# 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 A C C 43.62 9.17 14.53 24.92 118.12 -137.78 -83.79 149.97 99.82 0.14 0.04 99.73 0.13 0.03 0.02 0.00 0.00 0.07 0.02 1 T C C 60.45 5.20 16.96 23.03 120.52 -127.20 -85.39 159.83 76.81 18.74 4.45 75.12 1.29 0.43 4.43 0.21 0.00 2.82 15.70 2 I H H 61.54 14.29 11.73 26.13 92.99 -109.88 -59.68 -38.07 5.10 0.09 94.81 1.51 0.88 2.87 90.49 4.16 0.01 0.05 0.03 3 N H H 93.11 4.74 15.09 21.16 91.74 55.05 -65.63 -35.65 3.52 0.07 96.40 0.80 0.43 2.34 91.07 5.29 0.01 0.05 0.02 4 Q H H 95.74 3.20 16.05 19.78 92.81 52.75 -67.73 -35.85 2.64 0.08 97.28 0.56 0.32 1.74 91.74 5.55 0.01 0.06 0.01 5 L H H 48.34 11.99 13.04 25.88 93.17 53.67 -68.09 -36.00 6.51 0.18 93.31 1.25 0.86 4.61 89.73 3.34 0.04 0.11 0.06 6 V H H 55.83 11.95 13.34 25.77 95.42 53.32 -76.82 -20.34 34.29 0.80 64.91 5.40 4.52 24.76 62.17 2.25 0.14 0.36 0.42 7 R C H 149.60 3.36 15.72 19.93 97.09 62.12 -80.77 -15.44 59.53 0.86 39.61 10.30 11.14 37.15 38.29 2.24 0.08 0.32 0.47 8 K C S 127.42 3.72 15.02 20.12 117.23 63.60 -100.06 128.45 97.18 0.55 2.27 23.49 70.74 2.85 2.00 0.37 0.00 0.18 0.37 9 P C C 71.08 10.07 11.67 22.72 114.93 -112.89 -66.61 147.97 96.81 0.96 2.23 89.72 4.23 3.10 1.00 0.98 0.00 0.49 0.49 10 R C C 112.30 9.79 12.40 23.15 114.26 -116.98 -81.63 136.10 93.86 4.10 2.04 85.69 5.71 2.30 0.85 1.05 0.00 1.88 2.52 11 K C C 135.15 5.15 14.14 21.25 113.88 -135.52 -92.25 130.61 93.87 4.78 1.35 83.87 8.35 1.66 0.54 0.75 0.00 2.95 1.88 12 R C C 128.08 7.48 13.21 22.22 119.53 -151.93 -101.68 134.93 91.55 7.45 1.00 84.02 6.66 1.03 0.40 0.55 0.00 5.20 2.14 13 M C C 114.69 6.04 14.67 22.38 114.70 -130.17 -89.44 132.40 86.93 12.27 0.80 83.07 3.56 0.61 0.38 0.38 0.00 7.54 4.46 14 V C C 51.55 14.48 10.90 25.36 119.48 -151.65 -105.41 135.86 88.76 10.32 0.93 84.53 3.90 0.57 0.49 0.38 0.00 6.53 3.60 15 D C C 89.14 4.24 17.07 22.16 115.92 -144.80 -99.44 130.48 93.52 5.15 1.33 89.60 3.42 0.88 0.58 0.58 0.00 3.16 1.78 16 K C C 100.56 12.70 10.62 23.14 97.09 -142.53 -73.76 -17.30 75.31 3.24 21.44 55.11 7.99 10.63 2.71 20.46 0.00 2.02 1.07 17 S C T 84.80 2.62 14.47 18.09 94.11 73.36 -73.48 -17.61 75.62 1.63 22.75 15.00 14.72 44.79 1.71 22.22 0.00 1.00 0.57 18 D C T 107.11 3.01 15.74 19.33 98.05 47.84 -94.59 2.92 73.31 1.83 24.86 17.96 14.63 40.37 1.93 23.40 0.00 1.08 0.62 19 V C S 30.93 17.01 9.88 26.71 116.33 91.47 -102.23 124.93 97.48 1.50 1.01 37.78 59.32 0.64 0.65 0.25 0.00 0.46 0.91 20 P C C 59.39 6.15 19.59 26.76 112.02 -118.68 -66.13 148.28 90.78 2.15 7.07 86.34 2.62 2.45 3.37 2.81 0.00 0.85 1.56 21 A H G 34.78 14.19 17.36 31.74 94.48 -110.46 -64.19 -29.14 36.18 0.59 63.23 8.03 6.02 21.91 11.82 51.60 0.01 0.33 0.28 22 L H G 15.78 22.58 13.86 35.96 93.88 55.92 -78.16 -11.62 26.01 0.51 73.49 4.80 3.50 17.32 12.06 61.82 0.01 0.33 0.17 23 Q H G 105.04 7.70 18.60 27.39 94.51 87.68 -66.62 -21.05 24.64 0.27 75.09 2.82 2.87 18.07 10.79 65.18 0.00 0.17 0.09 24 N H G 107.77 4.35 19.59 24.70 95.49 39.77 -87.55 3.13 46.00 0.33 53.67 4.68 6.67 32.97 6.75 48.50 0.01 0.17 0.24 25 C C C 17.59 19.86 11.27 30.66 113.20 99.74 -101.33 116.07 99.20 0.52 0.29 58.58 40.00 0.47 0.12 0.12 0.00 0.12 0.58 26 P C T 82.21 5.58 19.81 26.45 94.01 -147.98 -66.23 -22.26 90.85 0.33 8.82 5.48 8.60 74.77 0.51 10.28 0.00 0.18 0.17 27 Q C T 81.30 11.17 18.68 29.94 96.74 55.69 -89.23 2.99 90.63 1.45 7.92 8.31 9.02 71.88 0.57 8.78 0.00 1.02 0.41 28 R C C 58.28 19.60 16.93 35.36 111.88 118.84 -75.91 127.54 81.04 11.13 7.83 66.75 9.56 4.13 0.95 7.79 0.00 9.14 1.68 29 R C C 92.51 11.09 25.40 36.53 130.62 157.11 -127.27 150.09 73.67 25.28 1.05 61.02 9.86 1.87 0.20 0.94 0.00 24.16 1.94 30 G E E 7.53 19.27 22.96 41.14 142.15 78.90 148.96 -173.67 22.67 77.15 0.18 16.39 5.86 0.76 0.02 0.15 0.00 76.28 0.54 31 V E E 37.95 13.53 26.17 40.12 124.30 -90.68 -119.95 138.33 4.05 95.93 0.02 3.61 0.34 0.02 0.01 0.01 0.00 95.61 0.40 32 C E E 6.96 23.95 16.87 41.42 110.32 -121.89 -78.26 124.37 2.54 97.45 0.01 2.46 0.07 0.00 0.00 0.00 0.00 97.34 0.12 33 T E E 52.42 9.57 23.45 33.69 100.20 177.09 -96.09 -29.45 7.81 92.17 0.01 3.36 3.77 0.24 0.00 0.01 0.00 92.55 0.06 34 R E E 96.53 7.41 25.16 33.28 136.24 4.40 -148.04 146.46 6.17 93.82 0.01 2.12 3.21 0.33 0.00 0.01 0.00 94.27 0.04 35 V E E 34.39 21.19 16.23 36.44 122.58 -158.13 -119.21 127.94 3.65 96.33 0.01 3.16 0.24 0.02 0.00 0.01 0.00 96.53 0.04 36 Y E E 61.09 11.04 22.17 33.95 128.21 -174.94 -125.84 145.17 0.83 99.17 0.00 0.73 0.03 0.00 0.00 0.00 0.00 99.22 0.02 37 T E E 56.32 13.65 18.19 31.81 122.35 -150.00 -110.97 135.19 2.32 97.68 0.00 2.07 0.11 0.00 0.00 0.00 0.00 97.76 0.05 38 T E E 34.65 13.64 16.01 30.53 125.70 -168.62 -119.77 145.55 16.10 83.88 0.01 13.88 1.99 0.08 0.00 0.01 0.00 83.32 0.71 39 T C C 84.88 4.97 18.43 24.58 115.67 -133.09 -98.17 130.01 69.56 30.42 0.02 61.87 6.06 0.12 0.00 0.02 0.00 31.37 0.56 40 P C C 36.98 15.23 9.01 24.13 115.91 -114.75 -66.89 148.70 85.67 14.15 0.17 80.68 3.96 0.79 0.03 0.16 0.00 12.64 1.73 41 K C S 162.08 1.42 14.17 15.86 95.45 -138.63 -76.55 -24.65 98.18 1.71 0.11 29.71 67.05 1.65 0.02 0.10 0.00 0.86 0.61 42 K C S 125.26 2.30 12.79 16.12 125.01 38.91 -125.64 140.94 97.92 1.80 0.28 15.22 79.96 2.65 0.05 0.20 0.00 0.59 1.32 43 P C T 105.01 2.96 11.33 15.84 104.52 -95.81 -62.12 138.15 97.68 0.20 2.12 2.28 7.77 86.96 0.06 2.72 0.00 0.11 0.09 44 N C T 125.50 2.29 13.43 16.34 96.93 18.13 57.71 15.79 97.19 0.33 2.48 3.00 8.13 85.37 0.09 3.10 0.00 0.21 0.11 45 S C C 43.76 8.97 11.29 21.76 120.43 118.55 -94.54 148.94 91.16 5.42 3.43 57.35 27.24 5.36 0.36 4.16 0.00 2.44 3.09 46 A C C 47.44 7.16 17.27 25.47 117.28 -114.61 -84.24 150.36 92.41 7.14 0.45 68.49 22.41 1.64 0.09 0.43 0.00 5.20 1.74 47 L C C 59.25 14.05 16.92 30.99 114.51 -113.10 -77.97 135.84 63.69 36.10 0.21 58.23 4.30 0.53 0.04 0.20 0.00 34.41 2.28 48 R E E 56.77 15.83 19.21 34.77 125.33 -167.72 -113.85 143.22 35.94 63.99 0.07 27.61 7.86 0.28 0.01 0.06 0.00 63.60 0.58 49 K E E 59.49 14.18 23.31 37.26 119.48 -122.45 -99.30 135.03 6.12 93.86 0.02 5.30 0.56 0.04 0.00 0.01 0.00 93.95 0.14 50 V E E 11.43 21.03 21.76 42.30 130.01 -170.74 -126.61 143.87 1.89 98.11 0.00 1.72 0.05 0.00 0.00 0.00 0.00 98.20 0.03 51 C E E 4.73 22.53 22.30 44.91 127.44 -157.93 -121.13 146.16 0.56 99.44 0.00 0.50 0.01 0.00 0.00 0.00 0.00 99.49 0.00 52 R E E 58.49 13.85 26.87 40.83 117.74 -145.07 -106.10 129.14 0.11 99.89 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.90 0.00 53 V E E 3.30 25.33 19.07 45.09 124.19 -169.28 -120.63 134.66 0.10 99.90 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.91 0.00 54 R E E 85.03 9.24 25.89 35.73 113.73 -146.41 -99.33 123.15 0.39 99.61 0.00 0.38 0.01 0.00 0.00 0.00 0.00 99.57 0.04 55 L E E 8.34 23.12 13.84 37.19 121.70 -149.93 -87.32 160.34 44.90 55.00 0.10 44.36 0.64 0.10 0.02 0.06 0.00 53.91 0.91 56 T C T 73.77 9.05 18.42 28.12 91.81 -107.22 -64.82 -23.79 95.14 2.58 2.29 0.82 3.97 90.91 0.07 2.13 0.00 1.89 0.22 57 N C T 84.04 7.26 16.93 25.25 93.02 57.66 -86.80 2.76 97.66 0.23 2.11 0.35 2.94 94.44 0.06 2.04 0.00 0.12 0.04 58 G C S 41.11 5.13 18.81 24.75 98.90 -97.72 92.41 4.93 97.48 0.80 1.72 10.33 79.63 7.71 0.09 1.50 0.00 0.51 0.23 59 F C C 45.50 15.97 14.96 31.46 118.16 134.41 -79.46 142.61 86.80 13.18 0.02 86.61 0.72 0.04 0.00 0.01 0.00 12.09 0.52 60 E E E 85.93 10.18 23.47 33.85 121.14 -141.14 -106.05 132.69 0.86 99.14 0.00 0.84 0.02 0.00 0.00 0.00 0.00 99.00 0.13 61 V E E 5.93 24.57 18.26 43.07 127.12 -172.14 -124.99 139.56 0.31 99.69 0.00 0.28 0.00 0.00 0.00 0.00 0.00 99.71 0.00 62 S E E 22.71 15.26 26.63 41.70 129.12 -160.22 -121.28 146.78 0.54 99.46 0.00 0.48 0.01 0.00 0.00 0.00 0.00 99.50 0.01 63 S E E 4.41 24.60 22.02 46.24 134.99 -174.81 -137.59 151.11 1.17 98.83 0.00 1.02 0.05 0.00 0.00 0.00 0.00 98.91 0.02 64 Y E E 46.69 16.29 27.36 43.28 122.41 -149.71 -118.73 132.06 2.51 97.48 0.01 2.26 0.14 0.01 0.00 0.00 0.00 97.35 0.24 65 I E E 8.10 23.55 20.80 44.26 118.69 -161.06 -110.15 127.91 33.99 65.86 0.15 30.74 2.20 0.32 0.03 0.11 0.00 65.62 0.97 66 G C C 16.60 14.07 22.59 36.41 116.17 -142.41 -81.11 166.60 84.06 15.23 0.70 57.82 21.16 4.63 0.10 0.75 0.00 14.27 1.27 67 G C S 28.79 13.26 18.97 31.41 108.50 -14.75 75.39 -86.01 89.28 5.80 4.92 24.33 44.85 20.34 0.68 4.21 0.01 3.23 2.34 68 E C T 130.82 4.48 18.40 23.92 107.30 18.68 -78.64 113.30 89.86 3.94 6.20 7.40 22.37 59.52 0.56 6.05 0.01 2.34 1.74 69 G C T 45.71 6.51 18.48 25.45 99.52 13.85 83.38 -1.74 91.99 2.40 5.61 16.88 20.99 53.70 0.56 5.56 0.00 1.50 0.81 70 H C C 55.19 17.19 14.18 30.55 116.52 114.71 -91.36 137.62 83.34 11.26 5.40 59.45 17.32 5.70 2.02 3.45 0.01 6.30 5.77 71 N C C 78.84 6.96 22.72 29.83 104.48 -138.08 -90.87 94.71 80.70 13.83 5.47 68.09 6.84 5.03 2.97 2.40 0.00 7.53 7.13 72 L C C 21.00 23.15 13.45 35.79 95.30 -171.32 -70.51 -17.95 56.35 2.78 40.87 41.09 7.48 8.27 23.89 16.50 0.01 1.62 1.15 73 Q H G 98.53 9.62 19.52 29.54 92.66 73.39 -64.32 -33.34 29.94 1.18 68.87 10.55 5.63 13.58 30.03 39.04 0.04 0.71 0.41 74 E H G 112.94 5.41 21.30 27.05 93.35 49.06 -74.80 -26.84 32.23 0.69 67.08 3.33 4.89 22.09 29.65 39.17 0.12 0.39 0.36 75 H H G 60.30 15.30 18.68 33.40 104.10 28.74 -109.14 4.44 42.20 1.31 56.49 5.76 7.59 27.44 26.92 30.62 0.21 0.77 0.67 76 S C C 12.79 20.76 19.20 39.45 112.13 105.65 -86.80 129.16 74.48 23.40 2.12 56.67 15.37 2.50 0.77 1.24 0.00 22.20 1.24 77 V E E 33.71 14.62 26.22 40.90 123.90 105.33 -117.77 134.95 9.99 89.86 0.15 9.05 0.91 0.14 0.06 0.08 0.00 89.33 0.43 78 V E E 3.95 25.63 21.69 47.52 121.68 -160.88 -115.28 131.25 1.19 98.79 0.01 1.08 0.08 0.01 0.00 0.01 0.00 98.78 0.04 79 L E E 26.03 15.39 27.67 43.29 116.38 -158.19 -105.92 126.89 0.49 99.51 0.00 0.42 0.04 0.00 0.00 0.00 0.00 99.53 0.01 80 I E E 6.51 25.05 19.93 45.16 120.25 -166.23 -112.30 128.04 0.50 99.50 0.00 0.43 0.03 0.00 0.00 0.00 0.00 99.52 0.01 81 R E E 93.77 10.74 25.73 36.39 119.02 -170.31 -104.42 132.34 4.39 95.58 0.03 3.53 0.59 0.07 0.00 0.02 0.00 95.70 0.09 82 G E E 15.26 16.29 20.18 35.74 134.67 -9.12 112.13 170.84 24.52 75.39 0.08 15.68 8.11 0.69 0.01 0.07 0.00 75.19 0.25 83 G E E 21.73 9.83 22.47 32.90 138.99 124.26 151.16 -173.78 29.97 69.88 0.15 19.85 10.24 0.94 0.02 0.13 0.00 68.18 0.64 84 R E E 123.61 7.84 20.13 28.79 120.36 -63.74 -100.70 140.04 28.45 71.22 0.34 22.86 4.54 0.54 0.17 0.24 0.00 61.66 9.99 85 V C C 26.02 19.20 10.88 29.60 116.96 -137.82 -95.48 128.12 67.34 32.24 0.42 62.31 3.36 0.95 0.12 0.35 0.00 28.01 4.90 86 K C T 155.00 2.02 18.04 20.28 95.12 -121.54 -63.51 -28.97 97.41 2.07 0.53 1.76 17.89 77.89 0.02 0.58 0.00 1.63 0.24 87 D C T 94.74 5.96 16.26 23.21 96.04 33.74 -83.83 -4.39 98.93 0.76 0.31 1.00 20.08 77.89 0.01 0.37 0.00 0.56 0.09 88 L C S 24.02 19.10 10.04 28.70 111.95 60.56 -120.30 96.91 80.09 19.71 0.20 28.07 52.03 1.41 0.04 0.19 0.00 14.56 3.70 89 P C T 88.87 3.79 18.59 23.45 111.17 -136.64 -64.78 135.50 84.59 14.86 0.55 2.42 7.93 75.38 0.02 0.53 0.00 13.19 0.53 90 G C T 45.20 4.94 19.10 24.91 94.23 21.80 83.05 -2.93 85.69 13.86 0.44 2.85 10.62 72.49 0.01 0.47 0.00 13.32 0.23 91 V C C 17.36 21.15 12.81 33.93 119.59 109.80 -100.22 131.91 55.34 44.52 0.13 49.35 4.44 0.36 0.02 0.12 0.00 44.67 1.03 92 R E E 97.65 8.88 25.19 34.20 123.68 -164.11 -113.47 139.52 14.46 85.49 0.06 13.55 0.67 0.08 0.02 0.03 0.00 83.86 1.80 93 Y E E 19.94 23.96 17.32 40.91 130.14 -164.91 -126.50 145.68 8.90 91.08 0.03 8.12 0.47 0.04 0.01 0.01 0.00 91.15 0.21 94 H E E 55.93 12.45 27.03 39.72 127.93 -169.59 -129.64 141.62 2.25 97.74 0.01 2.08 0.09 0.01 0.00 0.00 0.00 97.67 0.14 95 T E E 13.75 22.45 19.27 41.60 112.47 -120.66 -80.03 129.21 3.40 96.57 0.04 3.32 0.11 0.02 0.02 0.01 0.00 95.86 0.66 96 V E E 38.34 14.15 23.75 37.64 104.11 174.79 -98.76 -24.38 29.87 69.59 0.54 21.70 8.03 1.61 0.13 0.40 0.00 67.17 0.96 97 R C E 87.50 11.72 23.65 34.97 133.56 10.34 -139.57 145.94 54.80 43.22 1.97 27.64 22.05 7.36 0.35 1.59 0.01 38.86 2.13 98 G C C 20.94 16.89 17.87 33.37 123.81 -167.75 -96.07 -158.12 80.30 13.89 5.81 39.54 27.03 14.68 0.69 5.38 0.01 10.05 2.63 99 S C S 57.93 10.53 20.76 31.00 96.31 -80.84 -80.15 -13.10 86.91 4.75 8.35 14.74 43.32 29.42 0.99 7.13 0.01 3.01 1.38 100 L C S 61.39 14.35 17.74 31.67 113.80 69.12 -94.16 127.05 79.98 11.02 9.00 19.23 39.64 22.34 1.56 6.84 0.05 6.70 3.64 101 D C C 74.90 9.56 21.03 30.70 107.01 -110.25 -86.82 108.46 83.65 11.81 4.54 64.59 11.75 6.55 1.19 3.75 0.00 7.67 4.50 102 T C C 25.37 21.19 13.94 34.01 100.86 91.61 -97.15 10.58 80.17 13.91 5.92 63.59 9.62 5.76 2.41 3.75 0.00 7.76 7.12 103 S C T 66.07 6.46 21.79 28.96 102.72 120.01 -71.77 35.38 77.46 10.35 12.19 25.17 18.77 34.87 4.26 7.25 0.15 6.61 2.92 104 G C T 27.27 12.13 18.86 30.75 101.48 -11.25 85.56 -1.27 76.86 11.13 12.00 26.67 19.16 32.78 3.97 7.22 0.12 7.47 2.61 105 V C C 22.29 21.31 11.36 31.75 112.95 100.90 -92.78 125.36 68.92 18.98 12.09 55.27 8.09 4.43 6.21 6.14 0.03 12.03 7.81 106 K C C 137.17 3.43 19.48 23.62 108.68 -162.40 -87.17 125.89 67.68 17.48 14.84 26.01 17.88 25.48 6.86 7.35 0.39 11.52 4.51 107 D C T 101.36 3.60 18.53 22.62 99.71 19.45 -65.81 54.42 70.51 14.43 15.07 26.44 18.83 27.41 5.78 8.34 0.30 9.53 3.36 108 R C C 71.50 17.78 9.07 25.25 108.11 160.87 -81.89 104.61 72.96 12.26 14.78 57.01 7.64 7.46 7.32 7.74 0.01 7.62 5.18 109 K C C 143.33 3.13 16.80 20.78 100.03 134.25 -86.36 -21.02 71.34 12.56 16.10 33.03 16.74 22.45 6.51 9.02 0.15 7.28 4.81 110 Q C T 116.50 3.83 16.12 20.91 113.77 37.98 -108.18 115.12 79.06 6.00 14.95 15.42 27.04 37.57 4.69 9.07 0.12 3.57 2.52 111 G C S 39.63 8.10 14.72 23.62 106.54 -20.70 81.28 -5.11 87.91 4.17 7.92 21.51 38.37 28.74 1.50 5.94 0.01 2.41 1.51 112 R C C 123.64 8.81 18.24 27.29 100.16 82.41 -87.83 -9.10 79.20 13.52 7.27 39.83 23.90 16.04 2.07 5.09 0.05 6.84 6.18 113 S C C 20.65 18.45 12.79 30.66 117.97 84.00 -99.00 141.55 78.36 13.80 7.84 49.51 16.25 12.49 2.07 6.09 0.02 8.01 5.58 114 K C S 124.15 6.36 21.93 28.96 96.11 -147.15 -76.63 -13.28 83.34 8.57 8.09 23.00 31.17 30.47 1.56 5.96 0.02 5.77 2.05 115 Y C T 82.58 13.23 18.65 31.74 106.93 59.73 -99.13 27.91 73.36 20.16 6.48 19.81 25.35 30.43 1.27 4.70 0.07 14.69 3.68 116 G C C 15.41 16.61 16.19 32.19 124.21 -121.99 94.92 178.10 64.71 32.13 3.16 39.31 17.07 9.60 0.77 2.68 0.02 25.87 4.68 117 A C C 45.30 11.70 16.02 28.15 120.43 -89.12 -94.95 145.67 52.78 45.25 1.98 41.41 7.85 2.55 0.83 1.38 0.01 38.91 7.08 118 K C C 130.34 5.94 15.08 22.66 114.10 -120.34 -85.39 135.81 51.89 47.15 0.96 47.26 2.01 0.99 0.49 0.51 0.00 40.22 8.52 119 R C C 152.32 5.94 14.24 21.90 110.23 -117.06 -80.98 126.45 99.60 0.38 0.01 99.58 0.09 0.04 0.00 0.00 0.00 0.26 0.02