#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k3t h ALA -2 N 0.00 0.73 -2.54 4.61 0.00 -1.95 -3.44 119.26 116.67 2k3t h ALA -2 Ca 0.00 -0.55 -0.53 0.00 0.00 0.00 0.00 54.91 53.83 2k3t h ALA -2 Cb 0.00 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.72 2k3t h ALA -2 CO 0.00 0.73 0.57 1.41 0.00 0.00 0.00 179.25 181.95 2k3t s MET -1 N -3.79 4.45 0.89 0.00 0.00 -1.26 -2.93 119.30 116.66 2k3t s MET -1 Ca -0.05 1.81 -0.13 0.00 0.00 0.00 0.00 55.69 57.32 2k3t s MET -1 Cb 0.11 -3.31 0.13 0.00 0.00 0.00 0.00 34.83 31.76 2k3t s MET -1 CO 0.82 -0.21 1.19 0.20 0.00 0.00 0.00 175.02 177.02 2k3t s GLY 2427N 0.79 1.62 -0.05 2.11 0.00 -0.17 -4.90 107.32 106.71 2k3t s GLY 2427Ca 0.57 -0.71 0.05 0.00 0.00 0.00 0.00 44.72 44.63 2k3t s GLY 2427CO 0.31 -0.13 -0.21 0.99 0.00 0.00 0.00 173.10 174.06 2k3t s ASP 2428N -4.41 3.44 0.57 1.64 1.01 -1.26 -4.91 116.67 112.76 2k3t s ASP 2428Ca 0.65 -0.39 0.28 0.00 0.71 0.00 0.00 52.55 53.80 2k3t s ASP 2428Cb -0.11 -0.82 1.53 0.00 1.01 0.00 0.00 42.92 44.54 2k3t s ASP 2428CO 0.52 0.28 2.01 -0.65 0.21 0.00 0.00 175.17 177.54 2k3t h PRO 2429N 5.80 0.00 0.00 8.23 0.11 -1.90 -0.42 132.00 143.82 2k3t h PRO 2429Ca -0.38 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.67 2k3t h PRO 2429Cb 1.16 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2k3t h PRO 2429CO 0.49 0.00 -0.29 0.78 -0.21 0.00 0.00 178.00 178.77 2k3t h GLY 2430N 0.00 0.00 0.82 -0.55 0.00 -1.96 -2.88 103.07 98.50 2k3t h GLY 2430Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.18 2k3t h GLY 2430CO -0.00 0.00 -1.83 1.04 0.00 0.00 0.00 176.54 175.75 2k3t n LEU 2431N -3.20 1.20 -4.74 3.11 7.99 -0.45 -4.82 117.00 116.10 2k3t n LEU 2431Ca 0.02 0.34 -0.41 0.00 -0.01 0.00 0.00 56.01 55.95 2k3t n LEU 2431Cb 0.63 -0.08 -0.02 0.00 -0.11 0.00 0.00 43.42 43.83 2k3t n LEU 2431CO 0.37 0.50 1.13 -0.69 -1.51 0.00 0.00 177.39 177.19 2k3t s VAL 2432N -2.58 2.61 0.00 4.08 1.01 -0.29 -4.36 120.40 120.86 2k3t s VAL 2432Ca -0.09 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.39 2k3t s VAL 2432Cb 0.08 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 33.14 2k3t s VAL 2432CO 0.81 0.07 0.00 -0.24 0.00 0.00 0.00 175.10 175.74 2k3t n SER 2433N 2.55 1.27 -3.71 3.32 2.88 -0.64 -3.90 113.62 115.40 2k3t n SER 2433Ca 0.08 -0.79 -0.13 0.00 -1.33 0.00 0.00 58.87 56.70 2k3t n SER 2433Cb 0.40 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.76 2k3t n SER 2433CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k3t s ALA 2434N -2.00 -1.18 -0.07 -1.46 0.00 -1.26 -0.64 121.76 115.15 2k3t s ALA 2434Ca 0.00 1.37 -0.09 0.00 0.00 0.00 0.00 51.96 53.24 2k3t s ALA 2434Cb 0.00 -0.80 0.02 0.00 0.00 0.00 0.00 23.12 22.34 2k3t s ALA 2434CO 0.00 -0.23 0.23 0.71 0.00 0.00 0.00 175.76 176.47 2k3t s TYR 2435N 0.33 -0.22 0.00 0.00 2.02 -0.52 -4.94 117.35 114.02 2k3t s TYR 2435Ca -0.01 0.51 0.00 0.00 -0.37 0.00 0.00 57.07 57.21 2k3t s TYR 2435Cb -0.04 0.07 0.00 0.00 -0.40 0.00 0.00 41.96 41.60 2k3t s TYR 2435CO -0.00 -0.16 0.00 0.41 -1.57 0.00 0.00 175.55 174.22 2k3t n GLY 2436N 2.65 3.34 0.24 0.71 0.00 -1.26 -0.58 105.19 110.29 2k3t n GLY 2436Ca -0.15 -1.89 0.08 0.00 0.00 0.00 0.00 46.02 44.06 2k3t n GLY 2436CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t h ALA 2437N 0.00 1.59 0.00 4.61 0.00 -1.90 -3.02 119.26 120.54 2k3t h ALA 2437Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2k3t h ALA 2437Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2k3t h ALA 2437CO 0.00 0.19 0.00 0.78 0.00 0.00 0.00 179.25 180.22 2k3t h GLY 2438N 0.57 0.00 2.00 0.00 0.00 -1.23 -0.75 103.07 103.65 2k3t h GLY 2438Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 2k3t h GLY 2438CO 0.02 0.00 -0.42 1.41 0.00 0.00 0.00 176.54 177.55 2k3t h LEU 2439N 0.00 0.00 0.00 3.11 3.38 -1.80 -3.22 115.31 116.78 2k3t h LEU 2439Ca 0.00 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.77 2k3t h LEU 2439Cb 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2k3t h LEU 2439CO 0.00 0.42 -1.50 -0.62 0.09 0.00 0.00 178.44 176.83 2k3t n GLU 2440N -3.98 0.62 0.00 1.13 -0.58 -0.32 -3.67 120.64 113.85 2k3t n GLU 2440Ca -0.02 0.24 0.00 0.00 -0.42 0.00 0.00 57.16 56.97 2k3t n GLU 2440Cb 0.45 -1.80 0.00 0.00 -0.57 0.00 0.00 31.44 29.52 2k3t n GLU 2440CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k3t n GLY 2441N 1.44 0.54 0.00 0.62 0.00 -1.05 -1.07 105.19 105.67 2k3t n GLY 2441Ca -0.12 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2k3t n GLY 2441CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2442N 0.00 -0.52 3.78 -0.02 0.00 -1.02 -4.56 105.19 102.84 2k3t n GLY 2442Ca 0.00 -1.04 -0.39 0.00 0.00 0.00 0.00 46.02 44.59 2k3t n GLY 2442CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k3t s VAL 2443N -3.00 4.33 0.19 1.61 1.01 -1.26 -2.91 120.40 120.38 2k3t s VAL 2443Ca 0.00 1.71 -0.33 0.00 0.00 0.00 0.00 61.98 63.36 2k3t s VAL 2443Cb 0.00 -4.10 -0.13 0.00 0.00 0.00 0.00 36.38 32.15 2k3t s VAL 2443CO 0.00 0.40 1.56 0.35 0.00 0.00 0.00 175.10 177.41 2k3t n THR 2444N 1.26 0.28 0.00 3.92 -2.24 -0.67 -2.50 114.28 114.33 2k3t n THR 2444Ca -0.03 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2k3t n THR 2444Cb 0.49 -1.61 0.00 0.00 -2.10 0.00 0.00 70.33 67.11 2k3t n THR 2444CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k3t n GLY 2445N 3.11 2.61 3.87 3.38 0.00 -0.18 -4.90 105.19 113.09 2k3t n GLY 2445Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 2k3t n GLY 2445CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2k3t s ASN 2446N -3.46 6.65 0.37 1.61 0.01 -1.04 -4.98 114.94 114.10 2k3t s ASN 2446Ca 0.00 0.88 -0.26 0.00 -0.71 0.00 0.00 52.86 52.78 2k3t s ASN 2446Cb 0.00 -2.21 -0.09 0.00 0.41 0.00 0.00 41.25 39.36 2k3t s ASN 2446CO 0.00 0.03 1.14 -2.16 -1.51 0.00 0.00 177.10 174.60 2k3t s PRO 2447N -2.43 4.19 0.03 -0.60 0.04 -1.26 -4.39 135.00 130.59 2k3t s PRO 2447Ca 0.42 1.80 0.07 0.00 0.04 0.00 0.00 61.00 63.32 2k3t s PRO 2447Cb -0.13 -2.76 -0.02 0.00 0.04 0.00 0.00 34.50 31.63 2k3t s PRO 2447CO 0.21 -0.19 -0.21 0.00 0.04 0.00 0.00 177.00 176.85 2k3t s ALA 2448N -1.40 1.76 0.01 8.56 0.00 0.08 -4.98 121.76 125.79 2k3t s ALA 2448Ca 0.55 -1.03 -0.21 0.00 0.00 0.00 0.00 51.96 51.26 2k3t s ALA 2448Cb -0.30 -0.36 0.04 0.00 0.00 0.00 0.00 23.12 22.50 2k3t s ALA 2448CO 0.38 0.40 0.47 -1.83 0.00 0.00 0.00 175.76 175.18 2k3t s GLU 2449N -1.04 0.91 0.22 0.00 -1.05 -1.26 -1.22 118.70 115.25 2k3t s GLU 2449Ca 0.08 -0.15 -0.23 0.00 -0.15 0.00 0.00 54.97 54.52 2k3t s GLU 2449Cb -0.09 0.41 0.04 0.00 -0.44 0.00 0.00 34.13 34.06 2k3t s GLU 2449CO 0.01 -0.30 0.74 -0.59 0.95 0.00 0.00 175.26 176.08 2k3t s PHE 2450N -1.88 -0.27 -0.15 4.83 -0.71 -0.82 -0.83 117.98 118.15 2k3t s PHE 2450Ca -0.09 -0.09 -0.02 0.00 -1.04 0.00 0.00 56.93 55.69 2k3t s PHE 2450Cb -0.02 0.65 -0.02 0.00 -1.21 0.00 0.00 43.02 42.43 2k3t s PHE 2450CO 0.02 -1.05 -0.09 0.08 -1.34 0.00 0.00 175.22 172.84 2k3t s VAL 2451N -3.74 3.34 -0.55 -2.49 1.01 0.26 -0.81 120.40 117.42 2k3t s VAL 2451Ca 0.09 -0.55 -0.28 0.00 0.00 0.00 0.00 61.98 61.23 2k3t s VAL 2451Cb -0.04 -2.44 0.02 0.00 0.00 0.00 0.00 36.38 33.92 2k3t s VAL 2451CO 0.01 0.50 1.33 -0.69 0.00 0.00 0.00 175.10 176.25 2k3t s VAL 2452N 0.49 3.89 -0.56 2.92 1.01 0.56 -1.44 120.40 127.28 2k3t s VAL 2452Ca -0.07 0.79 -0.26 0.00 0.00 0.00 0.00 61.98 62.45 2k3t s VAL 2452Cb -0.15 -4.52 0.04 0.00 0.00 0.00 0.00 36.38 31.75 2k3t s VAL 2452CO 0.04 -1.18 1.05 0.21 0.00 0.00 0.00 175.10 175.22 2k3t s ASN 2453N 3.82 6.40 0.00 3.32 3.84 0.19 -1.58 114.94 130.94 2k3t s ASN 2453Ca 0.50 -0.11 0.22 0.00 0.21 0.00 0.00 52.86 53.68 2k3t s ASN 2453Cb -0.10 -2.49 0.02 0.00 -0.55 0.00 0.00 41.25 38.13 2k3t s ASN 2453CO 0.26 -1.32 1.08 0.35 -2.79 0.00 0.00 177.10 174.68 2k3t n THR 2454N 6.42 0.00 0.09 -5.21 -2.24 -1.25 -1.62 114.28 110.48 2k3t n THR 2454Ca 0.05 -0.08 0.10 0.00 -2.27 0.00 0.00 64.05 61.85 2k3t n THR 2454Cb 0.48 0.91 0.57 0.00 -2.10 0.00 0.00 70.33 70.19 2k3t n THR 2454CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2k3t h SER 2455N 0.74 0.19 1.25 3.42 0.87 -1.83 0.18 113.55 118.37 2k3t h SER 2455Ca 0.00 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2k3t h SER 2455Cb 0.57 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.49 2k3t h SER 2455CO 0.00 0.13 0.00 0.59 -0.53 0.00 0.00 176.83 177.02 2k3t n ASN 2456N -4.49 0.79 -0.07 6.23 3.02 -1.26 -4.24 115.26 115.24 2k3t n ASN 2456Ca 0.03 0.61 -0.09 0.00 -0.03 0.00 0.00 54.58 55.09 2k3t n ASN 2456Cb 0.21 -0.81 -0.07 0.00 -0.61 0.00 0.00 39.78 38.51 2k3t n ASN 2456CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k3t n ALA 2457N -1.79 1.70 0.00 5.41 0.00 -0.10 -4.85 120.51 120.88 2k3t n ALA 2457Ca 0.04 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.86 2k3t n ALA 2457Cb 0.37 0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.97 2k3t n ALA 2457CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k3t n GLY 2458N 2.77 0.21 3.91 0.00 0.00 -0.32 -4.07 105.19 107.68 2k3t n GLY 2458Ca -0.25 -1.94 -0.29 0.00 0.00 0.00 0.00 46.02 43.55 2k3t n GLY 2458CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t s ALA 2459N -2.00 3.63 0.00 4.61 0.00 -1.15 -4.65 121.76 122.20 2k3t s ALA 2459Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.39 2k3t s ALA 2459Cb 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 23.12 20.83 2k3t s ALA 2459CO 0.00 0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.41 2k3t n GLY 2460N -0.94 2.08 3.74 0.00 0.00 -1.26 -1.00 105.19 107.81 2k3t n GLY 2460Ca -0.02 -0.89 -0.41 0.00 0.00 0.00 0.00 46.02 44.71 2k3t n GLY 2460CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t s ALA 2461N -2.00 3.29 -0.04 4.61 0.00 -1.26 -4.93 121.76 121.44 2k3t s ALA 2461Ca 0.00 0.60 0.02 0.00 0.00 0.00 0.00 51.96 52.58 2k3t s ALA 2461Cb 0.00 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 19.85 2k3t s ALA 2461CO 0.00 0.09 -0.07 -1.17 0.00 0.00 0.00 175.76 174.61 2k3t s LEU 2462N -0.59 3.15 -0.26 0.00 2.96 -1.26 -1.20 118.68 121.48 2k3t s LEU 2462Ca 0.44 -0.08 0.16 0.00 -0.22 0.00 0.00 54.13 54.43 2k3t s LEU 2462Cb -0.25 -1.74 0.48 0.00 0.50 0.00 0.00 46.19 45.19 2k3t s LEU 2462CO 0.31 0.33 1.15 -0.24 -1.32 0.00 0.00 176.35 176.58 2k3t n SER 2463N 1.95 3.02 -4.77 3.68 2.88 0.43 -5.00 113.62 115.81 2k3t n SER 2463Ca -0.17 -2.87 -0.40 0.00 -1.33 0.00 0.00 58.87 54.10 2k3t n SER 2463Cb 0.53 -0.41 -0.01 0.00 -0.75 0.00 0.00 64.21 63.56 2k3t n SER 2463CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2k3t s VAL 2464N -3.93 2.60 0.22 2.46 0.11 -1.25 -4.19 120.40 116.42 2k3t s VAL 2464Ca 0.38 0.58 -0.16 0.00 -2.93 0.00 0.00 61.98 59.86 2k3t s VAL 2464Cb 0.37 -3.36 0.01 0.00 -1.53 0.00 0.00 36.38 31.87 2k3t s VAL 2464CO -0.01 0.12 0.52 0.28 -3.33 0.00 0.00 175.10 172.68 2k3t s THR 2465N -1.18 0.02 -0.04 5.04 -1.32 -0.50 -4.99 115.64 112.67 2k3t s THR 2465Ca 0.52 -1.06 0.01 0.00 -1.21 0.00 0.00 61.69 59.95 2k3t s THR 2465Cb -0.40 -1.86 0.02 0.00 -1.51 0.00 0.00 72.50 68.75 2k3t s THR 2465CO 0.53 -0.08 -0.04 -0.63 -2.21 0.00 0.00 174.62 172.19 2k3t s ILE 2466N -3.93 0.47 -0.04 5.08 1.01 -1.26 -0.67 121.20 121.85 2k3t s ILE 2466Ca 0.14 -0.11 0.06 0.00 0.00 0.00 0.00 60.65 60.74 2k3t s ILE 2466Cb -0.01 -0.50 -0.01 0.00 0.01 0.00 0.00 42.46 41.95 2k3t s ILE 2466CO 0.03 0.20 -0.22 -0.62 0.00 0.00 0.00 174.94 174.32 2k3t s ASP 2467N 0.79 2.72 0.00 3.58 2.15 -0.49 -4.88 116.67 120.54 2k3t s ASP 2467Ca -0.10 -0.44 0.00 0.00 0.43 0.00 0.00 52.55 52.44 2k3t s ASP 2467Cb -0.13 -0.60 0.00 0.00 -0.30 0.00 0.00 42.92 41.89 2k3t s ASP 2467CO -0.00 0.24 0.00 0.61 -0.17 0.00 0.00 175.17 175.85 2k3t n GLY 2468N 2.85 -0.74 0.00 2.66 0.00 -1.26 -0.58 105.19 108.11 2k3t n GLY 2468Ca -0.17 -0.83 0.09 0.00 0.00 0.00 0.00 46.02 45.12 2k3t n GLY 2468CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k3t n PRO 2469N 0.00 0.64 -3.74 1.61 -0.04 -1.26 -4.72 135.00 127.49 2k3t n PRO 2469Ca 0.00 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.34 2k3t n PRO 2469Cb 0.00 -1.44 -0.07 0.00 -0.04 0.00 0.00 33.50 31.95 2k3t n PRO 2469CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2k3t s SER 2470N -1.92 -0.17 -1.18 3.54 1.04 -1.26 -4.81 113.70 108.93 2k3t s SER 2470Ca 0.27 -0.10 -0.19 0.00 0.48 0.00 0.00 55.95 56.41 2k3t s SER 2470Cb 0.12 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.58 2k3t s SER 2470CO 0.21 -0.59 1.97 0.29 0.98 0.00 0.00 173.24 176.09 2k3t n LYS 2471N 0.69 2.33 -1.66 4.02 5.02 -1.26 -4.96 118.16 122.34 2k3t n LYS 2471Ca -0.19 -2.54 -0.41 0.00 -2.02 0.00 0.00 58.31 53.15 2k3t n LYS 2471Cb 0.59 -3.33 0.01 0.00 -0.02 0.00 0.00 35.03 32.28 2k3t n LYS 2471CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2k3t n VAL 2472N 6.20 2.53 -2.02 -0.18 0.24 -1.26 -4.90 118.33 118.93 2k3t n VAL 2472Ca 0.49 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.34 61.87 2k3t n VAL 2472Cb 0.43 -1.36 0.00 0.00 -1.47 0.00 0.00 33.84 31.44 2k3t n VAL 2472CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2k3t n LYS 2473N 0.08 3.16 -2.70 7.34 4.81 -1.26 -4.95 118.16 124.65 2k3t n LYS 2473Ca 0.08 -3.00 -0.42 0.00 -0.87 0.00 0.00 58.31 54.10 2k3t n LYS 2473Cb 0.39 -3.16 -0.03 0.00 0.02 0.00 0.00 35.03 32.25 2k3t n LYS 2473CO 0.00 0.00 0.00 1.41 1.17 0.00 0.00 177.40 179.98 2k3t s MET 2474N 2.19 4.54 -0.11 1.64 1.75 -1.26 -4.12 119.30 123.92 2k3t s MET 2474Ca 0.45 1.43 0.02 0.00 -1.25 0.00 0.00 55.69 56.34 2k3t s MET 2474Cb 0.11 -3.46 0.01 0.00 2.84 0.00 0.00 34.83 34.33 2k3t s MET 2474CO -0.04 -0.08 -0.18 0.34 -0.65 0.00 0.00 175.02 174.41 2k3t s ASP 2475N 1.02 2.66 -0.11 1.11 2.15 -0.07 -5.00 116.67 118.43 2k3t s ASP 2475Ca 0.52 -0.48 -0.06 0.00 0.43 0.00 0.00 52.55 52.96 2k3t s ASP 2475Cb -0.21 -1.21 -0.04 0.00 -0.30 0.00 0.00 42.92 41.16 2k3t s ASP 2475CO 0.27 0.05 0.10 0.00 -0.17 0.00 0.00 175.17 175.43 2k3t s GLN 2477N -0.97 0.22 0.04 0.00 -0.21 0.05 -5.01 119.66 113.78 2k3t s GLN 2477Ca 0.14 -0.25 -0.21 0.00 0.02 0.00 0.00 55.36 55.06 2k3t s GLN 2477Cb -0.12 0.09 -0.06 0.00 1.00 0.00 0.00 33.01 33.92 2k3t s GLN 2477CO 0.03 -0.04 0.62 -2.00 -2.12 0.00 0.00 175.29 171.79 2k3t s GLU 2478N -0.74 4.32 0.25 2.91 2.12 -1.26 -0.60 118.70 125.69 2k3t s GLU 2478Ca -0.08 0.81 -0.06 0.00 0.36 0.00 0.00 54.97 55.99 2k3t s GLU 2478Cb -0.05 -3.31 -0.02 0.00 0.26 0.00 0.00 34.13 31.01 2k3t s GLU 2478CO -0.00 0.46 0.34 0.00 -0.54 0.00 0.00 175.26 175.52 2k3t h PRO 2480N 2.37 0.00 0.00 0.00 0.11 -2.03 -2.30 132.00 130.14 2k3t h PRO 2480Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2k3t h PRO 2480Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2k3t h PRO 2480CO 0.42 0.00 -0.27 -1.91 -0.21 0.00 0.00 178.00 176.04 2k3t n GLU 2481N -4.26 0.24 0.00 1.05 4.07 -1.26 -4.89 120.64 115.59 2k3t n GLU 2481Ca -0.01 0.14 0.00 0.00 -0.06 0.00 0.00 57.16 57.23 2k3t n GLU 2481Cb 0.18 -1.72 0.00 0.00 -0.06 0.00 0.00 31.44 29.84 2k3t n GLU 2481CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2k3t n GLY 2482N 1.35 0.49 3.50 8.31 0.00 -0.87 -3.76 105.19 114.21 2k3t n GLY 2482Ca 0.05 -1.52 -0.43 0.00 0.00 0.00 0.00 46.02 44.12 2k3t n GLY 2482CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k3t s TYR 2483N -3.22 3.06 0.30 1.61 2.02 -0.61 -1.02 117.35 119.49 2k3t s TYR 2483Ca 0.00 -0.21 -0.29 0.00 -0.37 0.00 0.00 57.07 56.21 2k3t s TYR 2483Cb 0.00 -3.36 -0.09 0.00 -0.40 0.00 0.00 41.96 38.11 2k3t s TYR 2483CO 0.00 -0.91 1.09 0.50 -1.57 0.00 0.00 175.55 174.67 2k3t s ARG 2484N 2.73 4.56 0.00 -0.62 3.52 0.23 -0.32 118.95 129.06 2k3t s ARG 2484Ca 0.20 1.76 0.06 0.00 -0.13 0.00 0.00 55.73 57.62 2k3t s ARG 2484Cb -0.16 -3.09 -0.02 0.00 -1.56 0.00 0.00 34.95 30.13 2k3t s ARG 2484CO 0.17 0.15 -0.18 0.14 -0.81 0.00 0.00 175.30 174.77 2k3t s VAL 2485N -1.24 1.45 -0.03 7.11 -7.23 0.01 -0.77 120.40 119.71 2k3t s VAL 2485Ca 0.47 -0.89 0.02 0.00 -1.81 0.00 0.00 61.98 59.77 2k3t s VAL 2485Cb -0.30 -1.23 0.00 0.00 0.56 0.00 0.00 36.38 35.41 2k3t s VAL 2485CO 0.39 0.32 -0.09 -0.89 -0.31 0.00 0.00 175.10 174.52 2k3t s THR 2486N -0.55 0.75 0.10 5.32 2.01 -0.73 -1.95 115.64 120.59 2k3t s THR 2486Ca 0.07 -0.34 -0.12 0.00 0.31 0.00 0.00 61.69 61.60 2k3t s THR 2486Cb -0.07 -0.67 0.01 0.00 0.01 0.00 0.00 72.50 71.78 2k3t s THR 2486CO 0.00 0.24 0.28 -0.72 -0.69 0.00 0.00 174.62 173.73 2k3t s TYR 2487N 0.20 -0.00 -0.22 4.92 1.13 -0.36 -0.89 117.35 122.13 2k3t s TYR 2487Ca -0.03 -0.38 0.02 0.00 -1.41 0.00 0.00 57.07 55.27 2k3t s TYR 2487Cb -0.08 0.08 0.05 0.00 -1.10 0.00 0.00 41.96 40.90 2k3t s TYR 2487CO 0.00 -0.61 -0.12 0.99 -2.51 0.00 0.00 175.55 173.31 2k3t s THR 2488N -3.82 1.88 0.07 -3.49 2.01 -1.26 -0.75 115.64 110.28 2k3t s THR 2488Ca 0.04 -1.21 -0.26 0.00 0.31 0.00 0.00 61.69 60.57 2k3t s THR 2488Cb 0.04 -1.93 -0.06 0.00 0.01 0.00 0.00 72.50 70.56 2k3t s THR 2488CO -0.11 0.15 0.81 -2.16 -0.69 0.00 0.00 174.62 172.62 2k3t s PRO 2489N 1.28 4.54 -0.02 4.92 0.04 -1.26 -3.98 135.00 140.53 2k3t s PRO 2489Ca -0.03 1.15 0.20 0.00 0.04 0.00 0.00 61.00 62.36 2k3t s PRO 2489Cb -0.17 -3.36 -0.29 0.00 0.04 0.00 0.00 34.50 30.72 2k3t s PRO 2489CO -0.08 0.29 0.51 0.00 0.04 0.00 0.00 177.00 177.76 2k3t n MET 2490N 2.73 0.60 -4.44 4.56 0.00 -1.26 -1.01 117.12 118.31 2k3t n MET 2490Ca -0.02 -0.15 -0.31 0.00 0.00 0.00 0.00 57.70 57.23 2k3t n MET 2490Cb 0.50 -1.46 -0.11 0.00 0.00 0.00 0.00 33.22 32.15 2k3t n MET 2490CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2k3t s ALA 2491N -3.28 2.88 0.67 3.17 0.00 -1.26 -4.28 121.76 119.66 2k3t s ALA 2491Ca -0.04 -1.14 -0.14 0.00 0.00 0.00 0.00 51.96 50.64 2k3t s ALA 2491Cb 0.13 -0.95 0.00 0.00 0.00 0.00 0.00 23.12 22.30 2k3t s ALA 2491CO 0.83 0.61 1.08 -1.25 0.00 0.00 0.00 175.76 177.03 2k3t s PRO 2492N -1.68 2.89 0.00 0.00 0.04 -1.26 -4.79 135.00 130.20 2k3t s PRO 2492Ca 0.18 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.44 2k3t s PRO 2492Cb -0.11 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2k3t s PRO 2492CO 0.09 -1.16 0.00 0.41 0.04 0.00 0.00 177.00 176.38 2k3t n GLY 2493N -1.04 0.42 3.10 0.56 0.00 -0.47 -4.88 105.19 102.88 2k3t n GLY 2493Ca 0.09 -1.80 -0.22 0.00 0.00 0.00 0.00 46.02 44.09 2k3t n GLY 2493CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k3t s SER 2494N -4.00 1.57 -0.15 1.61 0.01 -1.26 -0.51 113.70 110.98 2k3t s SER 2494Ca 0.00 -0.26 -0.00 0.00 1.31 0.00 0.00 55.95 57.00 2k3t s SER 2494Cb 0.00 -0.17 -0.01 0.00 0.21 0.00 0.00 66.02 66.05 2k3t s SER 2494CO 0.00 0.15 -0.13 -0.31 0.41 0.00 0.00 173.24 173.36 2k3t s TYR 2495N -0.36 2.81 -0.30 2.43 1.51 -0.09 -4.38 117.35 118.97 2k3t s TYR 2495Ca 0.05 -0.81 -0.22 0.00 -1.01 0.00 0.00 57.07 55.08 2k3t s TYR 2495Cb -0.05 -1.88 -0.01 0.00 -0.11 0.00 0.00 41.96 39.91 2k3t s TYR 2495CO -0.00 -0.34 0.70 -0.51 -1.11 0.00 0.00 175.55 174.29 2k3t s LEU 2496N 0.61 4.12 -0.54 -1.29 1.02 0.26 -0.71 118.68 122.15 2k3t s LEU 2496Ca -0.08 0.56 -0.20 0.00 0.02 0.00 0.00 54.13 54.43 2k3t s LEU 2496Cb -0.16 -2.93 0.07 0.00 0.02 0.00 0.00 46.19 43.19 2k3t s LEU 2496CO 0.03 -0.52 0.68 -0.63 0.02 0.00 0.00 176.35 175.93 2k3t s ILE 2497N 2.74 4.80 -0.60 -0.59 1.01 0.02 -1.40 121.20 127.18 2k3t s ILE 2497Ca 0.28 -0.55 -0.21 0.00 0.00 0.00 0.00 60.65 60.18 2k3t s ILE 2497Cb -0.15 -4.38 0.08 0.00 0.01 0.00 0.00 42.46 38.02 2k3t s ILE 2497CO 0.12 -0.94 0.82 -0.44 0.00 0.00 0.00 174.94 174.50 2k3t s SER 2498N 2.97 6.20 -0.79 3.58 0.01 0.15 -1.54 113.70 124.27 2k3t s SER 2498Ca 0.16 -1.10 -0.16 0.00 1.31 0.00 0.00 55.95 56.16 2k3t s SER 2498Cb -0.20 -2.36 0.18 0.00 0.21 0.00 0.00 66.02 63.86 2k3t s SER 2498CO 0.11 -1.23 0.80 -0.63 0.41 0.00 0.00 173.24 172.70 2k3t s ILE 2499N 3.34 5.34 -0.11 1.44 1.01 -1.26 -1.41 121.20 129.54 2k3t s ILE 2499Ca 0.18 -2.07 -0.05 0.00 0.00 0.00 0.00 60.65 58.70 2k3t s ILE 2499Cb -0.20 -4.51 -0.04 0.00 0.01 0.00 0.00 42.46 37.72 2k3t s ILE 2499CO 0.10 -1.11 0.09 -0.54 0.00 0.00 0.00 174.94 173.48 2k3t s LYS 2500N 1.00 3.30 -0.02 2.79 1.02 -1.26 -1.09 119.74 125.48 2k3t s LYS 2500Ca 0.18 -0.23 -0.08 0.00 0.02 0.00 0.00 55.97 55.86 2k3t s LYS 2500Cb -0.13 -3.05 0.01 0.00 -0.52 0.00 0.00 37.83 34.14 2k3t s LYS 2500CO -0.06 0.74 0.17 -0.47 -0.92 0.00 0.00 175.35 174.80 2k3t s TYR 2501N -0.93 -0.04 -1.65 3.18 5.04 -0.62 -0.42 117.35 121.90 2k3t s TYR 2501Ca 0.14 0.06 0.00 0.00 -2.44 0.00 0.00 57.07 54.83 2k3t s TYR 2501Cb -0.12 -0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.19 2k3t s TYR 2501CO 0.03 -0.25 0.00 0.41 -1.34 0.00 0.00 175.55 174.40 2k3t n GLY 2502N 1.82 1.36 0.00 8.97 0.00 -0.34 -4.22 105.19 112.77 2k3t n GLY 2502Ca -0.20 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.56 2k3t n GLY 2502CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2503N -1.02 0.62 0.80 -0.02 0.00 -1.26 -4.91 105.19 99.39 2k3t n GLY 2503Ca -0.16 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.70 2k3t n GLY 2503CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k3t n PRO 2504N 0.00 1.57 -4.18 1.61 -0.04 -1.26 -4.81 135.00 127.89 2k3t n PRO 2504Ca 0.00 -0.51 -0.34 0.00 -0.04 0.00 0.00 63.50 62.61 2k3t n PRO 2504Cb 0.00 -1.56 -0.11 0.00 -0.04 0.00 0.00 33.50 31.79 2k3t n PRO 2504CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2k3t s TYR 2505N -1.18 3.16 0.36 0.54 2.02 -1.26 -4.92 117.35 116.08 2k3t s TYR 2505Ca 0.09 -0.06 -0.28 0.00 -0.37 0.00 0.00 57.07 56.44 2k3t s TYR 2505Cb 0.07 -2.02 -0.11 0.00 -0.40 0.00 0.00 41.96 39.51 2k3t s TYR 2505CO 0.02 0.10 1.43 -1.01 -1.57 0.00 0.00 175.55 174.53 2k3t s HIS 2506N 0.29 2.72 0.30 2.71 3.76 -1.26 -1.59 115.29 122.22 2k3t s HIS 2506Ca 0.01 1.24 -0.12 0.00 -0.15 0.00 0.00 55.06 56.04 2k3t s HIS 2506Cb -0.13 -3.92 -0.08 0.00 1.11 0.00 0.00 32.58 29.56 2k3t s HIS 2506CO 0.01 -2.66 0.67 0.96 -0.85 0.00 0.00 174.74 172.87 2k3t s ILE 2507N -1.13 4.79 0.00 0.60 -5.25 -0.25 -4.83 121.20 115.13 2k3t s ILE 2507Ca 0.52 0.71 0.00 0.00 -0.99 0.00 0.00 60.65 60.89 2k3t s ILE 2507Cb -0.44 -3.63 0.00 0.00 2.95 0.00 0.00 42.46 41.34 2k3t s ILE 2507CO 0.60 -0.19 0.00 0.61 -1.79 0.00 0.00 174.94 174.17 2k3t n GLY 2508N -0.42 2.64 1.45 6.27 0.00 -1.09 -0.94 105.19 113.11 2k3t n GLY 2508Ca 0.02 0.34 0.10 0.00 0.00 0.00 0.00 46.02 46.48 2k3t n GLY 2508CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2509N 0.00 2.46 3.76 -0.02 0.00 -1.26 -5.03 105.19 105.10 2k3t n GLY 2509Ca 0.00 -0.79 -0.38 0.00 0.00 0.00 0.00 46.02 44.85 2k3t n GLY 2509CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k3t s SER 2510N -0.91 5.88 0.30 1.61 0.15 -0.11 -4.27 113.70 116.34 2k3t s SER 2510Ca 0.48 2.57 -0.29 0.00 0.70 0.00 0.00 55.95 59.41 2k3t s SER 2510Cb 0.29 -2.62 -0.09 0.00 -1.71 0.00 0.00 66.02 61.88 2k3t s SER 2510CO 0.26 -1.14 1.08 -2.16 1.20 0.00 0.00 173.24 172.49 2k3t s PRO 2511N -2.65 4.57 -0.20 5.44 0.04 -1.26 -4.80 135.00 136.13 2k3t s PRO 2511Ca 0.65 1.74 -0.16 0.00 0.04 0.00 0.00 61.00 63.27 2k3t s PRO 2511Cb -0.35 -3.08 -0.04 0.00 0.04 0.00 0.00 34.50 31.06 2k3t s PRO 2511CO 0.43 0.17 0.40 -0.06 0.04 0.00 0.00 177.00 177.97 2k3t s PHE 2512N -1.24 3.38 -0.57 0.56 0.08 -0.59 -4.86 117.98 114.73 2k3t s PHE 2512Ca 0.47 0.62 -0.25 0.00 0.12 0.00 0.00 56.93 57.89 2k3t s PHE 2512Cb -0.30 -2.52 0.04 0.00 -0.57 0.00 0.00 43.02 39.67 2k3t s PHE 2512CO 0.38 -0.00 0.99 -1.59 -0.10 0.00 0.00 175.22 174.90 2k3t s LYS 2513N 1.28 3.33 -0.25 0.44 -2.85 -1.26 -0.80 119.74 119.63 2k3t s LYS 2513Ca 0.19 -0.26 -0.22 0.00 -1.00 0.00 0.00 55.97 54.68 2k3t s LYS 2513Cb -0.15 -4.07 -0.01 0.00 -2.06 0.00 0.00 37.83 31.54 2k3t s LYS 2513CO 0.08 -1.57 0.70 0.00 0.10 0.00 0.00 175.35 174.66 2k3t s ALA 2514N 4.15 3.63 -0.10 0.59 0.00 0.12 -4.71 121.76 125.43 2k3t s ALA 2514Ca 0.31 -0.32 -0.15 0.00 0.00 0.00 0.00 51.96 51.80 2k3t s ALA 2514Cb -0.12 -3.13 -0.05 0.00 0.00 0.00 0.00 23.12 19.83 2k3t s ALA 2514CO 0.19 -0.85 0.37 0.15 0.00 0.00 0.00 175.76 175.61 2k3t s LYS 2515N 2.63 4.14 -0.02 0.00 1.02 -0.24 -0.91 119.74 126.36 2k3t s LYS 2515Ca 0.29 0.27 0.03 0.00 0.02 0.00 0.00 55.97 56.58 2k3t s LYS 2515Cb -0.15 -3.36 -0.00 0.00 -0.52 0.00 0.00 37.83 33.80 2k3t s LYS 2515CO 0.08 0.37 -0.11 0.08 -0.92 0.00 0.00 175.35 174.85 2k3t s VAL 2516N 0.00 0.89 0.06 3.17 1.01 0.34 -2.45 120.40 123.42 2k3t s VAL 2516Ca 0.21 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.75 2k3t s VAL 2516Cb -0.15 -0.78 -0.03 0.00 0.00 0.00 0.00 36.38 35.42 2k3t s VAL 2516CO 0.08 0.27 -0.05 0.42 0.00 0.00 0.00 175.10 175.82 2k3t s THR 2517N 0.05 0.36 0.00 3.92 -4.23 -1.14 -1.36 115.64 113.23 2k3t s THR 2517Ca -0.01 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 2k3t s THR 2517Cb -0.08 -1.20 0.00 0.00 1.34 0.00 0.00 72.50 72.56 2k3t s THR 2517CO 0.00 -0.79 0.00 0.61 -0.54 0.00 0.00 174.62 173.90 2k3t n GLY 2518N 0.54 -0.43 3.77 3.99 0.00 -1.26 -1.67 105.19 110.13 2k3t n GLY 2518Ca -0.17 -2.26 -0.35 0.00 0.00 0.00 0.00 46.02 43.24 2k3t n GLY 2518CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k3t s PRO 2519N -0.63 3.40 0.36 1.61 0.04 -1.26 -4.31 135.00 134.20 2k3t s PRO 2519Ca 0.00 1.62 0.19 0.00 0.04 0.00 0.00 61.00 62.85 2k3t s PRO 2519Cb 0.00 -2.04 0.26 0.00 0.04 0.00 0.00 34.50 32.76 2k3t s PRO 2519CO 0.00 -0.81 1.55 -0.09 0.04 0.00 0.00 177.00 177.68 2k3t h ARG 2520N 1.28 0.00 0.00 4.56 2.43 -1.96 -3.43 114.38 117.26 2k3t h ARG 2520Ca -0.50 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 2k3t h ARG 2520Cb 1.26 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 2k3t h ARG 2520CO 0.57 0.29 0.00 1.28 -1.51 0.00 0.00 179.97 180.60 2k3t n LEU 2521N -3.19 0.00 0.00 3.80 7.99 -1.26 -4.59 117.00 119.74 2k3t n LEU 2521Ca 0.03 0.00 0.14 0.00 -0.01 0.00 0.00 56.01 56.17 2k3t n LEU 2521Cb 0.63 0.00 0.85 0.00 -0.11 0.00 0.00 43.42 44.79 2k3t n LEU 2521CO 0.37 0.00 1.02 1.33 -1.51 0.00 0.00 177.39 178.60