0.04 0.92 -0.01 0.28 0.23 0.00 0.00 176.91 178.37 3dyp h VAL 444 N 0.21 1.26 -0.53 -5.77 2.07 -1.16 -0.54 116.25 111.80 3dyp h VAL 444 Ca 0.02 -1.10 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 3dyp h VAL 444 Cb 0.86 0.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 3dyp h VAL 444 CO 0.07 0.39 0.32 1.56 0.02 0.00 0.00 177.57 179.92 3dyp h GLN 445 N 0.76 0.72 0.12 1.57 4.20 -1.08 -2.01 115.11 119.39 3dyp h GLN 445 Ca 0.14 -0.06 -0.25 0.00 0.06 0.00 0.00 58.65 58.55 3dyp h GLN 445 Cb 0.53 -0.15 0.03 0.00 0.30 0.00 0.00 27.48 28.19 3dyp h GLN 445 CO 0.03 0.51 -1.04 -0.09 -0.67 0.00 0.00 178.83 177.57 3dyp h ARG 446 N 0.73 0.49 -0.02 1.46 2.43 -0.84 -3.08 114.38 115.55 3dyp h ARG 446 Ca 0.19 -0.69 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 3dyp h ARG 446 Cb -0.02 0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3dyp h ARG 446 CO -0.04 1.30 -0.04 -0.25 -1.51 0.00 0.00 179.97 179.43 3dyp n ASP 447 N -3.96 2.26 0.14 -3.80 8.00 -0.25 -4.25 116.55 114.69 3dyp n ASP 447 Ca -0.14 -1.63 0.10 0.00 0.71 0.00 0.00 54.79 53.84 3dyp n ASP 447 Cb 0.90 0.06 0.52 0.00 -0.02 0.00 0.00 41.12 42.58 3dyp n ASP 447 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3dyp n ARG 448 N 0.78 0.14 -0.13 -1.24 1.85 -0.77 -1.65 116.66 115.64 3dyp n ARG 448 Ca 0.09 0.57 0.11 0.00 -1.00 0.00 0.00 57.85 57.62 3dyp n ARG 448 Cb 0.40 -1.90 0.27 0.00 -1.05 0.00 0.00 32.46 30.18 3dyp n ARG 448 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3dyp n ASN 449 N -2.19 2.72 -4.66 2.89 3.02 -1.26 -4.82 115.26 110.96 3dyp n ASN 449 Ca -0.00 -1.88 -0.41 0.00 -0.03 0.00 0.00 54.58 52.26 3dyp n ASN 449 Cb 0.08 -0.17 -0.05 0.00 -0.61 0.00 0.00 39.78 39.03 3dyp n ASN 449 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3dyp s HIS 450 N -1.65 3.38 0.42 3.10 3.76 -0.66 -4.86 115.29 118.78 3dyp s HIS 450 Ca 0.35 1.04 0.10 0.00 -0.15 0.00 0.00 55.06 56.41 3dyp s HIS 450 Cb 0.20 -2.89 0.91 0.00 1.11 0.00 0.00 32.58 31.91 3dyp s HIS 450 CO 0.29 -0.23 2.00 -1.00 -0.85 0.00 0.00 174.74 174.95 3dyp h PRO 451 N 7.48 0.25 0.00 8.40 0.13 -1.87 -2.44 132.00 143.95 3dyp h PRO 451 Ca -0.30 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.77 3dyp h PRO 451 Cb 1.13 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 3dyp h PRO 451 CO 0.80 0.29 -0.11 0.66 -0.23 0.00 0.00 178.00 179.41 3dyp h SER 452 N 0.24 0.00 -2.90 1.44 4.64 -1.87 -3.40 113.55 111.71 3dyp h SER 452 Ca 0.06 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.81 3dyp h SER 452 Cb 0.20 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 3dyp h SER 452 CO 0.01 0.11 1.03 -0.69 -0.87 0.00 0.00 176.83 176.41 3dyp s VAL 453 N -4.78 3.95 -0.12 0.95 1.01 -0.92 0.26 120.40 120.74 3dyp s VAL 453 Ca -0.04 1.10 0.11 0.00 0.00 0.00 0.00 61.98 63.14 3dyp s VAL 453 Cb 0.16 -3.88 -0.16 0.00 0.00 0.00 0.00 36.38 32.50 3dyp s VAL 453 CO 0.68 -0.29 0.28 2.30 0.00 0.00 0.00 175.10 178.07 3dyp n ILE 454 N 6.02 0.00 -3.81 2.22 -5.35 -0.39 -4.90 119.36 113.14 3dyp n ILE 454 Ca 0.16 -0.25 -0.13 0.00 -0.27 0.00 0.00 62.75 62.27 3dyp n ILE 454 Cb 0.45 0.42 -0.13 0.00 -1.74 0.00 0.00 39.64 38.64 3dyp n ILE 454 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3dyp s ILE 455 N -2.58 -0.01 -0.06 7.28 1.01 -1.19 -3.91 121.20 121.73 3dyp s ILE 455 Ca -0.02 0.02 -0.08 0.00 0.00 0.00 0.00 60.65 60.57 3dyp s ILE 455 Cb 0.07 -0.22 -0.05 0.00 0.01 0.00 0.00 42.46 42.28 3dyp s ILE 455 CO 0.44 0.01 0.23 0.26 0.00 0.00 0.00 174.94 175.88 3dyp s TRP 456 N 0.22 3.62 -0.03 3.97 0.52 -0.53 -1.68 118.94 125.02 3dyp s TRP 456 Ca -0.01 0.63 0.07 0.00 0.02 0.00 0.00 56.10 56.81 3dyp s TRP 456 Cb -0.02 -2.02 -0.02 0.00 -1.15 0.00 0.00 33.47 30.25 3dyp s TRP 456 CO -0.01 0.69 -0.23 0.45 0.02 0.00 0.00 176.95 177.87 3dyp s SER 457 N -1.23 3.29 0.00 2.95 0.15 0.97 -0.62 113.70 119.21 3dyp s SER 457 Ca 0.20 -0.41 0.21 0.00 0.70 0.00 0.00 55.95 56.65 3dyp s SER 457 Cb -0.13 -0.51 1.23 0.00 -1.71 0.00 0.00 66.02 64.89 3dyp s SER 457 CO 0.09 0.32 1.70 0.18 1.20 0.00 0.00 173.24 176.73 3dyp n LEU 458 N 2.47 0.00 0.00 3.45 4.77 -0.95 -1.30 117.00 125.44 3dyp n LEU 458 Ca -0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 3dyp n LEU 458 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3dyp n LEU 458 CO 0.24 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 3dyp n GLY 459 N 0.62 0.47 3.35 -0.72 0.00 -1.26 -4.64 105.19 103.02 3dyp n GLY 459 Ca 0.15 -2.03 -0.14 0.00 0.00 0.00 0.00 46.02 44.01 3dyp n GLY 459 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dyp s ASN 460 N -4.00 -0.44 -0.94 1.61 2.47 -0.28 -4.73 114.94 108.63 3dyp s ASN 460 Ca 0.00 0.71 -0.21 0.00 0.42 0.00 0.00 52.86 53.78 3dyp s ASN 460 Cb 0.00 0.76 0.03 0.00 -1.45 0.00 0.00 41.25 40.59 3dyp s ASN 460 CO 0.00 -0.28 0.56 -0.62 -3.72 0.00 0.00 177.10 173.04 3dyp n GLU 461 N 2.24 -0.62 -1.06 0.43 1.02 -1.26 -3.80 120.64 117.59 3dyp n GLU 461 Ca -0.16 0.17 0.05 0.00 -0.02 0.00 0.00 57.16 57.20 3dyp n GLU 461 Cb 0.57 -1.93 0.10 0.00 -0.02 0.00 0.00 31.44 30.15 3dyp n GLU 461 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3dyp n SER 462 N -1.84 1.28 0.00 1.62 7.64 -1.26 -1.28 113.62 119.78 3dyp n SER 462 Ca -0.15 -2.79 0.00 0.00 1.01 0.00 0.00 58.87 56.94 3dyp n SER 462 Cb 0.52 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 3dyp n SER 462 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dyp n GLY 463 N -0.22 0.57 2.90 0.23 0.00 -1.25 -3.90 105.19 103.52 3dyp n GLY 463 Ca 0.11 -0.85 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 3dyp n GLY 463 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3dyp s HIS 464 N 0.00 2.01 0.33 1.61 2.46 -1.26 -3.39 115.29 117.04 3dyp s HIS 464 Ca 0.00 -1.42 0.06 0.00 0.47 0.00 0.00 55.06 54.18 3dyp s HIS 464 Cb 0.00 -1.43 -0.07 0.00 -0.13 0.00 0.00 32.58 30.95 3dyp s HIS 464 CO 0.00 -0.70 -0.02 0.20 -2.47 0.00 0.00 174.74 171.75 3dyp s GLY 465 N 1.53 2.10 0.55 1.59 0.00 -1.26 -4.83 107.32 106.99 3dyp s GLY 465 Ca -0.03 -2.06 0.23 0.00 0.00 0.00 0.00 44.72 42.86 3dyp s GLY 465 CO -0.07 -1.92 2.20 0.00 0.00 0.00 0.00 173.10 173.30 3dyp h ALA 466 N 2.09 1.74 -0.49 3.20 0.00 -1.79 0.46 119.26 124.47 3dyp h ALA 466 Ca -0.41 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.51 3dyp h ALA 466 Cb 1.24 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 3dyp h ALA 466 CO 0.71 0.01 0.33 -0.91 0.00 0.00 0.00 179.25 179.39 3dyp h ASN 467 N 0.00 0.51 -0.35 0.00 2.35 -1.59 -1.57 115.58 114.93 3dyp h ASN 467 Ca -0.00 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 3dyp h ASN 467 Cb 0.02 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 3dyp h ASN 467 CO 0.00 0.36 0.12 0.45 -1.65 0.00 0.00 177.43 176.70 3dyp h HIS 468 N 0.59 0.55 -0.62 1.19 3.86 -1.08 -1.38 115.15 118.27 3dyp h HIS 468 Ca 0.19 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.35 3dyp h HIS 468 Cb 0.04 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.32 3dyp h HIS 468 CO -0.00 0.53 0.39 -0.44 0.86 0.00 0.00 177.93 179.28 3dyp h ASP 469 N 0.41 0.73 -0.47 2.45 3.32 -1.26 0.38 116.42 121.98 3dyp h ASP 469 Ca 0.11 -0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.14 3dyp h ASP 469 Cb 0.23 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 3dyp h ASP 469 CO -0.01 0.55 0.29 0.00 -1.72 0.00 0.00 179.24 178.35 3dyp h ALA 470 N 1.21 0.60 -0.19 3.45 0.00 -1.18 -1.91 119.26 121.24 3dyp h ALA 470 Ca 0.23 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.96 3dyp h ALA 470 Cb -0.06 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 3dyp h ALA 470 CO -0.05 -0.01 -0.57 -0.07 0.00 0.00 0.00 179.25 178.55 3dyp h LEU 471 N 0.58 0.65 -0.40 0.00 3.38 -0.85 -0.86 115.31 117.81 3dyp h LEU 471 Ca 0.19 -0.36 0.06 0.00 0.09 0.00 0.00 57.88 57.86 3dyp h LEU 471 Cb 0.00 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.51 3dyp h LEU 471 CO -0.08 1.08 0.10 0.22 0.09 0.00 0.00 178.44 179.85 3dyp h TYR 472 N 0.44 0.17 -0.71 1.13 3.20 -0.04 -1.66 116.97 119.51 3dyp h TYR 472 Ca 0.00 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.83 3dyp h TYR 472 Cb 1.12 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 39.35 3dyp h TYR 472 CO 0.05 0.04 0.17 -0.09 -1.64 0.00 0.00 178.16 176.69 3dyp h ARG 473 N 0.24 1.13 -0.33 1.82 9.65 -1.01 -1.24 114.38 124.64 3dyp h ARG 473 Ca 0.19 -0.27 0.05 0.00 -1.10 0.00 0.00 59.98 58.85 3dyp h ARG 473 Cb 0.21 -0.15 -0.05 0.00 -1.39 0.00 0.00 29.97 28.60 3dyp h ARG 473 CO -0.23 1.00 0.05 2.35 2.80 0.00 0.00 179.97 185.94 3dyp h TRP 474 N 1.07 0.07 -0.05 2.20 7.01 -0.68 0.41 115.95 125.98 3dyp h TRP 474 Ca 0.22 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.24 3dyp h TRP 474 Cb 0.38 0.02 -0.00 0.00 -2.10 0.00 0.00 29.16 27.46 3dyp h TRP 474 CO 0.03 -0.00 0.03 0.82 -2.79 0.00 0.00 178.44 176.53 3dyp h ILE 475 N 0.15 1.05 -0.95 2.65 2.04 -1.00 0.18 117.51 121.64 3dyp h ILE 475 Ca 0.16 -0.14 0.21 0.00 1.00 0.00 0.00 64.86 66.10 3dyp h ILE 475 Cb 0.19 1.05 -0.08 0.00 -0.74 0.00 0.00 36.82 37.24 3dyp h ILE 475 CO -0.23 0.04 0.62 0.11 0.00 0.00 0.00 178.15 178.69 3dyp h LYS 476 N 0.03 0.44 -0.00 2.37 1.79 -0.93 0.92 116.57 121.18 3dyp h LYS 476 Ca 0.02 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 3dyp h LYS 476 Cb 0.04 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.59 3dyp h LYS 476 CO -0.00 0.29 -0.02 1.03 -1.08 0.00 0.00 179.45 179.67 3dyp h SER 477 N 0.45 0.02 1.11 0.86 0.87 0.04 -3.30 113.55 113.60 3dyp h SER 477 Ca 0.51 -0.73 -0.13 0.00 -1.23 0.00 0.00 61.79 60.20 3dyp h SER 477 Cb 1.20 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 63.14 3dyp h SER 477 CO -0.22 0.75 -0.62 -0.37 -0.53 0.00 0.00 176.83 175.84 3dyp h VAL 478 N -0.71 1.17 -2.34 2.23 -1.51 -0.09 -3.41 116.25 111.60 3dyp h VAL 478 Ca -0.00 -2.37 -0.51 0.00 -1.23 0.00 0.00 66.70 62.59 3dyp h VAL 478 Cb 0.75 2.39 -0.36 0.00 -2.13 0.00 0.00 31.29 31.94 3dyp h VAL 478 CO 0.00 0.61 -0.80 -0.62 -1.23 0.00 0.00 177.57 175.53 3dyp s ASP 479 N -6.56 2.22 0.00 4.19 2.15 0.26 -4.95 116.67 113.98 3dyp s ASP 479 Ca 0.02 -2.03 0.23 0.00 0.43 0.00 0.00 52.55 51.19 3dyp s ASP 479 Cb 0.10 -0.05 1.15 0.00 -0.30 0.00 0.00 42.92 43.82 3dyp s ASP 479 CO 0.75 -0.28 1.75 -2.65 -0.17 0.00 0.00 175.17 174.57 3dyp n PRO 480 N 4.03 0.32 0.08 4.34 -0.02 -1.24 -3.44 135.00 139.06 3dyp n PRO 480 Ca 0.13 0.07 0.11 0.00 -2.02 0.00 0.00 63.50 61.79 3dyp n PRO 480 Cb 0.40 -1.50 0.44 0.00 -0.02 0.00 0.00 33.50 32.82 3dyp n PRO 480 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3dyp n SER 481 N -1.29 0.42 -3.92 2.55 3.41 -1.26 -4.75 113.62 108.79 3dyp n SER 481 Ca 0.11 0.59 -0.12 0.00 -0.26 0.00 0.00 58.87 59.19 3dyp n SER 481 Cb 0.18 -0.68 -0.13 0.00 -0.26 0.00 0.00 64.21 63.32 3dyp n SER 481 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dyp s ARG 482 N -3.16 0.15 0.72 4.33 0.52 -1.22 -4.15 118.95 116.13 3dyp s ARG 482 Ca 0.07 -0.22 -0.14 0.00 -0.52 0.00 0.00 55.73 54.91 3dyp s ARG 482 Cb 0.11 -0.02 0.03 0.00 0.52 0.00 0.00 34.95 35.59 3dyp s ARG 482 CO 0.39 -0.00 1.15 -2.14 0.02 0.00 0.00 175.30 174.72 3dyp s PRO 483 N -0.50 2.35 -0.12 3.54 0.02 -1.25 -4.77 135.00 134.26 3dyp s PRO 483 Ca -0.05 1.51 0.01 0.00 0.02 0.00 0.00 61.00 62.49 3dyp s PRO 483 Cb -0.03 -1.88 -0.01 0.00 0.02 0.00 0.00 34.50 32.59 3dyp s PRO 483 CO -0.00 -1.63 -0.14 0.08 -0.33 0.00 0.00 177.00 174.98 3dyp s VAL 484 N -2.30 2.97 0.18 3.83 1.01 -1.26 -1.46 120.40 123.38 3dyp s VAL 484 Ca 0.69 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 62.03 3dyp s VAL 484 Cb -0.23 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.87 3dyp s VAL 484 CO 0.46 0.53 -0.10 0.00 0.00 0.00 0.00 175.10 175.99 3dyp s GLN 485 N 0.24 1.21 -0.29 2.72 -2.07 0.21 0.11 119.66 121.80 3dyp s GLN 485 Ca -0.09 -1.54 -0.17 0.00 -1.82 0.00 0.00 55.36 51.73 3dyp s GLN 485 Cb -0.16 -0.82 0.14 0.00 -1.09 0.00 0.00 33.01 31.08 3dyp s GLN 485 CO 0.05 0.09 0.96 -0.47 -1.32 0.00 0.00 175.29 174.61 3dyp s TYR 486 N -3.20 -0.59 -0.23 9.60 5.04 -1.26 -2.23 117.35 124.48 3dyp s TYR 486 Ca 0.21 1.21 0.22 0.00 -2.44 0.00 0.00 57.07 56.27 3dyp s TYR 486 Cb 0.02 0.37 -0.08 0.00 0.35 0.00 0.00 41.96 42.61 3dyp s TYR 486 CO 0.04 -0.29 0.89 -1.91 -1.34 0.00 0.00 175.55 172.94 3dyp n GLU 487 N 3.58 0.58 -1.40 4.97 0.00 -1.26 -4.66 120.64 122.45 3dyp n GLU 487 Ca -0.18 0.02 -0.36 0.00 0.00 0.00 0.00 57.16 56.64 3dyp n GLU 487 Cb 0.58 -1.71 0.08 0.00 0.00 0.00 0.00 31.44 30.39 3dyp n GLU 487 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3dyp n GLY 488 N 1.23 -0.41 2.27 8.31 0.00 -1.26 0.49 105.19 115.82 3dyp n GLY 488 Ca -0.01 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 3dyp n GLY 488 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 489 N 1.12 0.82 0.00 -0.02 0.00 -1.22 -3.83 105.19 102.07 3dyp n GLY 489 Ca 0.13 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.62 3dyp n GLY 489 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 490 N -1.51 0.92 3.82 -0.02 0.00 -1.19 -4.71 105.19 102.50 3dyp n GLY 490 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3dyp n GLY 490 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dyp n ALA 491 N -0.37 0.00 -2.53 4.61 0.00 0.18 -4.69 120.51 117.71 3dyp n ALA 491 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 3dyp n ALA 491 Cb 0.00 -0.53 0.03 0.00 0.00 0.00 0.00 19.45 18.94 3dyp n ALA 491 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3dyp n ASP 492 N 0.00 1.08 -2.88 0.00 5.75 -1.26 -2.02 116.55 117.22 3dyp n ASP 492 Ca 0.00 -2.03 -0.13 0.00 -0.01 0.00 0.00 54.79 52.62 3dyp n ASP 492 Cb 0.00 -0.32 0.10 0.00 -1.03 0.00 0.00 41.12 39.86 3dyp n ASP 492 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3dyp n THR 493 N 0.35 0.00 1.49 2.12 -2.24 -1.26 -4.89 114.28 109.84 3dyp n THR 493 Ca 0.06 -0.35 0.09 0.00 -2.27 0.00 0.00 64.05 61.58 3dyp n THR 493 Cb 1.10 -1.55 0.53 0.00 -2.10 0.00 0.00 70.33 68.32 3dyp n THR 493 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3dyp n THR 494 N -3.06 0.00 -1.05 4.28 -2.24 -1.26 -2.85 114.28 108.10 3dyp n THR 494 Ca 0.07 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.87 3dyp n THR 494 Cb 0.25 -0.50 0.29 0.00 -2.10 0.00 0.00 70.33 68.27 3dyp n THR 494 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dyp n ALA 495 N -0.88 3.81 -3.39 6.98 0.00 -1.26 -4.95 120.51 120.83 3dyp n ALA 495 Ca 0.13 -2.36 -0.13 0.00 0.00 0.00 0.00 53.44 51.09 3dyp n ALA 495 Cb 0.06 -0.96 -0.13 0.00 0.00 0.00 0.00 19.45 18.42 3dyp n ALA 495 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3dyp s THR 496 N -2.93 -0.02 -0.99 0.00 -1.32 -1.13 -4.10 115.64 105.14 3dyp s THR 496 Ca 0.49 0.09 0.26 0.00 -1.21 0.00 0.00 61.69 61.32 3dyp s THR 496 Cb 0.40 -0.24 0.06 0.00 -1.51 0.00 0.00 72.50 71.21 3dyp s THR 496 CO 0.11 0.04 1.53 0.47 -2.21 0.00 0.00 174.62 174.55 3dyp n ASP 497 N 3.62 0.39 -4.09 8.08 8.00 0.12 -4.83 116.55 127.84 3dyp n ASP 497 Ca -0.20 -0.07 -0.24 0.00 0.71 0.00 0.00 54.79 54.99 3dyp n ASP 497 Cb 0.55 0.07 -0.16 0.00 -0.02 0.00 0.00 41.12 41.57 3dyp n ASP 497 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3dyp s ILE 498 N -3.00 1.22 -0.27 0.53 1.01 -1.26 -4.53 121.20 114.89 3dyp s ILE 498 Ca 0.12 -0.60 -0.29 0.00 0.00 0.00 0.00 60.65 59.88 3dyp s ILE 498 Cb 0.18 -1.05 -0.01 0.00 0.01 0.00 0.00 42.46 41.59 3dyp s ILE 498 CO 0.66 0.36 1.38 -0.63 0.00 0.00 0.00 174.94 176.71 3dyp s ILE 499 N 0.07 4.03 -0.47 2.92 1.01 0.39 -4.68 121.20 124.47 3dyp s ILE 499 Ca -0.03 1.17 0.09 0.00 0.00 0.00 0.00 60.65 61.87 3dyp s ILE 499 Cb -0.10 -4.03 0.36 0.00 0.01 0.00 0.00 42.46 38.69 3dyp s ILE 499 CO 0.01 -0.41 0.87 0.00 0.00 0.00 0.00 174.94 175.41 3dyp n PRO 501 N -0.03 -0.67 -4.33 0.00 -0.04 -1.26 -3.32 135.00 125.35 3dyp n PRO 501 Ca 0.28 -0.14 -0.34 0.00 -0.04 0.00 0.00 63.50 63.26 3dyp n PRO 501 Cb 0.55 -2.31 -0.15 0.00 -0.04 0.00 0.00 33.50 31.55 3dyp n PRO 501 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dyp s MET 502 N -4.53 3.25 -1.24 0.54 0.23 -1.26 -1.01 119.30 115.29 3dyp s MET 502 Ca 0.66 -0.72 0.00 0.00 -1.03 0.00 0.00 55.69 54.61 3dyp s MET 502 Cb -0.23 -2.73 0.00 0.00 -1.53 0.00 0.00 34.83 30.34 3dyp s MET 502 CO 0.60 -0.05 0.00 0.66 -2.03 0.00 0.00 175.02 174.20 3dyp n TYR 503 N 4.27 -0.04 -2.33 3.16 4.02 0.50 -4.97 117.16 121.77 3dyp n TYR 503 Ca -0.19 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.32 3dyp n TYR 503 Cb 0.51 -2.23 -0.02 0.00 -0.02 0.00 0.00 39.34 37.59 3dyp n TYR 503 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3dyp s ALA 504 N -2.45 3.09 0.59 -0.72 0.00 -1.26 -4.89 121.76 116.12 3dyp s ALA 504 Ca 0.00 0.91 -0.07 0.00 0.00 0.00 0.00 51.96 52.81 3dyp s ALA 504 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.76 3dyp s ALA 504 CO 0.00 -0.51 0.91 1.03 0.00 0.00 0.00 175.76 177.19 3dyp s ARG 505 N -2.45 3.01 -0.02 0.00 0.52 -1.26 -4.81 118.95 113.95 3dyp s ARG 505 Ca 0.59 0.09 -0.22 0.00 -0.52 0.00 0.00 55.73 55.67 3dyp s ARG 505 Cb -0.29 -2.25 -0.15 0.00 0.52 0.00 0.00 34.95 32.78 3dyp s ARG 505 CO 0.35 -0.67 1.02 0.28 0.02 0.00 0.00 175.30 176.30 3dyp h VAL 506 N -0.19 0.59 0.00 3.52 2.07 -1.94 0.29 116.25 120.60 3dyp h VAL 506 Ca -0.45 -0.75 -0.06 0.00 0.82 0.00 0.00 66.70 66.25 3dyp h VAL 506 Cb 1.25 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 3dyp h VAL 506 CO 0.61 0.12 -1.44 0.47 0.02 0.00 0.00 177.57 177.35 3dyp n ASP 507 N -5.08 3.12 -4.65 0.57 8.00 -1.26 -3.37 116.55 113.87 3dyp n ASP 507 Ca -0.09 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.02 3dyp n ASP 507 Cb 0.27 1.08 -0.06 0.00 -0.02 0.00 0.00 41.12 42.38 3dyp n ASP 507 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3dyp s GLU 508 N -2.40 4.18 0.47 -1.24 2.12 -1.26 -4.73 118.70 115.84 3dyp s GLU 508 Ca -0.03 0.50 -0.20 0.00 0.36 0.00 0.00 54.97 55.59 3dyp s GLU 508 Cb 0.04 -3.58 -0.09 0.00 0.26 0.00 0.00 34.13 30.76 3dyp s GLU 508 CO 0.33 -0.22 1.03 -0.51 -0.54 0.00 0.00 175.26 175.34 3dyp s ASP 509 N 1.23 6.45 -0.51 -1.70 1.01 -1.26 -3.76 116.67 118.13 3dyp s ASP 509 Ca 0.26 1.90 0.04 0.00 0.71 0.00 0.00 52.55 55.45 3dyp s ASP 509 Cb -0.16 -2.56 0.16 0.00 1.01 0.00 0.00 42.92 41.37 3dyp s ASP 509 CO 0.10 -0.71 0.36 -1.10 0.21 0.00 0.00 175.17 174.03 3dyp s GLN 510 N -3.20 1.53 -1.63 8.23 -0.21 -0.08 -4.90 119.66 119.41 3dyp s GLN 510 Ca 0.66 -2.46 -0.10 0.00 0.02 0.00 0.00 55.36 53.48 3dyp s GLN 510 Cb -0.15 -2.36 -0.09 0.00 1.00 0.00 0.00 33.01 31.41 3dyp s GLN 510 CO 0.19 -1.28 2.97 -0.35 -2.12 0.00 0.00 175.29 174.70 3dyp n PRO 511 N 2.81 3.70 -1.76 2.91 -0.04 -1.26 -0.98 135.00 140.38 3dyp n PRO 511 Ca 0.19 -2.20 -0.38 0.00 -0.04 0.00 0.00 63.50 61.08 3dyp n PRO 511 Cb 0.39 -2.80 0.05 0.00 -0.04 0.00 0.00 33.50 31.10 3dyp n PRO 511 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3dyp s PHE 512 N 2.18 2.20 0.39 0.54 0.40 -1.26 -4.84 117.98 117.58 3dyp s PHE 512 Ca 0.70 1.40 -0.27 0.00 -0.60 0.00 0.00 56.93 58.17 3dyp s PHE 512 Cb 0.18 -3.78 -0.09 0.00 0.51 0.00 0.00 43.02 39.84 3dyp s PHE 512 CO -0.06 -2.95 1.32 -2.14 0.70 0.00 0.00 175.22 172.08 3dyp s PRO 513 N -3.07 4.06 0.00 0.24 0.02 -1.26 -2.10 135.00 132.89 3dyp s PRO 513 Ca 0.75 2.20 0.00 0.00 0.02 0.00 0.00 61.00 63.97 3dyp s PRO 513 Cb -0.40 -2.84 0.00 0.00 0.02 0.00 0.00 34.50 31.29 3dyp s PRO 513 CO 0.45 -0.43 0.00 0.00 -0.33 0.00 0.00 177.00 176.69 3dyp n ALA 514 N 0.29 0.00 -3.18 -1.55 0.00 -1.26 -4.52 120.51 110.28 3dyp n ALA 514 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.26 3dyp n ALA 514 Cb 0.43 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.83 3dyp n ALA 514 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3dyp n VAL 515 N 0.00 0.04 -1.30 0.00 0.24 -1.20 -4.82 118.33 111.29 3dyp n VAL 515 Ca 0.00 -4.51 -0.34 0.00 -2.04 0.00 0.00 64.34 57.45 3dyp n VAL 515 Cb 0.00 -0.99 0.11 0.00 -1.47 0.00 0.00 33.84 31.49 3dyp n VAL 515 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3dyp s PRO 516 N -2.11 1.91 -0.53 7.34 0.04 -0.89 -4.58 135.00 136.19 3dyp s PRO 516 Ca 0.39 1.79 -0.03 0.00 0.04 0.00 0.00 61.00 63.19 3dyp s PRO 516 Cb 0.28 -1.80 0.14 0.00 0.04 0.00 0.00 34.50 33.15 3dyp s PRO 516 CO -0.09 -2.01 0.33 0.15 0.04 0.00 0.00 177.00 175.42 3dyp s LYS 517 N -3.98 2.31 0.71 4.56 1.02 -0.15 -4.88 119.74 119.33 3dyp s LYS 517 Ca 0.75 -2.23 -0.11 0.00 0.02 0.00 0.00 55.97 54.40 3dyp s LYS 517 Cb -0.30 -3.66 0.01 0.00 -0.52 0.00 0.00 37.83 33.37 3dyp s LYS 517 CO 0.48 -1.13 1.06 -1.58 -0.92 0.00 0.00 175.35 173.26 3dyp s TRP 518 N 0.45 3.07 0.28 3.18 0.52 -1.26 -0.90 118.94 124.28 3dyp s TRP 518 Ca 0.13 1.41 -0.29 0.00 0.02 0.00 0.00 56.10 57.36 3dyp s TRP 518 Cb -0.22 -2.91 -0.13 0.00 -1.15 0.00 0.00 33.47 29.06 3dyp s TRP 518 CO -0.04 -1.30 1.22 0.45 0.02 0.00 0.00 176.95 177.31 3dyp n SER 519 N -3.17 2.18 -0.24 2.95 2.88 -1.25 -4.38 113.62 112.60 3dyp n SER 519 Ca 0.08 1.18 0.03 0.00 -1.33 0.00 0.00 58.87 58.82 3dyp n SER 519 Cb 0.54 -1.39 0.26 0.00 -0.75 0.00 0.00 64.21 62.87 3dyp n SER 519 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 3dyp h ILE 520 N 2.52 1.13 -0.59 2.46 3.07 -0.94 0.20 117.51 125.36 3dyp h ILE 520 Ca -0.44 -0.33 -0.04 0.00 1.55 0.00 0.00 64.86 65.60 3dyp h ILE 520 Cb 1.30 0.07 -0.03 0.00 -0.27 0.00 0.00 36.82 37.89 3dyp h ILE 520 CO 0.66 0.18 0.23 0.11 -1.05 0.00 0.00 178.15 178.28 3dyp h LYS 521 N 0.98 0.89 -0.22 0.16 1.57 -1.83 -2.73 116.57 115.39 3dyp h LYS 521 Ca 0.31 -0.17 -0.16 0.00 -1.87 0.00 0.00 60.65 58.77 3dyp h LYS 521 Cb 0.04 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 3dyp h LYS 521 CO -0.09 0.77 -0.52 -0.22 -0.57 0.00 0.00 179.45 178.81 3dyp h LYS 522 N 0.83 0.63 -0.52 3.15 3.64 -1.64 -3.27 116.57 119.40 3dyp h LYS 522 Ca 0.20 -0.39 0.07 0.00 -1.27 0.00 0.00 60.65 59.26 3dyp h LYS 522 Cb 0.22 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.02 3dyp h LYS 522 CO -0.01 1.00 0.18 2.35 -2.27 0.00 0.00 179.45 180.70 3dyp h TRP 523 N 0.49 0.32 -0.78 1.91 2.91 -0.33 -2.17 115.95 118.31 3dyp h TRP 523 Ca 0.02 0.03 0.16 0.00 1.13 0.00 0.00 58.89 60.22 3dyp h TRP 523 Cb 1.08 -0.07 -0.05 0.00 -0.51 0.00 0.00 29.16 29.61 3dyp h TRP 523 CO 0.05 0.10 0.52 -0.07 -1.03 0.00 0.00 178.44 178.01 3dyp h LEU 524 N 0.36 0.38 -3.09 0.65 3.38 -1.55 -2.52 115.31 112.92 3dyp h LEU 524 Ca 0.25 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.25 3dyp h LEU 524 Cb 0.28 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3dyp h LEU 524 CO -0.26 0.19 0.00 -1.54 0.09 0.00 0.00 178.44 176.92 3dyp n SER 525 N -4.48 4.20 -4.70 -0.43 3.41 -0.83 -4.54 113.62 106.25 3dyp n SER 525 Ca 0.15 -2.44 -0.34 0.00 -0.26 0.00 0.00 58.87 55.98 3dyp n SER 525 Cb 0.57 -0.50 0.12 0.00 -0.26 0.00 0.00 64.21 64.14 3dyp n SER 525 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dyp n LEU 526 N 0.73 4.81 -4.63 1.04 4.77 -0.95 -4.77 117.00 118.01 3dyp n LEU 526 Ca 0.22 0.64 -0.50 0.00 -0.03 0.00 0.00 56.01 56.34 3dyp n LEU 526 Cb 0.78 -1.52 -0.05 0.00 -2.33 0.00 0.00 43.42 40.30 3dyp n LEU 526 CO 0.19 -1.53 1.06 -2.65 -1.33 0.00 0.00 177.39 173.12 3dyp n PRO 527 N -2.99 1.58 0.00 3.23 -0.02 -1.26 -0.85 135.00 134.68 3dyp n PRO 527 Ca 0.14 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3dyp n PRO 527 Cb 0.50 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 3dyp n PRO 527 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dyp n GLY 528 N 3.01 3.00 3.75 -1.23 0.00 -1.26 -5.01 105.19 107.45 3dyp n GLY 528 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3dyp n GLY 528 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3dyp s GLU 529 N -0.00 4.60 0.00 1.61 2.56 -0.03 -4.94 118.70 122.51 3dyp s GLU 529 Ca 0.00 1.77 0.00 0.00 0.00 0.00 0.00 54.97 56.74 3dyp s GLU 529 Cb 0.00 -3.24 0.00 0.00 2.00 0.00 0.00 34.13 32.89 3dyp s GLU 529 CO 0.00 0.11 0.00 0.25 -0.56 0.00 0.00 175.26 175.06 3dyp n THR 530 N 1.95 0.00 -1.58 -1.70 -2.24 -1.26 -4.80 114.28 104.64 3dyp n THR 530 Ca 0.01 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.49 3dyp n THR 530 Cb 0.45 1.73 0.08 0.00 -2.10 0.00 0.00 70.33 70.50 3dyp n THR 530 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3dyp s ARG 531 N 0.00 2.30 0.69 -0.78 0.52 -1.26 -4.18 118.95 116.24 3dyp s ARG 531 Ca 0.00 0.68 -0.11 0.00 -0.52 0.00 0.00 55.73 55.78 3dyp s ARG 531 Cb 0.00 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.53 3dyp s ARG 531 CO 0.00 -1.48 1.06 -1.25 0.02 0.00 0.00 175.30 173.65 3dyp s PRO 532 N -5.15 2.99 -0.13 3.54 0.04 -1.08 -4.79 135.00 130.42 3dyp s PRO 532 Ca 0.60 0.87 0.01 0.00 0.04 0.00 0.00 61.00 62.52 3dyp s PRO 532 Cb -0.14 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.42 3dyp s PRO 532 CO 0.54 -1.04 -0.14 -1.17 0.04 0.00 0.00 177.00 175.23 3dyp s LEU 533 N -5.49 1.68 -0.13 -3.56 0.20 0.08 -0.46 118.68 111.00 3dyp s LEU 533 Ca 0.58 -0.46 -0.02 0.00 0.69 0.00 0.00 54.13 54.91 3dyp s LEU 533 Cb -0.13 -1.14 0.04 0.00 -0.43 0.00 0.00 46.19 44.54 3dyp s LEU 533 CO 0.55 -0.03 0.03 -0.63 -0.29 0.00 0.00 176.35 175.97 3dyp s ILE 534 N 1.29 0.38 0.19 6.68 1.01 -0.46 -1.43 121.20 128.86 3dyp s ILE 534 Ca 0.00 -0.19 -0.32 0.00 0.00 0.00 0.00 60.65 60.15 3dyp s ILE 534 Cb -0.14 -0.74 -0.11 0.00 0.01 0.00 0.00 42.46 41.49 3dyp s ILE 534 CO -0.07 0.00 1.65 -0.76 0.00 0.00 0.00 174.94 175.76 3dyp s LEU 535 N 1.95 4.37 0.42 2.97 1.02 -0.61 -4.15 118.68 124.64 3dyp s LEU 535 Ca 0.02 2.75 0.23 0.00 0.02 0.00 0.00 54.13 57.15 3dyp s LEU 535 Cb -0.15 -3.60 0.69 0.00 0.02 0.00 0.00 46.19 43.15 3dyp s LEU 535 CO -0.07 -0.90 1.72 0.00 0.02 0.00 0.00 176.35 177.13 3dyp s GLU 537 N -3.43 0.40 0.25 0.00 2.02 -1.22 -4.31 118.70 112.41 3dyp s GLU 537 Ca 0.02 0.67 -0.20 0.00 0.02 0.00 0.00 54.97 55.48 3dyp s GLU 537 Cb 0.09 0.06 0.03 0.00 0.10 0.00 0.00 34.13 34.40 3dyp s GLU 537 CO 0.66 -0.12 0.66 1.52 0.02 0.00 0.00 175.26 178.00 3dyp s TYR 538 N 0.95 -0.18 -0.75 1.61 -0.85 -0.72 -0.37 117.35 117.03 3dyp s TYR 538 Ca -0.06 -0.22 -0.03 0.00 -0.52 0.00 0.00 57.07 56.24 3dyp s TYR 538 Cb -0.06 0.61 0.00 0.00 0.38 0.00 0.00 41.96 42.89 3dyp s TYR 538 CO -0.07 -1.13 0.66 0.00 -1.52 0.00 0.00 175.55 173.48 3dyp n ALA 539 N -0.43 -2.64 -1.91 9.51 0.00 -1.26 -0.79 120.51 123.00 3dyp n ALA 539 Ca -0.06 -0.03 -0.40 0.00 0.00 0.00 0.00 53.44 52.96 3dyp n ALA 539 Cb 0.60 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 3dyp n ALA 539 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3dyp s HIS 540 N -2.91 1.56 -0.15 0.00 2.46 -0.79 -3.63 115.29 111.82 3dyp s HIS 540 Ca 0.03 0.88 -0.03 0.00 0.47 0.00 0.00 55.06 56.41 3dyp s HIS 540 Cb -0.01 -3.99 -0.04 0.00 -0.13 0.00 0.00 32.58 28.41 3dyp s HIS 540 CO 0.81 -2.65 2.73 0.00 -2.47 0.00 0.00 174.74 173.17 3dyp n ALA 541 N 12.60 5.54 -2.61 1.58 0.00 0.51 -4.43 120.51 133.70 3dyp n ALA 541 Ca 0.25 -1.56 -0.42 0.00 0.00 0.00 0.00 53.44 51.71 3dyp n ALA 541 Cb 0.51 -1.76 -0.05 0.00 0.00 0.00 0.00 19.45 18.14 3dyp n ALA 541 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3dyp s MET 542 N -0.33 3.93 4.57 0.00 0.00 -1.26 -3.59 119.30 122.63 3dyp s MET 542 Ca 0.41 0.53 0.00 0.00 0.00 0.00 0.00 55.69 56.63 3dyp s MET 542 Cb 0.23 -3.74 0.00 0.00 0.00 0.00 0.00 34.83 31.32 3dyp s MET 542 CO -0.05 -0.70 0.00 0.41 0.00 0.00 0.00 175.02 174.68 3dyp n GLY 543 N 4.26 1.41 3.55 2.11 0.00 -1.26 -4.29 105.19 110.97 3dyp n GLY 543 Ca 0.03 -0.65 -0.40 0.00 0.00 0.00 0.00 46.02 45.00 3dyp n GLY 543 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dyp s ASN 544 N -4.00 6.22 0.00 1.61 3.84 -1.26 -4.87 114.94 116.48 3dyp s ASN 544 Ca 0.00 -0.80 0.00 0.00 0.21 0.00 0.00 52.86 52.27 3dyp s ASN 544 Cb 0.00 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 38.14 3dyp s ASN 544 CO 0.00 -1.77 0.00 -0.24 -2.79 0.00 0.00 177.10 172.30 3dyp n SER 545 N 9.49 0.00 0.00 -4.21 2.88 -1.26 -4.77 113.62 115.75 3dyp n SER 545 Ca 0.16 -0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 3dyp n SER 545 Cb 0.50 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 3dyp n SER 545 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3dyp n LEU 546 N 0.00 0.00 -4.69 2.46 4.32 -1.22 -4.77 117.00 113.10 3dyp n LEU 546 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 56.01 55.57 3dyp n LEU 546 Cb 0.00 -0.48 -0.03 0.00 -1.62 0.00 0.00 43.42 41.29 3dyp n LEU 546 CO 0.00 0.00 1.11 -0.83 -1.22 0.00 0.00 177.39 176.45 3dyp s GLY 547 N -2.46 1.88 0.00 -0.72 0.00 -0.23 -1.95 107.32 103.85 3dyp s GLY 547 Ca 0.00 0.89 0.00 0.00 0.00 0.00 0.00 44.72 45.61 3dyp s GLY 547 CO 0.00 2.48 0.00 0.61 0.00 0.00 0.00 173.10 176.19 3dyp n GLY 548 N 3.62 0.73 0.29 0.20 0.00 0.08 -3.85 105.19 106.26 3dyp n GLY 548 Ca 0.13 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 3dyp n GLY 548 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3dyp h PHE 549 N 0.00 0.88 -0.05 1.61 3.57 -1.57 -2.37 116.94 119.02 3dyp h PHE 549 Ca 0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 3dyp h PHE 549 Cb 0.00 -0.29 -0.00 0.00 2.79 0.00 0.00 35.95 38.45 3dyp h PHE 549 CO 0.00 0.47 -0.04 0.00 -2.23 0.00 0.00 178.31 176.52 3dyp h ALA 550 N 1.35 1.85 -0.68 2.41 0.00 -1.86 -2.16 119.26 120.18 3dyp h ALA 550 Ca 0.32 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 3dyp h ALA 550 Cb 0.09 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3dyp h ALA 550 CO -0.14 0.11 0.42 -0.22 0.00 0.00 0.00 179.25 179.42 3dyp h LYS 551 N 0.06 0.91 -0.31 0.00 3.64 -1.82 0.19 116.57 119.24 3dyp h LYS 551 Ca 0.02 -0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 3dyp h LYS 551 Cb 0.11 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 3dyp h LYS 551 CO 0.01 0.62 -0.22 1.88 -2.27 0.00 0.00 179.45 179.47 3dyp h TYR 552 N 0.93 0.81 -0.34 1.91 -1.99 -1.43 -2.53 116.97 114.32 3dyp h TYR 552 Ca 0.25 -0.22 -0.09 0.00 2.00 0.00 0.00 58.73 60.67 3dyp h TYR 552 Cb -0.06 -0.18 -0.02 0.00 2.00 0.00 0.00 36.73 38.47 3dyp h TYR 552 CO 0.00 0.94 -0.16 -1.49 -0.00 0.00 0.00 178.16 177.45 3dyp h TRP 553 N 0.44 0.68 -0.49 4.88 4.06 -1.39 0.82 115.95 124.95 3dyp h TRP 553 Ca 0.06 -0.13 -0.11 0.00 2.06 0.00 0.00 58.89 60.78 3dyp h TRP 553 Cb 0.77 -0.17 -0.02 0.00 -1.00 0.00 0.00 29.16 28.73 3dyp h TRP 553 CO 0.07 0.74 -0.12 0.37 -3.56 0.00 0.00 178.44 175.94 3dyp h GLN 554 N 0.56 0.91 -0.28 0.49 -0.00 -0.94 -1.32 115.11 114.54 3dyp h GLN 554 Ca 0.09 -0.32 -0.05 0.00 -0.00 0.00 0.00 58.65 58.37 3dyp h GLN 554 Cb 0.60 -0.06 -0.01 0.00 0.00 0.00 0.00 27.48 28.00 3dyp h GLN 554 CO 0.04 0.97 -0.02 0.00 0.00 0.00 0.00 178.83 179.82 3dyp h ALA 555 N 1.05 0.37 -1.00 3.38 0.00 -0.97 -1.72 119.26 120.38 3dyp h ALA 555 Ca 0.13 -0.24 0.11 0.00 0.00 0.00 0.00 54.91 54.90 3dyp h ALA 555 Cb 0.65 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.25 3dyp h ALA 555 CO 0.04 0.14 0.63 0.74 0.00 0.00 0.00 179.25 180.80 3dyp h PHE 556 N 0.27 1.14 0.00 0.00 0.05 -0.64 -1.19 116.94 116.57 3dyp h PHE 556 Ca 0.08 0.03 -0.15 0.00 3.82 0.00 0.00 57.97 61.75 3dyp h PHE 556 Cb 0.46 -0.36 -0.02 0.00 2.00 0.00 0.00 35.95 38.03 3dyp h PHE 556 CO 0.04 0.48 -0.73 0.00 -0.18 0.00 0.00 178.31 177.93 3dyp h ARG 557 N 1.02 0.00 0.00 1.51 3.08 -1.07 -3.29 114.38 115.63 3dyp h ARG 557 Ca 0.48 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.33 3dyp h ARG 557 Cb 0.42 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.44 3dyp h ARG 557 CO -0.25 0.73 -0.98 0.37 -1.07 0.00 0.00 179.97 178.77 3dyp h GLN 558 N 0.00 0.00 -4.93 0.04 4.15 -0.50 -3.43 115.11 110.44 3dyp h GLN 558 Ca -0.01 0.00 -0.66 0.00 0.77 0.00 0.00 58.65 58.75 3dyp h GLN 558 Cb 1.35 0.00 -0.26 0.00 0.21 0.00 0.00 27.48 28.78 3dyp h GLN 558 CO 0.09 0.89 -0.68 0.71 -1.93 0.00 0.00 178.83 177.92 3dyp s TYR 559 N -2.74 3.04 0.18 3.99 1.51 -0.53 -4.99 117.35 117.82 3dyp s TYR 559 Ca 0.01 -0.88 -0.17 0.00 -1.01 0.00 0.00 57.07 55.03 3dyp s TYR 559 Cb 0.10 -2.17 0.13 0.00 -0.11 0.00 0.00 41.96 39.91 3dyp s TYR 559 CO 0.81 -0.53 1.65 -1.35 -1.11 0.00 0.00 175.55 175.02 3dyp h PRO 560 N 8.16 -0.03 0.00 -1.71 0.11 -1.84 -1.22 132.00 135.47 3dyp h PRO 560 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3dyp h PRO 560 Cb 1.15 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3dyp h PRO 560 CO 0.59 -0.02 0.00 0.54 -0.21 0.00 0.00 178.00 178.91 3dyp n ARG 561 N -5.35 0.06 -2.97 1.05 1.74 -1.26 -4.28 116.66 105.64 3dyp n ARG 561 Ca 0.04 0.18 -0.44 0.00 -0.77 0.00 0.00 57.85 56.86 3dyp n ARG 561 Cb 0.26 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.16 3dyp n ARG 561 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3dyp s LEU 562 N -2.90 4.82 -0.26 0.55 1.43 -0.46 -0.74 118.68 121.11 3dyp s LEU 562 Ca 0.11 -1.19 0.13 0.00 -1.03 0.00 0.00 54.13 52.14 3dyp s LEU 562 Cb 0.12 -2.37 0.75 0.00 0.03 0.00 0.00 46.19 44.72 3dyp s LEU 562 CO 0.31 -1.30 1.71 0.00 0.23 0.00 0.00 176.35 177.31 3dyp n GLN 563 N 7.11 4.14 0.00 1.70 6.02 -0.51 -4.62 117.38 131.21 3dyp n GLN 563 Ca -0.06 -3.10 0.00 0.00 -0.01 0.00 0.00 57.00 53.83 3dyp n GLN 563 Cb 0.44 -2.18 0.00 0.00 1.02 0.00 0.00 30.24 29.52 3dyp n GLN 563 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dyp n GLY 564 N 0.14 0.19 0.00 1.08 0.00 -1.26 -0.05 105.19 105.30 3dyp n GLY 564 Ca 0.31 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.41 3dyp n GLY 564 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 565 N 0.00 0.16 3.21 -0.02 0.00 -0.96 -1.57 105.19 106.02 3dyp n GLY 565 Ca 0.00 -0.94 -0.35 0.00 0.00 0.00 0.00 46.02 44.74 3dyp n GLY 565 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dyp s PHE 566 N -2.00 3.08 0.59 1.61 0.40 -0.46 -0.74 117.98 120.46 3dyp s PHE 566 Ca 0.00 -1.51 -0.19 0.00 -0.60 0.00 0.00 56.93 54.62 3dyp s PHE 566 Cb 0.00 -2.08 -0.03 0.00 0.51 0.00 0.00 43.02 41.42 3dyp s PHE 566 CO 0.00 -0.72 1.24 0.08 0.70 0.00 0.00 175.22 176.52 3dyp s VAL 567 N 1.34 2.47 -0.38 -0.44 1.01 -0.07 -1.76 120.40 122.57 3dyp s VAL 567 Ca 0.00 0.30 -0.07 0.00 0.00 0.00 0.00 61.98 62.21 3dyp s VAL 567 Cb -0.17 -3.13 0.07 0.00 0.00 0.00 0.00 36.38 33.15 3dyp s VAL 567 CO -0.04 -0.05 0.18 0.86 0.00 0.00 0.00 175.10 176.06 3dyp s TRP 568 N -1.51 3.34 0.00 5.22 -0.11 0.03 -0.66 118.94 125.26 3dyp s TRP 568 Ca 0.77 -1.64 -0.00 0.00 1.22 0.00 0.00 56.10 56.45 3dyp s TRP 568 Cb -0.33 -2.72 0.00 0.00 -1.50 0.00 0.00 33.47 28.92 3dyp s TRP 568 CO 0.36 -0.82 0.01 -0.40 -4.62 0.00 0.00 176.95 171.47 3dyp n ASP 569 N 4.82 -0.02 0.22 5.86 5.75 -0.71 -0.36 116.55 132.11 3dyp n ASP 569 Ca -0.10 -1.02 -0.09 0.00 -0.01 0.00 0.00 54.79 53.57 3dyp n ASP 569 Cb 0.43 0.03 -0.04 0.00 -1.03 0.00 0.00 41.12 40.51 3dyp n ASP 569 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 3dyp h TRP 570 N 1.01 -0.54 -4.35 2.11 2.91 -0.96 -1.01 115.95 115.12 3dyp h TRP 570 Ca -0.00 -0.01 -0.57 0.00 1.13 0.00 0.00 58.89 59.43 3dyp h TRP 570 Cb 0.01 0.18 -0.30 0.00 -0.51 0.00 0.00 29.16 28.55 3dyp h TRP 570 CO 0.00 -0.34 -0.84 0.54 -1.03 0.00 0.00 178.44 176.77 3dyp s VAL 571 N -3.64 1.48 0.34 2.65 0.11 -1.26 -0.71 120.40 119.37 3dyp s VAL 571 Ca -0.09 -0.80 -0.29 0.00 -2.93 0.00 0.00 61.98 57.88 3dyp s VAL 571 Cb 0.01 -1.23 -0.11 0.00 -1.53 0.00 0.00 36.38 33.51 3dyp s VAL 571 CO 0.26 0.42 1.53 -1.81 -3.33 0.00 0.00 175.10 172.16 3dyp s ASP 572 N -0.42 6.36 -1.10 3.54 1.01 -0.39 -4.39 116.67 121.27 3dyp s ASP 572 Ca 0.07 3.00 -0.05 0.00 0.71 0.00 0.00 52.55 56.29 3dyp s ASP 572 Cb -0.07 -2.65 0.13 0.00 1.01 0.00 0.00 42.92 41.33 3dyp s ASP 572 CO -0.01 -0.88 2.41 0.00 0.21 0.00 0.00 175.17 176.90 3dyp n GLN 573 N 1.16 4.19 -3.28 8.23 6.02 -0.05 -4.02 117.38 129.63 3dyp n GLN 573 Ca 0.04 -3.35 -0.33 0.00 -0.01 0.00 0.00 57.00 53.35 3dyp n GLN 573 Cb 0.39 -2.51 -0.06 0.00 1.02 0.00 0.00 30.24 29.08 3dyp n GLN 573 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3dyp s SER 574 N 0.17 6.75 0.09 1.08 1.04 -1.26 -4.74 113.70 116.83 3dyp s SER 574 Ca 0.54 1.12 0.09 0.00 0.48 0.00 0.00 55.95 58.17 3dyp s SER 574 Cb 0.23 -2.31 -0.04 0.00 0.10 0.00 0.00 66.02 64.01 3dyp s SER 574 CO -0.13 -0.08 -0.21 -0.76 0.98 0.00 0.00 173.24 173.04 3dyp s LEU 575 N -2.66 2.54 0.12 2.42 1.43 -0.68 -4.32 118.68 117.52 3dyp s LEU 575 Ca 0.48 -0.56 -0.27 0.00 -1.03 0.00 0.00 54.13 52.75 3dyp s LEU 575 Cb -0.12 -1.45 -0.07 0.00 0.03 0.00 0.00 46.19 44.59 3dyp s LEU 575 CO 0.19 0.21 0.84 -0.63 0.23 0.00 0.00 176.35 177.19 3dyp s ILE 576 N -1.02 4.49 0.32 -0.59 -1.09 -0.57 -0.80 121.20 121.93 3dyp s ILE 576 Ca 0.15 1.82 0.07 0.00 -2.23 0.00 0.00 60.65 60.46 3dyp s ILE 576 Cb -0.10 -4.20 -0.06 0.00 -1.58 0.00 0.00 42.46 36.51 3dyp s ILE 576 CO 0.07 0.42 -0.04 -0.54 -1.23 0.00 0.00 174.94 173.61 3dyp s LYS 577 N -0.50 1.68 -0.04 2.79 1.02 0.74 -4.92 119.74 120.51 3dyp s LYS 577 Ca 0.40 -1.88 0.06 0.00 0.02 0.00 0.00 55.97 54.57 3dyp s LYS 577 Cb -0.23 -1.30 -0.02 0.00 -0.52 0.00 0.00 37.83 35.77 3dyp s LYS 577 CO 0.27 0.02 -0.23 0.71 -0.92 0.00 0.00 175.35 175.20 3dyp s TYR 578 N -2.92 2.46 0.44 3.18 1.51 -1.26 0.74 117.35 121.49 3dyp s TYR 578 Ca 0.32 -0.49 -0.06 0.00 -1.01 0.00 0.00 57.07 55.82 3dyp s TYR 578 Cb 0.05 -1.57 0.10 0.00 -0.11 0.00 0.00 41.96 40.43 3dyp s TYR 578 CO 0.14 -0.06 0.60 -0.40 -1.11 0.00 0.00 175.55 174.72 3dyp n ASP 579 N 2.63 0.16 0.13 2.29 5.68 0.78 -4.82 116.55 123.41 3dyp n ASP 579 Ca -0.17 -1.29 0.13 0.00 -0.50 0.00 0.00 54.79 52.96 3dyp n ASP 579 Cb 0.52 -0.45 0.64 0.00 -1.14 0.00 0.00 41.12 40.69 3dyp n ASP 579 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3dyp h GLU 580 N 0.00 0.04 -0.01 0.11 5.08 -2.01 0.74 114.58 118.54 3dyp h GLU 580 Ca -0.20 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 3dyp h GLU 580 Cb 0.57 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.81 3dyp h GLU 580 CO 0.15 0.03 -0.05 0.09 -1.00 0.00 0.00 179.01 178.23 3dyp n ASN 581 N -4.47 1.10 0.00 1.42 3.02 -1.26 -4.90 115.26 110.17 3dyp n ASN 581 Ca 0.03 -1.24 0.00 0.00 -0.03 0.00 0.00 54.58 53.33 3dyp n ASN 581 Cb 0.30 0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 3dyp n ASN 581 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyp n GLY 582 N 1.18 0.75 3.76 7.41 0.00 0.25 -5.03 105.19 113.52 3dyp n GLY 582 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 3dyp n GLY 582 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dyp s ASN 583 N -2.39 7.10 0.48 1.61 0.01 -1.26 -4.65 114.94 115.84 3dyp s ASN 583 Ca 0.00 1.32 -0.22 0.00 -0.71 0.00 0.00 52.86 53.25 3dyp s ASN 583 Cb 0.00 -2.41 -0.07 0.00 0.41 0.00 0.00 41.25 39.18 3dyp s ASN 583 CO 0.00 0.11 1.13 -2.16 -1.51 0.00 0.00 177.10 174.67 3dyp s PRO 584 N -0.37 3.68 0.01 -0.60 0.04 -1.26 -0.16 135.00 136.34 3dyp s PRO 584 Ca 0.34 1.66 -0.10 0.00 0.04 0.00 0.00 61.00 62.94 3dyp s PRO 584 Cb -0.20 -2.27 0.01 0.00 0.04 0.00 0.00 34.50 32.08 3dyp s PRO 584 CO 0.20 -0.59 0.20 1.67 0.04 0.00 0.00 177.00 178.52 3dyp s TRP 585 N -1.66 -0.02 -0.21 0.56 1.48 0.23 -4.89 118.94 114.42 3dyp s TRP 585 Ca 0.66 -0.05 -0.28 0.00 -1.06 0.00 0.00 56.10 55.37 3dyp s TRP 585 Cb -0.25 -0.00 0.00 0.00 -1.16 0.00 0.00 33.47 32.06 3dyp s TRP 585 CO 0.30 -0.35 0.97 -1.12 -4.06 0.00 0.00 176.95 172.68 3dyp s SER 586 N -1.55 7.04 0.19 -2.66 0.01 -1.26 -0.18 113.70 115.28 3dyp s SER 586 Ca -0.12 1.30 0.08 0.00 1.31 0.00 0.00 55.95 58.51 3dyp s SER 586 Cb -0.05 -2.51 -0.04 0.00 0.21 0.00 0.00 66.02 63.63 3dyp s SER 586 CO 0.01 -0.58 -0.01 0.00 0.41 0.00 0.00 173.24 173.06 3dyp s ALA 587 N 2.87 3.16 0.00 1.44 0.00 0.02 -4.90 121.76 124.34 3dyp s ALA 587 Ca 0.42 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 50.95 3dyp s ALA 587 Cb -0.16 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 22.04 3dyp s ALA 587 CO 0.08 0.45 0.00 2.48 0.00 0.00 0.00 175.76 178.77 3dyp n TYR 588 N -0.21 0.00 -1.56 0.00 0.18 -1.26 -1.69 117.16 112.61 3dyp n TYR 588 Ca -0.09 0.00 -0.50 0.00 1.88 0.00 0.00 57.90 59.19 3dyp n TYR 588 Cb 0.56 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 39.47 3dyp n TYR 588 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3dyp n GLY 589 N 2.12 -0.03 2.15 -7.48 0.00 -0.54 -1.49 105.19 99.92 3dyp n GLY 589 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.58 3dyp n GLY 589 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 590 N 2.02 2.77 0.00 -0.02 0.00 -1.26 -3.93 105.19 104.77 3dyp n GLY 590 Ca 0.16 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.25 3dyp n GLY 590 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dyp n ASP 591 N 0.00 0.00 -0.62 1.61 8.00 -0.55 -1.88 116.55 123.11 3dyp n ASP 591 Ca 0.00 0.24 0.06 0.00 0.71 0.00 0.00 54.79 55.80 3dyp n ASP 591 Cb 0.00 -0.36 0.17 0.00 -0.02 0.00 0.00 41.12 40.91 3dyp n ASP 591 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3dyp n PHE 592 N -1.36 0.55 -0.66 1.24 3.01 -1.26 -4.92 117.46 114.06 3dyp n PHE 592 Ca 0.05 -0.66 0.00 0.00 1.01 0.00 0.00 57.45 57.85 3dyp n PHE 592 Cb 0.13 -0.14 0.00 0.00 -0.01 0.00 0.00 39.48 39.46 3dyp n PHE 592 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dyp n GLY 593 N -0.07 0.81 3.70 1.37 0.00 -0.78 -4.85 105.19 105.36 3dyp n GLY 593 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3dyp n GLY 593 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3dyp s ASP 594 N -2.87 6.79 -0.26 1.61 -4.77 -1.26 -4.99 116.67 110.93 3dyp s ASP 594 Ca 0.00 2.28 -0.24 0.00 -3.30 0.00 0.00 52.55 51.29 3dyp s ASP 594 Cb 0.00 -2.57 0.07 0.00 -1.09 0.00 0.00 42.92 39.33 3dyp s ASP 594 CO 0.00 -0.72 0.69 0.28 0.70 0.00 0.00 175.17 176.12 3dyp s THR 595 N 1.85 -0.00 0.93 2.11 -1.32 -1.26 -3.99 115.64 113.96 3dyp s THR 595 Ca 0.66 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 61.02 3dyp s THR 595 Cb -0.35 -0.96 0.15 0.00 -1.51 0.00 0.00 72.50 69.82 3dyp s THR 595 CO 0.29 0.00 1.10 -2.84 -2.21 0.00 0.00 174.62 170.96 3dyp s PRO 596 N 0.42 0.99 0.20 7.08 0.02 -1.26 -5.17 135.00 137.28 3dyp s PRO 596 Ca -0.00 0.65 -0.11 0.00 0.02 0.00 0.00 61.00 61.56 3dyp s PRO 596 Cb -0.05 -1.79 -0.01 0.00 0.02 0.00 0.00 34.50 32.67 3dyp s PRO 596 CO 0.00 -2.38 0.37 0.54 -0.33 0.00 0.00 177.00 175.20 3dyp s ASN 597 N -3.51 -0.03 -0.30 2.53 2.20 -1.26 -4.74 114.94 109.82 3dyp s ASN 597 Ca 0.64 -0.91 0.09 0.00 -0.94 0.00 0.00 52.86 51.75 3dyp s ASN 597 Cb -0.18 0.51 0.56 0.00 -2.00 0.00 0.00 41.25 40.14 3dyp s ASN 597 CO 0.57 -1.00 1.57 0.47 -2.94 0.00 0.00 177.10 175.76 3dyp n ASP 598 N -0.30 3.14 0.00 3.54 8.00 -0.51 -4.94 116.55 125.48 3dyp n ASP 598 Ca -0.04 -3.57 0.00 0.00 0.71 0.00 0.00 54.79 51.89 3dyp n ASP 598 Cb 0.63 -0.67 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 3dyp n ASP 598 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3dyp n ARG 599 N -0.94 0.00 0.00 -1.24 1.85 -1.25 -1.78 116.66 113.30 3dyp n ARG 599 Ca 0.37 0.00 0.09 0.00 -1.00 0.00 0.00 57.85 57.31 3dyp n ARG 599 Cb 1.15 0.00 0.54 0.00 -1.05 0.00 0.00 32.46 33.11 3dyp n ARG 599 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3dyp n GLN 600 N 14.00 0.83 0.08 2.89 0.00 -1.26 -1.47 117.38 132.45 3dyp n GLN 600 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 57.00 57.06 3dyp n GLN 600 Cb 0.00 -1.34 0.31 0.00 0.00 0.00 0.00 30.24 29.20 3dyp n GLN 600 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3dyp n PHE 601 N -0.84 0.37 1.62 2.61 3.01 -0.73 -1.10 117.46 122.39 3dyp n PHE 601 Ca 0.14 0.19 0.15 0.00 1.01 0.00 0.00 57.45 58.93 3dyp n PHE 601 Cb 0.06 -0.80 0.82 0.00 -0.01 0.00 0.00 39.48 39.55 3dyp n PHE 601 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3dyp s MET 603 N -2.33 1.90 -0.04 0.00 -1.94 -0.26 -0.87 119.30 115.75 3dyp s MET 603 Ca 0.36 -1.90 0.11 0.00 -1.71 0.00 0.00 55.69 52.54 3dyp s MET 603 Cb 0.20 -3.49 0.19 0.00 2.01 0.00 0.00 34.83 33.75 3dyp s MET 603 CO 0.41 -1.05 1.09 0.09 -0.01 0.00 0.00 175.02 175.55 3dyp n ASN 604 N 4.39 0.80 -4.95 3.03 5.03 -1.26 -4.17 115.26 118.12 3dyp n ASN 604 Ca 0.00 -2.36 -0.23 0.00 0.87 0.00 0.00 54.58 52.87 3dyp n ASN 604 Cb 0.41 -0.29 0.01 0.00 -1.02 0.00 0.00 39.78 38.89 3dyp n ASN 604 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3dyp s GLY 605 N -1.76 1.59 0.48 7.41 0.00 -1.24 -1.74 107.32 112.06 3dyp s GLY 605 Ca 0.17 -1.09 0.27 0.00 0.00 0.00 0.00 44.72 44.07 3dyp s GLY 605 CO -0.04 -0.91 1.75 1.41 0.00 0.00 0.00 173.10 175.31 3dyp h LEU 606 N 0.39 0.00 -8.61 0.66 3.38 0.50 -3.44 115.31 108.19 3dyp h LEU 606 Ca -0.46 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.11 3dyp h LEU 606 Cb 1.26 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.83 3dyp h LEU 606 CO 0.57 0.00 -0.75 0.68 0.09 0.00 0.00 178.44 179.02 3dyp s VAL 607 N -3.38 1.32 0.77 1.22 -7.23 -0.05 -0.19 120.40 112.85 3dyp s VAL 607 Ca 0.05 -1.76 -0.11 0.00 -1.81 0.00 0.00 61.98 58.35 3dyp s VAL 607 Cb 0.07 -1.57 0.05 0.00 0.56 0.00 0.00 36.38 35.49 3dyp s VAL 607 CO 0.62 -0.46 1.08 -0.36 -0.31 0.00 0.00 175.10 175.68 3dyp s PHE 608 N -2.28 2.73 0.55 2.82 0.40 0.03 -1.26 117.98 120.98 3dyp s PHE 608 Ca 0.10 1.44 0.28 0.00 -0.60 0.00 0.00 56.93 58.15 3dyp s PHE 608 Cb -0.04 -3.02 1.46 0.00 0.51 0.00 0.00 43.02 41.93 3dyp s PHE 608 CO 0.03 -1.69 1.95 0.00 0.70 0.00 0.00 175.22 176.21 3dyp h ALA 609 N -1.05 2.44 -0.29 5.36 0.00 -1.90 0.53 119.26 124.35 3dyp h ALA 609 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3dyp h ALA 609 Cb 1.23 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3dyp h ALA 609 CO 0.54 -0.75 0.00 -0.40 0.00 0.00 0.00 179.25 178.64 3dyp n ASP 610 N -4.12 1.83 0.00 0.00 5.68 -1.26 -4.47 116.55 114.21 3dyp n ASP 610 Ca 0.11 -2.06 0.00 0.00 -0.50 0.00 0.00 54.79 52.34 3dyp n ASP 610 Cb 0.69 -0.26 0.00 0.00 -1.14 0.00 0.00 41.12 40.40 3dyp n ASP 610 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3dyp n ARG 611 N 0.36 0.00 -2.27 0.11 3.00 0.18 -5.01 116.66 113.04 3dyp n ARG 611 Ca 0.10 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.53 3dyp n ARG 611 Cb 0.32 -2.09 -0.03 0.00 0.00 0.00 0.00 32.46 30.66 3dyp n ARG 611 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 3dyp s THR 612 N -3.64 3.15 0.50 0.55 2.01 -1.26 -4.73 115.64 112.22 3dyp s THR 612 Ca 0.00 1.07 -0.21 0.00 0.31 0.00 0.00 61.69 62.86 3dyp s THR 612 Cb 0.00 -3.68 -0.07 0.00 0.01 0.00 0.00 72.50 68.76 3dyp s THR 612 CO 0.00 0.22 1.10 -2.84 -0.69 0.00 0.00 174.62 172.41 3dyp s PRO 613 N -1.06 3.62 0.62 4.92 0.02 -1.26 -0.79 135.00 141.08 3dyp s PRO 613 Ca 0.50 1.55 -0.05 0.00 0.02 0.00 0.00 61.00 63.01 3dyp s PRO 613 Cb -0.36 -2.13 0.03 0.00 0.02 0.00 0.00 34.50 32.06 3dyp s PRO 613 CO 0.44 -0.61 0.92 -1.01 -0.33 0.00 0.00 177.00 176.41 3dyp s HIS 614 N -1.80 3.11 0.48 6.54 3.76 0.74 -4.77 115.29 123.35 3dyp s HIS 614 Ca 0.69 0.52 0.23 0.00 -0.15 0.00 0.00 55.06 56.35 3dyp s HIS 614 Cb -0.22 -2.88 1.39 0.00 1.11 0.00 0.00 32.58 31.98 3dyp s HIS 614 CO 0.26 -1.01 2.10 -1.35 -0.85 0.00 0.00 174.74 173.89 3dyp h PRO 615 N -0.29 0.00 0.00 8.40 0.11 -1.93 -2.17 132.00 136.13 3dyp h PRO 615 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 3dyp h PRO 615 Cb 1.28 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.39 3dyp h PRO 615 CO 0.60 0.10 -0.06 0.00 -0.21 0.00 0.00 178.00 178.42 3dyp h ALA 616 N 1.90 1.31 -0.98 -0.75 0.00 -1.86 -2.77 119.26 116.13 3dyp h ALA 616 Ca -0.00 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.89 3dyp h ALA 616 Cb 0.22 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 3dyp h ALA 616 CO 0.01 0.08 0.64 1.25 0.00 0.00 0.00 179.25 181.23 3dyp h LEU 617 N 0.00 1.06 -1.09 0.00 5.85 -1.58 -1.59 115.31 117.96 3dyp h LEU 617 Ca -0.00 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 3dyp h LEU 617 Cb 0.20 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 3dyp h LEU 617 CO 0.01 0.72 0.18 0.00 -0.34 0.00 0.00 178.44 179.01 3dyp h THR 618 N 1.22 1.22 -0.16 1.05 1.03 -1.69 0.33 112.91 115.91 3dyp h THR 618 Ca 0.39 -0.73 0.02 0.00 -0.01 0.00 0.00 66.41 66.08 3dyp h THR 618 Cb 0.02 0.59 -0.02 0.00 -1.07 0.00 0.00 68.15 67.67 3dyp h THR 618 CO -0.12 0.28 0.03 -0.08 -0.01 0.00 0.00 175.52 175.61 3dyp h GLU 619 N 0.81 0.09 -0.32 0.00 4.57 -1.43 -0.67 114.58 117.63 3dyp h GLU 619 Ca 0.19 -0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.37 3dyp h GLU 619 Cb 0.23 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 3dyp h GLU 619 CO -0.01 0.06 0.19 0.00 -1.18 0.00 0.00 179.01 178.07 3dyp h ALA 620 N 1.12 0.40 -0.56 2.92 0.00 -0.79 -1.46 119.26 120.88 3dyp h ALA 620 Ca 0.07 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.06 3dyp h ALA 620 Cb 0.07 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.69 3dyp h ALA 620 CO -0.10 -0.17 0.17 -0.22 0.00 0.00 0.00 179.25 178.94 3dyp h LYS 621 N 0.39 0.32 -0.26 0.00 3.64 -0.54 -0.65 116.57 119.48 3dyp h LYS 621 Ca 0.12 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 3dyp h LYS 621 Cb -0.01 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 3dyp h LYS 621 CO -0.05 0.21 -0.05 1.25 -2.27 0.00 0.00 179.45 178.54 3dyp h HIS 622 N 0.33 0.54 0.00 1.91 2.76 -0.84 -2.76 115.15 117.10 3dyp h HIS 622 Ca 0.28 -0.11 -0.05 0.00 -2.20 0.00 0.00 60.37 58.29 3dyp h HIS 622 Cb 0.36 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 3dyp h HIS 622 CO -0.19 0.69 -0.22 1.96 -1.30 0.00 0.00 177.93 178.86 3dyp h GLN 623 N 0.24 0.00 -0.26 5.26 1.08 -1.06 -2.40 115.11 117.97 3dyp h GLN 623 Ca 0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 3dyp h GLN 623 Cb 0.50 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 3dyp h GLN 623 CO 0.02 0.22 0.00 1.04 -0.95 0.00 0.00 178.83 179.16 3dyp n GLN 624 N -4.22 1.71 -1.38 1.46 6.02 -0.27 -4.96 117.38 115.75 3dyp n GLN 624 Ca -0.02 -1.09 -0.37 0.00 -0.01 0.00 0.00 57.00 55.51 3dyp n GLN 624 Cb 0.28 -1.30 0.06 0.00 1.02 0.00 0.00 30.24 30.30 3dyp n GLN 624 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3dyp n GLN 625 N 0.35 0.48 -0.10 -1.09 6.02 -0.91 -4.88 117.38 117.26 3dyp n GLN 625 Ca 0.13 0.20 0.12 0.00 -0.01 0.00 0.00 57.00 57.44 3dyp n GLN 625 Cb 0.28 -1.94 0.16 0.00 1.02 0.00 0.00 30.24 29.76 3dyp n GLN 625 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3dyp n PHE 626 N -2.17 0.25 -4.87 1.08 3.01 -1.26 -4.88 117.46 108.62 3dyp n PHE 626 Ca 0.12 -0.13 -0.27 0.00 1.01 0.00 0.00 57.45 58.17 3dyp n PHE 626 Cb 0.49 -0.00 -0.17 0.00 -0.01 0.00 0.00 39.48 39.79 3dyp n PHE 626 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3dyp s PHE 627 N -1.73 1.89 0.09 1.38 0.40 -1.26 0.73 117.98 119.47 3dyp s PHE 627 Ca 0.33 -0.67 0.06 0.00 -0.60 0.00 0.00 56.93 56.05 3dyp s PHE 627 Cb 0.21 -1.30 -0.04 0.00 0.51 0.00 0.00 43.02 42.41 3dyp s PHE 627 CO 0.31 -0.28 -0.06 -0.65 0.70 0.00 0.00 175.22 175.24 3dyp s GLN 628 N 0.35 2.33 0.02 0.44 -1.52 -0.40 -4.95 119.66 115.92 3dyp s GLN 628 Ca -0.12 -0.92 0.03 0.00 -1.95 0.00 0.00 55.36 52.40 3dyp s GLN 628 Cb -0.15 -2.42 -0.01 0.00 -0.22 0.00 0.00 33.01 30.21 3dyp s GLN 628 CO 0.05 0.53 -0.10 -0.06 -0.25 0.00 0.00 175.29 175.46 3dyp s PHE 629 N -1.24 0.85 0.06 0.91 0.40 -1.26 -0.51 117.98 117.19 3dyp s PHE 629 Ca 0.23 -0.27 0.02 0.00 -0.60 0.00 0.00 56.93 56.31 3dyp s PHE 629 Cb -0.11 -0.52 -0.03 0.00 0.51 0.00 0.00 43.02 42.87 3dyp s PHE 629 CO 0.15 -0.01 -0.08 1.03 0.70 0.00 0.00 175.22 177.01 3dyp s ARG 630 N -0.72 0.62 -0.08 0.44 0.52 0.83 -4.96 118.95 115.60 3dyp s ARG 630 Ca 0.00 -0.93 0.03 0.00 -0.52 0.00 0.00 55.73 54.31 3dyp s ARG 630 Cb -0.06 -0.28 0.01 0.00 0.52 0.00 0.00 34.95 35.14 3dyp s ARG 630 CO 0.00 0.03 -0.17 -1.17 0.02 0.00 0.00 175.30 174.02 3dyp s LEU 631 N -2.01 1.82 -0.21 2.53 2.96 -1.26 0.32 118.68 122.83 3dyp s LEU 631 Ca -0.03 -0.40 -0.03 0.00 -0.22 0.00 0.00 54.13 53.45 3dyp s LEU 631 Cb -0.06 -1.05 0.06 0.00 0.50 0.00 0.00 46.19 45.65 3dyp s LEU 631 CO -0.01 0.08 0.04 -0.55 -1.32 0.00 0.00 176.35 174.60 3dyp s SER 632 N 0.53 3.03 1.20 3.68 0.15 -0.38 -4.99 113.70 116.92 3dyp s SER 632 Ca -0.16 -0.91 0.00 0.00 0.70 0.00 0.00 55.95 55.58 3dyp s SER 632 Cb -0.17 -0.61 0.00 0.00 -1.71 0.00 0.00 66.02 63.53 3dyp s SER 632 CO 0.06 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.79 3dyp n GLY 633 N 5.04 1.69 0.75 9.45 0.00 -1.26 -0.98 105.19 119.88 3dyp n GLY 633 Ca -0.08 -0.48 0.05 0.00 0.00 0.00 0.00 46.02 45.51 3dyp n GLY 633 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLN 634 N 12.41 2.08 -3.73 1.61 -0.00 -1.26 -4.95 117.38 123.55 3dyp n GLN 634 Ca 0.00 -2.93 -0.37 0.00 -0.00 0.00 0.00 57.00 53.70 3dyp n GLN 634 Cb 0.00 -1.73 -0.12 0.00 -0.00 0.00 0.00 30.24 28.38 3dyp n GLN 634 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 3dyp s THR 635 N -3.01 4.27 -0.21 -0.39 2.01 -0.15 0.12 115.64 118.29 3dyp s THR 635 Ca 0.40 -0.43 -0.15 0.00 0.31 0.00 0.00 61.69 61.82 3dyp s THR 635 Cb 0.35 -3.12 -0.04 0.00 0.01 0.00 0.00 72.50 69.70 3dyp s THR 635 CO 0.03 0.17 0.36 -0.63 -0.69 0.00 0.00 174.62 173.86 3dyp s ILE 636 N 1.57 5.22 -0.22 1.82 1.01 -0.25 -1.25 121.20 129.09 3dyp s ILE 636 Ca 0.05 0.62 -0.08 0.00 0.00 0.00 0.00 60.65 61.23 3dyp s ILE 636 Cb -0.16 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.57 3dyp s ILE 636 CO 0.04 0.26 0.10 -0.70 0.00 0.00 0.00 174.94 174.64 3dyp s GLU 637 N 1.31 3.89 -0.21 2.79 2.12 0.15 -0.98 118.70 127.76 3dyp s GLU 637 Ca 0.17 -0.37 -0.04 0.00 0.36 0.00 0.00 54.97 55.09 3dyp s GLU 637 Cb -0.15 -3.36 -0.02 0.00 0.26 0.00 0.00 34.13 30.87 3dyp s GLU 637 CO 0.07 0.04 -0.02 0.08 -0.54 0.00 0.00 175.26 174.89 3dyp s VAL 638 N 1.05 3.64 -0.08 3.70 1.01 -0.48 -0.12 120.40 129.11 3dyp s VAL 638 Ca 0.05 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 61.64 3dyp s VAL 638 Cb -0.14 -2.65 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 3dyp s VAL 638 CO 0.04 0.42 -0.13 -0.89 0.00 0.00 0.00 175.10 174.54 3dyp s THR 639 N 1.28 3.12 -0.03 3.92 2.01 0.33 -0.12 115.64 126.15 3dyp s THR 639 Ca 0.04 -0.68 -0.15 0.00 0.31 0.00 0.00 61.69 61.21 3dyp s THR 639 Cb -0.14 -2.26 -0.05 0.00 0.01 0.00 0.00 72.50 70.05 3dyp s THR 639 CO -0.00 0.56 0.40 -0.55 -0.69 0.00 0.00 174.62 174.34 3dyp s SER 640 N -0.30 6.76 0.00 3.53 0.15 0.35 -1.28 113.70 122.91 3dyp s SER 640 Ca 0.03 0.90 0.23 0.00 0.70 0.00 0.00 55.95 57.81 3dyp s SER 640 Cb -0.13 -2.25 0.43 0.00 -1.71 0.00 0.00 66.02 62.36 3dyp s SER 640 CO 0.03 0.27 1.39 -0.62 1.20 0.00 0.00 173.24 175.51 3dyp n GLU 641 N 2.16 2.50 -2.29 5.44 1.02 0.22 -2.33 120.64 127.36 3dyp n GLU 641 Ca -0.13 -2.29 -0.35 0.00 -0.02 0.00 0.00 57.16 54.36 3dyp n GLU 641 Cb 0.52 -1.51 -0.00 0.00 -0.02 0.00 0.00 31.44 30.43 3dyp n GLU 641 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3dyp s TYR 642 N -1.44 2.75 -0.17 -0.32 1.51 -1.26 -4.83 117.35 113.59 3dyp s TYR 642 Ca 0.38 1.55 0.19 0.00 -1.01 0.00 0.00 57.07 58.18 3dyp s TYR 642 Cb 0.22 -3.29 -0.26 0.00 -0.11 0.00 0.00 41.96 38.52 3dyp s TYR 642 CO 0.31 -1.48 0.13 1.28 -1.11 0.00 0.00 175.55 174.68 3dyp n LEU 643 N -1.07 0.00 0.00 -1.29 4.77 -1.26 -2.09 117.00 116.06 3dyp n LEU 643 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 3dyp n LEU 643 Cb 0.50 0.42 0.00 0.00 -2.33 0.00 0.00 43.42 42.02 3dyp n LEU 643 CO 0.43 0.42 -0.46 0.49 -1.33 0.00 0.00 177.39 176.94 3dyp n PHE 644 N -2.68 0.00 -3.66 -1.77 3.01 -1.26 -4.82 117.46 106.28 3dyp n PHE 644 Ca -0.29 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 57.89 3dyp n PHE 644 Cb 1.07 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 40.50 3dyp n PHE 644 CO 0.00 0.00 0.00 -0.98 1.01 0.00 0.00 176.76 176.79 3dyp s ARG 645 N -1.93 3.56 0.56 -1.08 1.70 -1.26 -4.79 118.95 115.71 3dyp s ARG 645 Ca 0.00 -0.24 -0.08 0.00 -0.47 0.00 0.00 55.73 54.94 3dyp s ARG 645 Cb 0.00 -2.83 -0.03 0.00 -0.57 0.00 0.00 34.95 31.53 3dyp s ARG 645 CO 0.00 0.40 0.90 -1.01 -1.08 0.00 0.00 175.30 174.52 3dyp s HIS 646 N -1.83 3.51 -1.33 5.89 3.76 -1.26 -3.33 115.29 120.70 3dyp s HIS 646 Ca 0.40 0.95 -0.16 0.00 -0.15 0.00 0.00 55.06 56.09 3dyp s HIS 646 Cb -0.11 -2.57 0.01 0.00 1.11 0.00 0.00 32.58 31.02 3dyp s HIS 646 CO 0.28 -0.57 2.13 -1.13 -0.85 0.00 0.00 174.74 174.60 3dyp n SER 647 N -2.53 3.75 -1.32 1.40 3.41 -0.55 -4.66 113.62 113.12 3dyp n SER 647 Ca 0.03 -2.82 0.06 0.00 -0.26 0.00 0.00 58.87 55.88 3dyp n SER 647 Cb 0.55 -1.58 0.27 0.00 -0.26 0.00 0.00 64.21 63.19 3dyp n SER 647 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3dyp n ASP 648 N 6.69 3.87 -2.74 4.04 5.68 -1.26 -3.85 116.55 128.99 3dyp n ASP 648 Ca 0.51 -2.46 -0.09 0.00 -0.50 0.00 0.00 54.79 52.25 3dyp n ASP 648 Cb 0.40 -0.55 0.07 0.00 -1.14 0.00 0.00 41.12 39.90 3dyp n ASP 648 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 3dyp n ASN 649 N 0.61 -0.38 -3.69 -1.12 5.15 -1.26 -5.06 115.26 109.50 3dyp n ASN 649 Ca 0.19 -2.74 -0.14 0.00 -0.60 0.00 0.00 54.58 51.29 3dyp n ASN 649 Cb 0.78 0.35 -0.09 0.00 -0.53 0.00 0.00 39.78 40.29 3dyp n ASN 649 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3dyp s GLU 650 N -1.35 0.63 0.07 1.20 8.01 -1.25 -4.17 118.70 121.85 3dyp s GLU 650 Ca 0.26 0.61 0.02 0.00 0.01 0.00 0.00 54.97 55.87 3dyp s GLU 650 Cb 0.41 0.31 -0.03 0.00 -4.31 0.00 0.00 34.13 30.50 3dyp s GLU 650 CO -0.03 -0.10 -0.08 -0.48 0.01 0.00 0.00 175.26 174.58 3dyp s LEU 651 N 0.05 2.39 -0.27 1.80 0.05 -0.21 -1.94 118.68 120.54 3dyp s LEU 651 Ca -0.02 -0.79 -0.10 0.00 0.05 0.00 0.00 54.13 53.27 3dyp s LEU 651 Cb -0.03 -0.14 -0.04 0.00 -2.05 0.00 0.00 46.19 43.92 3dyp s LEU 651 CO 0.02 -0.33 0.15 -0.22 -0.55 0.00 0.00 176.35 175.42 3dyp s LEU 652 N -2.37 3.85 -0.19 1.48 2.96 0.26 -1.16 118.68 123.51 3dyp s LEU 652 Ca 0.02 -0.07 -0.10 0.00 -0.22 0.00 0.00 54.13 53.76 3dyp s LEU 652 Cb -0.02 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.56 3dyp s LEU 652 CO -0.02 -0.05 0.12 -1.00 -1.32 0.00 0.00 176.35 174.09 3dyp s HIS 653 N 1.72 3.40 0.05 5.38 3.76 -0.31 0.15 115.29 129.43 3dyp s HIS 653 Ca 0.07 0.31 0.05 0.00 -0.15 0.00 0.00 55.06 55.34 3dyp s HIS 653 Cb -0.16 -2.14 -0.02 0.00 1.11 0.00 0.00 32.58 31.37 3dyp s HIS 653 CO 0.09 0.29 -0.15 1.67 -0.85 0.00 0.00 174.74 175.79 3dyp s TRP 654 N 0.30 1.33 -0.08 1.40 1.48 -0.22 -0.39 118.94 122.76 3dyp s TRP 654 Ca 0.08 -0.37 -0.06 0.00 -1.06 0.00 0.00 56.10 54.68 3dyp s TRP 654 Cb -0.11 -0.78 0.03 0.00 -1.16 0.00 0.00 33.47 31.45 3dyp s TRP 654 CO -0.02 0.05 0.21 1.41 -4.06 0.00 0.00 176.95 174.55 3dyp s MET 655 N -1.25 0.21 -0.10 3.25 1.75 -0.49 0.06 119.30 122.74 3dyp s MET 655 Ca 0.02 0.37 0.03 0.00 -1.25 0.00 0.00 55.69 54.86 3dyp s MET 655 Cb -0.08 0.01 -0.01 0.00 2.84 0.00 0.00 34.83 37.59 3dyp s MET 655 CO 0.02 -0.08 -0.20 0.08 -0.65 0.00 0.00 175.02 174.18 3dyp s VAL 656 N 0.56 2.42 0.03 10.11 1.01 -0.01 -0.87 120.40 133.66 3dyp s VAL 656 Ca -0.04 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.06 3dyp s VAL 656 Cb -0.05 -1.95 -0.02 0.00 0.00 0.00 0.00 36.38 34.35 3dyp s VAL 656 CO -0.03 0.55 -0.06 0.00 0.00 0.00 0.00 175.10 175.56 3dyp s ALA 657 N 0.24 0.41 -0.29 5.51 0.00 -0.33 -1.25 121.76 126.03 3dyp s ALA 657 Ca -0.13 -0.66 -0.08 0.00 0.00 0.00 0.00 51.96 51.09 3dyp s ALA 657 Cb -0.17 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 3dyp s ALA 657 CO 0.07 -0.06 0.11 -1.17 0.00 0.00 0.00 175.76 174.72 3dyp s LEU 658 N -1.41 3.89 -1.56 0.00 2.96 0.35 -1.32 118.68 121.58 3dyp s LEU 658 Ca -0.11 -0.50 -0.04 0.00 -0.22 0.00 0.00 54.13 53.26 3dyp s LEU 658 Cb -0.09 -1.95 0.04 0.00 0.50 0.00 0.00 46.19 44.68 3dyp s LEU 658 CO -0.00 -0.16 0.24 0.47 -1.32 0.00 0.00 176.35 175.58 3dyp n ASP 659 N 4.94 -0.02 0.00 3.68 8.00 -0.73 0.70 116.55 133.11 3dyp n ASP 659 Ca -0.15 -1.18 0.00 0.00 0.71 0.00 0.00 54.79 54.18 3dyp n ASP 659 Cb 0.49 -2.10 0.00 0.00 -0.02 0.00 0.00 41.12 39.49 3dyp n ASP 659 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dyp n GLY 660 N -2.16 2.69 3.58 0.44 0.00 -1.26 -4.89 105.19 103.59 3dyp n GLY 660 Ca -0.25 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 3dyp n GLY 660 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyp s LYS 661 N -0.17 3.67 -0.00 1.61 1.02 0.22 -4.68 119.74 121.40 3dyp s LYS 661 Ca 0.00 0.25 -0.30 0.00 0.02 0.00 0.00 55.97 55.94 3dyp s LYS 661 Cb 0.00 -3.85 -0.06 0.00 -0.52 0.00 0.00 37.83 33.40 3dyp s LYS 661 CO 0.00 -0.97 1.60 -2.14 -0.92 0.00 0.00 175.35 172.92 3dyp s PRO 662 N 3.29 4.21 -0.22 -1.68 0.02 -1.26 0.13 135.00 139.49 3dyp s PRO 662 Ca 0.33 2.19 0.03 0.00 0.02 0.00 0.00 61.00 63.56 3dyp s PRO 662 Cb -0.12 -3.77 -0.15 0.00 0.02 0.00 0.00 34.50 30.48 3dyp s PRO 662 CO 0.20 -0.75 -0.18 -0.11 -0.33 0.00 0.00 177.00 175.83 3dyp n LEU 663 N 6.25 2.74 -3.61 -5.54 -0.00 -0.38 -4.90 117.00 111.56 3dyp n LEU 663 Ca 0.16 -0.11 -0.02 0.00 -0.00 0.00 0.00 56.01 56.04 3dyp n LEU 663 Cb 0.42 -0.68 -0.01 0.00 -0.00 0.00 0.00 43.42 43.14 3dyp n LEU 663 CO 0.62 0.84 0.98 0.00 -0.00 0.00 0.00 177.39 179.82 3dyp s ALA 664 N -2.44 -2.08 0.01 1.96 0.00 -1.09 -5.02 121.76 113.10 3dyp s ALA 664 Ca -0.28 1.05 -0.29 0.00 0.00 0.00 0.00 51.96 52.44 3dyp s ALA 664 Cb 0.08 0.19 0.10 0.00 0.00 0.00 0.00 23.12 23.48 3dyp s ALA 664 CO 0.53 -0.83 0.97 -1.54 0.00 0.00 0.00 175.76 174.90 3dyp s SER 665 N -2.60 -0.27 0.19 0.00 1.04 -1.26 -0.83 113.70 109.98 3dyp s SER 665 Ca 0.11 -0.11 -0.05 0.00 0.48 0.00 0.00 55.95 56.38 3dyp s SER 665 Cb 0.01 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.52 3dyp s SER 665 CO -0.04 -0.62 0.34 0.61 0.98 0.00 0.00 173.24 174.51 3dyp n GLY 666 N -0.30 1.93 3.05 7.32 0.00 0.11 -4.97 105.19 112.33 3dyp n GLY 666 Ca -0.07 -1.27 -0.13 0.00 0.00 0.00 0.00 46.02 44.55 3dyp n GLY 666 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dyp s GLU 667 N -2.18 0.21 -0.02 1.61 2.02 -1.26 -1.05 118.70 118.02 3dyp s GLU 667 Ca 0.11 0.29 -0.01 0.00 0.02 0.00 0.00 54.97 55.37 3dyp s GLU 667 Cb -0.02 0.07 0.01 0.00 0.10 0.00 0.00 34.13 34.29 3dyp s GLU 667 CO 0.08 -0.05 0.04 0.08 0.02 0.00 0.00 175.26 175.43 3dyp s VAL 668 N 0.27 -0.01 0.28 2.63 1.01 0.12 -4.96 120.40 119.75 3dyp s VAL 668 Ca -0.01 0.04 -0.29 0.00 0.00 0.00 0.00 61.98 61.71 3dyp s VAL 668 Cb -0.03 -0.08 -0.10 0.00 0.00 0.00 0.00 36.38 36.18 3dyp s VAL 668 CO -0.01 0.02 1.24 -2.84 0.00 0.00 0.00 175.10 173.51 3dyp s PRO 669 N 0.23 4.45 -0.19 2.72 0.02 -1.26 0.90 135.00 141.86 3dyp s PRO 669 Ca -0.02 2.05 -0.12 0.00 0.02 0.00 0.00 61.00 62.93 3dyp s PRO 669 Cb -0.03 -3.14 -0.05 0.00 0.02 0.00 0.00 34.50 31.31 3dyp s PRO 669 CO -0.01 -0.08 0.23 -0.51 -0.33 0.00 0.00 177.00 176.30 3dyp s LEU 670 N -1.29 4.20 -0.48 -5.54 1.43 -0.82 -4.77 118.68 111.41 3dyp s LEU 670 Ca 0.49 0.35 0.03 0.00 -1.03 0.00 0.00 54.13 53.98 3dyp s LEU 670 Cb -0.37 -2.25 0.16 0.00 0.03 0.00 0.00 46.19 43.76 3dyp s LEU 670 CO 0.46 0.10 0.33 -0.62 0.23 0.00 0.00 176.35 176.85 3dyp s ASP 671 N 0.60 2.90 -0.12 2.29 2.15 -1.26 -4.72 116.67 118.52 3dyp s ASP 671 Ca 0.13 -3.03 0.03 0.00 0.43 0.00 0.00 52.55 50.10 3dyp s ASP 671 Cb -0.13 -0.84 0.01 0.00 -0.30 0.00 0.00 42.92 41.66 3dyp s ASP 671 CO 0.02 -0.19 -0.21 -0.69 -0.17 0.00 0.00 175.17 173.94 3dyp s VAL 672 N -0.09 1.88 0.76 1.11 1.01 -1.26 -4.87 120.40 118.93 3dyp s VAL 672 Ca 0.26 -0.89 -0.11 0.00 0.00 0.00 0.00 61.98 61.24 3dyp s VAL 672 Cb -0.08 -1.66 0.05 0.00 0.00 0.00 0.00 36.38 34.69 3dyp s VAL 672 CO -0.12 0.52 1.09 0.00 0.00 0.00 0.00 175.10 176.59 3dyp s ALA 673 N 0.69 2.46 0.16 5.51 0.00 -1.26 -1.49 121.76 127.83 3dyp s ALA 673 Ca -0.11 -0.21 -0.33 0.00 0.00 0.00 0.00 51.96 51.31 3dyp s ALA 673 Cb -0.16 -3.09 -0.13 0.00 0.00 0.00 0.00 23.12 19.74 3dyp s ALA 673 CO 0.02 -1.53 1.69 -0.35 0.00 0.00 0.00 175.76 175.60 3dyp n PRO 674 N -3.29 2.52 -0.63 0.00 -0.04 -1.21 -0.27 135.00 132.07 3dyp n PRO 674 Ca 0.07 0.91 0.00 0.00 -0.04 0.00 0.00 63.50 64.44 3dyp n PRO 674 Cb 0.56 -2.73 0.00 0.00 -0.04 0.00 0.00 33.50 31.29 3dyp n PRO 674 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3dyp n GLN 675 N 4.13 0.00 -2.16 0.54 1.13 -0.89 -4.93 117.38 115.20 3dyp n GLN 675 Ca 0.17 0.00 -0.21 0.00 -1.94 0.00 0.00 57.00 55.02 3dyp n GLN 675 Cb 0.33 -2.61 0.12 0.00 0.11 0.00 0.00 30.24 28.19 3dyp n GLN 675 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dyp n GLY 676 N -2.00 0.25 3.40 1.08 0.00 0.62 -4.69 105.19 103.86 3dyp n GLY 676 Ca 0.00 -1.96 -0.23 0.00 0.00 0.00 0.00 46.02 43.83 3dyp n GLY 676 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyp s LYS 677 N -4.87 1.48 -0.00 1.61 1.02 -1.26 -0.50 119.74 117.22 3dyp s LYS 677 Ca 0.58 -1.60 0.00 0.00 0.02 0.00 0.00 55.97 54.97 3dyp s LYS 677 Cb -0.03 -1.53 0.00 0.00 -0.52 0.00 0.00 37.83 35.75 3dyp s LYS 677 CO 0.39 0.30 -0.00 -1.14 -0.92 0.00 0.00 175.35 173.98 3dyp s GLN 678 N -3.23 0.05 -0.18 1.68 0.74 0.83 -4.83 119.66 114.71 3dyp s GLN 678 Ca 0.23 0.01 -0.06 0.00 0.05 0.00 0.00 55.36 55.59 3dyp s GLN 678 Cb -0.05 -0.10 -0.03 0.00 1.10 0.00 0.00 33.01 33.93 3dyp s GLN 678 CO 0.10 -0.02 0.03 -0.51 -0.55 0.00 0.00 175.29 174.34 3dyp s LEU 679 N 0.18 3.57 -0.11 3.68 1.43 -1.26 -1.38 118.68 124.78 3dyp s LEU 679 Ca -0.01 -0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.08 3dyp s LEU 679 Cb -0.03 -1.89 0.01 0.00 0.03 0.00 0.00 46.19 44.31 3dyp s LEU 679 CO -0.01 0.15 -0.18 -0.63 0.23 0.00 0.00 176.35 175.91 3dyp s ILE 680 N 0.51 1.71 -0.21 -0.59 1.01 -0.16 -4.97 121.20 118.51 3dyp s ILE 680 Ca 0.01 -0.78 -0.08 0.00 0.00 0.00 0.00 60.65 59.79 3dyp s ILE 680 Cb -0.13 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.76 3dyp s ILE 680 CO 0.02 0.48 0.10 -0.70 0.00 0.00 0.00 174.94 174.83 3dyp s GLU 681 N 0.80 3.99 0.51 2.79 2.12 -1.26 -1.10 118.70 126.56 3dyp s GLU 681 Ca -0.09 -0.32 -0.13 0.00 0.36 0.00 0.00 54.97 54.78 3dyp s GLU 681 Cb -0.16 -3.33 -0.07 0.00 0.26 0.00 0.00 34.13 30.84 3dyp s GLU 681 CO 0.01 0.17 0.93 -0.51 -0.54 0.00 0.00 175.26 175.32 3dyp s LEU 682 N 0.67 3.59 0.84 2.70 1.43 0.34 -4.99 118.68 123.26 3dyp s LEU 682 Ca 0.05 1.40 -0.12 0.00 -1.03 0.00 0.00 54.13 54.43 3dyp s LEU 682 Cb -0.13 -4.35 0.10 0.00 0.03 0.00 0.00 46.19 41.84 3dyp s LEU 682 CO 0.01 -0.60 1.17 -2.84 0.23 0.00 0.00 176.35 174.32 3dyp s PRO 683 N -4.28 1.48 0.18 1.29 0.02 -1.26 -4.90 135.00 127.53 3dyp s PRO 683 Ca 0.56 1.62 -0.32 0.00 0.02 0.00 0.00 61.00 62.88 3dyp s PRO 683 Cb -0.10 -1.77 -0.12 0.00 0.02 0.00 0.00 34.50 32.52 3dyp s PRO 683 CO 0.37 -2.30 1.71 -1.91 -0.33 0.00 0.00 177.00 174.53 3dyp n GLU 684 N -3.64 2.62 -3.64 5.54 2.13 -1.26 -4.92 120.64 117.47 3dyp n GLU 684 Ca 0.12 0.95 -0.39 0.00 0.66 0.00 0.00 57.16 58.50 3dyp n GLU 684 Cb 0.51 -2.78 -0.12 0.00 0.27 0.00 0.00 31.44 29.33 3dyp n GLU 684 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3dyp s LEU 685 N 1.38 4.32 1.00 4.31 1.43 -1.26 -5.07 118.68 124.79 3dyp s LEU 685 Ca 0.77 -0.71 -0.11 0.00 -1.03 0.00 0.00 54.13 53.05 3dyp s LEU 685 Cb -0.55 -2.00 0.18 0.00 0.03 0.00 0.00 46.19 43.85 3dyp s LEU 685 CO 0.35 -0.26 1.01 -0.81 0.23 0.00 0.00 176.35 176.86 3dyp n PRO 686 N 4.98 -1.06 -2.85 1.29 -0.04 -1.26 -4.97 135.00 131.09 3dyp n PRO 686 Ca -0.13 -0.26 -0.42 0.00 -0.04 0.00 0.00 63.50 62.65 3dyp n PRO 686 Cb 0.48 -2.25 -0.04 0.00 -0.04 0.00 0.00 33.50 31.65 3dyp n PRO 686 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 3dyp s GLN 687 N -4.45 4.17 0.48 0.54 1.11 -1.26 -5.02 119.66 115.24 3dyp s GLN 687 Ca 0.66 0.99 -0.21 0.00 0.01 0.00 0.00 55.36 56.81 3dyp s GLN 687 Cb -0.23 -3.65 -0.10 0.00 -1.01 0.00 0.00 33.01 28.01 3dyp s GLN 687 CO 0.61 -0.56 0.65 -0.35 0.01 0.00 0.00 175.29 175.65 3dyp n PRO 688 N 6.10 0.72 -0.32 2.91 -0.04 -1.26 -4.90 135.00 138.21 3dyp n PRO 688 Ca 0.07 0.27 0.16 0.00 -0.04 0.00 0.00 63.50 63.96 3dyp n PRO 688 Cb 0.47 -1.71 0.40 0.00 -0.04 0.00 0.00 33.50 32.62 3dyp n PRO 688 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3dyp h GLU 689 N 0.74 0.60 0.00 0.54 5.08 -2.03 -3.46 114.58 116.04 3dyp h GLU 689 Ca -0.43 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 3dyp h GLU 689 Cb 1.39 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3dyp h GLU 689 CO 0.51 0.39 0.00 -1.13 -1.00 0.00 0.00 179.01 177.78 3dyp n SER 690 N -4.69 0.00 -4.72 1.42 3.41 -1.26 -5.17 113.62 102.61 3dyp n SER 690 Ca 0.23 -0.74 -0.35 0.00 -0.26 0.00 0.00 58.87 57.75 3dyp n SER 690 Cb 0.66 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.70 3dyp n SER 690 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyp s ALA 691 N -1.22 2.14 0.00 7.33 0.00 -1.26 -4.89 121.76 123.86 3dyp s ALA 691 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 51.96 52.99 3dyp s ALA 691 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.60 3dyp s ALA 691 CO 0.00 -1.89 0.00 0.41 0.00 0.00 0.00 175.76 174.28 3dyp n GLY 692 N 0.66 0.99 3.57 0.00 0.00 0.03 -4.94 105.19 105.51 3dyp n GLY 692 Ca 0.15 -1.98 -0.36 0.00 0.00 0.00 0.00 46.02 43.82 3dyp n GLY 692 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dyp s GLN 693 N -1.19 3.89 0.10 1.61 2.00 -1.26 -1.21 119.66 123.60 3dyp s GLN 693 Ca 0.00 -0.37 -0.23 0.00 -2.00 0.00 0.00 55.36 52.77 3dyp s GLN 693 Cb 0.00 -3.39 -0.07 0.00 0.80 0.00 0.00 33.01 30.35 3dyp s GLN 693 CO 0.00 0.01 0.69 -0.51 -0.50 0.00 0.00 175.29 174.98 3dyp s LEU 694 N 1.13 4.53 -0.02 3.68 1.43 -0.13 -1.78 118.68 127.52 3dyp s LEU 694 Ca 0.06 1.44 0.04 0.00 -1.03 0.00 0.00 54.13 54.63 3dyp s LEU 694 Cb -0.14 -3.11 -0.01 0.00 0.03 0.00 0.00 46.19 42.96 3dyp s LEU 694 CO 0.04 0.19 -0.14 0.26 0.23 0.00 0.00 176.35 176.92 3dyp s TRP 695 N -0.85 1.36 -0.17 0.29 0.52 -0.44 0.36 118.94 120.02 3dyp s TRP 695 Ca 0.33 -0.31 -0.06 0.00 0.02 0.00 0.00 56.10 56.09 3dyp s TRP 695 Cb -0.21 -0.90 -0.03 0.00 -1.15 0.00 0.00 33.47 31.18 3dyp s TRP 695 CO 0.22 -0.07 0.02 -1.17 0.02 0.00 0.00 176.95 175.97 3dyp s LEU 696 N -0.16 3.56 -0.09 2.99 2.96 0.10 -1.19 118.68 126.84 3dyp s LEU 696 Ca 0.02 -0.02 0.02 0.00 -0.22 0.00 0.00 54.13 53.93 3dyp s LEU 696 Cb -0.08 -1.88 0.01 0.00 0.50 0.00 0.00 46.19 44.74 3dyp s LEU 696 CO 0.00 0.17 -0.16 -0.89 -1.32 0.00 0.00 176.35 174.15 3dyp s THR 697 N 0.39 1.47 0.15 3.68 2.01 -0.05 -0.58 115.64 122.71 3dyp s THR 697 Ca -0.00 -0.65 0.10 0.00 0.31 0.00 0.00 61.69 61.45 3dyp s THR 697 Cb -0.13 -1.33 -0.04 0.00 0.01 0.00 0.00 72.50 71.01 3dyp s THR 697 CO 0.01 0.43 -0.22 0.68 -0.69 0.00 0.00 174.62 174.83 3dyp s VAL 698 N 0.79 2.02 0.01 3.82 -7.23 0.44 -1.39 120.40 118.86 3dyp s VAL 698 Ca -0.11 -1.80 0.00 0.00 -1.81 0.00 0.00 61.98 58.26 3dyp s VAL 698 Cb -0.16 -1.86 -0.01 0.00 0.56 0.00 0.00 36.38 34.91 3dyp s VAL 698 CO 0.02 -0.10 -0.01 -0.13 -0.31 0.00 0.00 175.10 174.57 3dyp s ARG 699 N -2.33 0.10 -0.22 4.82 0.52 0.48 -1.93 118.95 120.38 3dyp s ARG 699 Ca 0.14 -0.16 -0.14 0.00 -0.52 0.00 0.00 55.73 55.04 3dyp s ARG 699 Cb -0.09 0.01 -0.04 0.00 0.52 0.00 0.00 34.95 35.35 3dyp s ARG 699 CO 0.07 -0.01 0.33 0.08 0.02 0.00 0.00 175.30 175.79 3dyp s VAL 700 N -0.37 5.24 -0.07 3.52 1.01 0.14 -1.16 120.40 128.71 3dyp s VAL 700 Ca -0.04 0.55 0.03 0.00 0.00 0.00 0.00 61.98 62.52 3dyp s VAL 700 Cb -0.03 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.67 3dyp s VAL 700 CO -0.00 0.26 -0.16 -0.69 0.00 0.00 0.00 175.10 174.51 3dyp s VAL 701 N 1.38 2.88 -0.42 2.92 1.01 -0.31 -0.93 120.40 126.94 3dyp s VAL 701 Ca 0.15 -0.77 -0.18 0.00 0.00 0.00 0.00 61.98 61.18 3dyp s VAL 701 Cb -0.15 -2.13 0.02 0.00 0.00 0.00 0.00 36.38 34.12 3dyp s VAL 701 CO 0.07 0.57 0.49 -1.10 0.00 0.00 0.00 175.10 175.14 3dyp s GLN 702 N -0.41 3.20 0.35 2.72 -0.21 0.11 -1.05 119.66 124.36 3dyp s GLN 702 Ca 0.05 -0.60 0.13 0.00 0.02 0.00 0.00 55.36 54.96 3dyp s GLN 702 Cb -0.12 -3.95 0.65 0.00 1.00 0.00 0.00 33.01 30.60 3dyp s GLN 702 CO 0.02 -0.87 1.77 -1.00 -2.12 0.00 0.00 175.29 173.10 3dyp h PRO 703 N 8.74 0.00 -5.88 2.91 0.13 -1.88 0.52 132.00 136.53 3dyp h PRO 703 Ca -0.26 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.20 3dyp h PRO 703 Cb 1.11 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.14 3dyp h PRO 703 CO 0.81 0.43 -0.55 -0.80 -0.23 0.00 0.00 178.00 177.66 3dyp s ASN 704 N -6.85 5.85 0.71 1.44 0.02 -1.26 -3.74 114.94 111.12 3dyp s ASN 704 Ca -0.02 0.25 -0.14 0.00 -1.02 0.00 0.00 52.86 51.93 3dyp s ASN 704 Cb 0.14 -1.75 0.03 0.00 0.02 0.00 0.00 41.25 39.68 3dyp s ASN 704 CO 0.73 0.33 1.14 0.00 0.02 0.00 0.00 177.10 179.31 3dyp s ALA 705 N -1.11 2.29 0.39 0.60 0.00 -1.26 -4.46 121.76 118.20 3dyp s ALA 705 Ca 0.20 0.61 0.02 0.00 0.00 0.00 0.00 51.96 52.79 3dyp s ALA 705 Cb -0.12 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.63 3dyp s ALA 705 CO 0.10 -1.59 0.08 0.25 0.00 0.00 0.00 175.76 174.60 3dyp n THR 706 N -2.73 0.00 0.28 0.00 -2.24 -0.42 -4.92 114.28 104.24 3dyp n THR 706 Ca 0.11 -2.09 0.16 0.00 -2.27 0.00 0.00 64.05 59.96 3dyp n THR 706 Cb 0.52 0.63 0.76 0.00 -2.10 0.00 0.00 70.33 70.14 3dyp n THR 706 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dyp h ALA 707 N 1.46 1.08 -0.02 6.98 0.00 -1.99 -3.21 119.26 123.56 3dyp h ALA 707 Ca -0.31 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3dyp h ALA 707 Cb 1.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3dyp h ALA 707 CO 0.50 0.08 0.00 -2.67 0.00 0.00 0.00 179.25 177.17 3dyp n TRP 708 N -3.28 0.02 -3.85 0.00 4.27 -1.26 -5.05 117.44 108.28 3dyp n TRP 708 Ca -0.01 -0.03 -0.09 0.00 -3.89 0.00 0.00 57.50 53.48 3dyp n TRP 708 Cb 0.26 -0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.14 3dyp n TRP 708 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 3dyp s SER 709 N -0.60 0.04 0.47 -0.67 1.04 -1.21 -4.67 113.70 108.09 3dyp s SER 709 Ca 0.08 -0.66 -0.05 0.00 0.48 0.00 0.00 55.95 55.81 3dyp s SER 709 Cb 0.06 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.54 3dyp s SER 709 CO 0.09 -0.80 0.77 -1.61 0.98 0.00 0.00 173.24 172.66 3dyp s GLU 710 N -3.88 3.52 0.40 4.02 0.41 -1.26 -1.31 118.70 120.60 3dyp s GLU 710 Ca 0.08 0.15 -0.27 0.00 -0.41 0.00 0.00 54.97 54.52 3dyp s GLU 710 Cb 0.04 -2.40 -0.10 0.00 -1.78 0.00 0.00 34.13 29.89 3dyp s GLU 710 CO -0.08 -0.19 1.46 0.00 -0.49 0.00 0.00 175.26 175.97 3dyp s ALA 711 N -2.71 3.45 0.00 5.21 0.00 -1.26 -2.01 121.76 124.43 3dyp s ALA 711 Ca 0.47 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.96 3dyp s ALA 711 Cb -0.10 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.42 3dyp s ALA 711 CO 0.44 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 175.51 3dyp n GLY 712 N 0.51 1.03 3.69 0.00 0.00 0.18 -4.91 105.19 105.68 3dyp n GLY 712 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 3dyp n GLY 712 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3dyp n HIS 713 N -2.00 2.23 -3.52 1.61 -0.00 -0.85 -4.54 115.22 108.15 3dyp n HIS 713 Ca 0.00 0.50 -0.38 0.00 0.46 0.00 0.00 57.72 58.30 3dyp n HIS 713 Cb 0.00 -2.43 -0.09 0.00 -0.12 0.00 0.00 29.99 27.34 3dyp n HIS 713 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 3dyp s ILE 714 N -0.68 5.26 -0.51 3.57 1.01 -1.26 0.04 121.20 128.63 3dyp s ILE 714 Ca 0.60 0.38 0.15 0.00 0.00 0.00 0.00 60.65 61.78 3dyp s ILE 714 Cb -0.60 -3.60 -0.19 0.00 0.01 0.00 0.00 42.46 38.08 3dyp s ILE 714 CO 0.57 0.25 0.56 -1.54 0.00 0.00 0.00 174.94 174.77 3dyp n SER 715 N 4.85 0.92 -3.50 3.58 3.41 -0.10 -5.00 113.62 117.78 3dyp n SER 715 Ca -0.12 -0.60 -0.13 0.00 -0.26 0.00 0.00 58.87 57.76 3dyp n SER 715 Cb 0.51 1.21 -0.04 0.00 -0.26 0.00 0.00 64.21 65.64 3dyp n SER 715 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyp s ALA 716 N -2.63 -1.77 0.21 7.33 0.00 -1.24 -4.69 121.76 118.97 3dyp s ALA 716 Ca 0.02 1.10 -0.17 0.00 0.00 0.00 0.00 51.96 52.91 3dyp s ALA 716 Cb 0.11 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.43 3dyp s ALA 716 CO 0.63 -0.52 0.54 1.67 0.00 0.00 0.00 175.76 178.08 3dyp s TRP 717 N -2.20 -0.07 -0.11 0.00 -2.14 -1.26 0.29 118.94 113.44 3dyp s TRP 717 Ca -0.03 -0.29 -0.30 0.00 2.66 0.00 0.00 56.10 58.14 3dyp s TRP 717 Cb -0.01 0.40 0.12 0.00 -3.10 0.00 0.00 33.47 30.89 3dyp s TRP 717 CO -0.01 -0.96 1.00 -1.14 -2.66 0.00 0.00 176.95 173.18 3dyp s GLN 718 N -3.89 0.62 0.11 3.25 2.00 -0.81 -4.99 119.66 115.94 3dyp s GLN 718 Ca 0.11 -0.06 0.04 0.00 -2.00 0.00 0.00 55.36 53.44 3dyp s GLN 718 Cb -0.01 0.29 -0.04 0.00 0.80 0.00 0.00 33.01 34.04 3dyp s GLN 718 CO -0.00 -0.24 -0.10 -0.65 -0.50 0.00 0.00 175.29 173.80 3dyp s GLN 719 N -2.05 0.88 0.01 1.67 -0.21 -1.26 -0.42 119.66 118.28 3dyp s GLN 719 Ca 0.03 -1.22 -0.06 0.00 0.02 0.00 0.00 55.36 54.13 3dyp s GLN 719 Cb -0.01 -0.54 -0.00 0.00 1.00 0.00 0.00 33.01 33.46 3dyp s GLN 719 CO -0.04 0.08 0.10 -1.58 -2.12 0.00 0.00 175.29 171.73 3dyp s TRP 720 N -2.64 0.08 0.13 0.91 0.51 0.25 -4.99 118.94 113.20 3dyp s TRP 720 Ca 0.08 -0.21 -0.30 0.00 -2.12 0.00 0.00 56.10 53.55 3dyp s TRP 720 Cb -0.02 -0.08 -0.06 0.00 -0.81 0.00 0.00 33.47 32.51 3dyp s TRP 720 CO -0.00 -0.26 0.99 1.03 -0.51 0.00 0.00 176.95 178.20 3dyp s ARG 721 N -1.36 4.68 0.00 4.98 0.52 -1.26 -0.73 118.95 125.78 3dyp s ARG 721 Ca -0.15 1.51 0.00 0.00 -0.52 0.00 0.00 55.73 56.58 3dyp s ARG 721 Cb -0.08 -3.35 0.00 0.00 0.52 0.00 0.00 34.95 32.04 3dyp s ARG 721 CO 0.01 0.20 0.00 1.28 0.02 0.00 0.00 175.30 176.81 3dyp n LEU 722 N 2.64 0.00 -4.78 2.53 4.77 0.16 -4.90 117.00 117.42 3dyp n LEU 722 Ca 0.02 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.66 3dyp n LEU 722 Cb 0.48 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.58 3dyp n LEU 722 CO 0.52 0.00 0.75 0.00 -1.33 0.00 0.00 177.39 177.32 3dyp s ALA 723 N -3.07 2.68 -0.07 -1.18 0.00 -1.26 -4.70 121.76 114.16 3dyp s ALA 723 Ca 0.00 0.63 0.03 0.00 0.00 0.00 0.00 51.96 52.62 3dyp s ALA 723 Cb 0.00 -3.31 0.01 0.00 0.00 0.00 0.00 23.12 19.82 3dyp s ALA 723 CO 0.00 -0.82 -0.14 -2.00 0.00 0.00 0.00 175.76 172.79 3dyp s GLU 724 N -3.63 1.89 -0.34 0.00 2.12 -1.26 -0.96 118.70 116.53 3dyp s GLU 724 Ca 0.69 -0.49 -0.02 0.00 0.36 0.00 0.00 54.97 55.51 3dyp s GLU 724 Cb -0.20 -1.54 0.07 0.00 0.26 0.00 0.00 34.13 32.72 3dyp s GLU 724 CO 0.31 0.06 0.07 -0.80 -0.54 0.00 0.00 175.26 174.36 3dyp s ASN 725 N 0.57 5.00 0.47 -1.70 0.01 -0.35 -4.97 114.94 113.98 3dyp s ASN 725 Ca -0.15 -1.55 -0.22 0.00 -0.71 0.00 0.00 52.86 50.23 3dyp s ASN 725 Cb -0.16 -1.74 -0.07 0.00 0.41 0.00 0.00 41.25 39.69 3dyp s ASN 725 CO 0.04 -0.35 1.16 -0.76 -1.51 0.00 0.00 177.10 175.68 3dyp s LEU 726 N 1.20 3.97 -0.07 0.60 1.43 -1.26 -0.79 118.68 123.75 3dyp s LEU 726 Ca -0.00 2.27 -0.30 0.00 -1.03 0.00 0.00 54.13 55.08 3dyp s LEU 726 Cb -0.21 -4.30 -0.03 0.00 0.03 0.00 0.00 46.19 41.68 3dyp s LEU 726 CO -0.02 -0.96 1.23 -0.55 0.23 0.00 0.00 176.35 176.28 3dyp s SER 727 N -1.44 7.01 0.00 2.29 0.15 -1.26 -4.85 113.70 115.61 3dyp s SER 727 Ca 0.65 1.82 0.00 0.00 0.70 0.00 0.00 55.95 59.11 3dyp s SER 727 Cb -0.28 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.48 3dyp s SER 727 CO 0.33 -0.63 0.65 1.33 1.20 0.00 0.00 173.24 176.11 3dyp n VAL 728 N 4.78 0.33 -3.23 4.45 0.24 -1.26 -5.00 118.33 118.65 3dyp n VAL 728 Ca 0.12 -0.64 -0.39 0.00 -2.04 0.00 0.00 64.34 61.39 3dyp n VAL 728 Cb 0.46 0.87 -0.06 0.00 -1.47 0.00 0.00 33.84 33.64 3dyp n VAL 728 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3dyp s THR 729 N -0.33 5.12 0.39 3.34 -4.23 -1.26 -5.01 115.64 113.67 3dyp s THR 729 Ca 0.00 1.06 -0.27 0.00 -1.18 0.00 0.00 61.69 61.31 3dyp s THR 729 Cb 0.00 -3.88 -0.09 0.00 1.34 0.00 0.00 72.50 69.87 3dyp s THR 729 CO 0.00 0.24 1.32 -1.48 -0.54 0.00 0.00 174.62 174.16 3dyp s LEU 730 N 1.11 4.25 0.19 4.79 2.34 -1.26 -4.99 118.68 125.11 3dyp s LEU 730 Ca 0.28 2.69 -0.28 0.00 0.06 0.00 0.00 54.13 56.88 3dyp s LEU 730 Cb -0.16 -3.85 -0.08 0.00 -0.56 0.00 0.00 46.19 41.54 3dyp s LEU 730 CO 0.11 -0.81 0.87 -2.84 -1.06 0.00 0.00 176.35 172.62 3dyp s PRO 731 N -2.17 4.71 -0.27 1.48 0.02 -1.26 -4.95 135.00 132.56 3dyp s PRO 731 Ca 0.56 1.33 -0.35 0.00 0.02 0.00 0.00 61.00 62.56 3dyp s PRO 731 Cb -0.39 -3.29 -0.11 0.00 0.02 0.00 0.00 34.50 30.73 3dyp s PRO 731 CO 0.51 0.50 2.08 0.00 -0.33 0.00 0.00 177.00 179.75 3dyp n ALA 732 N 1.73 0.98 -1.96 -1.55 0.00 -1.26 -4.79 120.51 113.66 3dyp n ALA 732 Ca -0.03 0.04 -0.42 0.00 0.00 0.00 0.00 53.44 53.03 3dyp n ALA 732 Cb 0.48 -2.55 -0.03 0.00 0.00 0.00 0.00 19.45 17.36 3dyp n ALA 732 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dyp s ALA 733 N 6.34 3.59 0.00 0.00 0.00 -1.26 -4.87 121.76 125.56 3dyp s ALA 733 Ca 1.04 0.98 0.00 0.00 0.00 0.00 0.00 51.96 53.98 3dyp s ALA 733 Cb -0.78 -3.77 0.00 0.00 0.00 0.00 0.00 23.12 18.57 3dyp s ALA 733 CO 0.50 -1.45 0.00 0.43 0.00 0.00 0.00 175.76 175.23 3dyp n SER 734 N 7.28 0.00 0.05 0.00 7.64 -1.26 -4.85 113.62 122.48 3dyp n SER 734 Ca 0.18 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.18 3dyp n SER 734 Cb 0.43 0.00 0.48 0.00 -1.01 0.00 0.00 64.21 64.10 3dyp n SER 734 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3dyp n HIS 735 N 0.00 0.38 -4.30 1.43 -0.00 -1.26 -4.87 115.22 106.60 3dyp n HIS 735 Ca 0.00 0.12 -0.16 0.00 -0.00 0.00 0.00 57.72 57.68 3dyp n HIS 735 Cb 0.00 -0.70 -0.10 0.00 -0.00 0.00 0.00 29.99 29.19 3dyp n HIS 735 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3dyp s ALA 736 N -3.08 1.67 -0.05 -1.41 0.00 -1.26 -5.15 121.76 112.48 3dyp s ALA 736 Ca 0.10 -1.84 0.02 0.00 0.00 0.00 0.00 51.96 50.24 3dyp s ALA 736 Cb 0.14 1.10 0.01 0.00 0.00 0.00 0.00 23.12 24.36 3dyp s ALA 736 CO 0.47 -0.48 -0.09 -1.50 0.00 0.00 0.00 175.76 174.16 3dyp s ILE 737 N -3.80 0.88 0.57 0.00 1.10 -1.26 -3.81 121.20 114.88 3dyp s ILE 737 Ca 0.38 -0.36 -0.19 0.00 -0.51 0.00 0.00 60.65 59.97 3dyp s ILE 737 Cb 0.08 -0.81 -0.04 0.00 0.15 0.00 0.00 42.46 41.83 3dyp s ILE 737 CO 0.14 0.29 1.17 -2.16 -2.11 0.00 0.00 174.94 172.26 3dyp s PRO 738 N 0.53 3.14 -0.19 3.50 0.04 -1.26 -4.96 135.00 135.80 3dyp s PRO 738 Ca -0.10 1.71 -0.07 0.00 0.04 0.00 0.00 61.00 62.59 3dyp s PRO 738 Cb -0.13 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 3dyp s PRO 738 CO 0.02 -1.05 0.05 -1.58 0.04 0.00 0.00 177.00 174.48 3dyp s HIS 739 N -1.70 3.17 -0.12 0.56 2.46 0.94 -4.81 115.29 115.79 3dyp s HIS 739 Ca 0.75 -0.10 -0.13 0.00 0.47 0.00 0.00 55.06 56.05 3dyp s HIS 739 Cb -0.27 -2.10 -0.05 0.00 -0.13 0.00 0.00 32.58 30.03 3dyp s HIS 739 CO 0.30 -0.00 0.31 -1.17 -2.47 0.00 0.00 174.74 171.71 3dyp s LEU 740 N 0.68 4.32 -0.16 8.88 2.96 -1.26 -0.87 118.68 133.23 3dyp s LEU 740 Ca 0.02 0.62 0.01 0.00 -0.22 0.00 0.00 54.13 54.57 3dyp s LEU 740 Cb -0.13 -2.39 0.02 0.00 0.50 0.00 0.00 46.19 44.18 3dyp s LEU 740 CO 0.02 0.19 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.16 3dyp s THR 741 N -0.10 1.93 -0.14 3.68 2.01 0.20 -4.97 115.64 118.25 3dyp s THR 741 Ca 0.18 -0.87 -0.05 0.00 0.31 0.00 0.00 61.69 61.26 3dyp s THR 741 Cb -0.14 -1.74 -0.04 0.00 0.01 0.00 0.00 72.50 70.59 3dyp s THR 741 CO 0.06 0.52 0.05 -0.89 -0.69 0.00 0.00 174.62 173.68 3dyp s THR 742 N 1.18 4.73 0.08 -0.82 2.01 -1.26 0.37 115.64 121.92 3dyp s THR 742 Ca 0.01 -0.07 -0.04 0.00 0.31 0.00 0.00 61.69 61.90 3dyp s THR 742 Cb -0.14 -3.07 -0.03 0.00 0.01 0.00 0.00 72.50 69.28 3dyp s THR 742 CO -0.09 0.54 0.07 -0.94 -0.69 0.00 0.00 174.62 173.51 3dyp s SER 743 N -0.30 0.33 0.20 3.53 1.04 0.58 -5.00 113.70 114.09 3dyp s SER 743 Ca 0.08 -0.91 -0.11 0.00 0.48 0.00 0.00 55.95 55.50 3dyp s SER 743 Cb -0.12 0.27 0.26 0.00 0.10 0.00 0.00 66.02 66.53 3dyp s SER 743 CO 0.02 -0.67 1.72 -0.33 0.98 0.00 0.00 173.24 174.95 3dyp h GLU 744 N 2.96 0.28 0.00 4.02 4.39 -2.03 -2.51 114.58 121.70 3dyp h GLU 744 Ca -0.34 -0.02 -0.16 0.00 0.34 0.00 0.00 59.36 59.19 3dyp h GLU 744 Cb 1.17 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.73 3dyp h GLU 744 CO 0.61 0.19 -0.75 0.52 -1.16 0.00 0.00 179.01 178.42 3dyp h MET 745 N 0.29 0.00 -3.71 2.33 2.86 -1.97 -3.44 114.93 111.29 3dyp h MET 745 Ca 0.29 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.85 3dyp h MET 745 Cb 0.40 0.00 -0.13 0.00 0.06 0.00 0.00 31.60 31.93 3dyp h MET 745 CO -0.35 0.75 -0.27 -0.51 1.06 0.00 0.00 176.91 177.58 3dyp s ASP 746 N -6.60 0.01 -0.23 1.22 1.11 -0.94 0.57 116.67 111.81 3dyp s ASP 746 Ca 0.02 -0.62 -0.02 0.00 0.18 0.00 0.00 52.55 52.11 3dyp s ASP 746 Cb 0.09 0.40 0.01 0.00 1.07 0.00 0.00 42.92 44.49 3dyp s ASP 746 CO 0.78 -0.81 -0.07 -0.36 1.18 0.00 0.00 175.17 175.89 3dyp s PHE 747 N -3.87 2.99 0.10 4.23 2.99 -0.74 -0.30 117.98 123.37 3dyp s PHE 747 Ca 0.07 -1.31 0.08 0.00 0.00 0.00 0.00 56.93 55.77 3dyp s PHE 747 Cb 0.04 -2.06 -0.04 0.00 0.00 0.00 0.00 43.02 40.95 3dyp s PHE 747 CO -0.08 -0.67 -0.14 0.00 -0.00 0.00 0.00 175.22 174.33 3dyp s ILE 749 N -1.16 1.21 -0.04 0.00 1.09 -0.53 0.59 121.20 122.36 3dyp s ILE 749 Ca 0.19 -0.54 0.05 0.00 -1.10 0.00 0.00 60.65 59.25 3dyp s ILE 749 Cb -0.11 -1.08 -0.01 0.00 -1.06 0.00 0.00 42.46 40.20 3dyp s ILE 749 CO 0.11 0.37 -0.19 -0.70 -0.10 0.00 0.00 174.94 174.43 3dyp s GLU 750 N 0.48 1.88 -0.25 2.79 2.12 -0.05 0.19 118.70 125.87 3dyp s GLU 750 Ca -0.12 -0.69 -0.02 0.00 0.36 0.00 0.00 54.97 54.50 3dyp s GLU 750 Cb -0.14 -1.66 0.14 0.00 0.26 0.00 0.00 34.13 32.72 3dyp s GLU 750 CO 0.03 0.31 0.39 -1.17 -0.54 0.00 0.00 175.26 174.28 3dyp s LEU 751 N -0.12 -0.67 0.00 2.70 2.96 -0.59 -0.04 118.68 122.92 3dyp s LEU 751 Ca -0.01 0.21 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 3dyp s LEU 751 Cb -0.11 1.15 0.00 0.00 0.50 0.00 0.00 46.19 47.73 3dyp s LEU 751 CO 0.02 -0.30 0.00 0.61 -1.32 0.00 0.00 176.35 175.36 3dyp n GLY 752 N 5.37 3.19 0.11 7.98 0.00 -1.26 0.10 105.19 120.68 3dyp n GLY 752 Ca -0.03 0.23 0.15 0.00 0.00 0.00 0.00 46.02 46.37 3dyp n GLY 752 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dyp n ASN 753 N 5.18 0.36 -4.72 1.61 6.94 -1.26 -4.87 115.26 118.51 3dyp n ASN 753 Ca 0.00 -0.94 -0.24 0.00 -0.02 0.00 0.00 54.58 53.38 3dyp n ASN 753 Cb 0.00 -0.04 -0.06 0.00 -2.36 0.00 0.00 39.78 37.32 3dyp n ASN 753 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3dyp s LYS 754 N -2.13 2.57 -0.14 -3.83 1.02 0.29 -1.77 119.74 115.74 3dyp s LYS 754 Ca 0.41 -1.17 -0.12 0.00 0.02 0.00 0.00 55.97 55.11 3dyp s LYS 754 Cb 0.21 -2.38 0.04 0.00 -0.52 0.00 0.00 37.83 35.18 3dyp s LYS 754 CO 0.39 0.41 0.36 0.50 -0.92 0.00 0.00 175.35 176.09 3dyp s ARG 755 N -3.46 0.41 -0.11 1.68 3.52 -0.80 -1.54 118.95 118.65 3dyp s ARG 755 Ca 0.31 0.52 0.03 0.00 -0.13 0.00 0.00 55.73 56.45 3dyp s ARG 755 Cb -0.08 0.18 0.01 0.00 -1.56 0.00 0.00 34.95 33.49 3dyp s ARG 755 CO 0.21 -0.06 -0.20 -1.58 -0.81 0.00 0.00 175.30 172.86 3dyp s TRP 756 N 0.31 2.36 -0.19 5.12 0.51 0.13 -1.45 118.94 125.73 3dyp s TRP 756 Ca -0.01 -1.06 -0.03 0.00 -2.12 0.00 0.00 56.10 52.88 3dyp s TRP 756 Cb -0.03 -1.62 -0.01 0.00 -0.81 0.00 0.00 33.47 31.00 3dyp s TRP 756 CO -0.01 -0.47 -0.07 -1.14 -0.51 0.00 0.00 176.95 174.75 3dyp s GLN 757 N 0.64 3.41 -0.31 4.98 0.74 0.56 -1.46 119.66 128.23 3dyp s GLN 757 Ca -0.13 -0.63 -0.05 0.00 0.05 0.00 0.00 55.36 54.60 3dyp s GLN 757 Cb -0.16 -2.89 0.03 0.00 1.10 0.00 0.00 33.01 31.08 3dyp s GLN 757 CO 0.03 -0.04 0.06 -0.06 -0.55 0.00 0.00 175.29 174.73 3dyp s PHE 758 N 1.05 3.19 0.11 1.67 0.40 -0.72 0.35 117.98 124.04 3dyp s PHE 758 Ca 0.00 -1.35 -0.31 0.00 -0.60 0.00 0.00 56.93 54.67 3dyp s PHE 758 Cb -0.15 -2.22 -0.09 0.00 0.51 0.00 0.00 43.02 41.08 3dyp s PHE 758 CO -0.01 -0.69 1.54 1.21 0.70 0.00 0.00 175.22 177.97 3dyp s ASN 759 N 1.40 6.67 0.24 1.36 3.84 0.07 -1.80 114.94 126.73 3dyp s ASN 759 Ca -0.01 2.47 0.24 0.00 0.21 0.00 0.00 52.86 55.78 3dyp s ASN 759 Cb -0.18 -2.58 0.47 0.00 -0.55 0.00 0.00 41.25 38.41 3dyp s ASN 759 CO 0.01 -0.79 1.52 0.03 -2.79 0.00 0.00 177.10 175.08 3dyp h ARG 760 N 7.33 0.00 0.00 0.43 3.08 -0.17 -0.45 114.38 124.60 3dyp h ARG 760 Ca -0.42 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.38 3dyp h ARG 760 Cb 1.20 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.21 3dyp h ARG 760 CO 0.91 0.00 -1.43 1.96 -1.07 0.00 0.00 179.97 180.34 3dyp h GLN 761 N 0.00 0.00 0.00 0.04 7.50 -1.89 -3.36 115.11 117.40 3dyp h GLN 761 Ca 0.00 0.00 -0.17 0.00 0.50 0.00 0.00 58.65 58.98 3dyp h GLN 761 Cb 0.84 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.33 3dyp h GLN 761 CO 0.00 0.63 -1.89 -1.13 -1.50 0.00 0.00 178.83 174.94 3dyp n SER 762 N -3.13 0.32 0.00 1.46 3.41 -1.23 -4.85 113.62 109.60 3dyp n SER 762 Ca -0.10 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 3dyp n SER 762 Cb 0.99 1.01 0.00 0.00 -0.26 0.00 0.00 64.21 65.95 3dyp n SER 762 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dyp n GLY 763 N 1.46 0.51 3.68 5.00 0.00 -0.18 -4.78 105.19 110.87 3dyp n GLY 763 Ca -0.15 -0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.47 3dyp n GLY 763 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dyp s PHE 764 N -2.00 2.82 -0.59 1.61 0.40 -1.24 -4.91 117.98 114.08 3dyp s PHE 764 Ca 0.00 -0.16 -0.27 0.00 -0.60 0.00 0.00 56.93 55.90 3dyp s PHE 764 Cb 0.00 -1.31 -0.01 0.00 0.51 0.00 0.00 43.02 42.21 3dyp s PHE 764 CO 0.00 0.55 1.73 -1.17 0.70 0.00 0.00 175.22 177.04 3dyp s LEU 765 N -3.31 3.31 0.12 -0.37 2.96 -1.26 -0.75 118.68 119.38 3dyp s LEU 765 Ca 0.29 0.35 0.23 0.00 -0.22 0.00 0.00 54.13 54.78 3dyp s LEU 765 Cb -0.08 -2.71 0.12 0.00 0.50 0.00 0.00 46.19 44.02 3dyp s LEU 765 CO 0.20 -2.16 1.11 -1.54 -1.32 0.00 0.00 176.35 172.64 3dyp n SER 766 N 11.71 0.69 -3.48 3.68 3.41 0.15 -2.08 113.62 127.70 3dyp n SER 766 Ca 0.18 0.08 -0.15 0.00 -0.26 0.00 0.00 58.87 58.71 3dyp n SER 766 Cb 0.51 0.52 -0.04 0.00 -0.26 0.00 0.00 64.21 64.93 3dyp n SER 766 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3dyp s GLN 767 N -3.25 1.11 -0.06 4.33 2.00 -1.01 -4.45 119.66 118.33 3dyp s GLN 767 Ca 0.03 -0.04 -0.06 0.00 -2.00 0.00 0.00 55.36 53.29 3dyp s GLN 767 Cb 0.13 0.52 0.02 0.00 0.80 0.00 0.00 33.01 34.47 3dyp s GLN 767 CO 0.77 -0.41 0.17 -1.64 -0.50 0.00 0.00 175.29 173.69 3dyp s MET 768 N -2.21 0.22 0.04 1.67 -1.94 -1.26 -0.32 119.30 115.50 3dyp s MET 768 Ca -0.06 0.21 0.06 0.00 -1.71 0.00 0.00 55.69 54.19 3dyp s MET 768 Cb -0.00 0.10 -0.02 0.00 2.01 0.00 0.00 34.83 36.92 3dyp s MET 768 CO 0.00 -0.03 -0.17 -1.58 -0.01 0.00 0.00 175.02 173.23 3dyp s TRP 769 N 0.02 1.49 -0.21 -0.03 0.51 -0.53 0.20 118.94 120.39 3dyp s TRP 769 Ca -0.01 -0.36 0.01 0.00 -2.12 0.00 0.00 56.10 53.62 3dyp s TRP 769 Cb -0.02 -0.88 0.05 0.00 -0.81 0.00 0.00 33.47 31.81 3dyp s TRP 769 CO 0.00 0.06 -0.10 0.42 -0.51 0.00 0.00 176.95 176.82 3dyp s ILE 770 N -0.83 1.73 0.00 2.03 1.01 -0.71 -1.91 121.20 122.51 3dyp s ILE 770 Ca 0.04 -1.13 0.00 0.00 0.00 0.00 0.00 60.65 59.56 3dyp s ILE 770 Cb -0.08 -1.82 0.00 0.00 0.01 0.00 0.00 42.46 40.57 3dyp s ILE 770 CO 0.02 0.12 0.00 0.61 0.00 0.00 0.00 174.94 175.69 3dyp n GLY 771 N 4.64 2.57 1.33 6.18 0.00 -0.73 -0.20 105.19 118.99 3dyp n GLY 771 Ca -0.15 -0.41 0.09 0.00 0.00 0.00 0.00 46.02 45.56 3dyp n GLY 771 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dyp n ASP 772 N 2.91 3.91 -4.64 1.61 5.68 -1.26 -4.90 116.55 119.85 3dyp n ASP 772 Ca 0.00 -2.24 -0.39 0.00 -0.50 0.00 0.00 54.79 51.66 3dyp n ASP 772 Cb 0.00 -0.50 -0.08 0.00 -1.14 0.00 0.00 41.12 39.41 3dyp n ASP 772 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 3dyp s LYS 773 N -1.55 4.11 0.34 0.11 2.20 0.72 -5.05 119.74 120.62 3dyp s LYS 773 Ca 0.44 0.25 -0.28 0.00 -0.36 0.00 0.00 55.97 56.01 3dyp s LYS 773 Cb 0.26 -3.60 -0.10 0.00 -1.51 0.00 0.00 37.83 32.88 3dyp s LYS 773 CO 0.25 -0.20 1.25 0.15 -0.36 0.00 0.00 175.35 176.43 3dyp s LYS 774 N 1.83 4.34 -0.02 4.03 1.02 -1.26 -1.75 119.74 127.93 3dyp s LYS 774 Ca 0.20 2.08 0.20 0.00 0.02 0.00 0.00 55.97 58.47 3dyp s LYS 774 Cb -0.15 -3.02 -0.30 0.00 -0.52 0.00 0.00 37.83 33.83 3dyp s LYS 774 CO 0.09 -0.15 0.48 1.04 -0.92 0.00 0.00 175.35 175.90 3dyp n GLN 775 N 0.73 0.60 -4.86 1.68 1.13 0.54 -4.80 117.38 112.41 3dyp n GLN 775 Ca 0.01 -0.17 -0.32 0.00 -1.94 0.00 0.00 57.00 54.58 3dyp n GLN 775 Cb 0.43 -1.47 -0.13 0.00 0.11 0.00 0.00 30.24 29.18 3dyp n GLN 775 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3dyp s LEU 776 N -4.25 2.59 -0.16 1.08 1.43 -1.26 -0.07 118.68 118.05 3dyp s LEU 776 Ca -0.06 -0.32 0.09 0.00 -1.03 0.00 0.00 54.13 52.81 3dyp s LEU 776 Cb 0.13 -1.51 -0.23 0.00 0.03 0.00 0.00 46.19 44.61 3dyp s LEU 776 CO 0.83 0.31 0.21 0.18 0.23 0.00 0.00 176.35 178.11 3dyp n LEU 777 N 2.03 1.26 -4.06 1.79 4.77 0.11 -4.70 117.00 118.20 3dyp n LEU 777 Ca -0.17 0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 55.78 3dyp n LEU 777 Cb 0.52 -0.13 -0.12 0.00 -2.33 0.00 0.00 43.42 41.36 3dyp n LEU 777 CO 0.26 0.62 -0.42 0.42 -1.33 0.00 0.00 177.39 176.94 3dyp s THR 778 N -2.54 0.64 0.91 -5.08 -4.23 -0.98 -4.95 115.64 99.42 3dyp s THR 778 Ca -0.16 -0.89 -0.10 0.00 -1.18 0.00 0.00 61.69 59.36 3dyp s THR 778 Cb 0.07 -0.65 0.14 0.00 1.34 0.00 0.00 72.50 73.40 3dyp s THR 778 CO 0.77 -0.20 1.10 -2.65 -0.54 0.00 0.00 174.62 173.10 3dyp n PRO 779 N 1.85 -0.41 -2.61 3.99 -0.02 -1.26 -3.47 135.00 133.07 3dyp n PRO 779 Ca -0.20 -0.05 -0.43 0.00 -2.02 0.00 0.00 63.50 60.80 3dyp n PRO 779 Cb 0.55 -2.34 -0.02 0.00 -0.02 0.00 0.00 33.50 31.67 3dyp n PRO 779 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3dyp s LEU 780 N -6.14 3.66 0.11 2.45 2.96 -0.88 -4.50 118.68 116.33 3dyp s LEU 780 Ca 0.67 0.48 0.04 0.00 -0.22 0.00 0.00 54.13 55.10 3dyp s LEU 780 Cb -0.23 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.88 3dyp s LEU 780 CO 0.58 -1.23 -0.10 -0.13 -1.32 0.00 0.00 176.35 174.15 3dyp s ARG 781 N 4.40 0.91 0.57 1.98 0.52 -0.09 -4.24 118.95 123.01 3dyp s ARG 781 Ca 0.48 -1.26 -0.21 0.00 -0.52 0.00 0.00 55.73 54.22 3dyp s ARG 781 Cb -0.07 -0.55 -0.04 0.00 0.52 0.00 0.00 34.95 34.81 3dyp s ARG 781 CO 0.31 0.08 1.32 -0.51 0.02 0.00 0.00 175.30 176.52 3dyp s ASP 782 N -2.70 5.15 -0.04 0.23 1.11 -1.26 0.86 116.67 120.03 3dyp s ASP 782 Ca 0.09 2.68 -0.00 0.00 0.18 0.00 0.00 52.55 55.51 3dyp s ASP 782 Cb -0.01 -2.63 0.03 0.00 1.07 0.00 0.00 42.92 41.38 3dyp s ASP 782 CO -0.00 -1.64 0.01 -1.58 1.18 0.00 0.00 175.17 173.13 3dyp s GLN 783 N -3.04 0.30 0.00 8.23 0.74 0.93 -4.74 119.66 122.08 3dyp s GLN 783 Ca 0.74 0.11 0.00 0.00 0.05 0.00 0.00 55.36 56.26 3dyp s GLN 783 Cb -0.38 -0.54 0.00 0.00 1.10 0.00 0.00 33.01 33.18 3dyp s GLN 783 CO 0.44 -0.17 0.64 1.19 -0.55 0.00 0.00 175.29 176.83 3dyp n PHE 784 N 4.37 0.00 -4.42 1.67 3.01 -1.26 -1.26 117.46 119.57 3dyp n PHE 784 Ca -0.22 -0.17 -0.21 0.00 1.01 0.00 0.00 57.45 57.86 3dyp n PHE 784 Cb 0.50 -0.02 -0.10 0.00 -0.01 0.00 0.00 39.48 39.85 3dyp n PHE 784 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 3dyp s THR 785 N -0.35 1.50 0.07 4.37 -4.23 -1.26 -2.86 115.64 112.88 3dyp s THR 785 Ca 0.00 -2.09 0.01 0.00 -1.18 0.00 0.00 61.69 58.43 3dyp s THR 785 Cb 0.00 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.30 3dyp s THR 785 CO 0.00 -0.25 -0.05 0.00 -0.54 0.00 0.00 174.62 173.77 3dyp s ARG 786 N -3.77 0.67 -0.13 3.99 1.70 -1.26 -4.75 118.95 115.40 3dyp s ARG 786 Ca 0.30 -1.13 -0.29 0.00 -0.47 0.00 0.00 55.73 54.14 3dyp s ARG 786 Cb 0.05 -0.08 -0.04 0.00 -0.57 0.00 0.00 34.95 34.31 3dyp s ARG 786 CO 0.12 -0.03 1.62 0.00 -1.08 0.00 0.00 175.30 175.93 3dyp s ALA 787 N -3.10 3.46 0.19 7.88 0.00 -1.26 -4.87 121.76 124.06 3dyp s ALA 787 Ca 0.04 0.71 -0.33 0.00 0.00 0.00 0.00 51.96 52.38 3dyp s ALA 787 Cb 0.02 -3.79 -0.14 0.00 0.00 0.00 0.00 23.12 19.21 3dyp s ALA 787 CO -0.05 -1.64 1.48 -0.35 0.00 0.00 0.00 175.76 175.20 3dyp n PRO 788 N 7.35 2.02 -1.83 0.00 -0.04 -1.26 -1.10 135.00 140.13 3dyp n PRO 788 Ca 0.18 0.72 -0.29 0.00 -0.04 0.00 0.00 63.50 64.07 3dyp n PRO 788 Cb 0.44 -2.43 0.10 0.00 -0.04 0.00 0.00 33.50 31.57 3dyp n PRO 788 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dyp s LEU 789 N 0.49 2.41 0.26 1.53 1.43 -1.26 -4.57 118.68 118.96 3dyp s LEU 789 Ca 0.74 0.81 -0.03 0.00 -1.03 0.00 0.00 54.13 54.62 3dyp s LEU 789 Cb -0.68 -3.26 0.45 0.00 0.03 0.00 0.00 46.19 42.72 3dyp s LEU 789 CO 0.44 -2.04 1.81 0.44 0.23 0.00 0.00 176.35 177.23 3dyp h ASP 790 N -1.15 0.73 0.35 2.29 3.32 -1.87 0.62 116.42 120.71 3dyp h ASP 790 Ca -0.47 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 56.60 3dyp h ASP 790 Cb 1.33 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.79 3dyp h ASP 790 CO 0.65 0.40 -0.15 0.78 -1.72 0.00 0.00 179.24 179.20 3dyp h ASN 791 N 0.83 0.00 1.03 6.45 2.35 -1.86 0.57 115.58 124.96 3dyp h ASN 791 Ca 0.43 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 56.03 3dyp h ASN 791 Cb 0.42 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 3dyp h ASN 791 CO -0.26 0.15 -0.70 0.44 -1.65 0.00 0.00 177.43 175.40 3dyp h ASP 792 N 0.00 0.00 0.12 5.81 3.32 -1.22 -3.34 116.42 121.11 3dyp h ASP 792 Ca -0.00 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.69 3dyp h ASP 792 Cb 0.36 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 3dyp h ASP 792 CO 0.02 0.70 -2.00 -0.38 -1.72 0.00 0.00 179.24 175.86 3dyp n ILE 793 N -3.43 1.77 -3.00 0.35 5.41 -0.67 -0.63 119.36 119.16 3dyp n ILE 793 Ca 0.00 -0.63 0.00 0.00 1.00 0.00 0.00 62.75 63.12 3dyp n ILE 793 Cb 0.76 -1.73 0.00 0.00 -0.71 0.00 0.00 39.64 37.96 3dyp n ILE 793 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3dyp n GLY 794 N 1.99 2.79 0.75 7.39 0.00 0.19 -1.39 105.19 116.91 3dyp n GLY 794 Ca -0.33 -0.35 0.11 0.00 0.00 0.00 0.00 46.02 45.45 3dyp n GLY 794 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3dyp n VAL 795 N 0.00 0.27 -1.75 1.61 0.24 -1.26 -4.91 118.33 112.53 3dyp n VAL 795 Ca 0.00 -0.47 -0.40 0.00 -2.04 0.00 0.00 64.34 61.43 3dyp n VAL 795 Cb 0.00 0.63 0.02 0.00 -1.47 0.00 0.00 33.84 33.02 3dyp n VAL 795 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 3dyp n SER 796 N 0.72 3.13 -3.80 -1.34 2.88 -0.49 -4.80 113.62 109.92 3dyp n SER 796 Ca 0.17 1.11 -0.13 0.00 -1.33 0.00 0.00 58.87 58.70 3dyp n SER 796 Cb 0.43 -1.58 -0.09 0.00 -0.75 0.00 0.00 64.21 62.22 3dyp n SER 796 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 3dyp s GLU 797 N -2.41 0.58 0.30 -1.46 2.02 -0.13 -4.89 118.70 112.71 3dyp s GLU 797 Ca 0.61 -0.21 0.03 0.00 0.02 0.00 0.00 54.97 55.42 3dyp s GLU 797 Cb -0.46 0.25 0.76 0.00 0.10 0.00 0.00 34.13 34.79 3dyp s GLU 797 CO 0.57 -0.15 1.60 0.00 0.02 0.00 0.00 175.26 177.30 3dyp h ALA 798 N 4.16 1.25 0.00 5.21 0.00 -1.99 0.56 119.26 128.45 3dyp h ALA 798 Ca -0.30 0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dyp h ALA 798 Cb 1.18 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.46 3dyp h ALA 798 CO 0.40 -0.57 -0.21 0.25 0.00 0.00 0.00 179.25 179.12 3dyp n THR 799 N -5.39 0.13 -2.92 0.00 -2.24 -1.26 -4.43 114.28 98.17 3dyp n THR 799 Ca 0.23 -0.08 -0.10 0.00 -2.27 0.00 0.00 64.05 61.84 3dyp n THR 799 Cb 0.76 -0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 68.70 3dyp n THR 799 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3dyp s ARG 800 N -3.04 1.03 0.39 -0.78 1.81 0.18 -5.11 118.95 113.43 3dyp s ARG 800 Ca 0.12 -1.33 -0.26 0.00 -1.72 0.00 0.00 55.73 52.54 3dyp s ARG 800 Cb 0.17 -0.39 -0.09 0.00 -0.45 0.00 0.00 34.95 34.19 3dyp s ARG 800 CO 0.61 -1.34 1.28 0.42 -0.68 0.00 0.00 175.30 175.58 3dyp s ILE 801 N 0.67 2.73 -0.49 1.52 -1.09 -0.05 -0.96 121.20 123.54 3dyp s ILE 801 Ca 0.31 0.66 -0.06 0.00 -2.23 0.00 0.00 60.65 59.33 3dyp s ILE 801 Cb 0.01 -3.39 0.13 0.00 -1.58 0.00 0.00 42.46 37.62 3dyp s ILE 801 CO -0.09 0.10 0.32 -0.62 -1.23 0.00 0.00 174.94 173.43 3dyp s ASP 802 N -0.75 5.50 0.29 3.58 2.15 -1.26 -4.83 116.67 121.35 3dyp s ASP 802 Ca 0.55 -2.14 0.20 0.00 0.43 0.00 0.00 52.55 51.59 3dyp s ASP 802 Cb -0.37 -1.92 1.07 0.00 -0.30 0.00 0.00 42.92 41.39 3dyp s ASP 802 CO 0.48 -0.58 1.60 -0.81 -0.17 0.00 0.00 175.17 175.69 3dyp n PRO 803 N 4.53 0.13 0.17 4.34 -0.04 -1.26 -0.93 135.00 141.93 3dyp n PRO 803 Ca -0.02 0.63 0.09 0.00 -0.04 0.00 0.00 63.50 64.15 3dyp n PRO 803 Cb 0.41 -1.92 0.08 0.00 -0.04 0.00 0.00 33.50 32.03 3dyp n PRO 803 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 3dyp h ASN 804 N 0.00 0.00 -3.99 3.54 -1.24 -1.96 -3.38 115.58 108.55 3dyp h ASN 804 Ca 0.00 0.00 -0.54 0.00 0.71 0.00 0.00 56.30 56.47 3dyp h ASN 804 Cb 0.01 0.00 0.12 0.00 0.73 0.00 0.00 38.32 39.18 3dyp h ASN 804 CO 0.00 0.17 0.72 0.00 -1.29 0.00 0.00 177.43 177.03 3dyp s ALA 805 N -3.15 3.29 0.25 1.57 0.00 -0.11 -4.71 121.76 118.90 3dyp s ALA 805 Ca 0.04 1.50 -0.04 0.00 0.00 0.00 0.00 51.96 53.47 3dyp s ALA 805 Cb 0.07 -3.60 0.41 0.00 0.00 0.00 0.00 23.12 19.99 3dyp s ALA 805 CO 0.72 -1.20 1.81 -1.49 0.00 0.00 0.00 175.76 175.59 3dyp h TRP 806 N 2.40 0.84 -0.98 0.00 4.06 -1.78 -1.24 115.95 119.25 3dyp h TRP 806 Ca -0.51 0.03 0.06 0.00 2.06 0.00 0.00 58.89 60.53 3dyp h TRP 806 Cb 1.26 -0.25 -0.06 0.00 -1.00 0.00 0.00 29.16 29.11 3dyp h TRP 806 CO 0.50 0.33 0.64 -0.24 -3.56 0.00 0.00 178.44 176.11 3dyp h VAL 807 N 0.77 1.10 -0.21 1.49 3.04 -1.22 -0.44 116.25 120.79 3dyp h VAL 807 Ca 0.40 -0.40 -0.15 0.00 -1.01 0.00 0.00 66.70 65.54 3dyp h VAL 807 Cb 0.39 -0.16 -0.01 0.00 -2.01 0.00 0.00 31.29 29.50 3dyp h VAL 807 CO -0.26 0.21 -0.49 -0.33 -1.01 0.00 0.00 177.57 175.70 3dyp h GLU 808 N 1.16 0.55 -0.23 4.17 4.39 -1.56 -0.55 114.58 122.52 3dyp h GLU 808 Ca 0.42 -0.32 -0.04 0.00 0.34 0.00 0.00 59.36 59.76 3dyp h GLU 808 Cb 0.14 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 3dyp h GLU 808 CO -0.16 0.91 0.00 0.00 -1.16 0.00 0.00 179.01 178.61 3dyp h ARG 809 N 0.44 0.40 -0.49 2.33 3.08 -0.29 0.19 114.38 120.04 3dyp h ARG 809 Ca 0.02 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 3dyp h ARG 809 Cb 1.01 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 3dyp h ARG 809 CO 0.09 0.58 0.25 -1.49 -1.07 0.00 0.00 179.97 178.33 3dyp h TRP 810 N 0.17 0.69 -0.04 3.04 6.55 -1.01 -1.35 115.95 123.99 3dyp h TRP 810 Ca 0.06 -0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.88 3dyp h TRP 810 Cb 0.40 -0.22 -0.00 0.00 -0.86 0.00 0.00 29.16 28.49 3dyp h TRP 810 CO 0.03 0.53 0.03 0.87 -1.05 0.00 0.00 178.44 178.86 3dyp h LYS 811 N 0.64 0.06 0.00 0.49 1.57 -0.94 -0.75 116.57 117.64 3dyp h LYS 811 Ca 0.17 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.93 3dyp h LYS 811 Cb 0.09 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 3dyp h LYS 811 CO -0.02 0.04 -0.08 0.00 -0.57 0.00 0.00 179.45 178.81 3dyp h ALA 812 N 1.01 1.85 -0.00 3.86 0.00 -0.44 -1.18 119.26 124.35 3dyp h ALA 812 Ca 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3dyp h ALA 812 Cb -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3dyp h ALA 812 CO -0.00 0.10 -0.12 0.00 0.00 0.00 0.00 179.25 179.23 3dyp n ALA 813 N -2.52 2.68 -0.63 0.00 0.00 -0.52 -4.90 120.51 114.61 3dyp n ALA 813 Ca -0.03 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.23 3dyp n ALA 813 Cb 0.16 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.23 3dyp n ALA 813 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dyp n GLY 814 N 1.44 0.67 0.37 0.00 0.00 -0.45 -4.87 105.19 102.36 3dyp n GLY 814 Ca 0.09 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.15 3dyp n GLY 814 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3dyp h HIS 815 N 0.00 0.88 0.00 1.61 3.86 -1.35 0.25 115.15 120.40 3dyp h HIS 815 Ca 0.00 0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.11 3dyp h HIS 815 Cb 0.00 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.18 3dyp h HIS 815 CO 0.00 0.28 -0.69 1.88 0.86 0.00 0.00 177.93 180.26 3dyp h TYR 816 N 0.70 0.00 -0.01 2.45 -1.99 -1.86 -3.32 116.97 112.95 3dyp h TYR 816 Ca 0.49 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.22 3dyp h TYR 816 Cb 0.82 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.55 3dyp h TYR 816 CO -0.00 0.56 -0.59 1.04 -0.00 0.00 0.00 178.16 179.17 3dyp n GLN 817 N -3.19 0.51 -1.76 4.88 6.02 -0.46 -5.00 117.38 118.40 3dyp n GLN 817 Ca 0.00 -0.38 -0.41 0.00 -0.01 0.00 0.00 57.00 56.19 3dyp n GLN 817 Cb 0.77 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 30.53 3dyp n GLN 817 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dyp n ALA 818 N -0.91 2.45 -2.82 -1.58 0.00 0.76 -5.00 120.51 113.41 3dyp n ALA 818 Ca 0.07 0.36 -0.34 0.00 0.00 0.00 0.00 53.44 53.53 3dyp n ALA 818 Cb 0.37 -2.44 -0.11 0.00 0.00 0.00 0.00 19.45 17.27 3dyp n ALA 818 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 3dyp s GLU 819 N -1.19 3.42 0.03 0.00 -1.05 -1.22 -4.91 118.70 113.77 3dyp s GLU 819 Ca 0.59 -0.47 -0.30 0.00 -0.15 0.00 0.00 54.97 54.64 3dyp s GLU 819 Cb -0.49 -2.88 -0.06 0.00 -0.44 0.00 0.00 34.13 30.27 3dyp s GLU 819 CO 0.55 0.42 1.29 0.00 0.95 0.00 0.00 175.26 178.46 3dyp s ALA 820 N -0.11 3.50 -0.19 -0.84 0.00 -1.26 -2.76 121.76 120.09 3dyp s ALA 820 Ca 0.03 0.86 -0.05 0.00 0.00 0.00 0.00 51.96 52.80 3dyp s ALA 820 Cb -0.13 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.45 3dyp s ALA 820 CO 0.02 -0.66 0.00 0.00 0.00 0.00 0.00 175.76 175.13 3dyp s ALA 821 N 1.65 3.06 0.01 0.00 0.00 0.33 -4.90 121.76 121.91 3dyp s ALA 821 Ca 0.61 -0.95 -0.30 0.00 0.00 0.00 0.00 51.96 51.31 3dyp s ALA 821 Cb -0.30 -1.76 -0.04 0.00 0.00 0.00 0.00 23.12 21.02 3dyp s ALA 821 CO 0.27 -0.08 1.09 -1.17 0.00 0.00 0.00 175.76 175.87 3dyp s LEU 822 N 0.88 4.35 -0.08 0.00 2.96 -1.26 -0.20 118.68 125.33 3dyp s LEU 822 Ca 0.01 1.81 0.14 0.00 -0.22 0.00 0.00 54.13 55.87 3dyp s LEU 822 Cb -0.14 -3.57 -0.21 0.00 0.50 0.00 0.00 46.19 42.77 3dyp s LEU 822 CO 0.02 -0.39 0.19 0.18 -1.32 0.00 0.00 176.35 175.03 3dyp n LEU 823 N 4.11 0.00 -3.63 -0.68 4.77 0.70 -4.93 117.00 117.34 3dyp n LEU 823 Ca 0.08 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 56.00 3dyp n LEU 823 Cb 0.49 0.18 -0.06 0.00 -2.33 0.00 0.00 43.42 41.69 3dyp n LEU 823 CO 0.54 0.18 0.96 -1.58 -1.33 0.00 0.00 177.39 176.15 3dyp s GLN 824 N -2.70 0.31 -0.25 3.23 0.74 -0.83 -4.91 119.66 115.26 3dyp s GLN 824 Ca -0.06 0.21 -0.02 0.00 0.05 0.00 0.00 55.36 55.53 3dyp s GLN 824 Cb 0.07 0.15 0.14 0.00 1.10 0.00 0.00 33.01 34.46 3dyp s GLN 824 CO 0.61 -0.07 0.38 0.00 -0.55 0.00 0.00 175.29 175.66 3dyp s THR 826 N 2.55 0.75 -0.05 0.00 -4.23 0.12 -4.95 115.64 109.83 3dyp s THR 826 Ca 0.13 -1.95 0.05 0.00 -1.18 0.00 0.00 61.69 58.74 3dyp s THR 826 Cb -0.15 -1.70 -0.01 0.00 1.34 0.00 0.00 72.50 71.98 3dyp s THR 826 CO -0.17 -0.86 -0.20 0.00 -0.54 0.00 0.00 174.62 172.85 3dyp s ALA 827 N -3.59 1.75 0.01 3.99 0.00 -1.26 -0.27 121.76 122.40 3dyp s ALA 827 Ca 0.12 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.27 3dyp s ALA 827 Cb 0.05 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 3dyp s ALA 827 CO -0.04 0.33 -0.02 -0.51 0.00 0.00 0.00 175.76 175.51 3dyp s ASP 828 N -0.04 0.21 -0.08 0.00 1.01 -0.41 -4.99 116.67 112.37 3dyp s ASP 828 Ca -0.04 -0.34 -0.01 0.00 0.71 0.00 0.00 52.55 52.87 3dyp s ASP 828 Cb -0.12 0.06 -0.03 0.00 1.01 0.00 0.00 42.92 43.84 3dyp s ASP 828 CO 0.03 -0.19 -0.02 -0.89 0.21 0.00 0.00 175.17 174.30 3dyp s THR 829 N -0.98 4.08 0.55 -1.27 2.01 -1.26 -0.99 115.64 117.78 3dyp s THR 829 Ca -0.10 -0.33 0.06 0.00 0.31 0.00 0.00 61.69 61.62 3dyp s THR 829 Cb -0.07 -2.70 0.04 0.00 0.01 0.00 0.00 72.50 69.78 3dyp s THR 829 CO -0.01 0.60 0.43 -0.76 -0.69 0.00 0.00 174.62 174.19 3dyp s LEU 830 N -0.79 2.70 0.53 4.42 1.43 0.22 -4.98 118.68 122.21 3dyp s LEU 830 Ca 0.12 -1.24 0.20 0.00 -1.03 0.00 0.00 54.13 52.18 3dyp s LEU 830 Cb -0.11 -1.19 1.36 0.00 0.03 0.00 0.00 46.19 46.27 3dyp s LEU 830 CO 0.02 -1.13 2.11 0.00 0.23 0.00 0.00 176.35 177.58 3dyp h ALA 831 N 0.70 2.09 0.00 4.21 0.00 -2.03 -3.13 119.26 121.11 3dyp h ALA 831 Ca -0.36 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3dyp h ALA 831 Cb 1.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3dyp h ALA 831 CO 0.56 -0.19 -0.02 -0.40 0.00 0.00 0.00 179.25 179.21 3dyp n ASP 832 N -4.41 0.48 -3.48 0.00 5.75 -1.26 -5.03 116.55 108.60 3dyp n ASP 832 Ca 0.01 -1.29 -0.08 0.00 -0.01 0.00 0.00 54.79 53.42 3dyp n ASP 832 Cb 0.24 -0.01 -0.01 0.00 -1.03 0.00 0.00 41.12 40.31 3dyp n ASP 832 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3dyp s ALA 833 N -0.26 -0.79 -0.10 2.12 0.00 -1.18 -3.15 121.76 118.40 3dyp s ALA 833 Ca 0.00 -0.63 0.03 0.00 0.00 0.00 0.00 51.96 51.36 3dyp s ALA 833 Cb 0.00 0.83 -0.01 0.00 0.00 0.00 0.00 23.12 23.94 3dyp s ALA 833 CO 0.00 -0.98 -0.18 0.08 0.00 0.00 0.00 175.76 174.68 3dyp s VAL 834 N -3.26 2.63 -0.24 0.00 1.01 -0.14 0.72 120.40 121.12 3dyp s VAL 834 Ca 0.15 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.31 3dyp s VAL 834 Cb -0.05 -2.05 0.04 0.00 0.00 0.00 0.00 36.38 34.33 3dyp s VAL 834 CO 0.10 0.55 -0.11 -0.22 0.00 0.00 0.00 175.10 175.42 3dyp s LEU 835 N 0.07 3.12 -0.17 3.92 2.96 -0.16 -0.79 118.68 127.63 3dyp s LEU 835 Ca -0.08 -1.08 -0.06 0.00 -0.22 0.00 0.00 54.13 52.69 3dyp s LEU 835 Cb -0.15 -1.58 -0.03 0.00 0.50 0.00 0.00 46.19 44.93 3dyp s LEU 835 CO 0.05 -0.14 0.02 -0.63 -1.32 0.00 0.00 176.35 174.33 3dyp s ILE 836 N 1.21 4.39 -0.15 6.68 -1.09 0.98 -1.29 121.20 131.94 3dyp s ILE 836 Ca -0.03 -0.18 0.01 0.00 -2.23 0.00 0.00 60.65 58.22 3dyp s ILE 836 Cb -0.18 -2.96 0.00 0.00 -1.58 0.00 0.00 42.46 37.75 3dyp s ILE 836 CO -0.06 0.47 -0.19 -0.89 -1.23 0.00 0.00 174.94 173.05 3dyp s THR 837 N 0.38 2.37 0.18 2.92 2.01 0.63 0.15 115.64 124.28 3dyp s THR 837 Ca -0.00 -0.87 0.04 0.00 0.31 0.00 0.00 61.69 61.16 3dyp s THR 837 Cb -0.13 -1.97 -0.05 0.00 0.01 0.00 0.00 72.50 70.36 3dyp s THR 837 CO 0.01 0.53 -0.05 0.42 -0.69 0.00 0.00 174.62 174.85 3dyp s THR 838 N 0.82 1.03 -0.21 -0.82 -4.23 -0.55 0.13 115.64 111.83 3dyp s THR 838 Ca -0.06 -2.04 -0.11 0.00 -1.18 0.00 0.00 61.69 58.30 3dyp s THR 838 Cb -0.15 -2.07 0.07 0.00 1.34 0.00 0.00 72.50 71.69 3dyp s THR 838 CO -0.01 -0.56 0.50 0.00 -0.54 0.00 0.00 174.62 174.01 3dyp s ALA 839 N -3.42 -1.32 0.09 3.99 0.00 -0.02 -1.35 121.76 119.73 3dyp s ALA 839 Ca 0.22 1.81 0.04 0.00 0.00 0.00 0.00 51.96 54.03 3dyp s ALA 839 Cb 0.04 -1.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 3dyp s ALA 839 CO 0.04 -0.33 -0.10 -1.01 0.00 0.00 0.00 175.76 174.36 3dyp s HIS 840 N 1.54 1.02 -0.09 0.00 3.76 -0.19 -0.21 115.29 121.12 3dyp s HIS 840 Ca -0.09 -0.61 0.04 0.00 -0.15 0.00 0.00 55.06 54.24 3dyp s HIS 840 Cb -0.08 -0.57 -0.01 0.00 1.11 0.00 0.00 32.58 33.04 3dyp s HIS 840 CO -0.15 -0.01 -0.21 0.00 -0.85 0.00 0.00 174.74 173.52 3dyp s ALA 841 N -2.17 2.32 -0.23 -1.40 0.00 0.72 -0.79 121.76 120.22 3dyp s ALA 841 Ca 0.02 -0.98 -0.08 0.00 0.00 0.00 0.00 51.96 50.92 3dyp s ALA 841 Cb -0.05 -0.88 -0.04 0.00 0.00 0.00 0.00 23.12 22.16 3dyp s ALA 841 CO 0.00 0.35 0.10 -1.58 0.00 0.00 0.00 175.76 174.63 3dyp s TRP 842 N 0.07 3.18 0.17 0.00 0.51 0.90 0.12 118.94 123.89 3dyp s TRP 842 Ca -0.09 -0.10 0.07 0.00 -2.12 0.00 0.00 56.10 53.85 3dyp s TRP 842 Cb -0.15 -2.22 -0.04 0.00 -0.81 0.00 0.00 33.47 30.25 3dyp s TRP 842 CO 0.06 -0.12 -0.14 -0.65 -0.51 0.00 0.00 176.95 175.59 3dyp s GLN 843 N 1.20 1.21 -0.16 4.98 -0.21 -1.11 0.76 119.66 126.33 3dyp s GLN 843 Ca 0.05 -1.48 -0.04 0.00 0.02 0.00 0.00 55.36 53.91 3dyp s GLN 843 Cb -0.14 -0.99 0.08 0.00 1.00 0.00 0.00 33.01 32.96 3dyp s GLN 843 CO 0.04 0.17 0.27 -1.58 -2.12 0.00 0.00 175.29 172.06 3dyp s HIS 844 N -2.82 -0.43 -1.51 0.91 2.46 0.48 -3.41 115.29 110.98 3dyp s HIS 844 Ca 0.18 0.80 -0.05 0.00 0.47 0.00 0.00 55.06 56.46 3dyp s HIS 844 Cb -0.01 -0.10 0.05 0.00 -0.13 0.00 0.00 32.58 32.38 3dyp s HIS 844 CO 0.05 -0.44 0.47 1.04 -2.47 0.00 0.00 174.74 173.39 3dyp n GLN 845 N 5.35 -2.98 -0.06 2.88 6.02 -1.26 -0.53 117.38 126.79 3dyp n GLN 845 Ca -0.06 0.36 0.00 0.00 -0.01 0.00 0.00 57.00 57.29 3dyp n GLN 845 Cb 0.50 -4.58 0.00 0.00 1.02 0.00 0.00 30.24 27.18 3dyp n GLN 845 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dyp n GLY 846 N -1.89 1.70 3.76 1.08 0.00 -1.26 -5.03 105.19 103.55 3dyp n GLY 846 Ca -0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 3dyp n GLY 846 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dyp s LYS 847 N -0.40 3.47 -0.44 1.61 2.47 0.31 -5.04 119.74 121.73 3dyp s LYS 847 Ca 0.00 -0.26 -0.23 0.00 -1.56 0.00 0.00 55.97 53.92 3dyp s LYS 847 Cb 0.00 -3.09 0.02 0.00 -1.46 0.00 0.00 37.83 33.30 3dyp s LYS 847 CO 0.00 0.62 0.78 0.99 0.16 0.00 0.00 175.35 177.89 3dyp s THR 848 N -0.59 4.66 -0.13 3.43 2.01 -1.26 -0.39 115.64 123.37 3dyp s THR 848 Ca 0.11 0.45 -0.28 0.00 0.31 0.00 0.00 61.69 62.28 3dyp s THR 848 Cb -0.12 -4.31 -0.26 0.00 0.01 0.00 0.00 72.50 67.82 3dyp s THR 848 CO 0.02 -0.69 0.77 -0.07 -0.69 0.00 0.00 174.62 173.96 3dyp h LEU 849 N 10.08 0.05 -7.84 4.42 3.38 -0.02 -3.42 115.31 121.97 3dyp h LEU 849 Ca -0.25 -0.98 -0.17 0.00 0.09 0.00 0.00 57.88 56.57 3dyp h LEU 849 Cb 1.09 -0.02 -0.22 0.00 0.09 0.00 0.00 40.66 41.60 3dyp h LEU 849 CO 0.95 1.06 -0.61 -0.36 0.09 0.00 0.00 178.44 179.57 3dyp s PHE 850 N -2.25 0.12 -0.11 1.13 0.40 -1.13 -1.64 117.98 114.50 3dyp s PHE 850 Ca -0.19 -0.26 0.01 0.00 -0.60 0.00 0.00 56.93 55.90 3dyp s PHE 850 Cb -0.02 -0.10 0.02 0.00 0.51 0.00 0.00 43.02 43.42 3dyp s PHE 850 CO 0.70 -0.20 -0.15 0.42 0.70 0.00 0.00 175.22 176.69 3dyp s ILE 851 N -1.19 1.47 -0.22 0.64 1.01 -0.41 -0.07 121.20 122.42 3dyp s ILE 851 Ca -0.13 -0.62 -0.02 0.00 0.00 0.00 0.00 60.65 59.88 3dyp s ILE 851 Cb -0.08 -1.35 0.01 0.00 0.01 0.00 0.00 42.46 41.05 3dyp s ILE 851 CO 0.00 0.44 -0.07 -0.55 0.00 0.00 0.00 174.94 174.76 3dyp s SER 852 N 1.06 4.11 -0.14 3.58 0.15 0.03 -0.11 113.70 122.38 3dyp s SER 852 Ca -0.05 -0.58 -0.00 0.00 0.70 0.00 0.00 55.95 56.01 3dyp s SER 852 Cb -0.15 -1.67 -0.01 0.00 -1.71 0.00 0.00 66.02 62.48 3dyp s SER 852 CO -0.03 -0.05 -0.13 -0.13 1.20 0.00 0.00 173.24 174.10 3dyp s ARG 853 N 1.40 3.35 0.14 5.44 0.52 -0.10 -1.02 118.95 128.68 3dyp s ARG 853 Ca 0.04 -0.69 0.00 0.00 -0.52 0.00 0.00 55.73 54.56 3dyp s ARG 853 Cb -0.15 -2.67 -0.04 0.00 0.52 0.00 0.00 34.95 32.61 3dyp s ARG 853 CO -0.05 0.13 0.03 0.15 0.02 0.00 0.00 175.30 175.57 3dyp s LYS 854 N 0.56 0.98 0.00 3.54 1.02 -0.46 -0.58 119.74 124.81 3dyp s LYS 854 Ca -0.08 -1.46 0.01 0.00 0.02 0.00 0.00 55.97 54.46 3dyp s LYS 854 Cb -0.16 0.02 -0.00 0.00 -0.52 0.00 0.00 37.83 37.17 3dyp s LYS 854 CO 0.03 -0.19 -0.03 0.95 -0.92 0.00 0.00 175.35 175.19 3dyp s THR 855 N -3.87 0.25 -0.11 2.17 -4.23 -0.94 -1.48 115.64 107.43 3dyp s THR 855 Ca 0.23 -0.20 0.02 0.00 -1.18 0.00 0.00 61.69 60.56 3dyp s THR 855 Cb 0.07 -0.23 0.01 0.00 1.34 0.00 0.00 72.50 73.70 3dyp s THR 855 CO 0.02 0.03 -0.16 -0.31 -0.54 0.00 0.00 174.62 173.65 3dyp s TYR 856 N -0.18 2.08 -0.23 3.99 1.51 0.12 -0.30 117.35 124.35 3dyp s TYR 856 Ca 0.00 -0.98 0.01 0.00 -1.01 0.00 0.00 57.07 55.09 3dyp s TYR 856 Cb -0.02 -1.48 0.05 0.00 -0.11 0.00 0.00 41.96 40.41 3dyp s TYR 856 CO -0.00 -0.49 -0.08 0.50 -1.11 0.00 0.00 175.55 174.37 3dyp s ARG 857 N 0.93 1.85 -0.21 -0.62 3.52 -0.30 -0.01 118.95 124.11 3dyp s ARG 857 Ca -0.07 -1.00 -0.09 0.00 -0.13 0.00 0.00 55.73 54.44 3dyp s ARG 857 Cb -0.15 -2.58 -0.04 0.00 -1.56 0.00 0.00 34.95 30.61 3dyp s ARG 857 CO -0.01 -0.54 0.10 0.42 -0.81 0.00 0.00 175.30 174.46 3dyp s ILE 858 N 1.35 5.01 0.51 4.11 1.01 0.03 -1.46 121.20 131.76 3dyp s ILE 858 Ca -0.05 0.05 0.02 0.00 0.00 0.00 0.00 60.65 60.67 3dyp s ILE 858 Cb -0.18 -3.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.98 3dyp s ILE 858 CO -0.07 0.41 0.01 1.51 0.00 0.00 0.00 174.94 176.81 3dyp s ASP 859 N 0.69 4.13 0.52 3.58 -4.77 -0.98 -0.96 116.67 118.88 3dyp s ASP 859 Ca 0.05 -1.63 0.35 0.00 -3.30 0.00 0.00 52.55 48.03 3dyp s ASP 859 Cb -0.13 0.46 1.51 0.00 -1.09 0.00 0.00 42.92 43.67 3dyp s ASP 859 CO 0.01 -0.83 1.79 1.23 0.70 0.00 0.00 175.17 178.07 3dyp h GLY 860 N 1.36 0.17 1.99 2.12 0.00 -1.64 1.62 103.07 108.69 3dyp h GLY 860 Ca -0.44 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3dyp h GLY 860 CO 0.74 -0.03 0.00 -1.14 0.00 0.00 0.00 176.54 176.12 3dyp n SER 861 N -4.23 0.00 0.00 0.19 3.41 -1.26 -4.32 113.62 107.40 3dyp n SER 861 Ca 0.27 0.49 0.00 0.00 -0.26 0.00 0.00 58.87 59.36 3dyp n SER 861 Cb 1.24 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 64.70 3dyp n SER 861 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dyp n GLY 862 N 1.33 0.65 3.78 5.00 0.00 0.55 -4.99 105.19 111.51 3dyp n GLY 862 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 3dyp n GLY 862 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dyp s GLN 863 N -0.23 4.29 -0.32 1.61 -0.21 -1.24 -4.61 119.66 118.95 3dyp s GLN 863 Ca 0.00 0.76 -0.07 0.00 0.02 0.00 0.00 55.36 56.06 3dyp s GLN 863 Cb 0.00 -3.31 0.02 0.00 1.00 0.00 0.00 33.01 30.72 3dyp s GLN 863 CO 0.00 0.46 0.11 1.41 -2.12 0.00 0.00 175.29 175.14 3dyp s MET 864 N -0.50 2.93 -0.21 2.91 -2.45 0.40 -2.32 119.30 120.05 3dyp s MET 864 Ca 0.31 -0.98 -0.15 0.00 -1.25 0.00 0.00 55.69 53.62 3dyp s MET 864 Cb -0.19 -3.46 -0.04 0.00 1.25 0.00 0.00 34.83 32.40 3dyp s MET 864 CO 0.18 -0.54 0.37 0.00 1.05 0.00 0.00 175.02 176.08 3dyp s ALA 865 N 1.48 3.56 -0.17 4.11 0.00 -0.53 -0.03 121.76 130.18 3dyp s ALA 865 Ca 0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 51.96 51.36 3dyp s ALA 865 Cb -0.18 -2.61 -0.02 0.00 0.00 0.00 0.00 23.12 20.31 3dyp s ALA 865 CO 0.03 -0.33 -0.06 0.42 0.00 0.00 0.00 175.76 175.83 3dyp s ILE 866 N 1.37 3.54 -0.15 0.00 1.01 0.29 -1.15 121.20 126.11 3dyp s ILE 866 Ca 0.18 -0.47 -0.02 0.00 0.00 0.00 0.00 60.65 60.34 3dyp s ILE 866 Cb -0.15 -2.56 -0.02 0.00 0.01 0.00 0.00 42.46 39.74 3dyp s ILE 866 CO 0.08 0.47 -0.08 -0.89 0.00 0.00 0.00 174.94 174.51 3dyp s THR 867 N 0.77 3.42 -0.07 2.92 2.01 0.59 -1.44 115.64 123.84 3dyp s THR 867 Ca -0.02 -0.52 0.03 0.00 0.31 0.00 0.00 61.69 61.49 3dyp s THR 867 Cb -0.15 -2.48 0.00 0.00 0.01 0.00 0.00 72.50 69.89 3dyp s THR 867 CO 0.02 0.50 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.59 3dyp s VAL 868 N 0.46 1.48 -0.20 3.82 1.01 0.48 -2.22 120.40 125.24 3dyp s VAL 868 Ca -0.07 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.20 3dyp s VAL 868 Cb -0.15 -1.30 0.05 0.00 0.00 0.00 0.00 36.38 34.98 3dyp s VAL 868 CO 0.04 0.43 -0.02 -1.81 0.00 0.00 0.00 175.10 173.73 3dyp s ASP 869 N 0.37 3.21 -0.08 3.32 1.01 0.25 -1.37 116.67 123.39 3dyp s ASP 869 Ca -0.12 -0.89 -0.02 0.00 0.71 0.00 0.00 52.55 52.23 3dyp s ASP 869 Cb -0.15 -0.90 -0.03 0.00 1.01 0.00 0.00 42.92 42.84 3dyp s ASP 869 CO 0.05 -0.24 -0.00 -0.69 0.21 0.00 0.00 175.17 174.49 3dyp s VAL 870 N 1.62 4.27 -0.08 -1.27 1.01 -0.07 -0.92 120.40 124.96 3dyp s VAL 870 Ca -0.02 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.72 3dyp s VAL 870 Cb -0.17 -2.79 -0.02 0.00 0.00 0.00 0.00 36.38 33.40 3dyp s VAL 870 CO -0.07 0.60 -0.16 -1.61 0.00 0.00 0.00 175.10 173.86 3dyp s GLU 871 N -0.88 2.80 -0.12 2.72 2.02 0.85 -1.14 118.70 124.95 3dyp s GLU 871 Ca 0.13 -0.74 0.02 0.00 0.02 0.00 0.00 54.97 54.40 3dyp s GLU 871 Cb -0.11 -2.41 0.01 0.00 0.10 0.00 0.00 34.13 31.72 3dyp s GLU 871 CO 0.02 0.43 -0.17 0.08 0.02 0.00 0.00 175.26 175.64 3dyp s VAL 872 N -0.25 1.66 0.22 2.63 1.01 0.94 -1.29 120.40 125.32 3dyp s VAL 872 Ca 0.01 -0.74 -0.32 0.00 0.00 0.00 0.00 61.98 60.93 3dyp s VAL 872 Cb -0.13 -1.50 -0.13 0.00 0.00 0.00 0.00 36.38 34.63 3dyp s VAL 872 CO 0.03 0.47 1.60 0.00 0.00 0.00 0.00 175.10 177.20 3dyp n ALA 873 N 4.16 2.12 0.21 5.51 0.00 -0.65 -4.59 120.51 127.27 3dyp n ALA 873 Ca -0.19 0.41 0.15 0.00 0.00 0.00 0.00 53.44 53.80 3dyp n ALA 873 Cb 0.51 -2.42 0.78 0.00 0.00 0.00 0.00 19.45 18.32 3dyp n ALA 873 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3dyp h SER 874 N 5.61 0.00 -0.61 0.00 4.64 -1.94 -2.07 113.55 119.18 3dyp h SER 874 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3dyp h SER 874 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 3dyp h SER 874 CO 0.86 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.92 3dyp n ASP 875 N -4.07 3.58 -4.91 4.97 5.75 -1.26 -4.88 116.55 115.73 3dyp n ASP 875 Ca 0.01 -1.99 -0.31 0.00 -0.01 0.00 0.00 54.79 52.48 3dyp n ASP 875 Cb 0.26 -0.41 -0.04 0.00 -1.03 0.00 0.00 41.12 39.90 3dyp n ASP 875 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 3dyp s THR 876 N -1.19 5.28 0.30 2.12 -1.32 -0.78 -5.04 115.64 115.02 3dyp s THR 876 Ca 0.44 -0.18 -0.28 0.00 -1.21 0.00 0.00 61.69 60.46 3dyp s THR 876 Cb 0.24 -3.63 -0.13 0.00 -1.51 0.00 0.00 72.50 67.46 3dyp s THR 876 CO 0.31 0.09 1.12 -0.81 -2.21 0.00 0.00 174.62 173.13 3dyp n PRO 877 N 0.20 1.65 -1.70 7.08 -0.04 -1.26 -4.83 135.00 136.09 3dyp n PRO 877 Ca -0.04 0.58 -0.44 0.00 -0.04 0.00 0.00 63.50 63.56 3dyp n PRO 877 Cb 0.51 -2.03 -0.03 0.00 -0.04 0.00 0.00 33.50 31.91 3dyp n PRO 877 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3dyp n HIS 878 N 0.34 2.50 -1.87 0.54 8.25 -1.26 -4.92 115.22 118.80 3dyp n HIS 878 Ca 0.08 0.26 -0.31 0.00 -0.26 0.00 0.00 57.72 57.48 3dyp n HIS 878 Cb 0.33 -2.56 0.02 0.00 1.12 0.00 0.00 29.99 28.90 3dyp n HIS 878 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3dyp s PRO 879 N 0.26 3.35 0.41 -0.41 0.04 -1.26 -4.88 135.00 132.51 3dyp s PRO 879 Ca 0.71 0.94 0.11 0.00 0.04 0.00 0.00 61.00 62.81 3dyp s PRO 879 Cb -0.59 -2.05 0.85 0.00 0.04 0.00 0.00 34.50 32.76 3dyp s PRO 879 CO 0.42 -0.77 1.94 0.00 0.04 0.00 0.00 177.00 178.63 3dyp h ALA 880 N -0.15 1.56 -2.59 8.56 0.00 -1.88 -3.41 119.26 121.36 3dyp h ALA 880 Ca -0.45 -0.20 0.11 0.00 0.00 0.00 0.00 54.91 54.37 3dyp h ALA 880 Cb 1.20 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.83 3dyp h ALA 880 CO 0.59 0.32 0.38 -0.98 0.00 0.00 0.00 179.25 179.56 3dyp s ARG 881 N -4.66 1.28 -0.30 0.00 1.70 -1.21 -0.12 118.95 115.65 3dyp s ARG 881 Ca -0.05 -0.64 -0.03 0.00 -0.47 0.00 0.00 55.73 54.55 3dyp s ARG 881 Cb 0.15 0.48 0.10 0.00 -0.57 0.00 0.00 34.95 35.11 3dyp s ARG 881 CO 0.72 -0.58 0.12 0.42 -1.08 0.00 0.00 175.30 174.90 3dyp s ILE 882 N -3.48 0.32 0.00 4.99 1.01 0.15 -4.15 121.20 120.04 3dyp s ILE 882 Ca 0.09 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 59.72 3dyp s ILE 882 Cb -0.02 -1.26 0.00 0.00 0.01 0.00 0.00 42.46 41.19 3dyp s ILE 882 CO -0.01 -0.70 0.00 0.61 0.00 0.00 0.00 174.94 174.84 3dyp n GLY 883 N 5.09 3.03 3.33 6.18 0.00 -0.39 -0.65 105.19 121.78 3dyp n GLY 883 Ca -0.04 -0.74 -0.18 0.00 0.00 0.00 0.00 46.02 45.06 3dyp n GLY 883 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyp s LEU 884 N 0.00 2.52 0.13 0.99 1.43 0.48 -0.05 118.68 124.18 3dyp s LEU 884 Ca 0.00 -1.05 -0.10 0.00 -1.03 0.00 0.00 54.13 51.95 3dyp s LEU 884 Cb 0.00 -0.56 0.00 0.00 0.03 0.00 0.00 46.19 45.66 3dyp s LEU 884 CO 0.00 -0.25 0.27 0.54 0.23 0.00 0.00 176.35 177.14 3dyp s ASN 885 N -3.29 0.03 0.04 2.29 4.22 0.25 -1.20 114.94 117.27 3dyp s ASN 885 Ca 0.22 -0.70 -0.27 0.00 -2.14 0.00 0.00 52.86 49.97 3dyp s ASN 885 Cb 0.01 0.41 0.09 0.00 1.28 0.00 0.00 41.25 43.04 3dyp s ASN 885 CO 0.06 -0.83 0.80 0.00 -2.04 0.00 0.00 177.10 175.09 3dyp s GLN 887 N -3.16 2.62 0.39 0.00 0.74 -1.23 -0.70 119.66 118.33 3dyp s GLN 887 Ca 0.03 -1.26 -0.24 0.00 0.05 0.00 0.00 55.36 53.94 3dyp s GLN 887 Cb -0.01 -3.59 -0.09 0.00 1.10 0.00 0.00 33.01 30.42 3dyp s GLN 887 CO -0.09 -0.76 1.02 -0.51 -0.55 0.00 0.00 175.29 174.40 3dyp s LEU 888 N 1.42 4.15 0.44 3.68 1.43 0.23 0.08 118.68 130.11 3dyp s LEU 888 Ca 0.01 1.97 0.20 0.00 -1.03 0.00 0.00 54.13 55.28 3dyp s LEU 888 Cb -0.20 -4.20 1.03 0.00 0.03 0.00 0.00 46.19 42.85 3dyp s LEU 888 CO 0.03 -0.42 1.92 0.00 0.23 0.00 0.00 176.35 178.11 3dyp h ALA 889 N 2.53 1.31 -2.55 4.21 0.00 -0.76 0.04 119.26 124.03 3dyp h ALA 889 Ca -0.48 -0.23 -0.54 0.00 0.00 0.00 0.00 54.91 53.66 3dyp h ALA 889 Cb 1.21 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 3dyp h ALA 889 CO 0.63 0.31 -0.27 -1.14 0.00 0.00 0.00 179.25 178.77 3dyp s GLN 890 N -4.13 3.59 -0.22 0.00 0.74 -1.26 -4.23 119.66 114.14 3dyp s GLN 890 Ca -0.02 -0.16 0.00 0.00 0.05 0.00 0.00 55.36 55.23 3dyp s GLN 890 Cb 0.13 -2.79 0.03 0.00 1.10 0.00 0.00 33.01 31.49 3dyp s GLN 890 CO 0.66 0.37 -0.12 0.08 -0.55 0.00 0.00 175.29 175.72 3dyp s VAL 891 N -1.86 2.43 0.25 1.34 1.01 -1.26 -3.52 120.40 118.79 3dyp s VAL 891 Ca 0.41 -1.09 0.10 0.00 0.00 0.00 0.00 61.98 61.39 3dyp s VAL 891 Cb -0.11 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 3dyp s VAL 891 CO 0.28 0.30 -0.03 0.00 0.00 0.00 0.00 175.10 175.64 3dyp s ALA 892 N 1.27 3.10 0.15 5.51 0.00 -1.26 -5.06 121.76 125.47 3dyp s ALA 892 Ca 0.00 -1.64 -0.07 0.00 0.00 0.00 0.00 51.96 50.25 3dyp s ALA 892 Cb -0.16 -0.73 -0.01 0.00 0.00 0.00 0.00 23.12 22.22 3dyp s ALA 892 CO -0.08 0.30 1.42 0.93 0.00 0.00 0.00 175.76 178.33 3dyp h GLU 893 N 2.09 0.68 -6.48 0.00 5.08 -2.00 -3.43 114.58 110.52 3dyp h GLU 893 Ca -0.44 -0.48 -0.64 0.00 -1.00 0.00 0.00 59.36 56.80 3dyp h GLU 893 Cb 1.24 0.07 -0.17 0.00 0.50 0.00 0.00 28.75 30.40 3dyp h GLU 893 CO 0.59 1.10 -0.79 1.03 -1.00 0.00 0.00 179.01 179.94 3dyp s ARG 894 N -3.91 1.64 -0.13 2.33 1.81 -1.26 -1.60 118.95 117.83 3dyp s ARG 894 Ca -0.09 -1.55 0.02 0.00 -1.72 0.00 0.00 55.73 52.39 3dyp s ARG 894 Cb 0.10 -1.87 0.02 0.00 -0.45 0.00 0.00 34.95 32.74 3dyp s ARG 894 CO 0.87 0.39 -0.17 0.08 -0.68 0.00 0.00 175.30 175.79 3dyp s VAL 895 N -1.90 1.65 -0.07 3.52 1.01 -0.19 -4.53 120.40 119.90 3dyp s VAL 895 Ca 0.24 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.52 3dyp s VAL 895 Cb -0.07 -1.51 0.01 0.00 0.00 0.00 0.00 36.38 34.81 3dyp s VAL 895 CO 0.12 0.47 -0.11 0.21 0.00 0.00 0.00 175.10 175.79 3dyp s ASN 896 N 1.08 1.73 0.12 3.32 3.84 -0.86 -0.81 114.94 123.36 3dyp s ASN 896 Ca -0.04 -0.29 -0.10 0.00 0.21 0.00 0.00 52.86 52.65 3dyp s ASN 896 Cb -0.14 -0.80 0.00 0.00 -0.55 0.00 0.00 41.25 39.76 3dyp s ASN 896 CO -0.04 0.02 0.26 -1.66 -2.79 0.00 0.00 177.10 172.89 3dyp s TRP 897 N 0.72 0.17 -0.34 0.43 -2.14 0.68 0.10 118.94 118.57 3dyp s TRP 897 Ca -0.14 -0.56 -0.00 0.00 2.66 0.00 0.00 56.10 58.06 3dyp s TRP 897 Cb -0.16 0.01 0.08 0.00 -3.10 0.00 0.00 33.47 30.30 3dyp s TRP 897 CO 0.03 -0.64 0.06 -1.17 -2.66 0.00 0.00 176.95 172.57 3dyp s LEU 898 N -2.89 4.45 0.00 -4.66 2.96 0.88 0.28 118.68 119.70 3dyp s LEU 898 Ca 0.09 -1.71 0.00 0.00 -0.22 0.00 0.00 54.13 52.29 3dyp s LEU 898 Cb 0.04 -1.71 0.00 0.00 0.50 0.00 0.00 46.19 45.02 3dyp s LEU 898 CO -0.07 -0.36 0.00 0.61 -1.32 0.00 0.00 176.35 175.20 3dyp n GLY 899 N 4.51 -0.73 3.74 7.98 0.00 -0.82 -0.03 105.19 119.84 3dyp n GLY 899 Ca -0.06 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.75 3dyp n GLY 899 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyp s LEU 900 N 0.00 4.56 0.00 0.99 1.43 -0.89 -1.63 118.68 123.15 3dyp s LEU 900 Ca 0.00 1.99 0.00 0.00 -1.03 0.00 0.00 54.13 55.09 3dyp s LEU 900 Cb 0.00 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.61 3dyp s LEU 900 CO 0.00 -0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.16 3dyp n GLY 901 N 1.75 -0.69 0.19 -3.19 0.00 0.50 -4.42 105.19 99.33 3dyp n GLY 901 Ca 0.00 -0.70 0.08 0.00 0.00 0.00 0.00 46.02 45.41 3dyp n GLY 901 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dyp h PRO 902 N 0.00 0.00 -7.59 1.61 0.13 -1.94 -0.24 132.00 123.98 3dyp h PRO 902 Ca 0.00 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.66 3dyp h PRO 902 Cb 0.00 0.00 0.10 0.00 0.13 0.00 0.00 31.00 31.23 3dyp h PRO 902 CO 0.00 0.21 0.40 -0.65 -0.23 0.00 0.00 178.00 177.73 3dyp s GLN 903 N -3.18 2.06 0.24 0.86 -0.21 -1.26 -4.97 119.66 113.20 3dyp s GLN 903 Ca 0.05 0.12 -0.30 0.00 0.02 0.00 0.00 55.36 55.25 3dyp s GLN 903 Cb 0.07 -1.97 -0.14 0.00 1.00 0.00 0.00 33.01 31.96 3dyp s GLN 903 CO 0.69 -1.52 1.15 -1.91 -2.12 0.00 0.00 175.29 171.57 3dyp n GLU 904 N -3.27 1.45 -3.74 2.91 2.13 -1.26 -4.88 120.64 113.98 3dyp n GLU 904 Ca 0.08 0.51 -0.13 0.00 0.66 0.00 0.00 57.16 58.28 3dyp n GLU 904 Cb 0.61 -1.99 -0.10 0.00 0.27 0.00 0.00 31.44 30.23 3dyp n GLU 904 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3dyp s ASN 905 N -0.21 -0.40 0.35 4.31 2.20 0.13 -4.93 114.94 116.38 3dyp s ASN 905 Ca 0.65 0.77 0.07 0.00 -0.94 0.00 0.00 52.86 53.42 3dyp s ASN 905 Cb -0.74 0.77 -0.07 0.00 -2.00 0.00 0.00 41.25 39.22 3dyp s ASN 905 CO 0.56 -0.14 -0.04 -0.31 -2.94 0.00 0.00 177.10 174.23 3dyp s TYR 906 N 0.31 2.28 0.25 1.54 1.51 -0.92 -3.79 117.35 118.53 3dyp s TYR 906 Ca -0.01 -0.66 -0.04 0.00 -1.01 0.00 0.00 57.07 55.35 3dyp s TYR 906 Cb -0.03 -1.43 0.48 0.00 -0.11 0.00 0.00 41.96 40.87 3dyp s TYR 906 CO -0.01 0.40 1.68 -1.35 -1.11 0.00 0.00 175.55 175.16 3dyp h PRO 907 N 2.01 0.25 -0.61 -1.71 0.11 -1.86 0.37 132.00 130.56 3dyp h PRO 907 Ca -0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3dyp h PRO 907 Cb 1.24 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3dyp h PRO 907 CO 0.73 0.16 0.00 -0.40 -0.21 0.00 0.00 178.00 178.28 3dyp n ASP 908 N -5.17 3.57 -3.01 -2.05 5.75 -1.26 -4.29 116.55 110.09 3dyp n ASP 908 Ca 0.15 -2.20 -0.15 0.00 -0.01 0.00 0.00 54.79 52.58 3dyp n ASP 908 Cb 0.48 -0.46 0.01 0.00 -1.03 0.00 0.00 41.12 40.12 3dyp n ASP 908 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3dyp n ARG 909 N 1.02 0.93 -0.02 0.11 0.63 0.12 -0.75 116.66 118.71 3dyp n ARG 909 Ca 0.20 -2.76 0.00 0.00 -0.92 0.00 0.00 57.85 54.37 3dyp n ARG 909 Cb 0.63 -1.41 0.00 0.00 0.45 0.00 0.00 32.46 32.13 3dyp n ARG 909 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 3dyp n LEU 910 N 0.58 0.66 0.07 6.15 -0.00 -0.90 -2.15 117.00 121.41 3dyp n LEU 910 Ca 0.17 -0.72 -0.02 0.00 -0.00 0.00 0.00 56.01 55.45 3dyp n LEU 910 Cb 0.65 -0.01 0.24 0.00 -0.00 0.00 0.00 43.42 44.30 3dyp n LEU 910 CO 0.14 0.18 0.70 0.71 -0.00 0.00 0.00 177.39 179.12 3dyp h THR 911 N 2.18 1.28 0.00 1.47 1.35 -1.91 -2.72 112.91 114.57 3dyp h THR 911 Ca 0.00 -1.34 -0.06 0.00 -0.55 0.00 0.00 66.41 64.46 3dyp h THR 911 Cb 0.86 1.51 -0.01 0.00 -1.73 0.00 0.00 68.15 68.78 3dyp h THR 911 CO 0.00 0.41 -0.27 0.00 -0.25 0.00 0.00 175.52 175.41 3dyp h ALA 912 N 1.38 1.03 -2.88 6.62 0.00 -1.87 -3.45 119.26 120.09 3dyp h ALA 912 Ca 0.04 -0.24 -0.53 0.00 0.00 0.00 0.00 54.91 54.17 3dyp h ALA 912 Cb 0.71 -0.04 0.12 0.00 0.00 0.00 0.00 17.79 18.58 3dyp h ALA 912 CO 0.05 0.34 0.49 0.00 0.00 0.00 0.00 179.25 180.12 3dyp s ALA 913 N -3.67 2.54 0.05 0.00 0.00 -1.03 -4.99 121.76 114.66 3dyp s ALA 913 Ca 0.00 1.06 0.08 0.00 0.00 0.00 0.00 51.96 53.10 3dyp s ALA 913 Cb 0.11 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 3dyp s ALA 913 CO 0.65 -1.23 -0.23 0.00 0.00 0.00 0.00 175.76 174.94 3dyp s PHE 915 N -0.82 3.13 0.14 0.00 5.36 -1.26 -0.37 117.98 124.17 3dyp s PHE 915 Ca 0.10 1.12 -0.17 0.00 -0.96 0.00 0.00 56.93 57.02 3dyp s PHE 915 Cb -0.09 -3.69 0.06 0.00 -0.34 0.00 0.00 43.02 38.96 3dyp s PHE 915 CO 0.02 -0.78 0.81 -3.47 -1.46 0.00 0.00 175.22 170.34 3dyp n ASP 916 N 6.86 -1.33 -4.62 6.13 -0.08 -0.64 -4.94 116.55 117.93 3dyp n ASP 916 Ca 0.11 -1.69 -0.39 0.00 -1.51 0.00 0.00 54.79 51.31 3dyp n ASP 916 Cb 0.47 2.16 -0.08 0.00 2.34 0.00 0.00 41.12 46.01 3dyp n ASP 916 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 3dyp s ARG 917 N -2.04 4.05 0.17 -0.67 6.06 -1.26 -1.94 118.95 123.31 3dyp s ARG 917 Ca 0.18 0.13 0.10 0.00 -2.50 0.00 0.00 55.73 53.64 3dyp s ARG 917 Cb -0.02 -3.64 -0.04 0.00 0.06 0.00 0.00 34.95 31.31 3dyp s ARG 917 CO 0.04 -0.26 -0.22 -1.58 -2.50 0.00 0.00 175.30 170.78 3dyp s TRP 918 N 2.02 2.10 -0.17 5.12 0.52 0.14 -4.97 118.94 123.70 3dyp s TRP 918 Ca 0.17 -0.40 -0.05 0.00 0.02 0.00 0.00 56.10 55.84 3dyp s TRP 918 Cb -0.16 -1.07 0.09 0.00 -1.15 0.00 0.00 33.47 31.18 3dyp s TRP 918 CO 0.09 0.39 0.30 0.34 0.02 0.00 0.00 176.95 178.10 3dyp s ASP 919 N -2.49 0.39 0.13 2.95 -1.08 -1.25 -0.23 116.67 115.09 3dyp s ASP 919 Ca 0.17 0.46 0.04 0.00 -0.52 0.00 0.00 52.55 52.69 3dyp s ASP 919 Cb -0.08 0.84 -0.04 0.00 -1.46 0.00 0.00 42.92 42.18 3dyp s ASP 919 CO 0.08 -0.26 -0.09 -0.76 0.52 0.00 0.00 175.17 174.66 3dyp s LEU 920 N 2.46 2.51 0.63 -1.34 1.43 0.01 -4.96 118.68 119.42 3dyp s LEU 920 Ca 0.04 -1.02 -0.18 0.00 -1.03 0.00 0.00 54.13 51.94 3dyp s LEU 920 Cb -0.13 -0.25 -0.02 0.00 0.03 0.00 0.00 46.19 45.82 3dyp s LEU 920 CO -0.11 -0.38 1.22 -2.16 0.23 0.00 0.00 176.35 175.14 3dyp s PRO 921 N -3.78 2.74 0.38 1.29 0.04 -1.26 -1.02 135.00 133.40 3dyp s PRO 921 Ca 0.16 1.84 0.11 0.00 0.04 0.00 0.00 61.00 63.14 3dyp s PRO 921 Cb 0.04 -1.90 0.91 0.00 0.04 0.00 0.00 34.50 33.58 3dyp s PRO 921 CO -0.01 -1.39 1.89 1.25 0.04 0.00 0.00 177.00 178.79 3dyp h LEU 922 N 0.58 0.55 -1.75 -3.56 5.85 -1.57 -1.30 115.31 114.11 3dyp h LEU 922 Ca -0.50 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.25 3dyp h LEU 922 Cb 1.30 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.25 3dyp h LEU 922 CO 0.54 0.28 0.00 0.77 -0.34 0.00 0.00 178.44 179.69 3dyp h SER 923 N 0.58 0.00 0.39 1.25 4.64 -1.89 0.99 113.55 119.51 3dyp h SER 923 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 3dyp h SER 923 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 3dyp h SER 923 CO -0.16 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.27 3dyp n ASP 924 N -3.05 0.00 -0.58 4.97 8.00 -0.49 -1.94 116.55 123.46 3dyp n ASP 924 Ca -0.00 0.03 0.09 0.00 0.71 0.00 0.00 54.79 55.62 3dyp n ASP 924 Cb 0.25 -0.30 0.31 0.00 -0.02 0.00 0.00 41.12 41.36 3dyp n ASP 924 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3dyp n MET 925 N -1.30 1.75 -5.06 -1.24 2.81 0.34 -4.76 117.12 109.67 3dyp n MET 925 Ca 0.09 -1.14 -0.29 0.00 -1.81 0.00 0.00 57.70 54.54 3dyp n MET 925 Cb 0.16 -1.36 -0.16 0.00 -0.71 0.00 0.00 33.22 31.15 3dyp n MET 925 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 3dyp s TYR 926 N -1.71 2.14 -0.29 2.03 5.04 -0.82 -4.47 117.35 119.27 3dyp s TYR 926 Ca 0.30 -0.69 -0.09 0.00 -2.44 0.00 0.00 57.07 54.16 3dyp s TYR 926 Cb 0.16 -1.42 -0.02 0.00 0.35 0.00 0.00 41.96 41.03 3dyp s TYR 926 CO 0.23 -0.24 0.12 0.99 -1.34 0.00 0.00 175.55 175.31 3dyp s THR 927 N 0.05 4.46 -1.48 4.34 2.01 -1.26 -4.97 115.64 118.79 3dyp s THR 927 Ca -0.07 -0.33 -0.10 0.00 0.31 0.00 0.00 61.69 61.50 3dyp s THR 927 Cb -0.14 -3.20 -0.10 0.00 0.01 0.00 0.00 72.50 69.07 3dyp s THR 927 CO 0.04 0.18 2.99 -0.81 -0.69 0.00 0.00 174.62 176.33 3dyp n PRO 928 N 4.95 3.52 -1.67 4.92 -0.04 -1.26 -4.85 135.00 140.56 3dyp n PRO 928 Ca -0.15 -2.08 -0.44 0.00 -0.04 0.00 0.00 63.50 60.79 3dyp n PRO 928 Cb 0.50 -2.73 -0.02 0.00 -0.04 0.00 0.00 33.50 31.22 3dyp n PRO 928 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3dyp n TYR 929 N 3.52 2.13 -0.34 0.54 4.02 -1.26 -4.86 117.16 120.90 3dyp n TYR 929 Ca 0.75 0.51 -0.00 0.00 -0.01 0.00 0.00 57.90 59.15 3dyp n TYR 929 Cb 0.28 -2.42 0.13 0.00 -0.02 0.00 0.00 39.34 37.31 3dyp n TYR 929 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 3dyp h VAL 930 N 2.75 1.13 -3.58 -0.72 2.07 -1.97 -3.30 116.25 112.64 3dyp h VAL 930 Ca -0.45 -0.39 -0.69 0.00 0.82 0.00 0.00 66.70 65.99 3dyp h VAL 930 Cb 1.28 -0.10 -0.19 0.00 -1.52 0.00 0.00 31.29 30.76 3dyp h VAL 930 CO 0.69 0.21 -0.33 0.12 0.02 0.00 0.00 177.57 178.28 3dyp s PHE 931 N -6.08 3.21 0.43 1.57 5.36 -1.26 -0.91 117.98 120.29 3dyp s PHE 931 Ca -0.13 -0.35 -0.24 0.00 -0.96 0.00 0.00 56.93 55.26 3dyp s PHE 931 Cb 0.18 -2.70 -0.08 0.00 -0.34 0.00 0.00 43.02 40.09 3dyp s PHE 931 CO 0.80 -0.56 1.13 -2.14 -1.46 0.00 0.00 175.22 172.99 3dyp s PRO 932 N 1.91 3.95 0.21 10.12 0.02 -1.24 -4.94 135.00 145.03 3dyp s PRO 932 Ca 0.09 1.70 -0.07 0.00 0.02 0.00 0.00 61.00 62.75 3dyp s PRO 932 Cb -0.18 -2.51 0.03 0.00 0.02 0.00 0.00 34.50 31.86 3dyp s PRO 932 CO 0.12 -0.37 0.39 -1.13 -0.33 0.00 0.00 177.00 175.68 3dyp n SER 933 N -0.24 -1.14 -4.67 2.53 3.41 -1.26 -4.74 113.62 107.52 3dyp n SER 933 Ca 0.06 -1.88 -0.43 0.00 -0.26 0.00 0.00 58.87 56.36 3dyp n SER 933 Cb 0.48 1.92 -0.01 0.00 -0.26 0.00 0.00 64.21 66.34 3dyp n SER 933 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3dyp n GLU 934 N -0.29 1.96 -3.71 4.33 4.07 -0.26 -4.94 120.64 121.80 3dyp n GLU 934 Ca -0.04 0.69 -0.06 0.00 -0.06 0.00 0.00 57.16 57.69 3dyp n GLU 934 Cb 0.32 -2.24 -0.02 0.00 -0.06 0.00 0.00 31.44 29.44 3dyp n GLU 934 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 3dyp s ASN 935 N -0.28 -0.27 0.00 4.31 2.20 -1.26 -4.89 114.94 114.75 3dyp s ASN 935 Ca 0.58 -0.35 0.00 0.00 -0.94 0.00 0.00 52.86 52.14 3dyp s ASN 935 Cb -0.61 0.55 0.00 0.00 -2.00 0.00 0.00 41.25 39.20 3dyp s ASN 935 CO 0.60 -0.99 0.00 0.61 -2.94 0.00 0.00 177.10 174.38 3dyp n GLY 936 N -0.42 0.68 3.73 0.45 0.00 -1.26 -4.81 105.19 103.56 3dyp n GLY 936 Ca -0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 3dyp n GLY 936 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3dyp n LEU 937 N 0.00 5.87 -3.95 0.99 7.94 -1.26 -4.66 117.00 121.94 3dyp n LEU 937 Ca 0.00 0.89 -0.24 0.00 -1.11 0.00 0.00 56.01 55.54 3dyp n LEU 937 Cb 0.03 -1.57 -0.17 0.00 0.53 0.00 0.00 43.42 42.25 3dyp n LEU 937 CO 0.00 -0.83 -0.44 -0.13 -1.11 0.00 0.00 177.39 174.87 3dyp s ARG 938 N -3.19 1.40 0.57 1.96 3.00 -0.51 0.20 118.95 122.38 3dyp s ARG 938 Ca 0.79 -0.27 0.09 0.00 0.00 0.00 0.00 55.73 56.34 3dyp s ARG 938 Cb -0.39 -1.31 0.08 0.00 0.00 0.00 0.00 34.95 33.32 3dyp s ARG 938 CO 0.44 -0.10 0.73 0.00 0.00 0.00 0.00 175.30 176.36 3dyp n GLY 940 N -2.16 -0.48 3.67 0.00 0.00 -1.19 -2.09 105.19 102.94 3dyp n GLY 940 Ca 0.13 0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.91 3dyp n GLY 940 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyp s THR 941 N -3.20 5.10 -0.26 2.61 2.01 0.85 -3.72 115.64 119.03 3dyp s THR 941 Ca 0.62 1.01 0.15 0.00 0.31 0.00 0.00 61.69 63.78 3dyp s THR 941 Cb -0.32 -3.86 -0.21 0.00 0.01 0.00 0.00 72.50 68.12 3dyp s THR 941 CO 0.77 0.19 0.43 0.54 -0.69 0.00 0.00 174.62 175.86 3dyp n ARG 942 N 4.67 1.07 -3.69 4.92 5.12 0.95 -0.87 116.66 128.83 3dyp n ARG 942 Ca -0.04 -0.09 -0.11 0.00 -1.93 0.00 0.00 57.85 55.68 3dyp n ARG 942 Cb 0.50 -1.30 -0.10 0.00 -1.16 0.00 0.00 32.46 30.41 3dyp n ARG 942 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 3dyp s GLU 943 N -2.81 0.48 -0.05 5.56 2.12 -1.07 -1.42 118.70 121.52 3dyp s GLU 943 Ca -0.02 0.80 0.02 0.00 0.36 0.00 0.00 54.97 56.13 3dyp s GLU 943 Cb 0.10 0.09 0.01 0.00 0.26 0.00 0.00 34.13 34.59 3dyp s GLU 943 CO 0.62 -0.13 -0.09 -1.17 -0.54 0.00 0.00 175.26 173.95 3dyp s LEU 944 N 1.06 1.60 -0.05 2.70 2.96 0.15 -0.09 118.68 127.01 3dyp s LEU 944 Ca -0.07 -0.23 0.05 0.00 -0.22 0.00 0.00 54.13 53.67 3dyp s LEU 944 Cb -0.06 -0.66 -0.00 0.00 0.50 0.00 0.00 46.19 45.96 3dyp s LEU 944 CO -0.09 0.02 -0.20 0.20 -1.32 0.00 0.00 176.35 174.96 3dyp s ASN 945 N 0.60 2.51 -0.23 3.68 0.01 0.28 -1.11 114.94 120.68 3dyp s ASN 945 Ca -0.11 -0.42 -0.09 0.00 -0.71 0.00 0.00 52.86 51.54 3dyp s ASN 945 Cb -0.14 -0.75 0.10 0.00 0.41 0.00 0.00 41.25 40.87 3dyp s ASN 945 CO 0.02 0.18 0.51 -0.47 -1.51 0.00 0.00 177.10 175.82 3dyp s TYR 946 N 0.02 -0.96 0.00 2.20 5.04 -0.43 -2.03 117.35 121.20 3dyp s TYR 946 Ca -0.05 1.78 0.00 0.00 -2.44 0.00 0.00 57.07 56.36 3dyp s TYR 946 Cb -0.13 0.47 0.00 0.00 0.35 0.00 0.00 41.96 42.65 3dyp s TYR 946 CO 0.03 -0.53 0.00 0.41 -1.34 0.00 0.00 175.55 174.13 3dyp n GLY 947 N 5.21 3.16 0.11 8.97 0.00 -1.26 -1.07 105.19 120.31 3dyp n GLY 947 Ca -0.12 -0.29 0.15 0.00 0.00 0.00 0.00 46.02 45.76 3dyp n GLY 947 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dyp n PRO 948 N 14.00 1.09 -3.78 1.61 -0.04 -1.26 -4.88 135.00 141.74 3dyp n PRO 948 Ca 0.00 -0.23 -0.33 0.00 -0.04 0.00 0.00 63.50 62.91 3dyp n PRO 948 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.92 3dyp n PRO 948 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3dyp s HIS 949 N -2.07 3.53 -0.03 0.54 3.76 -0.23 0.27 115.29 121.07 3dyp s HIS 949 Ca 0.43 0.47 0.01 0.00 -0.15 0.00 0.00 55.06 55.83 3dyp s HIS 949 Cb 0.22 -1.93 0.01 0.00 1.11 0.00 0.00 32.58 31.99 3dyp s HIS 949 CO 0.38 0.55 -0.04 -1.14 -0.85 0.00 0.00 174.74 173.63 3dyp s GLN 950 N -2.26 0.58 0.02 1.40 0.74 -0.47 -1.31 119.66 118.35 3dyp s GLN 950 Ca 0.34 -0.11 0.06 0.00 0.05 0.00 0.00 55.36 55.70 3dyp s GLN 950 Cb -0.13 -0.61 -0.02 0.00 1.10 0.00 0.00 33.01 33.36 3dyp s GLN 950 CO 0.22 -0.01 -0.18 -1.58 -0.55 0.00 0.00 175.29 173.19 3dyp s TRP 951 N 0.51 1.61 0.08 1.67 0.51 -0.27 -0.68 118.94 122.38 3dyp s TRP 951 Ca -0.06 -0.34 0.05 0.00 -2.12 0.00 0.00 56.10 53.64 3dyp s TRP 951 Cb -0.10 -1.00 -0.03 0.00 -0.81 0.00 0.00 33.47 31.54 3dyp s TRP 951 CO -0.00 0.03 -0.15 1.03 -0.51 0.00 0.00 176.95 177.35 3dyp s ARG 952 N -0.82 0.87 0.00 4.98 0.52 0.66 -0.67 118.95 124.49 3dyp s ARG 952 Ca 0.06 -1.01 0.00 0.00 -0.52 0.00 0.00 55.73 54.26 3dyp s ARG 952 Cb -0.08 -0.88 0.00 0.00 0.52 0.00 0.00 34.95 34.51 3dyp s ARG 952 CO 0.01 0.19 0.00 0.41 0.02 0.00 0.00 175.30 175.93 3dyp n GLY 953 N 1.16 -0.44 2.70 -3.53 0.00 -0.50 -1.24 105.19 103.34 3dyp n GLY 953 Ca -0.20 -0.33 -0.15 0.00 0.00 0.00 0.00 46.02 45.33 3dyp n GLY 953 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dyp s ASP 954 N -4.00 0.38 0.26 1.61 2.15 -1.24 -4.09 116.67 111.75 3dyp s ASP 954 Ca 0.00 -1.97 0.05 0.00 0.43 0.00 0.00 52.55 51.07 3dyp s ASP 954 Cb 0.00 0.73 -0.02 0.00 -0.30 0.00 0.00 42.92 43.33 3dyp s ASP 954 CO 0.00 -0.18 0.24 2.22 -0.17 0.00 0.00 175.17 177.29 3dyp n PHE 955 N 3.55 -0.70 -4.43 -5.34 1.16 -0.05 -4.86 117.46 106.79 3dyp n PHE 955 Ca 0.18 -2.18 -0.29 0.00 -1.87 0.00 0.00 57.45 53.28 3dyp n PHE 955 Cb 0.49 0.25 -0.12 0.00 -1.61 0.00 0.00 39.48 38.49 3dyp n PHE 955 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 3dyp s GLN 956 N -3.02 1.67 0.17 3.97 -1.52 0.36 -0.10 119.66 121.19 3dyp s GLN 956 Ca 0.31 -1.22 -0.11 0.00 -1.95 0.00 0.00 55.36 52.39 3dyp s GLN 956 Cb 0.01 -2.03 0.00 0.00 -0.22 0.00 0.00 33.01 30.78 3dyp s GLN 956 CO 0.22 0.48 0.35 -0.59 -0.25 0.00 0.00 175.29 175.49 3dyp s PHE 957 N -1.06 0.26 0.04 0.91 -0.12 -0.47 0.88 117.98 118.43 3dyp s PHE 957 Ca 0.15 -0.62 -0.03 0.00 -0.05 0.00 0.00 56.93 56.38 3dyp s PHE 957 Cb -0.10 0.07 -0.02 0.00 -0.63 0.00 0.00 43.02 42.33 3dyp s PHE 957 CO 0.07 -0.78 0.03 0.54 -0.05 0.00 0.00 175.22 175.04 3dyp s ASN 958 N -2.94 0.31 -0.21 1.98 2.20 0.09 -1.43 114.94 114.93 3dyp s ASN 958 Ca 0.15 -0.73 -0.12 0.00 -0.94 0.00 0.00 52.86 51.23 3dyp s ASN 958 Cb 0.02 0.21 0.07 0.00 -2.00 0.00 0.00 41.25 39.54 3dyp s ASN 958 CO -0.01 -0.53 0.51 -0.51 -2.94 0.00 0.00 177.10 173.62 3dyp s ILE 959 N -3.06 -0.02 0.17 0.54 2.07 -1.26 -0.93 121.20 118.72 3dyp s ILE 959 Ca -0.01 0.06 -0.22 0.00 -1.41 0.00 0.00 60.65 59.07 3dyp s ILE 959 Cb 0.02 -0.75 0.08 0.00 0.13 0.00 0.00 42.46 41.93 3dyp s ILE 959 CO -0.07 0.02 1.05 -1.54 -1.91 0.00 0.00 174.94 172.50 3dyp n SER 960 N 4.27 -1.70 -0.91 4.50 3.41 -0.42 -4.61 113.62 118.16 3dyp n SER 960 Ca -0.22 -1.86 0.07 0.00 -0.26 0.00 0.00 58.87 56.60 3dyp n SER 960 Cb 0.57 2.75 0.21 0.00 -0.26 0.00 0.00 64.21 67.48 3dyp n SER 960 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3dyp n ARG 961 N -0.74 2.22 -5.02 4.33 5.12 -1.26 -0.46 116.66 120.85 3dyp n ARG 961 Ca -0.02 -1.70 -0.30 0.00 -1.93 0.00 0.00 57.85 53.90 3dyp n ARG 961 Cb 0.58 -1.43 -0.17 0.00 -1.16 0.00 0.00 32.46 30.29 3dyp n ARG 961 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 3dyp s TYR 962 N -1.46 2.33 0.75 -1.55 1.51 -1.26 0.13 117.35 117.80 3dyp s TYR 962 Ca 0.31 -0.97 -0.11 0.00 -1.01 0.00 0.00 57.07 55.29 3dyp s TYR 962 Cb 0.17 -1.58 0.04 0.00 -0.11 0.00 0.00 41.96 40.48 3dyp s TYR 962 CO 0.20 -0.41 1.08 -1.54 -1.11 0.00 0.00 175.55 173.76 3dyp s SER 963 N 0.47 4.92 0.37 2.29 1.04 -1.26 -4.84 113.70 116.68 3dyp s SER 963 Ca -0.17 1.54 0.04 0.00 0.48 0.00 0.00 55.95 57.84 3dyp s SER 963 Cb -0.17 -2.34 0.71 0.00 0.10 0.00 0.00 66.02 64.32 3dyp s SER 963 CO 0.07 -1.73 2.00 1.56 0.98 0.00 0.00 173.24 176.12 3dyp h GLN 964 N -0.92 0.66 -0.49 4.02 1.08 -1.99 -0.90 115.11 116.57 3dyp h GLN 964 Ca -0.45 -0.06 -0.05 0.00 -1.45 0.00 0.00 58.65 56.65 3dyp h GLN 964 Cb 1.23 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 28.50 3dyp h GLN 964 CO 0.57 0.48 0.13 0.37 -0.95 0.00 0.00 178.83 179.43 3dyp h GLN 965 N 0.67 0.78 -0.56 1.46 4.15 -1.99 0.13 115.11 119.76 3dyp h GLN 965 Ca 0.18 -0.18 -0.07 0.00 0.77 0.00 0.00 58.65 59.34 3dyp h GLN 965 Cb -0.00 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.56 3dyp h GLN 965 CO -0.03 0.75 0.07 0.37 -1.93 0.00 0.00 178.83 178.06 3dyp h GLN 966 N 0.67 0.94 -0.82 1.69 4.15 -1.76 -1.53 115.11 118.46 3dyp h GLN 966 Ca 0.16 -0.26 -0.02 0.00 0.77 0.00 0.00 58.65 59.29 3dyp h GLN 966 Cb 0.31 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 27.86 3dyp h GLN 966 CO -0.00 0.91 0.44 -0.07 -1.93 0.00 0.00 178.83 178.18 3dyp h LEU 967 N 0.83 1.03 -0.30 -2.39 3.38 -0.79 -1.09 115.31 115.98 3dyp h LEU 967 Ca 0.17 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3dyp h LEU 967 Cb 0.44 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3dyp h LEU 967 CO 0.02 0.84 0.00 1.15 0.09 0.00 0.00 178.44 180.54 3dyp n MET 968 N -4.39 0.18 0.00 1.13 0.00 0.40 -2.89 117.12 111.56 3dyp n MET 968 Ca 0.08 0.29 0.12 0.00 0.00 0.00 0.00 57.70 58.19 3dyp n MET 968 Cb 0.10 -1.77 0.12 0.00 0.00 0.00 0.00 33.22 31.66 3dyp n MET 968 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 3dyp n GLU 969 N -2.11 1.68 -4.37 3.17 1.02 -0.50 -4.87 120.64 114.66 3dyp n GLU 969 Ca 0.04 -1.34 -0.34 0.00 -0.02 0.00 0.00 57.16 55.50 3dyp n GLU 969 Cb 0.31 -1.47 -0.13 0.00 -0.02 0.00 0.00 31.44 30.13 3dyp n GLU 969 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3dyp s THR 970 N -2.24 3.64 -0.31 2.62 2.01 -0.68 -5.01 115.64 115.66 3dyp s THR 970 Ca 0.25 -0.44 0.23 0.00 0.31 0.00 0.00 61.69 62.03 3dyp s THR 970 Cb 0.19 -2.60 0.02 0.00 0.01 0.00 0.00 72.50 70.12 3dyp s THR 970 CO 0.44 0.48 1.11 0.77 -0.69 0.00 0.00 174.62 176.72 3dyp h SER 971 N 7.02 0.00 -3.50 3.53 4.64 -1.89 -3.35 113.55 119.99 3dyp h SER 971 Ca -0.32 -0.04 -0.36 0.00 -0.47 0.00 0.00 61.79 60.60 3dyp h SER 971 Cb 1.19 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.94 3dyp h SER 971 CO 0.61 0.02 -0.75 -1.00 -0.87 0.00 0.00 176.83 174.84 3dyp s HIS 972 N -3.32 0.40 0.42 4.77 3.76 -1.26 -4.31 115.29 115.76 3dyp s HIS 972 Ca 0.01 -0.04 0.18 0.00 -0.15 0.00 0.00 55.06 55.06 3dyp s HIS 972 Cb 0.10 -0.45 1.10 0.00 1.11 0.00 0.00 32.58 34.43 3dyp s HIS 972 CO 0.78 -0.14 1.86 0.07 -0.85 0.00 0.00 174.74 176.46 3dyp h ARG 973 N 7.21 0.38 0.00 1.40 0.11 -1.23 -0.03 114.38 122.22 3dyp h ARG 973 Ca -0.42 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.64 3dyp h ARG 973 Cb 1.14 -0.09 0.00 0.00 1.11 0.00 0.00 29.97 32.13 3dyp h ARG 973 CO 0.48 0.25 0.00 1.12 0.10 0.00 0.00 179.97 181.92 3dyp h HIS 974 N 0.39 0.00 -0.02 4.08 2.07 -1.92 -2.03 115.15 117.72 3dyp h HIS 974 Ca 0.46 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.98 3dyp h HIS 974 Cb 1.16 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.14 3dyp h HIS 974 CO -0.00 0.00 -0.11 1.28 -3.07 0.00 0.00 177.93 176.03 3dyp n LEU 975 N -2.41 1.90 -4.78 6.12 4.77 -0.02 -4.93 117.00 117.64 3dyp n LEU 975 Ca 0.00 -0.63 -0.36 0.00 -0.03 0.00 0.00 56.01 54.99 3dyp n LEU 975 Cb 0.16 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.21 3dyp n LEU 975 CO 0.17 0.32 0.79 -0.76 -1.33 0.00 0.00 177.39 176.59 3dyp s LEU 976 N -2.15 3.94 -0.03 2.23 1.43 -0.76 -5.04 118.68 118.30 3dyp s LEU 976 Ca 0.30 2.19 0.02 0.00 -1.03 0.00 0.00 54.13 55.61 3dyp s LEU 976 Cb 0.20 -4.36 0.01 0.00 0.03 0.00 0.00 46.19 42.06 3dyp s LEU 976 CO 0.39 -0.93 -0.07 -1.38 0.23 0.00 0.00 176.35 174.59 3dyp s HIS 977 N -1.67 0.84 0.28 0.29 -3.43 -1.26 -5.11 115.29 105.23 3dyp s HIS 977 Ca 0.66 -0.21 -0.30 0.00 -0.80 0.00 0.00 55.06 54.40 3dyp s HIS 977 Cb -0.25 -0.63 -0.11 0.00 -1.43 0.00 0.00 32.58 30.16 3dyp s HIS 977 CO 0.30 -0.11 1.62 0.00 -2.00 0.00 0.00 174.74 174.55 3dyp s ALA 978 N 0.32 3.78 0.66 -1.38 0.00 -1.26 -4.83 121.76 119.05 3dyp s ALA 978 Ca -0.05 1.58 -0.03 0.00 0.00 0.00 0.00 51.96 53.46 3dyp s ALA 978 Cb -0.09 -3.66 0.06 0.00 0.00 0.00 0.00 23.12 19.43 3dyp s ALA 978 CO 0.00 -0.98 0.93 -1.21 0.00 0.00 0.00 175.76 174.51 3dyp s GLU 979 N -0.19 2.22 0.31 0.00 2.02 0.12 -5.02 118.70 118.16 3dyp s GLU 979 Ca 0.65 -0.55 -0.29 0.00 0.02 0.00 0.00 54.97 54.81 3dyp s GLU 979 Cb -0.48 -2.29 -0.10 0.00 0.10 0.00 0.00 34.13 31.35 3dyp s GLU 979 CO 0.45 -1.11 1.36 -2.00 0.02 0.00 0.00 175.26 173.98 3dyp s GLU 980 N -5.08 4.31 2.27 1.61 2.12 -1.26 -4.75 118.70 117.92 3dyp s GLU 980 Ca 0.60 2.27 0.00 0.00 0.36 0.00 0.00 54.97 58.20 3dyp s GLU 980 Cb -0.10 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.22 3dyp s GLU 980 CO 0.43 -0.28 0.00 0.41 -0.54 0.00 0.00 175.26 175.27 3dyp n GLY 981 N 1.13 -0.78 2.73 -1.50 0.00 -1.26 -4.82 105.19 100.68 3dyp n GLY 981 Ca 0.02 -1.17 -0.18 0.00 0.00 0.00 0.00 46.02 44.69 3dyp n GLY 981 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyp s THR 982 N 0.00 -0.03 -0.18 2.61 2.01 -0.00 -4.68 115.64 115.36 3dyp s THR 982 Ca 0.00 0.30 -0.26 0.00 0.31 0.00 0.00 61.69 62.04 3dyp s THR 982 Cb 0.00 -0.16 -0.01 0.00 0.01 0.00 0.00 72.50 72.34 3dyp s THR 982 CO 0.00 0.15 0.85 0.26 -0.69 0.00 0.00 174.62 175.19 3dyp s TRP 983 N 1.62 3.40 -0.13 4.92 0.52 0.40 0.75 118.94 130.42 3dyp s TRP 983 Ca -0.02 1.27 0.00 0.00 0.02 0.00 0.00 56.10 57.37 3dyp s TRP 983 Cb -0.13 -3.05 -0.01 0.00 -1.15 0.00 0.00 33.47 29.14 3dyp s TRP 983 CO -0.03 -0.28 -0.14 -1.17 0.02 0.00 0.00 176.95 175.35 3dyp s LEU 984 N 2.31 2.67 -0.20 2.99 2.96 0.12 -1.30 118.68 128.24 3dyp s LEU 984 Ca 0.39 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 53.97 3dyp s LEU 984 Cb -0.16 -1.60 0.03 0.00 0.50 0.00 0.00 46.19 44.96 3dyp s LEU 984 CO 0.11 0.16 -0.18 0.20 -1.32 0.00 0.00 176.35 175.33 3dyp s ASN 985 N 0.36 3.43 -0.28 3.68 0.01 -0.11 -1.95 114.94 120.07 3dyp s ASN 985 Ca -0.11 -0.81 -0.01 0.00 -0.71 0.00 0.00 52.86 51.21 3dyp s ASN 985 Cb -0.16 -1.50 0.05 0.00 0.41 0.00 0.00 41.25 40.05 3dyp s ASN 985 CO 0.06 -0.04 -0.03 -0.63 -1.51 0.00 0.00 177.10 174.95 3dyp s ILE 986 N 1.25 2.87 -0.11 0.60 1.01 -0.34 -0.74 121.20 125.75 3dyp s ILE 986 Ca 0.02 -1.33 -0.02 0.00 0.00 0.00 0.00 60.65 59.32 3dyp s ILE 986 Cb -0.15 -2.61 -0.03 0.00 0.01 0.00 0.00 42.46 39.68 3dyp s ILE 986 CO -0.11 -0.03 -0.02 -1.81 0.00 0.00 0.00 174.94 172.97 3dyp s ASP 987 N 1.25 5.01 0.06 3.58 1.01 0.25 -0.39 116.67 127.45 3dyp s ASP 987 Ca -0.04 0.03 -0.17 0.00 0.71 0.00 0.00 52.55 53.08 3dyp s ASP 987 Cb -0.19 -1.51 -0.16 0.00 1.01 0.00 0.00 42.92 42.07 3dyp s ASP 987 CO -0.02 0.31 1.27 1.23 0.21 0.00 0.00 175.17 178.17 3dyp h GLY 988 N 5.67 0.65 -5.14 0.21 0.00 -1.16 0.11 103.07 103.41 3dyp h GLY 988 Ca -0.44 -0.87 -0.18 0.00 0.00 0.00 0.00 47.33 45.83 3dyp h GLY 988 CO 0.57 0.78 -0.68 -1.36 0.00 0.00 0.00 176.54 175.85 3dyp s PHE 989 N -3.81 0.15 -0.00 5.60 0.40 -0.97 -4.68 117.98 114.67 3dyp s PHE 989 Ca -0.12 -0.31 0.01 0.00 -0.60 0.00 0.00 56.93 55.90 3dyp s PHE 989 Cb 0.07 -0.12 0.00 0.00 0.51 0.00 0.00 43.02 43.48 3dyp s PHE 989 CO 0.84 -0.14 -0.02 -1.58 0.70 0.00 0.00 175.22 175.02 3dyp s HIS 990 N -0.99 0.21 0.65 0.36 2.46 -1.26 -0.67 115.29 116.05 3dyp s HIS 990 Ca -0.11 -0.04 -0.13 0.00 0.47 0.00 0.00 55.06 55.25 3dyp s HIS 990 Cb -0.07 -0.15 -0.01 0.00 -0.13 0.00 0.00 32.58 32.22 3dyp s HIS 990 CO -0.00 -0.01 1.06 1.41 -2.47 0.00 0.00 174.74 174.73 3dyp s MET 991 N 0.02 3.05 0.97 2.88 1.75 0.83 -4.79 119.30 124.02 3dyp s MET 991 Ca 0.00 1.10 -0.11 0.00 -1.25 0.00 0.00 55.69 55.43 3dyp s MET 991 Cb -0.02 -2.00 0.18 0.00 2.84 0.00 0.00 34.83 35.83 3dyp s MET 991 CO -0.00 -1.02 1.10 0.20 -0.65 0.00 0.00 175.02 174.65 3dyp s GLY 992 N -3.25 1.63 0.01 2.11 0.00 -0.68 -4.73 107.32 102.41 3dyp s GLY 992 Ca 0.61 0.26 0.22 0.00 0.00 0.00 0.00 44.72 45.81 3dyp s GLY 992 CO 0.46 0.77 0.72 0.29 0.00 0.00 0.00 173.10 175.34 3dyp n ILE 993 N -4.32 0.07 -4.73 0.90 -5.35 -1.26 -4.94 119.36 99.73 3dyp n ILE 993 Ca 0.08 -0.33 0.00 0.00 -0.27 0.00 0.00 62.75 62.23 3dyp n ILE 993 Cb 0.53 0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.70 3dyp n ILE 993 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dyp n GLY 994 N 1.33 0.09 0.00 3.28 0.00 -1.26 -4.77 105.19 103.87 3dyp n GLY 994 Ca -0.01 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.03 3dyp n GLY 994 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyp n GLY 995 N 0.00 -0.72 0.40 -0.02 0.00 -1.25 -1.07 105.19 102.52 3dyp n GLY 995 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.22 3dyp n GLY 995 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dyp h ASP 996 N 0.00 0.49 -5.36 1.61 3.32 -1.79 -2.11 116.42 112.58 3dyp h ASP 996 Ca 0.00 0.07 -0.14 0.00 0.02 0.00 0.00 57.03 56.98 3dyp h ASP 996 Cb 0.00 -0.01 -0.10 0.00 0.22 0.00 0.00 39.33 39.44 3dyp h ASP 996 CO 0.00 0.14 -0.21 1.51 -1.72 0.00 0.00 179.24 178.96 3dyp s ASP 997 N -5.40 0.21 -0.26 6.45 1.47 -1.26 -4.04 116.67 113.84 3dyp s ASP 997 Ca -0.09 -1.15 0.10 0.00 1.18 0.00 0.00 52.55 52.59 3dyp s ASP 997 Cb 0.24 0.58 0.47 0.00 -0.34 0.00 0.00 42.92 43.87 3dyp s ASP 997 CO 0.79 -1.15 1.36 -1.20 0.68 0.00 0.00 175.17 175.66 3dyp n SER 998 N -0.65 2.16 0.00 2.11 7.64 -1.26 -4.62 113.62 119.00 3dyp n SER 998 Ca -0.01 -3.82 0.00 0.00 1.01 0.00 0.00 58.87 56.05 3dyp n SER 998 Cb 0.62 -0.59 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 3dyp n SER 998 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 3dyp n TRP 999 N -1.12 0.00 -3.81 1.43 2.14 -1.26 -4.13 117.44 110.69 3dyp n TRP 999 Ca 0.27 -0.04 -0.11 0.00 2.07 0.00 0.00 57.50 59.69 3dyp n TRP 999 Cb 0.89 -0.00 -0.08 0.00 -0.81 0.00 0.00 31.31 31.31 3dyp n TRP 999 CO 0.00 0.00 0.00 -1.54 2.07 0.00 0.00 177.69 178.22 3dyp s SER 1000N -0.09 -0.04 0.17 -0.67 1.04 -1.26 -4.46 113.70 108.39 3dyp s SER 1000Ca 0.00 -0.26 -0.34 0.00 0.48 0.00 0.00 55.95 55.84 3dyp s SER 1000Cb 0.00 0.31 -0.14 0.00 0.10 0.00 0.00 66.02 66.29 3dyp s SER 1000CO 0.00 -0.56 1.52 -2.65 0.98 0.00 0.00 173.24 172.53 3dyp n PRO 1001N 0.75 2.02 0.00 4.02 -0.02 -1.26 -4.78 135.00 135.72 3dyp n PRO 1001Ca -0.19 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 3dyp n PRO 1001Cb 0.59 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 3dyp n PRO 1001CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3dyp n SER 1002N 3.08 0.77 -4.65 2.55 3.41 -1.26 -5.00 113.62 112.52 3dyp n SER 1002Ca 0.16 -1.18 -0.43 0.00 -0.26 0.00 0.00 58.87 57.17 3dyp n SER 1002Cb 0.28 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.21 3dyp n SER 1002CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3dyp s VAL 1003N -0.18 4.58 0.57 -3.33 1.01 -1.26 -4.39 120.40 117.40 3dyp s VAL 1003Ca 0.00 1.89 -0.20 0.00 0.00 0.00 0.00 61.98 63.67 3dyp s VAL 1003Cb 0.00 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 3dyp s VAL 1003CO 0.00 -0.25 1.26 -0.55 0.00 0.00 0.00 175.10 175.56 3dyp s SER 1004N 1.43 5.26 0.46 3.32 0.15 -1.26 -4.87 113.70 118.18 3dyp s SER 1004Ca 0.46 2.53 0.21 0.00 0.70 0.00 0.00 55.95 59.84 3dyp s SER 1004Cb -0.15 -2.61 1.19 0.00 -1.71 0.00 0.00 66.02 62.73 3dyp s SER 1004CO 0.09 -1.56 1.90 0.00 1.20 0.00 0.00 173.24 174.88 3dyp h ALA 1005N 1.17 2.33 0.00 5.45 0.00 -1.96 0.74 119.26 126.99 3dyp h ALA 1005Ca -0.51 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3dyp h ALA 1005Cb 1.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3dyp h ALA 1005CO 0.56 -0.57 0.00 -0.85 0.00 0.00 0.00 179.25 178.39 3dyp n GLU 1006N -4.44 0.19 -0.25 0.00 0.00 -1.26 -2.21 120.64 112.67 3dyp n GLU 1006Ca 0.16 0.42 0.07 0.00 0.00 0.00 0.00 57.16 57.81 3dyp n GLU 1006Cb 0.69 -1.86 0.20 0.00 0.00 0.00 0.00 31.44 30.46 3dyp n GLU 1006CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 3dyp n PHE 1007N -2.22 0.63 -3.46 -1.84 3.01 0.25 -4.97 117.46 108.86 3dyp n PHE 1007Ca 0.02 -0.55 -0.35 0.00 1.01 0.00 0.00 57.45 57.58 3dyp n PHE 1007Cb 0.23 -0.07 -0.06 0.00 -0.01 0.00 0.00 39.48 39.57 3dyp n PHE 1007CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 3dyp s GLN 1008N -1.26 3.88 -1.21 -1.08 -0.21 -0.94 -1.69 119.66 117.14 3dyp s GLN 1008Ca 0.30 0.35 -0.13 0.00 0.02 0.00 0.00 55.36 55.90 3dyp s GLN 1008Cb 0.17 -2.97 0.18 0.00 1.00 0.00 0.00 33.01 31.39 3dyp s GLN 1008CO 0.17 0.52 1.48 1.28 -2.12 0.00 0.00 175.29 176.63 3dyp n LEU 1009N 0.88 5.44 -0.92 2.90 4.77 -1.26 -4.67 117.00 124.14 3dyp n LEU 1009Ca -0.07 -4.53 0.08 0.00 -0.03 0.00 0.00 56.01 51.47 3dyp n LEU 1009Cb 0.52 -1.59 0.21 0.00 -2.33 0.00 0.00 43.42 40.23 3dyp n LEU 1009CO 0.42 0.86 0.67 -1.54 -1.33 0.00 0.00 177.39 176.48 3dyp n SER 1010N 5.18 3.27 0.25 -1.43 3.41 -1.26 -4.38 113.62 118.66 3dyp n SER 1010Ca 0.36 -1.97 0.17 0.00 -0.26 0.00 0.00 58.87 57.18 3dyp n SER 1010Cb 0.41 -0.31 0.85 0.00 -0.26 0.00 0.00 64.21 64.90 3dyp n SER 1010CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyp h ALA 1011N 3.06 1.00 0.00 7.33 0.00 -1.98 -3.46 119.26 125.21 3dyp h ALA 1011Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dyp h ALA 1011Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3dyp h ALA 1011CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3dyp n GLY 1012N -0.74 1.88 3.03 0.00 0.00 -1.26 -4.88 105.19 103.23 3dyp n GLY 1012Ca -0.01 -0.20 -0.26 0.00 0.00 0.00 0.00 46.02 45.54 3dyp n GLY 1012CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dyp s ARG 1013N 0.00 1.88 0.04 1.61 0.52 -1.26 -0.04 118.95 121.70 3dyp s ARG 1013Ca 0.00 -0.46 0.05 0.00 -0.52 0.00 0.00 55.73 54.80 3dyp s ARG 1013Cb 0.00 -1.57 -0.02 0.00 0.52 0.00 0.00 34.95 33.87 3dyp s ARG 1013CO 0.00 -0.00 -0.14 0.71 0.02 0.00 0.00 175.30 175.89 3dyp s TYR 1014N 0.78 1.22 -0.01 -0.53 1.51 -0.29 -5.00 117.35 115.04 3dyp s TYR 1014Ca -0.12 -0.35 0.02 0.00 -1.01 0.00 0.00 57.07 55.61 3dyp s TYR 1014Cb -0.16 -0.73 -0.01 0.00 -0.11 0.00 0.00 41.96 40.96 3dyp s TYR 1014CO 0.02 0.03 -0.08 -1.58 -1.11 0.00 0.00 175.55 172.84 3dyp s HIS 1015N -0.84 0.71 0.09 2.71 2.46 -1.26 -0.90 115.29 118.27 3dyp s HIS 1015Ca 0.02 -0.14 -0.16 0.00 0.47 0.00 0.00 55.06 55.25 3dyp s HIS 1015Cb -0.08 -0.46 0.03 0.00 -0.13 0.00 0.00 32.58 31.94 3dyp s HIS 1015CO 0.01 -0.02 0.39 1.52 -2.47 0.00 0.00 174.74 174.17 3dyp s TYR 1016N -0.15 -0.20 -0.02 3.88 -0.85 -0.47 -5.02 117.35 114.52 3dyp s TYR 1016Ca 0.03 -0.02 -0.00 0.00 -0.52 0.00 0.00 57.07 56.56 3dyp s TYR 1016Cb -0.03 0.22 0.03 0.00 0.38 0.00 0.00 41.96 42.55 3dyp s TYR 1016CO -0.00 -0.63 0.03 1.14 -1.52 0.00 0.00 175.55 174.56 3dyp s GLN 1017N -3.27 -0.04 0.00 -3.49 -2.07 -1.26 -0.38 119.66 109.15 3dyp s GLN 1017Ca -0.00 0.18 0.06 0.00 -1.82 0.00 0.00 55.36 53.78 3dyp s GLN 1017Cb 0.01 -0.24 -0.02 0.00 -1.09 0.00 0.00 33.01 31.68 3dyp s GLN 1017CO -0.08 -0.16 -0.19 -0.51 -1.32 0.00 0.00 175.29 173.03 3dyp s LEU 1018N 1.02 2.07 -0.17 2.60 1.43 -0.52 -4.23 118.68 120.88 3dyp s LEU 1018Ca -0.08 -0.39 -0.01 0.00 -1.03 0.00 0.00 54.13 52.61 3dyp s LEU 1018Cb -0.12 -0.97 -0.01 0.00 0.03 0.00 0.00 46.19 45.12 3dyp s LEU 1018CO -0.03 0.21 -0.11 -0.69 0.23 0.00 0.00 176.35 175.96 3dyp s VAL 1019N -0.55 3.02 -0.17 -1.59 1.01 -0.37 0.11 120.40 121.85 3dyp s VAL 1019Ca 0.07 -0.64 -0.05 0.00 0.00 0.00 0.00 61.98 61.36 3dyp s VAL 1019Cb -0.08 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 3dyp s VAL 1019CO -0.00 0.49 -0.01 0.86 0.00 0.00 0.00 175.10 176.44 3dyp s TRP 1020N 0.87 3.06 0.35 5.22 -0.11 0.96 -0.24 118.94 129.05 3dyp s TRP 1020Ca -0.03 -0.28 -0.06 0.00 1.22 0.00 0.00 56.10 56.95 3dyp s TRP 1020Cb -0.15 -2.01 0.02 0.00 -1.50 0.00 0.00 33.47 29.82 3dyp s TRP 1020CO 0.00 -0.06 0.56 0.00 -4.62 0.00 0.00 176.95 172.83 3dyp s GLN 1022N -2.88 3.46 0.00 0.00 -0.21 -1.26 -1.37 119.66 117.39 3dyp s GLN 1022Ca 0.26 0.15 0.25 0.00 0.02 0.00 0.00 55.36 56.04 3dyp s GLN 1022Cb -0.02 -2.37 0.32 0.00 1.00 0.00 0.00 33.01 31.94 3dyp s GLN 1022CO 0.18 -0.26 1.33 1.63 -2.12 0.00 0.00 175.29 176.05