# 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 G C C 42.67 5.58 13.12 20.01 118.88 -156.83 -127.39 167.64 99.87 0.10 0.03 99.63 0.20 0.09 0.01 0.00 0.00 0.05 0.02 1 S C C 79.72 3.80 10.39 15.69 109.36 -112.92 -90.18 92.48 80.56 2.36 17.08 69.14 2.84 8.95 12.54 4.02 0.00 1.30 1.22 2 E C C 131.03 3.11 9.91 14.52 106.72 117.55 -86.34 64.13 67.88 4.18 27.93 39.33 14.40 15.16 19.96 7.06 0.04 2.13 1.93 3 D C C 95.86 4.00 10.89 16.22 104.76 104.83 -83.98 41.96 58.14 2.47 39.40 31.06 12.71 16.27 28.99 8.54 0.05 1.23 1.14 4 G H H 40.80 6.55 10.94 18.62 101.56 46.41 -53.06 -28.65 48.13 1.58 50.28 23.04 12.24 14.90 39.71 8.53 0.07 0.78 0.72 5 E H H 123.86 3.39 13.00 17.55 99.38 69.18 -74.61 -27.80 36.72 1.66 61.63 19.71 8.86 10.32 51.28 8.26 0.06 0.90 0.61 6 E H H 114.55 4.24 13.40 18.75 97.25 57.04 -74.80 -25.86 34.52 2.34 63.14 20.66 7.30 8.55 53.04 8.26 0.05 1.41 0.72 7 T H H 70.74 7.61 12.56 21.21 99.32 57.80 -76.26 -25.10 33.98 3.26 62.76 18.32 6.65 11.15 52.89 7.82 0.08 2.21 0.89 8 C H H 69.00 6.97 14.09 22.00 99.80 58.14 -76.32 -24.05 38.87 4.24 56.88 18.79 8.73 13.99 47.14 7.22 0.16 2.74 1.24 9 A H H 61.97 4.92 15.09 21.07 101.64 66.61 -73.07 -24.46 44.48 5.98 49.54 26.44 9.23 10.97 40.91 6.87 0.11 3.95 1.53 10 L H H 87.35 8.28 12.91 22.07 101.70 53.38 -77.93 -12.52 44.43 9.92 45.65 25.33 8.92 12.15 35.43 8.54 0.20 7.20 2.23 11 A C H 65.31 6.98 13.38 21.46 103.73 70.31 -82.05 20.35 49.21 13.07 37.72 26.06 10.19 14.42 28.55 8.13 0.26 9.63 2.78 12 S C C 76.02 4.78 13.23 19.29 106.56 67.86 -91.18 63.16 61.36 13.32 25.33 32.49 12.62 16.79 18.42 6.89 0.19 9.52 3.08 13 H C C 112.61 6.72 11.69 19.85 116.23 103.45 -101.46 128.25 71.44 14.46 14.10 40.70 18.38 12.55 9.79 4.74 0.09 9.52 4.23 14 S C C 82.23 3.69 13.09 18.37 113.05 -147.75 -90.73 131.26 82.03 9.24 8.74 42.46 16.87 23.58 4.10 4.21 0.02 6.24 2.52 15 G C C 46.90 5.98 12.33 19.60 114.90 20.71 106.24 23.62 87.18 7.43 5.39 40.57 24.71 22.82 1.43 3.68 0.01 4.50 2.29 16 S C C 74.21 4.87 12.80 19.17 111.64 -89.80 -90.41 124.10 85.60 8.94 5.46 54.25 20.95 10.30 1.67 3.87 0.00 4.85 4.11 17 S C C 77.69 4.88 12.20 18.63 107.75 -146.52 -88.42 88.45 82.45 7.10 10.45 40.90 20.06 22.24 2.70 7.41 0.02 3.92 2.76 18 G C C 44.78 5.90 12.46 19.67 112.55 7.35 95.15 -14.99 83.27 5.25 11.48 35.42 23.78 25.00 2.54 8.46 0.01 2.78 2.02 19 S C C 74.13 4.77 12.48 18.71 111.40 -70.06 -88.90 130.45 79.88 7.43 12.69 45.74 18.61 15.66 3.36 9.41 0.02 4.08 3.13 20 K C C 131.73 5.36 10.50 17.56 108.61 -146.88 -87.91 106.17 80.52 7.88 11.60 45.94 19.63 15.24 3.59 7.84 0.02 4.22 3.53 21 S C C 82.80 3.24 11.08 15.94 107.22 -126.64 -85.42 89.01 83.97 5.45 10.58 38.75 20.11 25.90 2.65 7.48 0.01 2.98 2.12 22 G C C 56.61 2.63 12.31 16.12 105.49 -27.04 85.85 2.21 86.31 3.52 10.16 31.52 26.82 28.55 2.12 7.69 0.01 1.81 1.48 23 G C C 42.56 5.91 11.16 18.45 120.02 111.92 -84.59 167.54 84.29 4.18 11.54 37.28 28.91 18.59 2.65 8.66 0.01 2.25 1.65 24 D C C 109.45 3.13 14.00 18.43 111.34 -70.75 -85.92 125.31 78.62 8.79 12.59 49.12 18.94 11.01 4.15 8.39 0.01 6.16 2.21 25 K C C 116.73 8.28 12.78 22.25 113.17 -138.18 -87.60 126.39 68.57 19.47 11.96 51.99 10.86 5.50 6.08 5.99 0.02 16.75 2.81 26 M C C 89.45 9.81 15.58 25.90 102.28 -172.01 -93.21 -23.87 52.93 36.36 10.71 35.01 14.00 4.44 7.33 3.86 0.05 32.44 2.87 27 F E E 49.60 16.04 13.61 29.80 132.38 9.18 -135.04 145.19 29.10 61.83 9.07 22.83 4.62 2.40 7.00 2.79 0.02 57.82 2.51 28 S E E 59.51 6.61 19.58 27.34 125.35 -161.66 -123.56 139.16 22.93 70.39 6.68 19.35 2.43 1.35 5.33 1.83 0.00 67.86 1.84 29 L E E 48.83 16.76 11.75 28.24 116.33 -152.62 -103.34 125.44 30.85 56.60 12.56 25.86 3.05 1.90 9.25 3.48 0.01 54.54 1.90 30 K C E 123.96 4.55 16.56 22.13 106.84 -161.86 -87.79 1.40 46.54 36.90 16.56 27.67 11.61 8.72 9.19 6.63 0.07 34.66 1.45 31 K C C 124.66 5.56 15.66 22.19 113.19 -3.33 -101.02 123.45 53.09 28.29 18.63 30.83 12.64 11.35 9.93 7.87 0.15 25.22 2.03 32 W C C 115.35 11.86 12.53 24.54 110.50 -143.91 -95.80 94.49 52.89 24.90 22.21 30.42 11.54 11.85 14.17 7.93 0.24 20.71 3.15 33 N C C 85.46 7.82 16.62 25.09 104.14 71.46 -93.39 22.75 56.21 20.57 23.22 28.74 14.40 13.73 16.25 6.88 0.25 17.38 2.36 34 A C H 44.02 12.39 15.42 28.04 112.85 100.55 -97.46 119.71 41.41 26.35 32.24 22.01 10.83 9.63 23.59 8.39 0.38 22.80 2.38 35 V E E 60.52 11.87 17.85 30.03 115.59 -127.54 -99.64 127.52 25.88 39.44 34.68 15.61 5.68 6.07 26.51 8.41 0.19 35.45 2.08 36 A E E 34.33 15.25 16.73 31.87 115.45 -155.49 -96.64 127.61 22.83 43.08 34.09 14.54 4.48 5.14 24.52 9.19 0.08 40.55 1.51 37 M E E 74.40 11.66 19.19 31.12 116.38 -160.19 -107.03 130.57 24.03 44.95 31.01 15.38 4.64 5.44 21.95 8.88 0.08 41.91 1.72 38 W E E 91.95 13.96 16.46 30.42 117.43 -157.67 -105.38 130.66 33.34 44.49 22.17 22.23 6.55 5.88 16.52 6.45 0.12 39.38 2.87 39 S C C 35.59 11.40 16.07 28.50 123.97 -168.74 -119.06 142.01 55.17 35.05 9.79 42.43 6.98 4.97 6.91 3.42 0.02 32.34 2.94 40 W C T 138.09 9.71 14.15 24.52 99.52 -149.54 -79.61 -15.56 70.92 18.58 10.50 20.16 16.69 35.23 5.67 4.48 0.11 15.49 2.19 41 D C T 111.72 2.46 16.79 19.66 99.44 52.76 -89.26 9.93 78.30 13.98 7.72 22.35 20.80 36.00 3.29 3.88 0.03 12.28 1.37 42 V C C 50.99 13.17 10.64 24.29 119.23 103.71 -100.07 133.12 68.01 24.54 7.46 47.79 13.24 6.62 4.30 3.48 0.02 21.46 3.10 43 E C C 134.76 3.20 17.16 21.67 113.76 -144.99 -95.57 125.46 66.20 28.33 5.47 54.28 6.68 4.03 3.66 2.22 0.01 24.65 4.47 44 C C C 39.22 15.34 10.92 26.05 128.77 166.03 -130.84 147.60 71.33 20.25 8.41 51.86 10.93 8.12 5.20 3.55 0.02 17.02 3.31 45 D C C 103.01 4.15 18.24 23.21 100.83 -159.56 -91.99 4.29 79.09 10.90 10.01 33.37 30.30 16.22 6.36 3.74 0.05 8.26 1.70 46 T C C 64.41 8.45 18.11 27.29 126.67 47.85 -127.72 146.61 71.87 14.34 13.79 33.17 25.96 13.65 9.36 4.66 0.15 9.60 3.46 47 C C C 21.82 17.52 13.80 31.36 116.15 -125.46 -86.24 134.97 76.44 12.92 10.64 62.07 9.56 3.87 9.20 2.45 0.01 7.50 5.35 48 A H H 53.70 7.96 19.75 28.63 93.35 -126.85 -62.87 -34.33 32.46 4.03 63.51 10.19 9.39 15.03 54.43 6.44 0.62 2.66 1.24 49 I H H 57.06 13.18 19.84 32.76 94.15 51.19 -69.69 -39.33 26.29 4.33 69.38 4.59 4.36 17.66 59.24 8.50 1.14 3.49 1.02 50 C H H 18.78 18.90 17.90 36.23 98.10 36.46 -89.43 -24.04 24.62 6.86 68.53 6.76 4.07 14.25 57.57 9.37 0.74 6.03 1.20 51 R H H 91.51 13.99 19.96 32.96 94.40 68.47 -62.82 -28.74 17.95 7.61 74.43 10.24 3.29 5.85 68.20 4.52 0.13 6.75 1.03 52 V H H 59.55 8.90 21.69 30.75 93.58 54.08 -68.12 -39.83 15.12 7.85 77.02 7.43 2.57 5.78 73.59 2.54 0.16 7.18 0.75 53 Q H H 63.57 11.43 22.96 34.20 93.33 49.84 -67.83 -39.46 12.52 7.06 80.41 6.55 1.71 4.56 77.89 2.09 0.08 6.55 0.57 54 V H H 5.87 24.39 19.40 43.36 92.08 50.78 -64.40 -43.21 4.65 1.74 93.61 2.63 0.72 1.66 92.48 0.94 0.02 1.42 0.13 55 M H H 53.56 15.03 23.16 37.40 91.68 50.94 -63.39 -42.07 2.98 0.70 96.32 1.47 0.40 1.28 95.52 0.69 0.01 0.58 0.05 56 D H H 72.62 4.26 26.67 30.92 91.64 49.14 -64.66 -41.27 2.72 0.43 96.86 1.08 0.34 1.38 96.15 0.64 0.01 0.35 0.04 57 A H H 11.29 15.72 21.93 38.26 91.63 50.32 -64.54 -42.49 2.36 0.30 97.35 0.82 0.30 1.26 96.78 0.55 0.01 0.24 0.03 58 C H H 4.86 23.48 19.16 42.60 91.91 50.83 -63.40 -42.71 2.52 0.33 97.15 0.97 0.31 1.27 96.58 0.54 0.01 0.27 0.03 59 L H H 64.93 7.56 23.78 31.85 91.46 50.51 -63.73 -41.38 2.30 0.53 97.17 0.90 0.30 1.18 96.47 0.62 0.01 0.48 0.04 60 R H H 115.28 3.92 24.26 27.89 91.73 49.83 -64.81 -41.13 2.88 0.69 96.43 1.01 0.42 1.60 95.51 0.78 0.03 0.60 0.06 61 C H H 8.98 16.92 15.28 33.45 91.68 50.08 -64.95 -41.40 4.99 0.67 94.34 1.80 0.66 2.70 93.16 1.03 0.02 0.55 0.08 62 Q H H 71.34 12.05 16.20 28.46 92.11 52.22 -64.84 -39.19 8.97 0.44 90.59 2.42 1.03 5.47 89.35 1.28 0.03 0.31 0.09 63 A H H 77.04 2.31 16.14 18.79 91.82 54.62 -66.86 -30.43 18.46 0.34 81.20 2.96 2.21 13.14 79.78 1.53 0.07 0.17 0.14 64 E C T 115.10 3.47 14.26 18.71 95.30 47.56 -87.80 -1.02 59.13 0.42 40.45 5.26 7.25 44.85 39.91 2.25 0.05 0.16 0.27 65 N C T 118.20 3.71 13.91 19.38 95.93 -118.48 60.36 33.40 84.16 0.63 15.22 15.53 12.18 56.24 12.17 3.26 0.01 0.28 0.34 66 K C C 99.43 7.14 14.35 22.86 104.40 126.62 -96.86 51.52 84.33 1.84 13.83 54.03 13.57 16.61 7.28 6.53 0.00 0.91 1.07 67 Q C C 80.09 14.01 12.68 26.04 100.37 109.68 -79.31 -14.37 72.32 2.08 25.60 47.11 11.45 12.99 5.08 21.34 0.00 1.18 0.85 68 E C T 131.30 3.55 19.04 23.32 96.43 74.53 -75.16 -20.70 67.40 2.73 29.87 21.24 18.54 28.63 3.68 25.35 0.01 1.68 0.87 69 D C C 78.37 7.89 19.52 27.72 101.30 46.50 -95.67 17.04 66.70 6.53 26.77 27.42 15.31 25.25 2.81 23.16 0.01 5.05 0.99 70 C C C 11.23 22.31 14.82 36.89 126.28 96.85 -112.00 145.13 63.62 32.66 3.72 48.68 11.82 2.90 0.93 2.72 0.00 31.77 1.18 71 V E E 27.66 14.15 26.46 41.09 121.88 -156.85 -114.35 136.43 15.15 84.08 0.78 13.45 1.35 0.30 0.44 0.32 0.00 83.56 0.58 72 V E E 6.76 24.44 22.71 47.15 119.61 -152.31 -109.34 128.84 2.93 96.86 0.22 2.74 0.19 0.05 0.13 0.06 0.00 96.61 0.22 73 V E E 14.34 18.62 26.11 44.28 127.48 -172.53 -123.95 142.03 2.87 96.95 0.19 2.62 0.29 0.09 0.09 0.07 0.00 96.56 0.28 74 W E E 36.57 19.41 21.65 40.67 117.66 -146.22 -101.66 129.12 14.42 85.29 0.29 12.24 1.97 0.58 0.10 0.19 0.00 84.17 0.74 75 G C C 10.33 18.05 17.82 35.73 117.40 -146.99 -80.30 -157.42 73.74 23.58 2.68 47.23 15.94 10.25 0.29 2.74 0.00 22.22 1.32 76 E C T 109.74 7.88 21.05 29.29 93.76 -69.49 -67.43 -26.37 92.66 2.36 4.98 3.92 22.05 66.10 0.18 5.52 0.00 1.72 0.52 77 C C T 40.42 13.04 16.66 30.30 96.38 40.87 -93.92 6.02 93.91 1.15 4.94 3.53 20.48 69.20 0.19 5.51 0.00 0.75 0.33 78 N C S 89.57 8.80 21.04 30.35 94.62 -114.86 65.73 28.30 87.56 9.54 2.90 27.05 48.18 12.56 0.35 2.77 0.00 6.58 2.51 79 H C C 30.33 18.62 18.96 37.52 118.06 151.74 -84.21 142.89 80.74 18.71 0.55 70.49 7.99 1.21 0.26 0.33 0.00 18.03 1.69 80 S E E 24.92 17.94 24.89 41.77 127.33 -157.76 -116.97 143.58 36.23 63.04 0.73 30.14 5.10 0.62 0.56 0.32 0.00 60.31 2.94 81 F E E 9.05 23.80 22.77 46.24 137.70 172.59 -141.39 157.72 12.43 86.85 0.72 10.33 1.44 0.24 0.71 0.23 0.00 77.27 9.78 82 H E E 26.77 17.80 24.29 41.92 115.54 -103.87 -73.89 144.50 45.96 52.63 1.41 44.86 1.32 0.25 1.29 0.27 0.00 46.91 5.10 83 N H H 43.63 17.35 21.79 38.82 91.79 -118.19 -60.18 -37.38 4.45 0.23 95.31 0.68 0.60 3.20 94.17 1.06 0.02 0.25 0.03 84 C H H 45.16 9.37 25.48 35.53 91.89 54.57 -65.04 -38.64 2.05 0.11 97.84 0.25 0.20 1.58 96.76 1.06 0.02 0.11 0.02 85 C H H 10.97 19.28 22.38 41.43 92.71 48.65 -66.22 -42.48 0.82 0.16 99.02 0.21 0.09 0.52 97.87 1.13 0.01 0.16 0.01 86 M H H 4.70 25.17 20.22 45.18 91.71 50.93 -64.14 -42.27 0.24 0.04 99.72 0.09 0.03 0.13 99.52 0.20 0.00 0.03 0.00 87 S H H 34.00 10.55 22.73 33.78 91.58 52.12 -62.93 -42.44 0.32 0.01 99.67 0.04 0.02 0.23 99.61 0.09 0.00 0.01 0.00 88 L H H 57.49 6.31 22.86 29.69 91.75 49.55 -64.61 -42.14 0.62 0.01 99.38 0.04 0.03 0.53 99.31 0.09 0.00 0.00 0.00 89 W H H 23.33 16.65 17.47 34.86 92.11 48.99 -64.53 -42.64 0.80 0.01 99.18 0.07 0.06 0.61 99.16 0.09 0.00 0.01 0.00 90 V H H 25.37 17.57 14.61 32.07 92.33 49.75 -65.13 -40.45 0.97 0.04 98.98 0.16 0.08 0.66 98.88 0.18 0.00 0.02 0.01 91 K H H 142.83 2.39 17.90 20.65 92.98 47.85 -68.42 -37.00 1.88 0.02 98.11 0.21 0.11 1.38 98.01 0.27 0.00 0.01 0.00 92 Q H H 122.54 2.13 16.70 18.75 98.72 35.33 -87.00 -33.08 5.77 0.03 94.20 0.32 0.43 4.88 94.04 0.29 0.01 0.01 0.01 93 N H H 70.87 7.90 15.37 24.30 119.25 13.86 -132.60 103.41 27.19 0.30 72.51 5.31 6.33 15.28 72.23 0.52 0.05 0.08 0.21 94 N C C 80.62 11.86 15.53 27.74 97.55 -147.17 -23.47 32.14 98.93 0.97 0.11 51.76 34.08 13.14 0.03 0.08 0.00 0.78 0.14 95 R E B 93.86 7.45 21.82 30.38 132.13 107.33 -126.11 150.59 8.39 91.56 0.04 5.49 0.74 0.02 0.04 0.00 0.00 8.14 85.56 96 C C C 6.09 22.25 14.21 37.65 109.64 -108.61 -71.68 128.04 94.84 5.13 0.02 95.61 0.35 0.03 0.01 0.01 0.00 3.06 0.94 97 P C T 43.02 11.45 20.41 33.41 92.61 -145.42 -68.32 -23.20 99.84 0.05 0.11 0.31 2.96 96.61 0.00 0.07 0.00 0.03 0.01 98 L C T 58.24 13.70 17.95 31.32 98.89 46.17 -82.26 -41.41 99.82 0.06 0.13 0.07 2.00 97.81 0.00 0.08 0.00 0.02 0.01 99 C C T 57.31 7.01 16.42 24.94 101.10 20.60 -107.08 -8.94 99.77 0.08 0.15 0.61 3.87 95.32 0.01 0.12 0.00 0.05 0.02 100 Q C C 123.43 4.92 15.69 22.48 93.13 -124.17 64.27 22.89 99.58 0.31 0.11 82.26 8.63 8.67 0.03 0.06 0.00 0.15 0.19 101 Q C C 79.78 6.79 15.27 23.82 120.31 144.82 -82.90 147.53 91.10 8.83 0.07 81.75 9.49 0.24 0.02 0.05 0.00 6.00 2.45 102 D E B 97.49 4.08 19.98 24.98 113.43 -105.54 -72.48 137.80 13.01 86.85 0.13 10.85 0.50 0.04 0.14 0.03 0.00 25.03 63.42 103 W C C 26.76 23.29 10.50 32.95 122.34 -156.32 -107.55 142.22 87.20 12.75 0.05 85.95 1.18 0.10 0.01 0.03 0.00 12.22 0.51 104 V C C 74.63 5.22 24.30 29.80 118.05 -144.14 -105.77 130.05 67.08 32.81 0.10 64.59 2.16 0.16 0.03 0.06 0.00 31.26 1.74 105 V E E 38.10 20.53 12.91 32.55 119.41 -154.59 -105.51 131.41 45.21 54.60 0.18 43.73 1.54 0.21 0.07 0.11 0.00 52.03 2.33 106 Q E E 83.84 6.71 19.31 27.05 124.22 -172.34 -119.70 140.49 38.24 61.45 0.31 35.89 1.77 0.38 0.10 0.18 0.00 60.55 1.12 107 R E E 135.04 7.88 15.06 24.39 114.47 -122.06 -83.69 132.17 40.60 58.72 0.68 37.01 2.38 0.97 0.25 0.42 0.00 56.82 2.14 108 I C C 74.00 11.38 10.81 22.84 114.79 -160.39 -101.94 128.41 69.28 29.76 0.96 55.72 7.10 5.55 0.30 0.69 0.00 28.73 1.91 109 G C C 47.46 3.41 12.85 17.70 119.49 -16.35 100.96 -173.44 85.09 14.40 0.51 72.58 4.66 7.08 0.11 0.38 0.00 14.19 1.01 110 K C C 155.29 2.36 13.78 17.34 111.87 -50.81 -91.81 124.28 99.58 0.40 0.02 99.35 0.25 0.07 0.01 0.00 0.00 0.29 0.03