#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c1p s GLN 3 N 0.00 0.42 -0.29 5.55 0.74 -0.14 -4.96 119.66 120.98 2c1p s GLN 3 Ca 0.00 0.66 -0.04 0.00 0.05 0.00 0.00 55.36 56.03 2c1p s GLN 3 Cb 0.00 0.11 0.03 0.00 1.10 0.00 0.00 33.01 34.25 2c1p s GLN 3 CO 0.00 -0.08 0.03 -0.51 -0.55 0.00 0.00 175.29 174.19 2c1p s LEU 4 N 1.09 3.79 -0.44 3.68 1.43 -1.26 -1.62 118.68 125.36 2c1p s LEU 4 Ca -0.06 -0.94 -0.19 0.00 -1.03 0.00 0.00 54.13 51.91 2c1p s LEU 4 Cb -0.04 -1.79 0.03 0.00 0.03 0.00 0.00 46.19 44.42 2c1p s LEU 4 CO -0.13 -0.22 0.53 -1.58 0.23 0.00 0.00 176.35 175.18 2c1p s GLN 5 N 1.39 3.16 0.04 1.70 2.00 0.11 -3.94 119.66 124.12 2c1p s GLN 5 Ca -0.00 -0.65 -0.04 0.00 -2.00 0.00 0.00 55.36 52.67 2c1p s GLN 5 Cb -0.18 -3.98 -0.05 0.00 0.80 0.00 0.00 33.01 29.61 2c1p s GLN 5 CO 0.00 -0.95 0.26 -0.65 -0.50 0.00 0.00 175.29 173.45 2c1p s GLN 6 N 2.42 3.53 0.89 1.67 -0.21 -1.26 0.04 119.66 126.75 2c1p s GLN 6 Ca 0.16 -0.20 -0.11 0.00 0.02 0.00 0.00 55.36 55.23 2c1p s GLN 6 Cb -0.16 -3.03 0.13 0.00 1.00 0.00 0.00 33.01 30.94 2c1p s GLN 6 CO 0.15 0.61 1.10 -1.54 -2.12 0.00 0.00 175.29 173.50 2c1p s SER 7 N -2.05 3.37 1.04 5.90 1.04 -1.01 -4.95 113.70 117.04 2c1p s SER 7 Ca 0.31 1.82 -0.12 0.00 0.48 0.00 0.00 55.95 58.44 2c1p s SER 7 Cb -0.13 -2.42 0.21 0.00 0.10 0.00 0.00 66.02 63.78 2c1p s SER 7 CO 0.21 -2.76 1.07 -0.83 0.98 0.00 0.00 173.24 171.91 2c1p s GLY 8 N -3.09 1.57 0.51 7.32 0.00 -1.26 -4.61 107.32 107.76 2c1p s GLY 8 Ca 0.64 -0.17 -0.21 0.00 0.00 0.00 0.00 44.72 44.98 2c1p s GLY 8 CO 0.58 0.45 0.94 0.00 0.00 0.00 0.00 173.10 175.07 2c1p n ALA 9 N -4.40 0.06 -2.70 3.20 0.00 -1.26 -4.74 120.51 110.68 2c1p n ALA 9 Ca 0.05 0.11 -0.24 0.00 0.00 0.00 0.00 53.44 53.37 2c1p n ALA 9 Cb 0.55 -2.07 -0.15 0.00 0.00 0.00 0.00 19.45 17.78 2c1p n ALA 9 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2c1p s GLU 10 N -2.31 1.38 -0.25 0.00 2.56 0.48 -4.98 118.70 115.59 2c1p s GLU 10 Ca 0.68 -0.54 -0.07 0.00 0.00 0.00 0.00 54.97 55.04 2c1p s GLU 10 Cb -0.49 -1.28 -0.03 0.00 2.00 0.00 0.00 34.13 34.33 2c1p s GLU 10 CO 0.53 0.29 0.07 -1.17 -0.56 0.00 0.00 175.26 174.41 2c1p s LEU 11 N -0.19 3.44 -0.08 2.70 0.20 -1.26 -1.19 118.68 122.30 2c1p s LEU 11 Ca 0.02 -0.24 0.04 0.00 0.69 0.00 0.00 54.13 54.65 2c1p s LEU 11 Cb -0.08 -1.91 0.00 0.00 -0.43 0.00 0.00 46.19 43.77 2c1p s LEU 11 CO 0.00 -0.04 -0.20 -0.69 -0.29 0.00 0.00 176.35 175.13 2c1p s VAL 12 N 1.61 1.74 0.16 1.68 1.01 0.34 -4.97 120.40 121.96 2c1p s VAL 12 Ca 0.06 -0.86 -0.30 0.00 0.00 0.00 0.00 61.98 60.89 2c1p s VAL 12 Cb -0.15 -1.51 -0.07 0.00 0.00 0.00 0.00 36.38 34.64 2c1p s VAL 12 CO 0.03 0.49 1.14 -0.13 0.00 0.00 0.00 175.10 176.64 2c1p s ARG 13 N 0.27 4.53 0.46 2.72 1.81 -1.26 -0.68 118.95 126.81 2c1p s ARG 13 Ca -0.13 1.77 -0.24 0.00 -1.72 0.00 0.00 55.73 55.41 2c1p s ARG 13 Cb -0.16 -3.28 -0.08 0.00 -0.45 0.00 0.00 34.95 30.98 2c1p s ARG 13 CO 0.06 -0.03 1.33 -0.35 -0.68 0.00 0.00 175.30 175.62 2c1p n PRO 14 N 2.69 1.94 -0.60 3.54 -0.04 -1.26 -2.46 135.00 138.82 2c1p n PRO 14 Ca 0.04 0.70 0.00 0.00 -0.04 0.00 0.00 63.50 64.20 2c1p n PRO 14 Cb 0.46 -2.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.43 2c1p n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2c1p n GLY 15 N 0.75 1.71 0.00 0.55 0.00 0.22 -4.96 105.19 103.46 2c1p n GLY 15 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2c1p n GLY 15 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c1p n THR 16 N -2.00 0.00 -3.71 2.61 -2.24 -1.03 -4.44 114.28 103.47 2c1p n THR 16 Ca 0.00 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.71 2c1p n THR 16 Cb 0.00 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.21 2c1p n THR 16 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2c1p s SER 17 N -1.00 -0.29 -0.10 3.42 1.04 -1.26 -1.37 113.70 114.13 2c1p s SER 17 Ca 0.00 -0.37 -0.30 0.00 0.48 0.00 0.00 55.95 55.77 2c1p s SER 17 Cb 0.00 0.58 0.07 0.00 0.10 0.00 0.00 66.02 66.77 2c1p s SER 17 CO 0.00 -1.04 0.70 0.54 0.98 0.00 0.00 173.24 174.42 2c1p s VAL 18 N -3.57 0.00 -0.07 5.02 0.11 -0.99 -4.88 120.40 116.02 2c1p s VAL 18 Ca 0.09 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.14 2c1p s VAL 18 Cb -0.03 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.84 2c1p s VAL 18 CO 0.00 0.00 -0.04 -0.75 -3.33 0.00 0.00 175.10 170.98 2c1p s LYS 19 N -0.88 0.96 0.18 1.54 2.20 -1.26 0.34 119.74 122.83 2c1p s LYS 19 Ca -0.08 -0.09 0.06 0.00 -0.36 0.00 0.00 55.97 55.50 2c1p s LYS 19 Cb -0.01 -1.08 -0.04 0.00 -1.51 0.00 0.00 37.83 35.19 2c1p s LYS 19 CO 0.08 -0.19 0.08 -0.51 -0.36 0.00 0.00 175.35 174.45 2c1p s LEU 20 N 1.43 3.57 0.29 5.43 1.43 -0.17 -4.95 118.68 125.71 2c1p s LEU 20 Ca -0.02 -0.27 0.09 0.00 -1.03 0.00 0.00 54.13 52.90 2c1p s LEU 20 Cb -0.13 -2.19 -0.06 0.00 0.03 0.00 0.00 46.19 43.84 2c1p s LEU 20 CO -0.03 0.07 -0.13 -0.94 0.23 0.00 0.00 176.35 175.55 2c1p s SER 21 N -3.11 3.29 -0.27 2.29 1.04 -1.26 -1.79 113.70 113.89 2c1p s SER 21 Ca 0.30 -1.12 -0.01 0.00 0.48 0.00 0.00 55.95 55.60 2c1p s SER 21 Cb -0.09 -0.26 0.13 0.00 0.10 0.00 0.00 66.02 65.90 2c1p s SER 21 CO 0.21 -0.15 0.31 0.00 0.98 0.00 0.00 173.24 174.59 2c1p s LYS 23 N 2.41 4.11 0.23 0.00 2.20 0.11 -0.32 119.74 128.48 2c1p s LYS 23 Ca 0.09 0.38 -0.01 0.00 -0.36 0.00 0.00 55.97 56.08 2c1p s LYS 23 Cb -0.14 -3.63 -0.04 0.00 -1.51 0.00 0.00 37.83 32.51 2c1p s LYS 23 CO -0.27 -0.30 0.44 0.00 -0.36 0.00 0.00 175.35 174.85 2c1p s ALA 24 N 2.14 3.78 -0.11 3.13 0.00 -0.61 0.04 121.76 130.14 2c1p s ALA 24 Ca 0.23 -0.79 -0.30 0.00 0.00 0.00 0.00 51.96 51.10 2c1p s ALA 24 Cb -0.16 -2.06 0.08 0.00 0.00 0.00 0.00 23.12 20.98 2c1p s ALA 24 CO 0.09 0.35 0.76 -1.54 0.00 0.00 0.00 175.76 175.42 2c1p s SER 25 N -3.26 -0.61 0.00 0.00 1.04 -0.64 -4.87 113.70 105.37 2c1p s SER 25 Ca 0.40 0.75 0.00 0.00 0.48 0.00 0.00 55.95 57.57 2c1p s SER 25 Cb -0.11 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2c1p s SER 25 CO 0.30 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.63 2c1p n GLY 26 N 1.13 0.37 3.75 7.32 0.00 -1.26 -0.97 105.19 115.53 2c1p n GLY 26 Ca -0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 2c1p n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2c1p s TYR 27 N -2.00 0.04 -0.43 1.61 -0.85 -1.26 -4.44 117.35 110.02 2c1p s TYR 27 Ca 0.00 -0.46 -0.29 0.00 -0.52 0.00 0.00 57.07 55.80 2c1p s TYR 27 Cb 0.00 0.51 0.01 0.00 0.38 0.00 0.00 41.96 42.87 2c1p s TYR 27 CO 0.00 -1.16 1.35 0.45 -1.52 0.00 0.00 175.55 174.68 2c1p s SER 28 N -2.96 6.40 0.19 -0.18 0.15 -1.26 -4.90 113.70 111.14 2c1p s SER 28 Ca 0.16 0.74 -0.12 0.00 0.70 0.00 0.00 55.95 57.43 2c1p s SER 28 Cb -0.04 -2.54 0.22 0.00 -1.71 0.00 0.00 66.02 61.95 2c1p s SER 28 CO 0.08 -1.40 1.72 0.15 1.20 0.00 0.00 173.24 174.99 2c1p h PHE 29 N 10.38 0.21 0.00 3.44 3.57 -1.95 -2.13 116.94 130.47 2c1p h PHE 29 Ca -0.27 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.27 2c1p h PHE 29 Cb 1.10 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.82 2c1p h PHE 29 CO 0.97 0.01 0.00 0.25 -2.23 0.00 0.00 178.31 177.31 2c1p n THR 30 N -5.09 0.00 1.02 4.41 -2.24 -1.26 -3.68 114.28 107.44 2c1p n THR 30 Ca 0.07 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.95 2c1p n THR 30 Cb 0.26 -0.12 0.02 0.00 -2.10 0.00 0.00 70.33 68.39 2c1p n THR 30 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2c1p n ASN 31 N -0.59 1.15 -3.87 3.42 3.02 -0.80 -4.12 115.26 113.47 2c1p n ASN 31 Ca 0.04 -0.97 -0.11 0.00 -0.03 0.00 0.00 54.58 53.51 2c1p n ASN 31 Cb 0.02 0.67 -0.09 0.00 -0.61 0.00 0.00 39.78 39.76 2c1p n ASN 31 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2c1p s TYR 32 N -2.84 0.07 0.45 3.10 1.51 -1.24 -5.11 117.35 113.30 2c1p s TYR 32 Ca 0.12 -0.26 -0.24 0.00 -1.01 0.00 0.00 57.07 55.68 2c1p s TYR 32 Cb 0.17 -0.05 -0.07 0.00 -0.11 0.00 0.00 41.96 41.89 2c1p s TYR 32 CO 0.74 -0.38 1.25 -1.58 -1.11 0.00 0.00 175.55 174.47 2c1p s TRP 33 N -2.22 2.76 -0.20 2.71 0.52 -1.26 -4.47 118.94 116.78 2c1p s TRP 33 Ca -0.08 1.46 -0.04 0.00 0.02 0.00 0.00 56.10 57.46 2c1p s TRP 33 Cb -0.03 -3.56 -0.02 0.00 -1.15 0.00 0.00 33.47 28.71 2c1p s TRP 33 CO -0.02 -1.95 -0.02 1.41 0.02 0.00 0.00 176.95 176.39 2c1p s MET 34 N -2.53 3.55 0.23 4.98 -2.45 0.14 -4.77 119.30 118.45 2c1p s MET 34 Ca 0.62 -0.55 0.01 0.00 -1.25 0.00 0.00 55.69 54.51 2c1p s MET 34 Cb -0.34 -3.04 -0.04 0.00 1.25 0.00 0.00 34.83 32.66 2c1p s MET 34 CO 0.43 -0.03 0.41 -0.80 1.05 0.00 0.00 175.02 176.08 2c1p s ASN 35 N 1.08 6.36 -0.08 1.11 0.01 0.48 -0.66 114.94 123.23 2c1p s ASN 35 Ca 0.02 0.35 0.01 0.00 -0.71 0.00 0.00 52.86 52.53 2c1p s ASN 35 Cb -0.14 -1.98 0.02 0.00 0.41 0.00 0.00 41.25 39.55 2c1p s ASN 35 CO 0.01 -0.09 -0.10 0.26 -1.51 0.00 0.00 177.10 175.67 2c1p s TRP 36 N -1.97 1.35 0.35 2.20 0.52 -0.30 -0.44 118.94 120.65 2c1p s TRP 36 Ca 0.38 -0.54 0.07 0.00 0.02 0.00 0.00 56.10 56.03 2c1p s TRP 36 Cb -0.10 -1.05 -0.07 0.00 -1.15 0.00 0.00 33.47 31.10 2c1p s TRP 36 CO 0.30 -0.33 -0.03 -0.51 0.02 0.00 0.00 176.95 176.40 2c1p s LEU 37 N 1.01 2.65 0.02 2.99 2.01 0.32 -0.73 118.68 126.96 2c1p s LEU 37 Ca -0.08 -1.28 0.00 0.00 0.01 0.00 0.00 54.13 52.77 2c1p s LEU 37 Cb -0.15 -0.80 -0.02 0.00 0.01 0.00 0.00 46.19 45.24 2c1p s LEU 37 CO -0.00 -0.38 -0.03 -0.60 1.01 0.00 0.00 176.35 176.35 2c1p s ARG 38 N -3.71 0.27 -0.29 1.70 3.52 0.89 -1.02 118.95 120.30 2c1p s ARG 38 Ca 0.33 -0.52 -0.02 0.00 -0.13 0.00 0.00 55.73 55.39 2c1p s ARG 38 Cb 0.06 0.08 0.12 0.00 -1.56 0.00 0.00 34.95 33.65 2c1p s ARG 38 CO 0.16 -0.04 0.22 -1.14 -0.81 0.00 0.00 175.30 173.69 2c1p s GLN 39 N -1.25 0.28 0.73 5.12 0.74 -0.52 -0.46 119.66 124.29 2c1p s GLN 39 Ca -0.13 -0.34 -0.11 0.00 0.05 0.00 0.00 55.36 54.82 2c1p s GLN 39 Cb -0.09 -0.88 0.03 0.00 1.10 0.00 0.00 33.01 33.17 2c1p s GLN 39 CO -0.01 -1.03 1.07 1.03 -0.55 0.00 0.00 175.29 175.80 2c1p s ARG 40 N 2.21 2.65 -0.47 1.67 0.52 -1.26 -1.26 118.95 123.00 2c1p s ARG 40 Ca 0.10 1.07 -0.43 0.00 -0.52 0.00 0.00 55.73 55.94 2c1p s ARG 40 Cb -0.15 -1.95 -0.18 0.00 0.52 0.00 0.00 34.95 33.19 2c1p s ARG 40 CO -0.34 -1.33 1.81 -2.30 0.02 0.00 0.00 175.30 173.16 2c1p n PRO 41 N -3.25 0.00 -1.01 3.54 -0.02 -1.26 -0.74 135.00 132.25 2c1p n PRO 41 Ca 0.08 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.54 2c1p n PRO 41 Cb 0.53 -1.41 -0.01 0.00 -0.02 0.00 0.00 33.50 32.59 2c1p n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c1p n GLY 42 N 5.72 0.20 0.60 -1.23 0.00 -1.26 -4.95 105.19 104.27 2c1p n GLY 42 Ca 0.43 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.41 2c1p n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2c1p n GLN 43 N 0.60 0.81 -0.14 1.61 1.13 0.08 -5.14 117.38 116.32 2c1p n GLN 43 Ca -0.02 -0.46 0.00 0.00 -1.94 0.00 0.00 57.00 54.58 2c1p n GLN 43 Cb 0.49 -0.06 0.00 0.00 0.11 0.00 0.00 30.24 30.78 2c1p n GLN 43 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2c1p n GLY 44 N 3.88 0.47 3.89 1.08 0.00 -1.26 -4.75 105.19 108.50 2c1p n GLY 44 Ca 0.03 -1.85 -0.35 0.00 0.00 0.00 0.00 46.02 43.85 2c1p n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c1p s LEU 45 N 0.00 4.38 -0.06 0.99 1.43 -1.26 -4.18 118.68 119.97 2c1p s LEU 45 Ca 0.00 0.41 0.02 0.00 -1.03 0.00 0.00 54.13 53.53 2c1p s LEU 45 Cb 0.00 -2.45 0.02 0.00 0.03 0.00 0.00 46.19 43.79 2c1p s LEU 45 CO 0.00 0.31 -0.10 -1.81 0.23 0.00 0.00 176.35 174.98 2c1p s ASP 46 N -1.62 1.59 -0.22 2.29 1.01 0.39 -4.96 116.67 115.15 2c1p s ASP 46 Ca 0.23 -0.25 -0.22 0.00 0.71 0.00 0.00 52.55 53.02 2c1p s ASP 46 Cb -0.13 -0.73 -0.02 0.00 1.01 0.00 0.00 42.92 43.06 2c1p s ASP 46 CO 0.14 -0.00 0.70 0.86 0.21 0.00 0.00 175.17 177.08 2c1p s TRP 47 N 0.82 3.33 -0.13 4.23 -0.00 -1.26 -0.08 118.94 125.85 2c1p s TRP 47 Ca -0.12 0.98 -0.21 0.00 -0.00 0.00 0.00 56.10 56.75 2c1p s TRP 47 Cb -0.15 -2.90 -0.25 0.00 -0.00 0.00 0.00 33.47 30.16 2c1p s TRP 47 CO 0.02 -0.29 0.56 0.82 -0.00 0.00 0.00 176.95 178.05 2c1p h ILE 48 N 5.32 1.25 0.00 5.86 2.04 -1.26 -3.43 117.51 127.29 2c1p h ILE 48 Ca -0.27 -2.34 0.00 0.00 1.00 0.00 0.00 64.86 63.24 2c1p h ILE 48 Cb 1.12 2.81 0.00 0.00 -0.74 0.00 0.00 36.82 40.01 2c1p h ILE 48 CO 0.81 0.58 0.00 0.61 0.00 0.00 0.00 178.15 180.14 2c1p n GLY 49 N 1.62 -1.62 3.20 5.37 0.00 -1.17 -0.85 105.19 111.74 2c1p n GLY 49 Ca -0.22 -1.14 -0.10 0.00 0.00 0.00 0.00 46.02 44.56 2c1p n GLY 49 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2c1p s MET 50 N -1.59 0.78 0.01 1.61 0.23 -0.29 -1.15 119.30 118.91 2c1p s MET 50 Ca 0.00 -0.77 0.02 0.00 -1.03 0.00 0.00 55.69 53.90 2c1p s MET 50 Cb 0.00 0.32 -0.01 0.00 -1.53 0.00 0.00 34.83 33.61 2c1p s MET 50 CO 0.00 -0.24 -0.05 -1.50 -2.03 0.00 0.00 175.02 171.19 2c1p s ILE 51 N -3.20 0.39 -0.36 3.16 2.07 0.16 -2.09 121.20 121.33 2c1p s ILE 51 Ca -0.00 -0.50 -0.09 0.00 -1.41 0.00 0.00 60.65 58.64 2c1p s ILE 51 Cb 0.02 -0.39 0.04 0.00 0.13 0.00 0.00 42.46 42.25 2c1p s ILE 51 CO -0.07 -0.08 0.17 -2.28 -1.91 0.00 0.00 174.94 170.76 2c1p s HIS 52 N -0.57 3.25 -0.96 3.50 5.65 -0.67 0.26 115.29 125.76 2c1p s HIS 52 Ca -0.03 -1.17 0.00 0.00 0.25 0.00 0.00 55.06 54.11 2c1p s HIS 52 Cb -0.05 -2.40 0.00 0.00 -1.18 0.00 0.00 32.58 28.95 2c1p s HIS 52 CO -0.00 -0.69 0.89 -0.35 -0.65 0.00 0.00 174.74 173.94 2c1p n PRO 52 N 4.92 0.00 -0.08 2.88 -0.04 -1.26 -0.20 135.00 141.22 2c1p n PRO 52 Ca -0.12 0.40 -0.14 0.00 -0.04 0.00 0.00 63.50 63.60 2c1p n PRO 52 Cb 0.45 -1.56 -0.05 0.00 -0.04 0.00 0.00 33.50 32.31 2c1p n PRO 52 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2c1p h SER 53 N 0.00 0.76 0.00 3.54 4.64 -1.89 -3.38 113.55 117.22 2c1p h SER 53 Ca 0.00 -0.50 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2c1p h SER 53 Cb 0.11 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 2c1p h SER 53 CO 0.00 1.11 0.00 -0.90 -0.87 0.00 0.00 176.83 176.17 2c1p n ASP 54 N -4.23 0.51 -2.80 4.97 3.85 -1.05 -5.00 116.55 112.80 2c1p n ASP 54 Ca -0.04 -1.22 -0.22 0.00 -0.71 0.00 0.00 54.79 52.60 2c1p n ASP 54 Cb 0.50 0.00 0.02 0.00 -1.35 0.00 0.00 41.12 40.29 2c1p n ASP 54 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 2c1p n SER 55 N -0.11 -6.01 -4.77 -1.12 7.64 0.72 -4.96 113.62 105.02 2c1p n SER 55 Ca 0.00 -0.19 -0.39 0.00 1.01 0.00 0.00 58.87 59.31 2c1p n SER 55 Cb 0.37 -4.91 -0.04 0.00 -1.01 0.00 0.00 64.21 58.62 2c1p n SER 55 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2c1p s GLU 56 N -5.47 4.46 0.01 1.43 2.56 -1.20 -4.82 118.70 115.68 2c1p s GLU 56 Ca 0.19 1.65 0.02 0.00 0.00 0.00 0.00 54.97 56.84 2c1p s GLU 56 Cb -0.09 -2.92 -0.01 0.00 2.00 0.00 0.00 34.13 33.11 2c1p s GLU 56 CO 0.24 0.09 -0.07 0.95 -0.56 0.00 0.00 175.26 175.91 2c1p s THR 57 N -1.37 0.51 -0.20 -1.70 -4.23 -1.26 -1.67 115.64 105.72 2c1p s THR 57 Ca 0.50 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 2c1p s THR 57 Cb -0.27 -0.47 0.05 0.00 1.34 0.00 0.00 72.50 73.15 2c1p s THR 57 CO 0.35 -0.01 -0.06 -0.13 -0.54 0.00 0.00 174.62 174.22 2c1p s ARG 58 N -0.56 1.63 -0.04 3.99 1.81 -0.89 -5.02 118.95 119.88 2c1p s ARG 58 Ca -0.01 -0.73 0.02 0.00 -1.72 0.00 0.00 55.73 53.28 2c1p s ARG 58 Cb -0.04 -2.29 -0.03 0.00 -0.45 0.00 0.00 34.95 32.13 2c1p s ARG 58 CO 0.00 -0.48 -0.07 -0.51 -0.68 0.00 0.00 175.30 173.56 2c1p s LEU 59 N 1.51 3.17 -0.00 2.53 1.43 -1.26 -1.13 118.68 124.92 2c1p s LEU 59 Ca -0.02 -0.06 -0.30 0.00 -1.03 0.00 0.00 54.13 52.72 2c1p s LEU 59 Cb -0.17 -1.73 -0.06 0.00 0.03 0.00 0.00 46.19 44.26 2c1p s LEU 59 CO -0.07 0.34 1.60 0.21 0.23 0.00 0.00 176.35 178.65 2c1p s ASN 60 N -1.01 6.69 0.60 2.29 3.84 -0.03 -4.81 114.94 122.50 2c1p s ASN 60 Ca 0.14 2.29 0.28 0.00 0.21 0.00 0.00 52.86 55.78 2c1p s ASN 60 Cb -0.11 -2.55 1.45 0.00 -0.55 0.00 0.00 41.25 39.49 2c1p s ASN 60 CO 0.03 -0.87 1.86 1.56 -2.79 0.00 0.00 177.10 176.89 2c1p h GLN 61 N 8.77 0.00 0.00 0.43 7.50 -1.95 0.12 115.11 129.98 2c1p h GLN 61 Ca -0.40 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.75 2c1p h GLN 61 Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.71 2c1p h GLN 61 CO 0.94 0.00 0.00 -0.22 -1.50 0.00 0.00 178.83 178.05 2c1p h LYS 62 N 0.00 0.00 -0.03 1.46 3.64 -1.93 -2.64 116.57 117.08 2c1p h LYS 62 Ca 0.19 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 2c1p h LYS 62 Cb 1.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2c1p h LYS 62 CO -0.00 0.00 0.00 1.19 -2.27 0.00 0.00 179.45 178.37 2c1p n PHE 63 N -2.81 0.03 -0.34 1.91 3.01 0.42 -4.80 117.46 114.88 2c1p n PHE 63 Ca -0.01 -0.16 0.24 0.00 1.01 0.00 0.00 57.45 58.52 2c1p n PHE 63 Cb 0.14 -0.01 0.47 0.00 -0.01 0.00 0.00 39.48 40.07 2c1p n PHE 63 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 2c1p h LYS 64 N 0.44 0.34 -0.31 -1.08 2.10 -1.38 0.51 116.57 117.20 2c1p h LYS 64 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 2c1p h LYS 64 Cb 0.24 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 31.50 2c1p h LYS 64 CO 0.00 0.22 0.00 -0.25 -2.00 0.00 0.00 179.45 177.42 2c1p n ASP 65 N -4.99 3.35 -0.10 7.07 8.00 -1.26 -4.46 116.55 124.15 2c1p n ASP 65 Ca 0.31 -1.98 -0.17 0.00 0.71 0.00 0.00 54.79 53.65 2c1p n ASP 65 Cb 0.97 -0.19 -0.09 0.00 -0.02 0.00 0.00 41.12 41.79 2c1p n ASP 65 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2c1p n LYS 66 N 1.44 0.49 -4.86 -1.24 4.76 0.15 -4.92 118.16 113.98 2c1p n LYS 66 Ca 0.18 0.15 -0.33 0.00 -2.87 0.00 0.00 58.31 55.44 2c1p n LYS 66 Cb 0.60 -1.36 -0.13 0.00 -1.84 0.00 0.00 35.03 32.30 2c1p n LYS 66 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2c1p s ALA 67 N -2.40 2.66 -0.16 7.82 0.00 0.40 -4.17 121.76 125.91 2c1p s ALA 67 Ca -0.28 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 50.72 2c1p s ALA 67 Cb 0.09 -1.02 0.02 0.00 0.00 0.00 0.00 23.12 22.21 2c1p s ALA 67 CO 0.44 0.50 -0.17 0.99 0.00 0.00 0.00 175.76 177.52 2c1p s THR 68 N -0.54 1.78 -0.16 0.00 2.01 -0.64 -4.78 115.64 113.31 2c1p s THR 68 Ca 0.07 -0.77 -0.07 0.00 0.31 0.00 0.00 61.69 61.24 2c1p s THR 68 Cb -0.12 -1.64 -0.04 0.00 0.01 0.00 0.00 72.50 70.71 2c1p s THR 68 CO 0.01 0.49 0.09 -0.76 -0.69 0.00 0.00 174.62 173.76 2c1p s LEU 69 N 1.40 4.00 0.26 4.42 1.43 -1.26 -1.14 118.68 127.79 2c1p s LEU 69 Ca 0.05 0.21 0.02 0.00 -1.03 0.00 0.00 54.13 53.38 2c1p s LEU 69 Cb -0.13 -2.00 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 2c1p s LEU 69 CO -0.12 0.25 0.17 0.42 0.23 0.00 0.00 176.35 177.30 2c1p s THR 70 N -0.08 0.13 0.05 5.49 -4.23 -0.53 -5.00 115.64 111.46 2c1p s THR 70 Ca 0.08 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.51 2c1p s THR 70 Cb -0.12 -2.51 -0.00 0.00 1.34 0.00 0.00 72.50 71.21 2c1p s THR 70 CO 0.01 0.00 0.16 -0.69 -0.54 0.00 0.00 174.62 173.55 2c1p s VAL 71 N -3.81 0.13 -0.37 2.29 1.01 -1.26 -0.65 120.40 117.74 2c1p s VAL 71 Ca 0.38 -1.08 0.01 0.00 0.00 0.00 0.00 61.98 61.29 2c1p s VAL 71 Cb 0.05 -1.07 0.12 0.00 0.00 0.00 0.00 36.38 35.49 2c1p s VAL 71 CO 0.17 -0.60 0.17 -0.62 0.00 0.00 0.00 175.10 174.23 2c1p s ASP 72 N -2.37 3.77 0.57 3.32 -1.08 -0.43 -4.98 116.67 115.47 2c1p s ASP 72 Ca -0.01 -2.13 0.26 0.00 -0.52 0.00 0.00 52.55 50.14 2c1p s ASP 72 Cb 0.01 -0.91 1.58 0.00 -1.46 0.00 0.00 42.92 42.14 2c1p s ASP 72 CO -0.06 -0.34 2.13 0.03 0.52 0.00 0.00 175.17 177.44 2c1p h ARG 73 N 7.38 0.00 -0.79 4.34 3.08 -1.88 -0.57 114.38 125.94 2c1p h ARG 73 Ca -0.06 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.01 2c1p h ARG 73 Cb 0.97 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.98 2c1p h ARG 73 CO 0.46 0.00 0.52 0.77 -1.07 0.00 0.00 179.97 180.64 2c1p h SER 74 N 0.00 0.88 -0.16 7.04 0.02 -1.96 -2.83 113.55 116.54 2c1p h SER 74 Ca 0.07 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2c1p h SER 74 Cb 0.36 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.69 2c1p h SER 74 CO -0.00 0.62 0.00 -1.54 -1.14 0.00 0.00 176.83 174.77 2c1p n SER 75 N -4.56 3.08 -4.31 3.07 3.41 -0.94 -4.98 113.62 108.39 2c1p n SER 75 Ca 0.09 -2.79 -0.32 0.00 -0.26 0.00 0.00 58.87 55.58 2c1p n SER 75 Cb 0.05 -0.41 -0.10 0.00 -0.26 0.00 0.00 64.21 63.49 2c1p n SER 75 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2c1p n SER 76 N -0.66 0.61 -4.44 4.04 3.41 -0.27 -4.69 113.62 111.63 2c1p n SER 76 Ca 0.16 -1.25 -0.33 0.00 -0.26 0.00 0.00 58.87 57.19 2c1p n SER 76 Cb 0.68 -1.56 -0.13 0.00 -0.26 0.00 0.00 64.21 62.94 2c1p n SER 76 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2c1p s THR 77 N -4.22 3.22 -0.02 6.66 2.01 -0.95 -1.57 115.64 120.77 2c1p s THR 77 Ca 0.10 -0.63 -0.02 0.00 0.31 0.00 0.00 61.69 61.45 2c1p s THR 77 Cb -0.06 -2.33 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 2c1p s THR 77 CO 0.98 0.55 0.14 0.00 -0.69 0.00 0.00 174.62 175.60 2c1p s ALA 78 N -0.07 3.80 0.07 7.40 0.00 0.57 -1.31 121.76 132.21 2c1p s ALA 78 Ca -0.02 -0.79 0.06 0.00 0.00 0.00 0.00 51.96 51.21 2c1p s ALA 78 Cb -0.14 -1.78 -0.03 0.00 0.00 0.00 0.00 23.12 21.18 2c1p s ALA 78 CO 0.04 0.71 -0.16 0.71 0.00 0.00 0.00 175.76 177.05 2c1p s TYR 79 N -1.24 1.39 -0.07 0.00 1.51 0.17 -0.67 117.35 118.46 2c1p s TYR 79 Ca 0.24 -0.41 -0.00 0.00 -1.01 0.00 0.00 57.07 55.89 2c1p s TYR 79 Cb -0.12 -0.79 0.02 0.00 -0.11 0.00 0.00 41.96 40.96 2c1p s TYR 79 CO 0.15 0.09 -0.03 -1.50 -1.11 0.00 0.00 175.55 173.14 2c1p s ILE 80 N -1.09 0.55 -0.12 2.71 2.07 -0.74 -1.46 121.20 123.12 2c1p s ILE 80 Ca 0.02 -0.05 -0.02 0.00 -1.41 0.00 0.00 60.65 59.19 2c1p s ILE 80 Cb -0.09 -0.63 -0.03 0.00 0.13 0.00 0.00 42.46 41.84 2c1p s ILE 80 CO 0.02 0.26 -0.06 -1.58 -1.91 0.00 0.00 174.94 171.67 2c1p s GLN 81 N 1.45 3.35 0.14 3.50 0.74 -0.29 -1.00 119.66 127.54 2c1p s GLN 81 Ca -0.02 -0.56 0.02 0.00 0.05 0.00 0.00 55.36 54.84 2c1p s GLN 81 Cb -0.13 -2.76 0.02 0.00 1.10 0.00 0.00 33.01 31.23 2c1p s GLN 81 CO -0.03 0.36 0.14 1.28 -0.55 0.00 0.00 175.29 176.49 2c1p n LEU 82 N 3.14 0.00 0.00 3.68 4.77 0.15 -1.62 117.00 127.13 2c1p n LEU 82 Ca -0.18 -0.68 0.00 0.00 -0.03 0.00 0.00 56.01 55.12 2c1p n LEU 82 Cb 0.53 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2c1p n LEU 82 CO 0.31 -0.41 0.00 -1.20 -1.33 0.00 0.00 177.39 174.75 2c1p n SER 82 N -2.28 0.00 -4.77 -1.43 7.64 -0.47 -2.35 113.62 109.96 2c1p n SER 82 Ca 0.01 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.48 2c1p n SER 82 Cb 0.15 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 2c1p n SER 82 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2c1p n PRO 82 N 0.00 2.58 -4.19 1.43 -0.04 -1.26 -4.43 135.00 129.10 2c1p n PRO 82 Ca 0.00 0.91 -0.28 0.00 -0.04 0.00 0.00 63.50 64.09 2c1p n PRO 82 Cb 0.00 -2.66 -0.04 0.00 -0.04 0.00 0.00 33.50 30.75 2c1p n PRO 82 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2c1p n THR 83 N 0.28 0.00 0.29 0.52 -2.24 -1.26 -0.61 114.28 111.25 2c1p n THR 83 Ca 0.02 -2.12 0.14 0.00 -2.27 0.00 0.00 64.05 59.82 2c1p n THR 83 Cb 0.39 0.28 0.85 0.00 -2.10 0.00 0.00 70.33 69.76 2c1p n THR 83 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2c1p h SER 84 N 0.95 0.00 0.79 3.42 4.64 -1.96 0.63 113.55 122.02 2c1p h SER 84 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2c1p h SER 84 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2c1p h SER 84 CO 0.59 0.04 0.00 1.21 -0.87 0.00 0.00 176.83 177.81 2c1p n GLU 85 N -3.77 0.06 0.00 4.77 2.13 -1.26 -2.56 120.64 120.01 2c1p n GLU 85 Ca -0.03 0.20 0.12 0.00 0.66 0.00 0.00 57.16 58.11 2c1p n GLU 85 Cb 0.14 -1.59 0.24 0.00 0.27 0.00 0.00 31.44 30.50 2c1p n GLU 85 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2c1p n ASP 86 N -1.69 1.58 -4.74 4.31 8.00 0.21 -4.90 116.55 119.33 2c1p n ASP 86 Ca 0.05 -1.26 -0.42 0.00 0.71 0.00 0.00 54.79 53.87 2c1p n ASP 86 Cb 0.26 0.23 -0.02 0.00 -0.02 0.00 0.00 41.12 41.57 2c1p n ASP 86 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2c1p s SER 87 N -2.40 6.49 0.00 -2.24 0.01 -1.06 -4.90 113.70 109.60 2c1p s SER 87 Ca 0.24 2.79 0.00 0.00 1.31 0.00 0.00 55.95 60.29 2c1p s SER 87 Cb 0.19 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.80 2c1p s SER 87 CO 0.50 -0.85 0.00 0.00 0.41 0.00 0.00 173.24 173.30 2c1p n ALA 88 N 2.92 0.00 -2.62 1.44 0.00 -0.24 -4.41 120.51 117.60 2c1p n ALA 88 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.16 2c1p n ALA 88 Cb 0.38 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.74 2c1p n ALA 88 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2c1p s VAL 89 N -2.00 5.24 -0.21 0.00 1.01 -0.39 -0.72 120.40 123.32 2c1p s VAL 89 Ca 0.00 0.44 -0.11 0.00 0.00 0.00 0.00 61.98 62.31 2c1p s VAL 89 Cb 0.00 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.70 2c1p s VAL 89 CO 0.00 0.22 0.17 -0.31 0.00 0.00 0.00 175.10 175.18 2c1p s TYR 90 N 1.73 3.37 -0.03 5.22 1.51 0.15 -1.44 117.35 127.87 2c1p s TYR 90 Ca 0.13 0.33 0.06 0.00 -1.01 0.00 0.00 57.07 56.58 2c1p s TYR 90 Cb -0.15 -2.24 -0.02 0.00 -0.11 0.00 0.00 41.96 39.43 2c1p s TYR 90 CO 0.09 0.18 -0.21 0.71 -1.11 0.00 0.00 175.55 175.21 2c1p s TYR 91 N 0.71 2.49 0.03 2.71 2.02 -0.19 -0.53 117.35 124.59 2c1p s TYR 91 Ca 0.09 -0.31 0.03 0.00 -0.37 0.00 0.00 57.07 56.51 2c1p s TYR 91 Cb -0.12 -1.55 -0.04 0.00 -0.40 0.00 0.00 41.96 39.85 2c1p s TYR 91 CO 0.02 0.07 -0.04 0.00 -1.57 0.00 0.00 175.55 174.03 2c1p s ALA 93 N -1.10 -1.44 -0.04 0.00 0.00 0.42 -1.32 121.76 118.27 2c1p s ALA 93 Ca 0.20 0.15 0.06 0.00 0.00 0.00 0.00 51.96 52.37 2c1p s ALA 93 Cb -0.11 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.84 2c1p s ALA 93 CO 0.11 -0.89 -0.24 1.03 0.00 0.00 0.00 175.76 175.77 2c1p s ARG 94 N -3.79 2.37 -0.43 0.00 0.52 0.13 -0.39 118.95 117.36 2c1p s ARG 94 Ca 0.06 -0.88 0.05 0.00 -0.52 0.00 0.00 55.73 54.44 2c1p s ARG 94 Cb -0.03 -2.15 0.17 0.00 0.52 0.00 0.00 34.95 33.46 2c1p s ARG 94 CO -0.04 0.48 0.52 0.34 0.02 0.00 0.00 175.30 176.62 2c1p s ASP 95 N -0.41 -0.01 0.34 0.23 2.15 -1.22 -0.83 116.67 116.92 2c1p s ASP 95 Ca 0.04 -1.83 0.02 0.00 0.43 0.00 0.00 52.55 51.21 2c1p s ASP 95 Cb -0.12 0.98 -0.01 0.00 -0.30 0.00 0.00 42.92 43.47 2c1p s ASP 95 CO 0.01 -0.16 0.39 1.51 -0.17 0.00 0.00 175.17 176.75 2c1p s ASP 96 N 1.02 1.32 0.49 -0.34 3.84 0.15 -4.99 116.67 118.16 2c1p s ASP 96 Ca 0.24 -1.64 0.27 0.00 -0.00 0.00 0.00 52.55 51.43 2c1p s ASP 96 Cb -0.05 0.62 1.34 0.00 -1.38 0.00 0.00 42.92 43.45 2c1p s ASP 96 CO -0.08 -1.20 1.86 0.10 -0.00 0.00 0.00 175.17 175.85 2c1p h TYR 97 N 2.11 0.22 0.00 2.11 -0.00 -2.04 0.04 116.97 119.41 2c1p h TYR 97 Ca -0.27 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.47 2c1p h TYR 97 Cb 1.24 -0.07 0.00 0.00 0.00 0.00 0.00 36.73 37.90 2c1p h TYR 97 CO 1.65 0.04 -0.77 -0.25 -0.00 0.00 0.00 178.16 178.84 2c1p n ASP 98 N -4.37 0.67 0.00 0.10 8.00 -1.26 -5.02 116.55 114.67 2c1p n ASP 98 Ca 0.20 0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.72 2c1p n ASP 98 Cb 0.91 0.38 0.00 0.00 -0.02 0.00 0.00 41.12 42.39 2c1p n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2c1p n GLY 99 N 1.34 0.77 2.58 0.44 0.00 -0.00 -5.10 105.19 105.22 2c1p n GLY 99 Ca 0.03 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 44.95 2c1p n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c1p s ALA 101 N -2.00 0.92 0.00 4.61 0.00 -1.26 0.33 121.76 124.37 2c1p s ALA 101 Ca 0.00 -1.39 0.03 0.00 0.00 0.00 0.00 51.96 50.60 2c1p s ALA 101 Cb 0.00 -1.49 -0.01 0.00 0.00 0.00 0.00 23.12 21.62 2c1p s ALA 101 CO 0.00 -1.74 -0.10 -0.06 0.00 0.00 0.00 175.76 173.85 2c1p s PHE 102 N 1.77 0.93 0.02 0.00 0.40 -0.01 -4.97 117.98 116.12 2c1p s PHE 102 Ca 0.11 -0.21 0.07 0.00 -0.60 0.00 0.00 56.93 56.30 2c1p s PHE 102 Cb -0.18 -0.59 -0.02 0.00 0.51 0.00 0.00 43.02 42.74 2c1p s PHE 102 CO -0.27 -0.01 -0.21 -1.58 0.70 0.00 0.00 175.22 173.84 2c1p s TRP 103 N -0.37 1.89 1.07 0.36 0.52 -1.26 0.21 118.94 121.35 2c1p s TRP 103 Ca 0.03 -0.37 -0.16 0.00 0.02 0.00 0.00 56.10 55.62 2c1p s TRP 103 Cb -0.05 -1.16 0.23 0.00 -1.15 0.00 0.00 33.47 31.34 2c1p s TRP 103 CO -0.00 0.05 1.14 0.20 0.02 0.00 0.00 176.95 178.36 2c1p s GLY 104 N -0.93 1.61 0.25 0.98 0.00 -0.44 -4.69 107.32 104.11 2c1p s GLY 104 Ca 0.08 -0.78 0.25 0.00 0.00 0.00 0.00 44.72 44.27 2c1p s GLY 104 CO 0.01 -0.04 1.75 0.61 0.00 0.00 0.00 173.10 175.43 2c1p n GLN 105 N -4.30 0.23 0.00 2.90 0.00 -1.25 -4.83 117.38 110.13 2c1p n GLN 105 Ca 0.10 0.35 0.00 0.00 0.00 0.00 0.00 57.00 57.45 2c1p n GLN 105 Cb 0.59 -1.86 0.00 0.00 0.00 0.00 0.00 30.24 28.97 2c1p n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2c1p n GLY 106 N 0.54 0.82 3.17 2.61 0.00 -1.26 -5.04 105.19 106.02 2c1p n GLY 106 Ca 0.03 -1.57 -0.32 0.00 0.00 0.00 0.00 46.02 44.16 2c1p n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c1p s THR 107 N -2.13 2.04 -0.09 2.61 2.01 0.30 -4.90 115.64 115.48 2c1p s THR 107 Ca 0.00 -0.97 -0.25 0.00 0.31 0.00 0.00 61.69 60.78 2c1p s THR 107 Cb 0.00 -1.81 -0.03 0.00 0.01 0.00 0.00 72.50 70.67 2c1p s THR 107 CO 0.00 0.55 0.79 -0.22 -0.69 0.00 0.00 174.62 175.04 2c1p s LEU 108 N 0.82 4.27 -0.18 4.42 2.96 -1.26 0.32 118.68 130.04 2c1p s LEU 108 Ca -0.07 1.25 0.01 0.00 -0.22 0.00 0.00 54.13 55.10 2c1p s LEU 108 Cb -0.15 -3.21 0.03 0.00 0.50 0.00 0.00 46.19 43.36 2c1p s LEU 108 CO -0.02 -0.24 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.94 2c1p s VAL 109 N 1.30 1.78 -0.22 1.68 1.01 0.10 -0.38 120.40 125.67 2c1p s VAL 109 Ca 0.40 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.45 2c1p s VAL 109 Cb -0.18 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 2c1p s VAL 109 CO 0.18 0.38 -0.03 -0.89 0.00 0.00 0.00 175.10 174.74 2c1p s THR 110 N 1.38 3.45 -0.42 3.92 2.01 -0.33 -1.08 115.64 124.56 2c1p s THR 110 Ca 0.03 -0.47 -0.16 0.00 0.31 0.00 0.00 61.69 61.40 2c1p s THR 110 Cb -0.14 -2.57 0.03 0.00 0.01 0.00 0.00 72.50 69.83 2c1p s THR 110 CO -0.10 0.42 0.35 -0.69 -0.69 0.00 0.00 174.62 173.90 2c1p s VAL 111 N 1.47 5.22 -0.08 3.82 1.01 -1.26 -0.51 120.40 130.07 2c1p s VAL 111 Ca 0.06 -0.67 -0.25 0.00 0.00 0.00 0.00 61.98 61.12 2c1p s VAL 111 Cb -0.14 -3.99 0.06 0.00 0.00 0.00 0.00 36.38 32.30 2c1p s VAL 111 CO -0.03 -0.39 0.57 -0.55 0.00 0.00 0.00 175.10 174.71 2c1p s SER 112 N 1.88 -0.53 0.00 3.32 0.15 0.14 -4.51 113.70 114.15 2c1p s SER 112 Ca 0.06 0.66 0.25 0.00 0.70 0.00 0.00 55.95 57.63 2c1p s SER 112 Cb -0.20 0.63 0.50 0.00 -1.71 0.00 0.00 66.02 65.25 2c1p s SER 112 CO 0.10 -0.48 1.41 0.00 1.20 0.00 0.00 173.24 175.47 2c1p n ALA 113 N 1.41 3.37 -1.81 5.45 0.00 -1.26 -4.04 120.51 123.63 2c1p n ALA 113 Ca -0.18 -0.45 -0.41 0.00 0.00 0.00 0.00 53.44 52.39 2c1p n ALA 113 Cb 0.56 -1.04 -0.02 0.00 0.00 0.00 0.00 19.45 18.95 2c1p n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c1p s ALA 114 N -2.62 3.55 0.78 0.00 0.00 -1.26 -5.03 121.76 117.17 2c1p s ALA 114 Ca 0.20 1.32 -0.04 0.00 0.00 0.00 0.00 51.96 53.44 2c1p s ALA 114 Cb 0.18 -3.52 0.15 0.00 0.00 0.00 0.00 23.12 19.93 2c1p s ALA 114 CO 0.59 -0.73 1.07 0.15 0.00 0.00 0.00 175.76 176.83 2c1p s LYS 115 N -1.31 1.42 0.12 0.00 -0.14 -1.26 -4.97 119.74 113.61 2c1p s LYS 115 Ca 0.53 -1.00 -0.31 0.00 -1.36 0.00 0.00 55.97 53.83 2c1p s LYS 115 Cb -0.41 -2.23 -0.10 0.00 -1.68 0.00 0.00 37.83 33.40 2c1p s LYS 115 CO 0.51 -1.68 1.83 0.99 -0.76 0.00 0.00 175.35 176.24 2c1p s THR 116 N -3.31 2.54 -0.09 2.17 2.01 -1.26 -4.74 115.64 112.96 2c1p s THR 116 Ca 0.68 0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.73 2c1p s THR 116 Cb -0.05 -3.03 0.03 0.00 0.01 0.00 0.00 72.50 69.46 2c1p s THR 116 CO 0.46 -0.00 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.46 2c1p s THR 117 N 2.75 0.71 0.49 -0.82 2.01 0.86 -4.97 115.64 116.68 2c1p s THR 117 Ca 0.81 -0.09 -0.21 0.00 0.31 0.00 0.00 61.69 62.51 2c1p s THR 117 Cb -0.46 -0.80 -0.07 0.00 0.01 0.00 0.00 72.50 71.18 2c1p s THR 117 CO 0.36 0.32 1.10 -2.16 -0.69 0.00 0.00 174.62 173.55 2c1p s PRO 118 N 1.82 3.70 0.59 4.92 0.04 -1.26 -1.27 135.00 143.54 2c1p s PRO 118 Ca 0.05 1.55 -0.16 0.00 0.04 0.00 0.00 61.00 62.49 2c1p s PRO 118 Cb -0.12 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 2c1p s PRO 118 CO -0.07 -0.55 1.06 -1.25 0.04 0.00 0.00 177.00 176.23 2c1p s PRO 119 N -3.03 3.31 -0.32 0.56 0.04 -1.26 -4.60 135.00 129.71 2c1p s PRO 119 Ca 0.67 1.21 -0.17 0.00 0.04 0.00 0.00 61.00 62.75 2c1p s PRO 119 Cb -0.22 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.27 2c1p s PRO 119 CO 0.26 -0.82 0.46 -1.12 0.04 0.00 0.00 177.00 175.83 2c1p s SER 120 N -2.78 6.29 -0.23 6.66 0.01 0.30 -4.90 113.70 119.05 2c1p s SER 120 Ca 0.64 0.07 -0.13 0.00 1.31 0.00 0.00 55.95 57.83 2c1p s SER 120 Cb -0.16 -2.25 -0.04 0.00 0.21 0.00 0.00 66.02 63.78 2c1p s SER 120 CO 0.37 -0.37 0.28 -0.69 0.41 0.00 0.00 173.24 173.24 2c1p s VAL 121 N 2.25 5.27 -0.01 3.43 1.01 -1.26 -1.33 120.40 129.76 2c1p s VAL 121 Ca 0.17 0.44 0.08 0.00 0.00 0.00 0.00 61.98 62.66 2c1p s VAL 121 Cb -0.16 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 2c1p s VAL 121 CO 0.12 0.27 -0.25 -0.31 0.00 0.00 0.00 175.10 174.93 2c1p s TYR 122 N 1.38 2.23 0.28 5.22 4.12 0.07 -4.98 117.35 125.68 2c1p s TYR 122 Ca 0.13 -0.42 -0.28 0.00 0.02 0.00 0.00 57.07 56.52 2c1p s TYR 122 Cb -0.15 -1.42 -0.09 0.00 -1.52 0.00 0.00 41.96 38.78 2c1p s TYR 122 CO 0.07 -0.02 1.00 -1.25 0.02 0.00 0.00 175.55 175.37 2c1p s PRO 123 N -0.68 4.67 -0.42 -1.71 0.04 -1.26 -1.07 135.00 134.57 2c1p s PRO 123 Ca 0.10 1.55 -0.00 0.00 0.04 0.00 0.00 61.00 62.69 2c1p s PRO 123 Cb -0.10 -3.08 0.11 0.00 0.04 0.00 0.00 34.50 31.48 2c1p s PRO 123 CO -0.01 0.31 0.19 -0.51 0.04 0.00 0.00 177.00 177.03 2c1p s LEU 124 N -1.59 5.05 -0.04 -3.56 1.43 0.95 -4.87 118.68 116.06 2c1p s LEU 124 Ca 0.46 -2.22 0.04 0.00 -1.03 0.00 0.00 54.13 51.38 2c1p s LEU 124 Cb -0.26 -1.76 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 2c1p s LEU 124 CO 0.33 -0.46 -0.16 0.00 0.23 0.00 0.00 176.35 176.29 2c1p s ALA 125 N 0.84 2.58 0.38 4.21 0.00 -1.26 -2.00 121.76 126.51 2c1p s ALA 125 Ca 0.11 -1.01 -0.24 0.00 0.00 0.00 0.00 51.96 50.81 2c1p s ALA 125 Cb -0.22 -0.89 -0.12 0.00 0.00 0.00 0.00 23.12 21.89 2c1p s ALA 125 CO -0.05 0.55 0.79 -2.30 0.00 0.00 0.00 175.76 174.76 2c1p n PRO 126 N 2.29 0.94 -1.66 0.00 -0.02 -1.26 -4.84 135.00 130.44 2c1p n PRO 126 Ca -0.17 0.34 -0.36 0.00 -2.02 0.00 0.00 63.50 61.28 2c1p n PRO 126 Cb 0.52 -1.72 -0.03 0.00 -0.02 0.00 0.00 33.50 32.25 2c1p n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c1p n GLY 127 N 1.49 4.68 3.93 -1.23 0.00 -1.26 -4.27 105.19 108.53 2c1p n GLY 127 Ca 0.11 -1.81 -0.33 0.00 0.00 0.00 0.00 46.02 43.98 2c1p n GLY 127 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2c1p n SER 128 N 2.25 -1.49 -4.08 1.61 2.88 -1.26 -4.85 113.62 108.68 2c1p n SER 128 Ca 0.65 -0.94 -0.35 0.00 -1.33 0.00 0.00 58.87 56.90 2c1p n SER 128 Cb 0.32 -1.31 -0.11 0.00 -0.75 0.00 0.00 64.21 62.36 2c1p n SER 128 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2c1p s ALA 129 N -2.81 3.44 0.62 -1.46 0.00 -1.26 -5.03 121.76 115.26 2c1p s ALA 129 Ca 0.65 -3.10 0.00 0.00 0.00 0.00 0.00 51.96 49.52 2c1p s ALA 129 Cb -0.38 -2.52 0.00 0.00 0.00 0.00 0.00 23.12 20.22 2c1p s ALA 129 CO 0.80 -2.02 0.00 0.00 0.00 0.00 0.00 175.76 174.54 2c1p n ALA 130 N 3.67 -3.45 -2.12 0.00 0.00 -1.26 -4.93 120.51 112.42 2c1p n ALA 130 Ca 0.05 0.85 -0.01 0.00 0.00 0.00 0.00 53.44 54.34 2c1p n ALA 130 Cb 0.38 -1.58 -0.01 0.00 0.00 0.00 0.00 19.45 18.24 2c1p n ALA 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c1p n GLN 131 N -4.02 0.00 0.00 0.00 -0.00 -1.26 -4.89 117.38 107.22 2c1p n GLN 131 Ca -0.08 -1.00 0.02 0.00 -0.00 0.00 0.00 57.00 55.94 2c1p n GLN 131 Cb 0.65 -0.02 0.08 0.00 -0.00 0.00 0.00 30.24 30.95 2c1p n GLN 131 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 2c1p n THR 132 N 0.12 1.50 -2.84 -0.39 -1.04 -1.26 -4.64 114.28 105.73 2c1p n THR 132 Ca -0.05 0.37 -0.36 0.00 -2.04 0.00 0.00 64.05 61.97 2c1p n THR 132 Cb 0.76 -1.31 -0.06 0.00 -1.82 0.00 0.00 70.33 67.89 2c1p n THR 132 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2c1p s ASN 133 N -2.85 7.24 0.19 8.00 0.01 -1.26 -4.96 114.94 121.31 2c1p s ASN 133 Ca 0.02 1.75 0.09 0.00 -0.71 0.00 0.00 52.86 54.02 2c1p s ASN 133 Cb 0.02 -2.55 -0.00 0.00 0.41 0.00 0.00 41.25 39.13 2c1p s ASN 133 CO 0.06 -0.09 1.40 0.77 -1.51 0.00 0.00 177.10 177.73 2c1p h SER 134 N 3.05 0.00 -2.47 -1.22 4.64 -1.99 -3.46 113.55 112.11 2c1p h SER 134 Ca -0.47 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.30 2c1p h SER 134 Cb 1.19 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.21 2c1p h SER 134 CO 0.65 0.82 -0.56 -0.04 -0.87 0.00 0.00 176.83 176.82 2c1p s MET 135 N -2.99 2.83 -0.08 4.77 -1.94 -1.26 -1.79 119.30 118.84 2c1p s MET 135 Ca 0.01 -1.01 0.02 0.00 -1.71 0.00 0.00 55.69 53.00 2c1p s MET 135 Cb 0.10 -2.55 0.01 0.00 2.01 0.00 0.00 34.83 34.40 2c1p s MET 135 CO 0.79 0.44 -0.13 0.08 -0.01 0.00 0.00 175.02 176.19 2c1p s VAL 136 N -1.95 1.25 -0.20 -6.03 1.01 0.62 -4.79 120.40 110.32 2c1p s VAL 136 Ca 0.31 -0.53 -0.07 0.00 0.00 0.00 0.00 61.98 61.70 2c1p s VAL 136 Cb -0.09 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 2c1p s VAL 136 CO 0.23 0.38 0.05 -0.89 0.00 0.00 0.00 175.10 174.88 2c1p s THR 137 N 0.78 4.57 0.49 3.92 2.01 -1.26 -1.49 115.64 124.66 2c1p s THR 137 Ca -0.12 -0.11 0.02 0.00 0.31 0.00 0.00 61.69 61.79 2c1p s THR 137 Cb -0.16 -3.07 -0.02 0.00 0.01 0.00 0.00 72.50 69.27 2c1p s THR 137 CO 0.02 0.43 0.03 -0.76 -0.69 0.00 0.00 174.62 173.65 2c1p s LEU 138 N 0.68 2.24 -0.00 4.42 1.43 0.05 -4.64 118.68 122.86 2c1p s LEU 138 Ca 0.03 -1.66 -0.29 0.00 -1.03 0.00 0.00 54.13 51.18 2c1p s LEU 138 Cb -0.13 -0.61 0.11 0.00 0.03 0.00 0.00 46.19 45.58 2c1p s LEU 138 CO 0.02 -0.87 1.27 -0.83 0.23 0.00 0.00 176.35 176.17 2c1p s GLY 139 N -3.83 -0.25 -0.03 -3.19 0.00 -0.85 -1.35 107.32 97.83 2c1p s GLY 139 Ca 0.09 0.32 0.02 0.00 0.00 0.00 0.00 44.72 45.15 2c1p s GLY 139 CO 0.05 2.80 -0.06 0.00 0.00 0.00 0.00 173.10 175.89 2c1p s LEU 141 N 0.47 3.98 -0.64 0.00 2.96 -0.23 -1.58 118.68 123.63 2c1p s LEU 141 Ca -0.06 -0.00 -0.07 0.00 -0.22 0.00 0.00 54.13 53.78 2c1p s LEU 141 Cb -0.10 -2.10 0.17 0.00 0.50 0.00 0.00 46.19 44.66 2c1p s LEU 141 CO 0.00 -0.03 0.49 -0.69 -1.32 0.00 0.00 176.35 174.81 2c1p s VAL 142 N 1.61 4.26 -0.10 1.68 1.01 0.12 -0.75 120.40 128.24 2c1p s VAL 142 Ca 0.07 -2.58 -0.02 0.00 0.00 0.00 0.00 61.98 59.44 2c1p s VAL 142 Cb -0.15 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 2c1p s VAL 142 CO 0.09 -0.89 0.01 -0.75 0.00 0.00 0.00 175.10 173.56 2c1p s LYS 143 N 0.31 3.11 -0.87 2.72 2.20 -0.45 -0.96 119.74 125.81 2c1p s LYS 143 Ca 0.15 -0.40 -0.05 0.00 -0.36 0.00 0.00 55.97 55.31 2c1p s LYS 143 Cb -0.19 -2.84 -0.05 0.00 -1.51 0.00 0.00 37.83 33.24 2c1p s LYS 143 CO -0.04 0.64 0.77 0.41 -0.36 0.00 0.00 175.35 176.76 2c1p n GLY 144 N 2.34 -0.88 3.54 5.54 0.00 -0.79 -0.54 105.19 114.39 2c1p n GLY 144 Ca -0.18 0.45 -0.25 0.00 0.00 0.00 0.00 46.02 46.04 2c1p n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2c1p s TYR 145 N -3.30 2.40 -0.28 1.61 1.13 -0.54 -4.37 117.35 114.00 2c1p s TYR 145 Ca 0.36 -0.41 -0.23 0.00 -1.41 0.00 0.00 57.07 55.37 2c1p s TYR 145 Cb -0.05 -1.24 0.13 0.00 -1.10 0.00 0.00 41.96 39.71 2c1p s TYR 145 CO 0.63 0.62 1.06 0.12 -2.51 0.00 0.00 175.55 175.47 2c1p s PHE 146 N -2.54 -0.46 0.17 -3.49 5.36 -0.40 -0.62 117.98 116.01 2c1p s PHE 146 Ca 0.32 1.07 -0.02 0.00 -0.96 0.00 0.00 56.93 57.34 2c1p s PHE 146 Cb -0.01 0.37 0.04 0.00 -0.34 0.00 0.00 43.02 43.07 2c1p s PHE 146 CO 0.17 -0.22 0.23 -0.35 -1.46 0.00 0.00 175.22 173.59 2c1p n PRO 147 N 2.42 0.12 -2.10 10.12 -0.04 -1.26 -0.10 135.00 144.17 2c1p n PRO 147 Ca -0.13 -0.48 -0.30 0.00 -0.04 0.00 0.00 63.50 62.55 2c1p n PRO 147 Cb 0.56 -0.20 0.01 0.00 -0.04 0.00 0.00 33.50 33.83 2c1p n PRO 147 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2c1p s ALA 148 N -3.41 3.19 0.00 0.55 0.00 -1.26 -4.82 121.76 116.00 2c1p s ALA 148 Ca 0.14 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.90 2c1p s ALA 148 Cb -0.01 -2.94 0.00 0.00 0.00 0.00 0.00 23.12 20.17 2c1p s ALA 148 CO 0.10 -0.59 0.00 -0.35 0.00 0.00 0.00 175.76 174.92 2c1p n PRO 149 N -2.59 2.20 -4.14 0.00 -0.04 -1.26 -4.98 135.00 124.18 2c1p n PRO 149 Ca 0.04 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.41 2c1p n PRO 149 Cb 0.54 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.90 2c1p n PRO 149 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2c1p s VAL 150 N -0.04 0.34 -0.07 0.52 -7.23 -1.26 -4.40 120.40 108.26 2c1p s VAL 150 Ca 0.00 -1.88 0.05 0.00 -1.81 0.00 0.00 61.98 58.33 2c1p s VAL 150 Cb 0.00 -1.78 -0.00 0.00 0.56 0.00 0.00 36.38 35.16 2c1p s VAL 150 CO 0.00 -0.76 -0.21 -0.89 -0.31 0.00 0.00 175.10 172.93 2c1p s THR 151 N -3.86 1.78 -0.08 5.32 2.01 0.03 -4.95 115.64 115.89 2c1p s THR 151 Ca 0.15 -0.89 0.05 0.00 0.31 0.00 0.00 61.69 61.31 2c1p s THR 151 Cb 0.07 -1.53 -0.01 0.00 0.01 0.00 0.00 72.50 71.05 2c1p s THR 151 CO -0.04 0.50 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.46 2c1p s VAL 152 N 0.13 2.12 0.17 3.82 1.01 -1.26 -0.39 120.40 126.00 2c1p s VAL 152 Ca -0.09 -1.02 0.03 0.00 0.00 0.00 0.00 61.98 60.90 2c1p s VAL 152 Cb -0.15 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 2c1p s VAL 152 CO 0.05 0.56 -0.05 0.42 0.00 0.00 0.00 175.10 176.09 2c1p s THR 153 N 0.09 0.95 -0.12 3.92 -4.23 -0.69 -4.96 115.64 110.60 2c1p s THR 153 Ca -0.11 -2.02 0.03 0.00 -1.18 0.00 0.00 61.69 58.41 2c1p s THR 153 Cb -0.16 -2.02 0.00 0.00 1.34 0.00 0.00 72.50 71.66 2c1p s THR 153 CO 0.06 -0.59 -0.22 0.26 -0.54 0.00 0.00 174.62 173.60 2c1p s TRP 154 N -3.47 2.63 -1.55 3.99 0.52 -1.26 -0.49 118.94 119.30 2c1p s TRP 154 Ca 0.21 -1.10 -0.12 0.00 0.02 0.00 0.00 56.10 55.11 2c1p s TRP 154 Cb 0.05 -1.77 0.09 0.00 -1.15 0.00 0.00 33.47 30.69 2c1p s TRP 154 CO 0.03 -0.46 0.81 0.09 0.02 0.00 0.00 176.95 177.44 2c1p n ASN 155 N 3.72 -3.33 -3.69 2.95 4.13 0.31 -1.41 115.26 117.94 2c1p n ASN 155 Ca -0.19 -0.89 -0.25 0.00 1.68 0.00 0.00 54.58 54.92 2c1p n ASN 155 Cb 0.52 -3.40 0.06 0.00 -1.54 0.00 0.00 39.78 35.43 2c1p n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2c1p n SER 156 N -2.82 -5.23 0.00 6.41 7.64 -1.26 -1.94 113.62 116.42 2c1p n SER 156 Ca -0.03 -0.64 0.00 0.00 1.01 0.00 0.00 58.87 59.22 2c1p n SER 156 Cb 0.55 -4.64 0.00 0.00 -1.01 0.00 0.00 64.21 59.12 2c1p n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2c1p n GLY 157 N -1.81 0.81 0.12 0.23 0.00 -0.50 -4.91 105.19 99.12 2c1p n GLY 157 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 2c1p n GLY 157 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2c1p h SER 158 N 0.00 0.00 -3.42 1.61 0.87 -0.96 -3.38 113.55 108.27 2c1p h SER 158 Ca 0.00 0.00 -0.72 0.00 -1.23 0.00 0.00 61.79 59.84 2c1p h SER 158 Cb 0.00 0.00 -0.26 0.00 -0.44 0.00 0.00 62.40 61.70 2c1p h SER 158 CO 0.00 0.70 -0.43 -0.76 -0.53 0.00 0.00 176.83 175.80 2c1p s LEU 159 N -7.16 5.26 -0.04 2.23 1.02 -0.82 -4.89 118.68 114.28 2c1p s LEU 159 Ca 0.00 -1.42 -0.07 0.00 0.02 0.00 0.00 54.13 52.66 2c1p s LEU 159 Cb 0.11 -2.04 -0.03 0.00 0.02 0.00 0.00 46.19 44.25 2c1p s LEU 159 CO 0.77 -0.56 -0.14 -1.20 0.02 0.00 0.00 176.35 175.24 2c1p n SER 160 N 5.00 1.28 -4.82 2.29 7.64 -1.26 -4.07 113.62 119.68 2c1p n SER 160 Ca -0.11 0.20 -0.32 0.00 1.01 0.00 0.00 58.87 59.65 2c1p n SER 160 Cb 0.43 -0.46 0.02 0.00 -1.01 0.00 0.00 64.21 63.19 2c1p n SER 160 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2c1p s SER 161 N -5.98 5.80 -0.07 6.43 0.01 -1.26 -3.45 113.70 115.18 2c1p s SER 161 Ca -0.13 1.65 0.00 0.00 1.31 0.00 0.00 55.95 58.79 2c1p s SER 161 Cb 0.03 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.75 2c1p s SER 161 CO 0.18 -1.15 0.00 0.61 0.41 0.00 0.00 173.24 173.29 2c1p n GLY 162 N -1.68 0.48 3.53 3.44 0.00 -1.26 -4.79 105.19 104.92 2c1p n GLY 162 Ca 0.08 -0.37 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 2c1p n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c1p s VAL 163 N -1.97 3.52 -0.23 1.61 1.01 -1.22 -1.70 120.40 121.42 2c1p s VAL 163 Ca 0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 2c1p s VAL 163 Cb 0.00 -2.44 0.07 0.00 0.00 0.00 0.00 36.38 34.01 2c1p s VAL 163 CO 0.00 0.58 0.05 -1.00 0.00 0.00 0.00 175.10 174.73 2c1p s HIS 164 N -0.55 1.22 -0.41 5.22 3.76 -0.54 -4.98 115.29 119.00 2c1p s HIS 164 Ca 0.08 -1.11 -0.10 0.00 -0.15 0.00 0.00 55.06 53.78 2c1p s HIS 164 Cb -0.12 -1.21 0.07 0.00 1.11 0.00 0.00 32.58 32.44 2c1p s HIS 164 CO 0.02 -0.69 0.25 0.99 -0.85 0.00 0.00 174.74 174.46 2c1p s THR 165 N 1.79 4.32 0.47 1.30 2.01 -1.26 0.10 115.64 124.36 2c1p s THR 165 Ca 0.02 -1.30 -0.23 0.00 0.31 0.00 0.00 61.69 60.49 2c1p s THR 165 Cb -0.17 -3.60 -0.07 0.00 0.01 0.00 0.00 72.50 68.67 2c1p s THR 165 CO -0.13 -0.46 1.20 -0.36 -0.69 0.00 0.00 174.62 174.17 2c1p s PHE 166 N 1.45 2.80 0.52 4.92 0.08 -0.42 -4.99 117.98 122.35 2c1p s PHE 166 Ca 0.03 1.51 -0.23 0.00 0.12 0.00 0.00 56.93 58.36 2c1p s PHE 166 Cb -0.22 -3.46 -0.06 0.00 -0.57 0.00 0.00 43.02 38.71 2c1p s PHE 166 CO 0.03 -1.73 1.38 -2.14 -0.10 0.00 0.00 175.22 172.66 2c1p s PRO 167 N -2.68 3.30 0.50 0.24 0.02 -1.26 -4.37 135.00 130.75 2c1p s PRO 167 Ca 0.64 2.29 -0.20 0.00 0.02 0.00 0.00 61.00 63.75 2c1p s PRO 167 Cb -0.31 -2.38 -0.08 0.00 0.02 0.00 0.00 34.50 31.76 2c1p s PRO 167 CO 0.38 -1.08 1.06 0.00 -0.33 0.00 0.00 177.00 177.02 2c1p s ALA 168 N -1.27 2.83 -0.09 -1.55 0.00 -1.26 -4.82 121.76 115.60 2c1p s ALA 168 Ca 0.68 0.65 0.04 0.00 0.00 0.00 0.00 51.96 53.34 2c1p s ALA 168 Cb -0.41 -3.27 -0.00 0.00 0.00 0.00 0.00 23.12 19.43 2c1p s ALA 168 CO 0.50 -0.42 -0.23 0.08 0.00 0.00 0.00 175.76 175.70 2c1p s VAL 169 N -1.95 1.97 -0.37 0.00 1.01 -0.73 -4.95 120.40 115.39 2c1p s VAL 169 Ca 0.68 -0.98 -0.23 0.00 0.00 0.00 0.00 61.98 61.45 2c1p s VAL 169 Cb -0.18 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.51 2c1p s VAL 169 CO 0.22 0.54 0.78 -0.22 0.00 0.00 0.00 175.10 176.42 2c1p s LEU 170 N 0.25 4.14 -0.03 3.92 1.98 -1.26 -2.10 118.68 125.58 2c1p s LEU 170 Ca -0.15 0.30 -0.01 0.00 -2.89 0.00 0.00 54.13 51.39 2c1p s LEU 170 Cb -0.17 -3.02 0.03 0.00 0.66 0.00 0.00 46.19 43.69 2c1p s LEU 170 CO 0.07 -0.75 0.03 -1.58 -1.89 0.00 0.00 176.35 172.23 2c1p s GLN 171 N 3.12 0.02 -1.29 1.98 0.74 0.55 -4.88 119.66 119.90 2c1p s GLN 171 Ca 0.31 0.22 -0.00 0.00 0.05 0.00 0.00 55.36 55.94 2c1p s GLN 171 Cb -0.13 -0.38 -0.00 0.00 1.10 0.00 0.00 33.01 33.60 2c1p s GLN 171 CO 0.18 -0.21 0.72 0.43 -0.55 0.00 0.00 175.29 175.85 2c1p n SER 172 N 4.51 -1.30 0.00 6.67 7.64 -1.26 -2.27 113.62 127.61 2c1p n SER 172 Ca -0.20 -0.81 0.00 0.00 1.01 0.00 0.00 58.87 58.87 2c1p n SER 172 Cb 0.50 -4.12 0.00 0.00 -1.01 0.00 0.00 64.21 59.58 2c1p n SER 172 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2c1p n ASP 173 N -3.06 0.00 -4.33 6.43 9.92 -1.26 -4.97 116.55 119.28 2c1p n ASP 173 Ca -0.30 0.00 -0.19 0.00 -0.53 0.00 0.00 54.79 53.77 2c1p n ASP 173 Cb 0.68 -0.59 -0.10 0.00 -0.64 0.00 0.00 41.12 40.47 2c1p n ASP 173 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2c1p s LEU 174 N 0.00 2.52 0.07 0.64 1.43 -0.96 -4.59 118.68 117.79 2c1p s LEU 174 Ca 0.00 -0.97 -0.03 0.00 -1.03 0.00 0.00 54.13 52.10 2c1p s LEU 174 Cb 0.00 -0.69 -0.05 0.00 0.03 0.00 0.00 46.19 45.48 2c1p s LEU 174 CO 0.00 -0.14 0.27 -0.31 0.23 0.00 0.00 176.35 176.40 2c1p s TYR 175 N -2.72 3.52 -0.01 0.29 2.02 0.21 -0.33 117.35 120.33 2c1p s TYR 175 Ca 0.20 0.42 -0.01 0.00 -0.37 0.00 0.00 57.07 57.31 2c1p s TYR 175 Cb -0.02 -1.89 0.01 0.00 -0.40 0.00 0.00 41.96 39.66 2c1p s TYR 175 CO 0.06 0.55 0.03 0.99 -1.57 0.00 0.00 175.55 175.62 2c1p s THR 176 N -1.50 -0.01 0.04 -0.71 2.01 -0.89 -1.46 115.64 113.11 2c1p s THR 176 Ca 0.35 0.05 -0.10 0.00 0.31 0.00 0.00 61.69 62.29 2c1p s THR 176 Cb -0.13 -0.06 0.01 0.00 0.01 0.00 0.00 72.50 72.33 2c1p s THR 176 CO 0.24 0.02 0.22 -0.22 -0.69 0.00 0.00 174.62 174.19 2c1p s LEU 177 N 0.25 1.25 0.26 4.42 0.20 -0.13 -1.77 118.68 123.16 2c1p s LEU 177 Ca -0.02 -0.30 0.03 0.00 0.69 0.00 0.00 54.13 54.53 2c1p s LEU 177 Cb -0.03 1.04 -0.05 0.00 -0.43 0.00 0.00 46.19 46.72 2c1p s LEU 177 CO -0.01 -0.56 0.04 -0.94 -0.29 0.00 0.00 176.35 174.59 2c1p s SER 178 N -2.01 1.82 -0.16 3.68 1.04 -1.26 0.16 113.70 116.96 2c1p s SER 178 Ca -0.06 -1.30 -0.13 0.00 0.48 0.00 0.00 55.95 54.95 2c1p s SER 178 Cb -0.01 0.02 0.05 0.00 0.10 0.00 0.00 66.02 66.17 2c1p s SER 178 CO -0.03 -0.59 0.41 -0.55 0.98 0.00 0.00 173.24 173.46 2c1p s SER 179 N -3.35 -0.46 0.24 7.02 0.15 -0.62 -1.29 113.70 115.39 2c1p s SER 179 Ca 0.33 0.85 0.11 0.00 0.70 0.00 0.00 55.95 57.94 2c1p s SER 179 Cb 0.07 0.82 -0.05 0.00 -1.71 0.00 0.00 66.02 65.16 2c1p s SER 179 CO 0.12 -0.16 -0.16 -0.94 1.20 0.00 0.00 173.24 173.29 2c1p s SER 180 N 0.58 3.80 -0.10 5.45 1.04 0.12 -1.23 113.70 123.35 2c1p s SER 180 Ca -0.03 -0.86 -0.09 0.00 0.48 0.00 0.00 55.95 55.45 2c1p s SER 180 Cb -0.05 -0.44 0.03 0.00 0.10 0.00 0.00 66.02 65.67 2c1p s SER 180 CO -0.04 0.06 0.26 0.54 0.98 0.00 0.00 173.24 175.05 2c1p s VAL 181 N -2.14 -0.00 -0.10 5.02 0.11 -0.46 -1.47 120.40 121.36 2c1p s VAL 181 Ca 0.27 0.01 0.03 0.00 -2.93 0.00 0.00 61.98 59.37 2c1p s VAL 181 Cb -0.07 -0.37 0.00 0.00 -1.53 0.00 0.00 36.38 34.42 2c1p s VAL 181 CO 0.14 0.01 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.82 2c1p s THR 182 N 0.24 1.89 0.07 5.04 2.01 -0.69 -0.77 115.64 123.44 2c1p s THR 182 Ca -0.01 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 61.08 2c1p s THR 182 Cb -0.03 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.79 2c1p s THR 182 CO -0.01 0.52 -0.05 0.68 -0.69 0.00 0.00 174.62 175.08 2c1p s VAL 183 N 0.51 0.45 0.77 3.82 -7.23 -0.56 -4.78 120.40 113.38 2c1p s VAL 183 Ca -0.16 -1.81 -0.13 0.00 -1.81 0.00 0.00 61.98 58.08 2c1p s VAL 183 Cb -0.17 -1.52 0.06 0.00 0.56 0.00 0.00 36.38 35.31 2c1p s VAL 183 CO 0.06 -0.90 1.14 -2.16 -0.31 0.00 0.00 175.10 172.92 2c1p s PRO 184 N -3.71 2.05 0.58 4.82 0.04 -1.26 -0.27 135.00 137.25 2c1p s PRO 184 Ca 0.08 1.46 0.29 0.00 0.04 0.00 0.00 61.00 62.87 2c1p s PRO 184 Cb 0.05 -1.85 1.76 0.00 0.04 0.00 0.00 34.50 34.50 2c1p s PRO 184 CO -0.07 -1.84 2.23 0.66 0.04 0.00 0.00 177.00 178.02 2c1p h SER 185 N -0.84 0.00 0.78 6.66 4.64 -1.62 -1.08 113.55 122.10 2c1p h SER 185 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2c1p h SER 185 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2c1p h SER 185 CO 0.49 0.02 -0.04 -1.54 -0.87 0.00 0.00 176.83 174.89 2c1p n SER 186 N -3.82 0.07 -0.10 4.97 3.41 -1.26 -3.88 113.62 113.00 2c1p n SER 186 Ca -0.03 0.17 -0.21 0.00 -0.26 0.00 0.00 58.87 58.54 2c1p n SER 186 Cb 0.11 -0.35 -0.12 0.00 -0.26 0.00 0.00 64.21 63.58 2c1p n SER 186 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2c1p n THR 187 N -1.39 1.57 -5.11 6.66 -1.04 -0.42 -4.74 114.28 109.80 2c1p n THR 187 Ca 0.10 -0.53 -0.31 0.00 -2.04 0.00 0.00 64.05 61.27 2c1p n THR 187 Cb 0.30 -1.60 -0.15 0.00 -1.82 0.00 0.00 70.33 67.06 2c1p n THR 187 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 2c1p s TRP 188 N -2.52 2.35 -2.09 -1.42 -0.00 -1.16 0.84 118.94 114.94 2c1p s TRP 188 Ca -0.32 -0.41 0.14 0.00 -0.00 0.00 0.00 56.10 55.51 2c1p s TRP 188 Cb 0.09 -1.46 0.48 0.00 -0.00 0.00 0.00 33.47 32.57 2c1p s TRP 188 CO 0.63 0.04 1.36 -0.35 -0.00 0.00 0.00 176.95 178.63 2c1p n PRO 189 N 2.15 1.69 0.13 5.86 -0.04 -1.26 -4.66 135.00 138.87 2c1p n PRO 189 Ca -0.16 -1.05 0.09 0.00 -0.04 0.00 0.00 63.50 62.33 2c1p n PRO 189 Cb 0.51 -1.30 0.58 0.00 -0.04 0.00 0.00 33.50 33.26 2c1p n PRO 189 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2c1p h SER 190 N 1.86 0.15 -4.14 3.54 4.64 -1.84 -3.39 113.55 114.36 2c1p h SER 190 Ca 0.00 -0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.63 2c1p h SER 190 Cb 0.42 -0.04 -0.27 0.00 -0.31 0.00 0.00 62.40 62.21 2c1p h SER 190 CO 0.00 0.10 -0.82 -1.61 -0.87 0.00 0.00 176.83 173.63 2c1p s GLU 191 N -5.20 2.46 0.32 4.77 2.02 0.25 -5.09 118.70 118.23 2c1p s GLU 191 Ca -0.06 -0.79 -0.29 0.00 0.02 0.00 0.00 54.97 53.85 2c1p s GLU 191 Cb 0.18 -2.27 -0.10 0.00 0.10 0.00 0.00 34.13 32.03 2c1p s GLU 191 CO 0.70 0.54 1.37 0.99 0.02 0.00 0.00 175.26 178.88 2c1p s THR 192 N -0.54 2.58 -0.16 3.63 2.01 -1.26 -4.36 115.64 117.54 2c1p s THR 192 Ca 0.07 0.56 0.00 0.00 0.31 0.00 0.00 61.69 62.63 2c1p s THR 192 Cb -0.11 -3.35 0.03 0.00 0.01 0.00 0.00 72.50 69.08 2c1p s THR 192 CO 0.01 0.12 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.28 2c1p s VAL 193 N -0.88 1.36 -0.04 3.82 1.01 -1.26 -5.01 120.40 119.40 2c1p s VAL 193 Ca 0.52 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.86 2c1p s VAL 193 Cb -0.42 -1.40 0.01 0.00 0.00 0.00 0.00 36.38 34.57 2c1p s VAL 193 CO 0.53 0.28 -0.08 -0.89 0.00 0.00 0.00 175.10 174.94 2c1p s THR 194 N 1.55 0.75 0.11 3.92 2.01 -1.26 -0.83 115.64 121.89 2c1p s THR 194 Ca 0.02 -0.29 -0.10 0.00 0.31 0.00 0.00 61.69 61.63 2c1p s THR 194 Cb -0.14 -0.71 -0.06 0.00 0.01 0.00 0.00 72.50 71.60 2c1p s THR 194 CO -0.09 0.26 0.43 0.00 -0.69 0.00 0.00 174.62 174.53 2c1p s ASN 196 N -1.90 3.56 -0.25 0.00 -0.87 0.35 -1.22 114.94 114.61 2c1p s ASN 196 Ca 0.36 -0.94 -0.07 0.00 -1.57 0.00 0.00 52.86 50.64 2c1p s ASN 196 Cb -0.14 -1.36 -0.03 0.00 -0.02 0.00 0.00 41.25 39.71 2c1p s ASN 196 CO 0.19 -0.12 0.07 -0.69 -2.57 0.00 0.00 177.10 173.98 2c1p s VAL 197 N 1.31 4.28 -0.18 1.60 1.01 0.23 -1.70 120.40 126.95 2c1p s VAL 197 Ca -0.01 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.74 2c1p s VAL 197 Cb -0.16 -3.01 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 2c1p s VAL 197 CO -0.09 0.34 -0.04 0.00 0.00 0.00 0.00 175.10 175.32 2c1p s ALA 198 N 1.61 2.94 -0.53 5.51 0.00 0.48 -0.96 121.76 130.81 2c1p s ALA 198 Ca 0.06 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 51.13 2c1p s ALA 198 Cb -0.15 -1.61 0.13 0.00 0.00 0.00 0.00 23.12 21.49 2c1p s ALA 198 CO 0.03 0.00 0.28 -1.58 0.00 0.00 0.00 175.76 174.50 2c1p s HIS 199 N 0.73 3.20 0.19 0.00 2.46 0.11 -0.79 115.29 121.20 2c1p s HIS 199 Ca -0.02 -3.18 -0.22 0.00 0.47 0.00 0.00 55.06 52.11 2c1p s HIS 199 Cb -0.14 -2.80 0.11 0.00 -0.13 0.00 0.00 32.58 29.61 2c1p s HIS 199 CO 0.02 -0.73 1.46 -2.30 -2.47 0.00 0.00 174.74 170.72 2c1p n PRO 200 N 3.02 -0.30 -0.28 2.88 -0.02 -1.26 -1.87 135.00 137.17 2c1p n PRO 200 Ca 0.06 1.44 0.09 0.00 -2.02 0.00 0.00 63.50 63.07 2c1p n PRO 200 Cb 0.32 -2.13 0.23 0.00 -0.02 0.00 0.00 33.50 31.91 2c1p n PRO 200 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2c1p h ALA 201 N 0.97 1.19 -0.53 3.55 0.00 -1.91 0.53 119.26 123.06 2c1p h ALA 201 Ca 0.26 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2c1p h ALA 201 Cb 0.49 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2c1p h ALA 201 CO -0.92 -0.29 0.00 -1.13 0.00 0.00 0.00 179.25 176.92 2c1p n SER 202 N -5.05 2.87 -4.01 0.00 3.41 -0.78 -4.94 113.62 105.12 2c1p n SER 202 Ca 0.18 -2.01 -0.30 0.00 -0.26 0.00 0.00 58.87 56.47 2c1p n SER 202 Cb 0.52 -0.36 -0.00 0.00 -0.26 0.00 0.00 64.21 64.11 2c1p n SER 202 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2c1p n SER 203 N 1.04 -2.95 -4.32 4.04 7.64 0.18 -4.96 113.62 114.29 2c1p n SER 203 Ca 0.18 -0.91 -0.24 0.00 1.01 0.00 0.00 58.87 58.90 2c1p n SER 203 Cb 0.46 -3.34 -0.12 0.00 -1.01 0.00 0.00 64.21 60.20 2c1p n SER 203 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2c1p s THR 204 N -3.48 1.84 -0.25 0.44 -4.23 -1.09 -5.01 115.64 103.86 2c1p s THR 204 Ca 0.48 -1.68 -0.02 0.00 -1.18 0.00 0.00 61.69 59.29 2c1p s THR 204 Cb -0.25 -1.71 0.13 0.00 1.34 0.00 0.00 72.50 72.01 2c1p s THR 204 CO 0.87 -0.10 0.31 -0.75 -0.54 0.00 0.00 174.62 174.41 2c1p s LYS 205 N -2.17 0.30 0.16 3.99 2.36 -1.26 0.09 119.74 123.22 2c1p s LYS 205 Ca 0.10 0.17 0.11 0.00 -2.55 0.00 0.00 55.97 53.81 2c1p s LYS 205 Cb -0.09 -0.74 -0.04 0.00 -1.05 0.00 0.00 37.83 35.91 2c1p s LYS 205 CO 0.05 -0.81 -0.24 0.14 1.55 0.00 0.00 175.35 176.04 2c1p s VAL 206 N 2.42 2.39 0.05 4.02 -7.23 -0.13 -4.95 120.40 116.96 2c1p s VAL 206 Ca 0.10 -1.87 0.05 0.00 -1.81 0.00 0.00 61.98 58.44 2c1p s VAL 206 Cb -0.15 -2.11 -0.04 0.00 0.56 0.00 0.00 36.38 34.65 2c1p s VAL 206 CO -0.22 -0.02 -0.06 -1.81 -0.31 0.00 0.00 175.10 172.68 2c1p s ASP 207 N -2.39 4.66 -0.27 4.85 1.01 -1.26 -0.60 116.67 122.67 2c1p s ASP 207 Ca 0.18 -0.21 -0.04 0.00 0.71 0.00 0.00 52.55 53.19 2c1p s ASP 207 Cb -0.09 -1.04 0.09 0.00 1.01 0.00 0.00 42.92 42.89 2c1p s ASP 207 CO 0.09 0.23 0.11 -0.75 0.21 0.00 0.00 175.17 175.06 2c1p s LYS 208 N -1.81 0.29 0.28 8.23 2.47 -0.36 -4.99 119.74 123.86 2c1p s LYS 208 Ca 0.20 -0.54 -0.29 0.00 -1.56 0.00 0.00 55.97 53.78 2c1p s LYS 208 Cb -0.11 -1.49 -0.10 0.00 -1.46 0.00 0.00 37.83 34.67 2c1p s LYS 208 CO 0.11 -0.92 1.24 0.21 0.16 0.00 0.00 175.35 176.15 2c1p s LYS 209 N 2.01 4.46 -0.55 4.03 2.20 -1.26 -2.49 119.74 128.13 2c1p s LYS 209 Ca 0.07 2.04 -0.20 0.00 -0.36 0.00 0.00 55.97 57.51 2c1p s LYS 209 Cb -0.16 -3.15 0.07 0.00 -1.51 0.00 0.00 37.83 33.08 2c1p s LYS 209 CO -0.28 -0.08 0.73 0.42 -0.36 0.00 0.00 175.35 175.78 2c1p s ILE 210 N -0.79 4.73 0.08 5.43 -1.09 -0.01 -4.91 121.20 124.64 2c1p s ILE 210 Ca 0.50 -0.46 -0.19 0.00 -2.23 0.00 0.00 60.65 58.27 2c1p s ILE 210 Cb -0.36 -4.42 -0.07 0.00 -1.58 0.00 0.00 42.46 36.03 2c1p s ILE 210 CO 0.45 -0.99 0.57 -0.69 -1.23 0.00 0.00 174.94 173.05 2c1p s VAL 211 N 3.00 4.74 0.33 2.92 1.01 -1.26 -4.66 120.40 126.47 2c1p s VAL 211 Ca 0.17 1.20 -0.29 0.00 0.00 0.00 0.00 61.98 63.07 2c1p s VAL 211 Cb -0.19 -3.89 -0.12 0.00 0.00 0.00 0.00 36.38 32.18 2c1p s VAL 211 CO 0.12 0.53 1.40 -2.65 0.00 0.00 0.00 175.10 174.50 2c1p n PRO 212 N 1.65 2.33 -1.52 2.72 -0.02 -1.26 -4.82 135.00 134.08 2c1p n PRO 212 Ca -0.10 0.82 -0.48 0.00 -2.02 0.00 0.00 63.50 61.72 2c1p n PRO 212 Cb 0.51 -2.48 -0.06 0.00 -0.02 0.00 0.00 33.50 31.46 2c1p n PRO 212 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2c1p n ARG 213 N 0.93 1.49 -0.96 -0.52 3.00 -1.26 -4.82 116.66 114.51 2c1p n ARG 213 Ca 0.05 0.43 -0.29 0.00 -0.00 0.00 0.00 57.85 58.04 2c1p n ARG 213 Cb 0.36 -2.73 -0.02 0.00 0.00 0.00 0.00 32.46 30.07 2c1p n ARG 213 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2c1p n ASP 214 N 10.02 6.34 0.00 6.15 8.00 -1.26 -4.77 116.55 141.04 2c1p n ASP 214 Ca 0.35 -2.42 0.00 0.00 0.71 0.00 0.00 54.79 53.43 2c1p n ASP 214 Cb 0.31 -1.27 0.00 0.00 -0.02 0.00 0.00 41.12 40.13 2c1p n ASP 214 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81