# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 M C C 129.12 3.43 10.96 16.19 115.62 -156.25 -97.67 128.34 99.81 0.18 0.01 99.79 0.07 0.02 0.00 0.00 0.00 0.09 0.02 1 V C C 99.46 4.51 7.73 14.15 116.89 -152.90 -98.23 133.39 87.66 8.16 4.18 85.47 1.00 2.29 1.66 1.61 0.00 5.95 2.01 2 Q C C 135.74 2.27 9.24 13.18 115.75 -153.40 -100.32 132.70 79.50 14.49 6.01 61.45 11.95 5.77 1.92 4.05 0.00 12.58 2.28 3 H C C 131.89 3.77 9.40 15.21 119.56 -159.77 -112.27 134.92 73.59 19.54 6.87 59.75 8.97 4.50 2.52 4.35 0.01 16.55 3.35 4 L C C 98.55 6.77 9.43 17.85 116.19 -145.15 -96.95 131.25 74.18 20.97 4.85 64.04 6.74 2.70 2.24 2.49 0.00 17.92 3.87 5 T C C 85.00 5.00 11.99 18.78 118.42 -163.10 -108.31 133.74 77.64 18.26 4.11 59.51 13.28 4.56 1.77 2.35 0.00 15.42 3.10 6 H C C 115.60 6.53 10.75 18.93 116.37 -146.20 -101.20 127.14 80.13 16.83 3.03 59.62 15.42 4.84 1.22 1.92 0.00 13.01 3.95 7 R C C 149.18 4.68 11.73 18.24 117.05 -164.21 -104.97 128.43 88.17 10.09 1.74 70.00 12.64 5.18 0.59 1.16 0.00 7.94 2.49 8 G C C 44.24 6.20 11.40 18.86 118.92 -137.80 -92.70 153.81 90.76 7.65 1.59 63.35 21.08 6.32 0.46 1.19 0.00 5.25 2.36 9 R C C 148.24 4.62 11.75 18.11 116.64 -132.23 -97.90 138.39 90.10 7.93 1.97 72.87 13.73 3.05 0.72 1.30 0.00 4.35 3.98 10 R C C 135.99 6.45 10.98 18.86 113.23 -121.99 -80.69 134.69 84.77 4.28 10.95 64.76 10.94 8.03 1.92 10.09 0.00 2.56 1.71 11 T C C 93.64 4.07 13.13 18.60 101.96 -137.83 -81.36 -3.56 82.70 3.28 14.02 38.09 23.50 21.08 1.94 12.38 0.00 1.82 1.19 12 Y C C 120.11 7.71 11.95 20.90 106.50 62.44 -95.47 44.06 78.24 7.02 14.74 41.31 19.04 18.18 2.54 12.22 0.01 3.60 3.09 13 N C C 65.82 10.31 10.54 21.87 111.76 107.15 -93.94 117.92 88.55 6.23 5.22 71.88 11.79 4.38 2.10 3.01 0.00 3.21 3.63 14 N C C 85.12 5.99 12.54 20.01 119.62 -163.83 -97.15 156.91 82.64 5.41 11.95 48.00 22.61 12.13 4.14 7.32 0.01 2.24 3.54 15 A C T 84.52 2.78 13.65 17.43 96.13 -97.36 -67.88 -24.38 72.67 1.63 25.71 12.80 21.66 39.10 3.49 21.14 0.01 0.82 0.97 16 S C T 62.26 5.78 13.00 19.99 98.86 60.61 -84.87 -10.58 72.68 1.98 25.33 14.36 18.27 40.59 3.27 21.45 0.01 1.06 0.98 17 N C C 75.58 10.32 12.42 23.38 105.32 60.49 -88.09 75.13 71.12 7.12 21.76 34.00 20.15 18.71 3.06 17.78 0.01 4.52 1.77 18 Q C C 84.50 6.92 15.45 23.66 116.36 145.33 -90.67 136.88 72.00 25.95 2.05 57.74 9.70 3.44 0.46 1.56 0.00 25.73 1.37 19 K E E 99.77 10.70 13.36 24.89 122.47 -152.75 -108.66 136.41 15.88 84.04 0.08 14.85 0.87 0.10 0.02 0.04 0.00 83.65 0.46 20 K E E 90.71 7.03 15.59 24.18 126.36 -172.49 -127.02 144.76 2.19 97.80 0.01 2.11 0.07 0.01 0.00 0.00 0.00 97.73 0.08 21 I E E 90.86 7.92 13.17 22.62 117.07 -133.16 -97.60 129.78 1.29 98.71 0.00 1.25 0.02 0.00 0.00 0.00 0.00 98.69 0.03 22 R E E 100.34 6.94 13.00 21.76 127.06 -175.80 -124.41 147.82 1.49 98.51 0.00 1.38 0.05 0.00 0.00 0.00 0.00 98.51 0.05 23 R E E 155.88 3.21 12.31 17.33 115.13 -124.52 -92.11 127.98 7.53 92.46 0.01 7.09 0.31 0.02 0.00 0.01 0.00 92.07 0.49 24 T C C 43.66 8.99 7.43 17.84 122.62 -148.64 -90.58 161.27 95.33 4.58 0.09 94.74 0.81 0.16 0.01 0.05 0.00 3.91 0.30 25 P C T 114.97 1.44 10.38 12.65 106.71 -88.70 -62.09 137.01 91.81 0.73 7.47 1.54 5.61 82.66 0.12 9.42 0.00 0.49 0.17 26 G C T 62.18 0.90 10.31 11.05 97.58 23.69 73.84 0.16 91.72 0.16 8.11 0.78 4.64 84.21 0.14 10.08 0.00 0.09 0.06 27 N C S 127.71 1.79 10.23 13.29 96.48 -96.25 73.72 14.97 92.58 0.90 6.52 15.41 62.97 13.65 0.40 6.67 0.00 0.49 0.41 28 R C C 131.38 3.18 10.28 15.44 118.38 136.46 -89.18 141.69 85.91 13.95 0.14 81.42 3.80 0.41 0.03 0.10 0.00 13.05 1.18 29 R E E 130.63 5.79 11.65 19.39 115.35 -127.40 -92.10 130.97 3.43 96.56 0.00 3.15 0.14 0.01 0.00 0.00 0.00 96.50 0.20 30 V E E 46.37 10.02 12.95 24.95 124.60 -171.09 -121.73 139.49 0.46 99.54 0.00 0.42 0.01 0.00 0.00 0.00 0.00 99.57 0.00 31 Y E E 88.45 9.83 14.95 26.44 117.56 -141.32 -104.29 129.15 0.26 99.74 0.00 0.24 0.00 0.00 0.00 0.00 0.00 99.75 0.01 32 I E E 51.79 10.11 16.14 28.14 117.15 -162.57 -113.15 122.51 1.26 98.73 0.00 1.22 0.02 0.00 0.00 0.00 0.00 98.75 0.02 33 P E E 44.83 11.79 13.95 27.02 114.60 -143.57 -79.43 137.06 8.36 91.63 0.01 7.96 0.29 0.02 0.00 0.00 0.00 91.43 0.29 34 K C C 107.53 7.14 16.53 24.66 114.80 -165.60 -99.39 125.13 57.71 42.17 0.12 51.45 4.94 0.34 0.03 0.10 0.00 41.81 1.32 35 K C C 101.94 9.17 12.85 23.06 119.02 -131.77 -92.89 137.24 82.12 17.77 0.10 73.94 8.08 0.37 0.03 0.10 0.00 13.95 3.52 36 K C C 120.23 5.02 14.69 21.26 118.36 -135.38 -93.21 139.41 96.49 3.43 0.07 93.13 3.53 0.19 0.02 0.05 0.00 1.93 1.15 37 P C T 86.39 6.79 12.69 20.94 111.12 -101.38 -64.68 141.47 97.29 1.94 0.78 18.63 14.29 64.37 0.08 0.86 0.00 1.32 0.46 38 G C T 40.50 7.11 14.08 22.01 119.18 9.96 79.65 2.62 98.23 1.30 0.47 15.38 16.39 66.35 0.03 0.65 0.00 0.95 0.25 39 R C C 147.59 3.66 17.93 22.71 121.38 -96.77 -106.62 140.86 92.77 7.02 0.20 77.40 14.39 0.49 0.05 0.18 0.00 2.03 5.44 40 V C C 55.90 13.75 15.46 29.43 118.10 -110.12 -82.30 141.45 96.62 3.35 0.03 89.20 7.78 0.13 0.01 0.02 0.00 1.74 1.13 41 P C C 23.34 17.47 15.26 33.20 114.52 -106.70 -66.39 145.11 97.12 2.86 0.02 89.03 8.15 0.19 0.00 0.03 0.00 2.19 0.40 42 K E B 101.85 6.64 22.80 30.21 125.20 -153.17 -117.41 143.82 9.15 90.83 0.03 7.02 0.24 0.00 0.03 0.00 0.00 12.33 80.38 43 C C C 9.25 20.63 11.90 33.25 110.81 -111.37 -69.95 129.74 82.69 17.27 0.03 84.18 0.60 0.04 0.01 0.01 0.00 12.47 2.68 44 V C T 75.31 7.05 18.61 27.02 93.11 -145.46 -68.43 -27.08 99.79 0.11 0.09 0.39 7.31 92.11 0.00 0.09 0.00 0.07 0.03 45 K C T 107.65 6.73 16.85 24.56 99.85 43.30 -84.25 -41.53 99.83 0.08 0.09 0.11 4.57 95.18 0.00 0.09 0.00 0.04 0.02 46 C C T 57.98 6.96 13.78 22.32 102.99 20.06 -107.77 -10.33 99.71 0.16 0.12 0.72 7.82 91.18 0.00 0.14 0.00 0.09 0.05 47 R C C 170.65 3.12 15.13 19.93 95.02 -129.95 66.44 18.21 99.05 0.80 0.15 76.52 15.43 7.05 0.03 0.14 0.00 0.43 0.40 48 S C C 48.41 5.89 15.27 22.93 123.57 132.92 -85.00 155.21 94.50 5.40 0.10 70.89 23.16 0.87 0.02 0.09 0.00 3.82 1.14 49 K E B 121.56 5.76 19.69 26.46 114.90 -100.45 -73.13 141.11 4.86 95.08 0.06 3.48 0.24 0.01 0.07 0.00 0.00 13.42 82.78 50 L C C 11.45 23.80 10.49 33.96 111.86 -127.78 -87.82 127.26 89.71 9.91 0.37 88.76 1.34 0.36 0.05 0.35 0.00 7.77 1.37 51 R C T 148.83 4.19 21.72 26.82 113.27 -141.98 -77.62 135.99 92.34 6.41 1.24 19.45 19.52 53.56 0.12 1.35 0.00 5.02 0.98 52 G C T 38.20 7.93 20.08 28.16 98.55 16.80 88.02 -2.41 90.24 8.57 1.19 14.47 18.95 57.05 0.11 1.31 0.00 7.31 0.80 53 I C C 20.46 22.68 11.65 33.61 116.89 121.70 -93.70 129.59 78.84 20.89 0.27 70.07 8.08 0.42 0.10 0.21 0.00 15.51 5.63 54 D C C 81.65 5.86 23.50 29.54 118.42 -151.84 -96.16 140.47 74.49 25.32 0.19 73.54 1.66 0.27 0.07 0.11 0.00 18.34 6.02 55 I C C 72.75 14.89 16.09 30.46 113.76 -120.70 -80.32 130.11 83.41 15.98 0.60 63.91 17.83 1.91 0.25 0.43 0.00 11.73 3.95 56 C C C 41.82 13.51 13.47 27.23 119.96 -149.18 -101.56 147.35 95.19 4.29 0.51 61.62 32.50 1.23 0.29 0.23 0.00 1.89 2.24 57 R C C 126.32 3.36 18.09 21.44 119.09 -98.66 -83.92 150.55 99.15 0.40 0.45 90.21 8.69 0.22 0.43 0.06 0.00 0.13 0.26 58 P H H 80.15 7.55 11.80 20.82 91.83 -111.71 -57.10 -39.33 4.66 0.03 95.30 0.75 0.61 3.14 90.20 5.26 0.01 0.02 0.01 59 A H H 76.48 1.35 15.47 16.04 91.95 52.69 -64.29 -37.64 2.66 0.02 97.31 0.28 0.23 1.94 91.14 6.38 0.01 0.02 0.00 60 A H H 40.00 6.30 13.50 21.70 92.42 49.42 -67.58 -38.55 1.49 0.02 98.49 0.24 0.14 0.98 92.81 5.81 0.00 0.02 0.00 61 F H H 51.51 15.29 10.34 25.45 92.01 52.47 -65.42 -37.05 2.39 0.02 97.59 0.33 0.21 1.66 92.14 5.64 0.00 0.02 0.00 62 A H H 72.29 3.90 14.42 19.64 90.71 59.17 -67.38 -22.80 39.88 0.06 60.06 0.57 0.83 40.42 53.70 4.35 0.05 0.03 0.05 63 R C T 179.73 0.94 15.89 15.48 94.50 54.72 -89.19 -6.11 65.28 0.07 34.65 0.94 1.65 64.23 29.06 4.00 0.01 0.03 0.07 64 L C S 43.62 14.85 6.68 20.98 118.37 105.87 -75.42 145.03 97.06 0.81 2.13 39.95 55.50 1.39 1.72 0.38 0.00 0.18 0.88 65 R C C 144.55 1.77 16.55 17.69 117.57 -118.86 -79.78 150.45 97.07 2.16 0.78 94.69 1.63 0.25 0.39 0.21 0.00 0.54 2.28 66 K H G 130.31 7.47 10.21 19.22 91.95 -114.17 -58.74 -35.03 22.68 0.31 77.01 1.57 2.36 17.33 1.61 76.83 0.00 0.20 0.11 67 S H G 88.43 1.61 14.06 16.11 91.27 60.32 -70.33 -18.76 22.32 0.16 77.52 0.81 1.75 18.03 1.45 77.81 0.00 0.10 0.06 68 Q H G 110.36 4.46 14.32 20.02 96.24 52.95 -91.45 -5.16 19.46 0.33 80.21 2.86 3.25 11.59 1.73 80.28 0.00 0.19 0.10 69 R C C 76.22 15.45 11.14 26.06 111.02 91.35 -82.75 120.28 93.45 1.56 4.99 65.21 26.21 2.01 2.59 1.93 0.00 0.46 1.58 70 T C C 65.70 6.90 19.20 26.72 123.35 151.01 -112.60 145.66 85.64 12.36 2.00 74.56 7.16 1.09 1.26 0.67 0.00 3.23 12.03 71 V C C 47.79 16.70 12.72 28.93 102.60 -138.06 -85.02 33.78 89.22 6.83 3.95 61.63 21.24 5.83 1.81 2.04 0.00 3.05 4.41 72 A C C 75.78 4.35 17.84 23.08 98.94 103.75 -94.40 -7.93 91.34 5.85 2.81 59.73 25.50 5.76 1.18 1.57 0.00 2.32 3.93 73 R C S 100.58 7.91 13.98 23.27 123.62 88.79 -94.41 155.88 83.25 8.51 8.24 30.55 44.04 7.58 3.55 3.85 0.06 2.53 7.84 74 T C T 83.63 7.05 15.05 23.16 93.98 -104.77 -63.10 -30.34 84.05 0.75 15.20 3.06 12.88 67.95 2.98 12.17 0.01 0.40 0.55 75 Y C T 122.03 7.71 14.21 22.93 98.83 43.27 -95.68 6.28 83.38 1.54 15.08 4.02 11.78 67.16 2.50 12.74 0.01 0.90 0.88 76 G C C 30.33 10.68 13.50 24.76 113.39 65.87 53.08 155.01 78.43 6.09 15.49 28.93 23.06 26.83 3.66 11.11 0.05 2.36 4.01 77 G C T 40.05 6.76 15.98 23.64 116.27 11.93 81.15 -153.15 85.48 3.85 10.67 24.15 28.40 33.27 2.44 7.79 0.01 1.69 2.25 78 N C S 103.76 5.23 17.31 23.31 98.94 -31.75 -87.09 -8.95 83.82 4.71 11.47 15.67 41.16 28.20 3.27 6.99 0.02 2.49 2.19 79 L C S 71.57 10.87 15.53 26.88 112.27 72.99 -91.88 137.04 73.00 17.08 9.92 23.67 37.38 11.25 5.09 3.97 0.19 5.74 12.71 80 C C C 40.98 9.86 17.67 28.48 113.42 -105.34 -79.20 139.79 87.19 6.21 6.60 76.75 6.59 2.81 5.84 1.15 0.00 2.25 4.60 81 G H H 25.02 13.24 15.78 29.36 94.11 -122.78 -61.08 -36.55 6.65 0.04 93.32 1.80 1.30 3.60 91.80 1.47 0.01 0.01 0.02 82 S H H 68.60 3.28 22.06 25.25 92.30 53.42 -65.23 -40.00 3.53 0.02 96.46 0.54 0.41 2.47 95.02 1.54 0.00 0.01 0.01 83 C H H 36.39 7.74 19.18 28.31 91.92 49.15 -65.19 -42.34 2.22 0.02 97.76 0.59 0.26 1.31 96.35 1.46 0.00 0.01 0.01 84 L H H 19.47 17.08 16.43 34.09 92.04 50.55 -64.04 -42.97 0.86 0.01 99.13 0.40 0.11 0.34 98.90 0.23 0.00 0.01 0.00 85 E H H 76.44 9.93 19.68 29.73 91.65 50.78 -63.51 -41.98 0.50 0.00 99.50 0.15 0.05 0.25 99.49 0.06 0.00 0.00 0.00 86 N H H 89.63 2.93 22.13 24.59 91.92 49.42 -65.17 -40.81 0.43 0.00 99.57 0.17 0.05 0.18 99.56 0.04 0.00 0.00 0.00 87 R H H 97.20 8.29 19.91 28.61 92.36 49.23 -65.81 -41.26 0.18 0.00 99.82 0.05 0.01 0.09 99.82 0.02 0.00 0.00 0.00 88 I H H 40.69 14.49 17.73 32.45 92.10 48.69 -65.19 -42.68 0.13 0.00 99.87 0.04 0.01 0.06 99.88 0.01 0.00 0.00 0.00 89 L H H 71.93 8.07 19.60 27.96 91.63 49.54 -63.69 -42.23 0.14 0.00 99.86 0.04 0.01 0.07 99.87 0.02 0.00 0.00 0.00 90 D H H 80.89 3.12 20.93 23.81 92.02 49.23 -65.03 -41.40 0.31 0.00 99.69 0.04 0.01 0.20 99.71 0.03 0.00 0.00 0.00 91 A H H 36.65 7.74 18.39 27.17 92.17 50.12 -65.08 -41.82 0.77 0.00 99.23 0.06 0.04 0.59 99.24 0.07 0.00 0.00 0.00 92 F H H 68.30 10.84 17.87 28.83 92.57 47.64 -65.82 -41.89 1.65 0.01 98.34 0.22 0.13 1.17 98.35 0.13 0.00 0.00 0.00 93 L H H 75.48 5.85 18.57 24.97 92.10 49.74 -64.75 -41.07 2.40 0.02 97.58 0.47 0.23 1.55 97.54 0.20 0.00 0.01 0.01 94 S H H 54.98 3.30 19.21 22.46 92.18 49.66 -64.73 -41.40 2.20 0.01 97.79 0.59 0.25 1.21 97.74 0.18 0.00 0.01 0.01 95 A H H 43.44 6.42 17.68 24.92 92.13 50.09 -65.04 -40.75 1.09 0.00 98.90 0.29 0.11 0.55 98.92 0.12 0.00 0.00 0.00 96 E H H 75.50 8.37 16.78 25.76 92.10 50.68 -65.11 -40.30 0.86 0.00 99.14 0.21 0.07 0.45 99.17 0.10 0.00 0.00 0.00 97 E H H 100.45 4.14 17.66 22.30 91.66 51.73 -64.28 -40.42 0.54 0.00 99.46 0.13 0.04 0.27 99.49 0.07 0.00 0.00 0.00 98 Q H H 107.43 2.36 18.43 20.40 91.91 50.53 -65.26 -40.66 0.58 0.00 99.42 0.13 0.04 0.32 99.42 0.09 0.00 0.00 0.00 99 L H H 74.45 5.55 16.80 22.84 92.20 49.93 -65.13 -41.90 0.61 0.00 99.39 0.11 0.04 0.36 99.39 0.10 0.00 0.00 0.00 100 L H H 72.53 5.40 16.42 22.51 92.07 49.43 -64.67 -41.98 0.46 0.00 99.54 0.10 0.03 0.24 99.56 0.07 0.00 0.00 0.00 101 L H H 84.82 2.71 17.34 20.10 91.67 49.90 -63.95 -41.47 0.45 0.00 99.54 0.09 0.03 0.24 99.57 0.07 0.00 0.00 0.00 102 G H H 33.39 3.17 16.44 20.26 91.62 50.64 -63.92 -40.96 0.78 0.00 99.22 0.13 0.05 0.46 99.26 0.10 0.00 0.00 0.00 103 K H H 99.76 4.62 15.83 20.78 92.23 50.05 -64.98 -41.25 0.94 0.00 99.06 0.19 0.08 0.52 99.09 0.12 0.00 0.00 0.00 104 K H H 114.78 2.68 15.92 18.82 92.05 50.19 -65.05 -40.62 1.24 0.01 98.75 0.31 0.11 0.65 98.77 0.16 0.00 0.00 0.00 105 Q H H 108.91 1.74 15.63 16.98 92.12 50.07 -65.29 -40.24 1.81 0.01 98.17 0.51 0.18 0.92 98.15 0.22 0.00 0.01 0.00 106 T H H 70.59 2.57 14.17 17.27 92.12 50.31 -64.81 -40.26 2.73 0.02 97.24 0.80 0.30 1.41 97.08 0.39 0.00 0.01 0.01 107 N H H 89.80 2.25 13.53 16.16 92.30 50.57 -65.62 -39.33 4.62 0.04 95.34 1.32 0.53 2.51 95.02 0.60 0.00 0.02 0.01 108 A H H 63.35 1.96 12.00 14.61 92.43 51.54 -66.00 -38.38 8.39 0.06 91.55 2.34 1.08 4.65 90.81 1.06 0.01 0.03 0.03 109 A H H 75.48 1.64 10.79 13.11 93.51 53.06 -69.31 -32.73 17.60 0.11 82.29 4.11 2.39 10.76 81.01 1.62 0.02 0.04 0.05 110 D H H 113.71 1.32 9.74 11.65 96.07 54.51 -76.14 -20.31 39.43 0.28 60.29 10.08 6.25 23.37 58.12 1.88 0.03 0.10 0.17 111 N C C 124.09 1.35 8.30 10.69 100.53 65.11 -82.28 -0.84 69.54 0.31 30.15 39.67 2.50 25.29 30.77 1.45 0.00 0.12 0.19 112 N C C 125.05 1.71 10.11 13.07 105.61 82.53 -77.98 82.90 99.92 0.02 0.05 99.74 0.09 0.11 0.03 0.00 0.00 0.01 0.00