A0A3Q0KNG2_SCHMA Loading...

Kelch-like protein 3

AlphaFold DB , UniProt , Accession A0A3Q0KNG2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 981 aa.

						>A0A3Q0KNG2_SCHMA|A0A3Q0KNG2
MSFYDSETYTNDNQNSRSESSRSSRESPVQNVNLDNEISTTSSLPSNLFWRSRSQPPFGENLNHVNTPCGPNFLNTESSQQVSLLNHTDPSRTLGSSHQAVGVGLSGSTRSVGLGSTNRTSMFGTPRSTHQRRALRMTRFTQNRDSIPGLLSSSSSNSSLLGRYRTISGVNSRPQSIDPSVCESHLSRLLRFSSLRFDDSVSDEAETSVKRQESPLGDCSNDEFAELPVRLGPTHYNFLPANRSSEQIPLSHSLPTSNSPSHEPPQEQPPLNPGNTHTNNLSLIPDSVISTNSDSDNDNQDGNCPASATSGDQTSIWIPSTPKQCVVKFPKRGDLDHRRSVTGASSSYQPEADHDFYQDSCFASKSSHRSSDHVYKTFAKLNELRCHGLFCDVVLQAGSVKIPAHRNVLAASSQYFHAMFTGSMTEARSPCVEFRGIESSALIQLVNFIYTNEINVNEENVQTLLPAANLLQLTAVRDICCEFLQFQLHPSNCLGIQRFADLHNCQDLLDFTRRFTEQHFGELLKQDDEFVKLSSDQLIELISSDRLAVSEDQVFEAVLRWIAHNPGKRQTEAQNLCSHVRFALLPRDYLVRLSQSDNFLTVNPWCKDYLIEALSYHLLPWDQKLRMASERTKPRTPVGLPKILLVIGGQAPKAIRSVECFEFQGGSWTSLSGDFVQKDNSSSSTSQLMCNPSTSSQPTSNGYANSTIPNVNCNSDSICNLIISDLPSRRCRTGVAVLGGLMYVIGGFNGSLRVRSVEVYDLLRNTWHSGPNMECRRATLGVAVLNGLIYAVGGFDGTVGLNSAEVLDIWSGSWRPIPSMTYQRSSVGVGALDGKLYAVGGYDGTVRRCLSSVECYDPVSDSWSLVSEMTCRRSGPSVCELNNRLYAVGGHDGPTVQTSGEVFSPETGTWQRIADLNVKRRNAGLVAHDGFLYIIGGEDGENNLTSIEKYDPIGNTWSILPSHLTIGRSYAGVAIIERSFI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.8	Very low	30.9	Very low	248 Å²	248	167.7 Å²	167.7	100%	1.222	85%	0.853	S	S	*	*				0	135.3	0	-82	158.4	160.1	0	0	106.9
2	S	31.5	Very low	31	Very low	94 Å²	94	165.8 Å²	165.8	66%	0.657	85%	0.846	S	S	*	*			trans	-68.2	163.2	175	43.3	0	0	0	0	110.4
3	F	30.1	Very low	31.2	Very low	194 Å²	194	164 Å²	164	85%	0.851	84%	0.84	S	S	*	*			cis	-137.4	156.5	33.7	-87.5	-97.3	0	0	0	115.3
4	Y	35.1	Very low	31.3	Very low	209 Å²	209	165.1 Å²	165.1	82%	0.82	84%	0.84	S	S	*	*			trans	-76.2	156.5	153.3	-93.5	-107.1	0	0	0	109.2
5	D	32.4	Very low	31.3	Very low	164 Å²	164	165.4 Å²	165.4	88%	0.877	84%	0.844	S	S	*	*				-163	160.8	114	-95.2	-23.9	0	0	0	110.8
6	S	34	Very low	31.2	Very low	104 Å²	104	161.1 Å²	161.1	73%	0.727	83%	0.834	S	S	*	*			trans	-110	158.1	-163.9	54.7	0	0	0	0	114.2
7	E	29.3	Very low	31.4	Very low	175 Å²	175	165.6 Å²	165.6	82%	0.818	84%	0.838	S	S	*	*			trans	-65.3	151.4	179.9	-56.7	-180	140	0	0	113.9
8	T	29.4	Very low	31.5	Very low	138 Å²	138	162.2 Å²	162.2	85%	0.847	83%	0.831	S	S	*	*			trans	-130.8	120.1	162	42.9	0	0	0	0	110.2
9	Y	30.2	Very low	31.5	Very low	218 Å²	218	163.7 Å²	163.7	86%	0.855	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-92.5	130.3	171.4	-107.7	-89	0	0	0	110.6
10	T	31.1	Very low	31.5	Very low	132 Å²	132	160.8 Å²	160.8	81%	0.81	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-89.3	121.7	169.3	49.4	0	0	0	0	110.4
11	N	29.4	Very low	31.5	Very low	169 Å²	169	157.9 Å²	157.9	90%	0.904	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-73.6	147.8	165.6	-102.2	-15.8	0	0	0	110.4
12	D	32.1	Very low	31.7	Very low	144 Å²	144	157.1 Å²	157.1	77%	0.77	81%	0.807	S	S	*	*			trans	-149.5	152.7	159.3	-152.4	-0.9	0	0	0	113.3
13	N	33.4	Very low	31.8	Very low	143 Å²	143	157.4 Å²	157.4	77%	0.765	81%	0.809	S	S	*	*			trans	65.6	134.6	173.7	-74.8	-71.8	0	0	0	120.7
14	Q	32.1	Very low	31.8	Very low	179 Å²	179	153 Å²	153	84%	0.836	80%	0.803	S	S	*	*			trans	-96.1	156.8	176.2	-58.1	170.7	-10.5	0	0	110.1
15	N	31.8	Very low	31.6	Very low	170 Å²	170	153.3 Å²	153.3	91%	0.909	80%	0.802	S	S	*	*			trans	-149.2	139.9	143.1	-140.1	-24.6	0	0	0	110.3
16	S	29.8	Very low	31.5	Very low	97 Å²	97	153.1 Å²	153.1	68%	0.678	80%	0.796	S	S	*	*			trans	-154.3	131.3	-174.9	65	0	0	0	0	112.8
17	R	33.6	Very low	31.2	Very low	237 Å²	237	153.8 Å²	153.8	89%	0.894	80%	0.801	S	S	*	*			trans	-169.6	124.3	159.4	-110.9	165	-164.2	-161	2.6	110.7
18	S	33	Very low	31.4	Very low	104 Å²	104	151.2 Å²	151.2	73%	0.727	80%	0.799	S	S	*	*			trans	43.7	139	139.2	59.1	0	0	0	0	120.2
19	E	31.9	Very low	31.5	Very low	192 Å²	192	151.1 Å²	151.1	90%	0.897	80%	0.798	S	S	*	*			cis	-133.8	-164.9	32.2	-73.6	-174.2	137.5	0	0	114.2
20	S	32.7	Very low	31.6	Very low	104 Å²	104	150.2 Å²	150.2	73%	0.727	80%	0.802	S	S	*	*			trans	-135.7	163.2	-157.1	61.5	0	0	0	0	115.7
21	S	31.4	Very low	31.3	Very low	101 Å²	101	151.1 Å²	151.1	71%	0.706	80%	0.802	S	S	*	*			trans	72.3	103.5	151.1	70.6	0	0	0	0	120.5
22	R	32.2	Very low	31.4	Very low	231 Å²	231	149.2 Å²	149.2	87%	0.872	80%	0.796	S	S	*	*				165.1	102.5	124.9	-88.6	164.1	-174.5	-163.7	1.4	108.1
23	S	31.9	Very low	31.2	Very low	101 Å²	101	148.7 Å²	148.7	71%	0.706	79%	0.793	S	S	*	*				62.9	129.8	82	72.1	0	0	0	0	114.4
24	S	31.4	Very low	31	Very low	102 Å²	102	148.4 Å²	148.4	71%	0.713	79%	0.791	S	S	*	*			cis	-179.8	144.1	-9	43.8	0	0	0	0	110.2
25	R	30.4	Very low	30.9	Very low	215 Å²	215	146.1 Å²	146.1	81%	0.811	78%	0.784	S	S	*	*			trans	65.7	124.7	163.8	-68.9	-158.6	155.4	129	0.2	116.9
26	E	29.5	Very low	30.9	Very low	160 Å²	160	144.6 Å²	144.6	75%	0.748	78%	0.776	S	S	*	*				67	113.3	66.1	-66.1	-179.8	127.8	0	0	113.8
27	S	28.3	Very low	31	Very low	118 Å²	118	146.5 Å²	146.5	83%	0.825	77%	0.774	S	S	*	*			trans	-174.4	128.3	143.9	49.3	0	0	0	0	112.1
28	P	34.5	Very low	31	Very low	120 Å²	120	142 Å²	142	78%	0.779	77%	0.767	S	S	*	*			trans	-94.7	136.5	161.1	34.1	-28.9	0	0	0	112
29	V	30.7	Very low	31	Very low	137 Å²	137	141.5 Å²	141.5	83%	0.83	76%	0.763	S	S	*	*			trans	48.6	112	153.6	-171.4	0	0	0	0	119.2
30	Q	31.6	Very low	31.1	Very low	198 Å²	198	138.3 Å²	138.3	93%	0.925	76%	0.757	S	S	*	*			trans	-148.5	162.6	131.7	-114	175.7	19.5	0	0	110.7
31	N	26.1	Very low	31.1	Very low	152 Å²	152	139.5 Å²	139.5	81%	0.813	76%	0.76	S	S	*	*			trans	-116.9	175.6	-162.7	-128.7	0.6	0	0	0	112.5
32	V	30.2	Very low	31.2	Very low	128 Å²	128	140 Å²	140	78%	0.776	76%	0.764	S	S	*	*			trans	111.9	102.3	172.8	175.4	0	0	0	0	111.8
33	N	28.5	Very low	31.2	Very low	133 Å²	133	134.1 Å²	134.1	71%	0.711	76%	0.758	S	S	*	*				71.8	136	69.5	-84.3	15.5	0	0	0	114
34	L	29.5	Very low	31	Very low	137 Å²	137	136.9 Å²	136.9	72%	0.717	76%	0.764	S	S	*	*			cis	-130.4	-164.4	-7.8	-59.9	94	0	0	0	108.1
35	D	30.1	Very low	31.2	Very low	131 Å²	131	137.2 Å²	137.2	70%	0.701	76%	0.764	S	S	*	*			cis	-143.7	-160.7	1	-54.1	-90.9	0	0	0	106.9
36	N	32.2	Very low	31	Very low	138 Å²	138	131.1 Å²	131.1	74%	0.738	75%	0.754	S	S	*	*			cis	-166.9	166.2	-15.9	-130	-8.2	0	0	0	107.2
37	E	32.2	Very low	30.9	Very low	137 Å²	137	130.7 Å²	130.7	64%	0.64	76%	0.757	S	S	*	*			cis	-127.4	-113.4	-23.2	-164	-148.9	121.4	0	0	106.5	S39	E37-S39 PolarHBondContact OE1-N 3.15Å
38	I	33.5	Very low	30.9	Very low	143 Å²	143	132.2 Å²	132.2	73%	0.733	76%	0.755	S	S	*	*			cis	-130.7	114	-13.8	-62	169.9	0	0	0	108.8
39	S	32.8	Very low	30.6	Very low	93 Å²	93	136.9 Å²	136.9	65%	0.65	76%	0.763	S	S	*	*			trans	59.5	150.6	161.9	-62.3	0	0	0	0	119.1	E37	E37-S39 PolarHBondContact OE1-N 3.15Å
40	T	33.9	Very low	30.4	Very low	125 Å²	125	139.9 Å²	139.9	77%	0.767	76%	0.76	S	S	*	*			cis	-135.9	149.3	18.6	45.2	0	0	0	0	114.6
41	T	32.9	Very low	30.2	Very low	129 Å²	129	142 Å²	142	79%	0.791	76%	0.759	S	S	*	*			trans	-11.1	146.5	152.1	56	0	0	0	0	118.5
42	S	32.8	Very low	30.4	Very low	113 Å²	113	139.1 Å²	139.1	79%	0.79	75%	0.751	S	S	*	*			cis	-172.5	-167	-1.7	55.3	0	0	0	0	107.9
43	S	32.3	Very low	30.3	Very low	107 Å²	107	143.1 Å²	143.1	75%	0.748	75%	0.752	S	S	*	*			cis	-159.3	-166.6	12.6	60.8	0	0	0	0	111.8
44	L	28.3	Very low	30.4	Very low	158 Å²	158	142.8 Å²	142.8	83%	0.827	76%	0.76	S	S	*	*			trans	-150.4	169.2	178.2	-97.8	170.5	0	0	0	107.5
45	P	35.2	Very low	30.4	Very low	110 Å²	110	143.3 Å²	143.3	71%	0.714	76%	0.759	S	S	*	*			cis	-156.4	166.4	43	43.5	-21.3	0	0	0	121.3
46	S	26.7	Very low	30.7	Very low	87 Å²	87	142.4 Å²	142.4	61%	0.608	76%	0.76	S	S	*	*			trans	68.3	144.5	138.8	68	0	0	0	0	123.8
47	N	26.3	Very low	31.5	Very low	151 Å²	151	141.8 Å²	141.8	81%	0.807	76%	0.763	S	S	*	*			trans	84.8	154.6	158.4	-59.5	-31.4	0	0	0	119.8
48	L	28.3	Very low	31.5	Very low	150 Å²	150	145.3 Å²	145.3	79%	0.785	78%	0.777	S	S	*	*			trans	69.6	82.5	175.7	-58.5	177	0	0	0	117.9
49	F	28	Very low	31.4	Very low	217 Å²	217	141.6 Å²	141.6	95%	0.952	77%	0.774	S	S	*	*			trans	-85.1	112.2	151.7	-96.6	-79.6	0	0	0	110.3
50	W	27.6	Very low	31.4	Very low	200 Å²	200	145.2 Å²	145.2	76%	0.758	78%	0.781	S	S	*	*			trans	-109.5	123.9	165.6	-85.8	89.9	0	0	0	110.9
51	R	27	Very low	31.4	Very low	243 Å²	243	145.3 Å²	145.3	92%	0.917	78%	0.776	S	S	*	*			trans	-139.9	79.2	159.1	-86.3	-163.4	173.2	-150.8	-0.1	109.7
52	S	29.6	Very low	31.4	Very low	91 Å²	91	145.6 Å²	145.6	64%	0.636	77%	0.773	S	S	*	*			trans	-68.3	130.4	155.6	38	0	0	0	0	107.8
53	R	27.7	Very low	31.4	Very low	213 Å²	213	145.7 Å²	145.7	80%	0.804	76%	0.764	S	S	*	*				56.9	108	54	-77.9	-165.4	172.9	-127.5	2.2	113.8
54	S	31.1	Very low	31.4	Very low	125 Å²	125	148.6 Å²	148.6	87%	0.874	77%	0.766	S	S	*	*			trans	-127.9	118.7	138.5	50	0	0	0	0	108.4
55	Q	30.9	Very low	31.7	Very low	149 Å²	149	146.8 Å²	146.8	70%	0.696	76%	0.761	S	S	*	*			trans	-125.2	150.6	163.9	-89.2	-171.9	-54.1	0	0	106.9
56	P	35.1	Very low	31.6	Very low	111 Å²	111	148.4 Å²	148.4	72%	0.721	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-71.5	156.8	172.9	31.7	-35.2	0	0	0	111.7
57	P	48.9	Very low	31.6	Very low	125 Å²	125	150.6 Å²	150.6	81%	0.812	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-83.8	161.2	-177	33.4	-35.6	0	0	0	114.9
58	F	33.2	Very low	32.4	Very low	211 Å²	211	148.8 Å²	148.8	93%	0.925	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-83.5	173.6	172.3	-65.2	-103.8	0	0	0	111
59	G	31.6	Very low	32.5	Very low	65 Å²	65	148.3 Å²	148.3	67%	0.67	78%	0.777	S	S	*	*			cis	-152.8	-157.8	3.2	0	0	0	0	0	110.5
60	E	33.2	Very low	32.6	Very low	170 Å²	170	141 Å²	141	79%	0.794	76%	0.763	S	S	*	*			cis	-151.2	173.1	8.9	-47.6	-176.7	131.5	0	0	111.7
61	N	32.7	Very low	33.3	Very low	126 Å²	126	136.7 Å²	136.7	67%	0.674	76%	0.761	S	S	*	*			trans	60.6	131.1	142.9	-71.9	-34.5	0	0	0	120.1
62	L	33.4	Very low	33.4	Very low	136 Å²	136	131.3 Å²	131.3	71%	0.712	75%	0.751	S	S	*	*			cis	-153.6	158.4	16	-91.8	130.7	0	0	0	112.9
63	N	33.2	Very low	33.4	Very low	115 Å²	115	136.7 Å²	136.7	62%	0.615	76%	0.763	S	S	*	*			trans	64	108.6	149.5	-63.1	-8.5	0	0	0	120.4
64	H	32.4	Very low	33.5	Very low	168 Å²	168	133.6 Å²	133.6	78%	0.778	76%	0.762	S	S	*	*				88	139	92.1	-77.1	-44.7	0	0	0	114.2
65	V	34.3	Very low	33.5	Very low	119 Å²	119	133.8 Å²	133.8	72%	0.721	75%	0.753	S	S	*	*			cis	-142.8	143	16	179.7	0	0	0	0	112.6
66	N	31.8	Very low	33.6	Very low	145 Å²	145	132.2 Å²	132.2	78%	0.775	75%	0.754	S	S	*	*			trans	24.7	139.6	155.7	-50.5	-5.1	0	0	0	125.1
67	T	27.4	Very low	33.4	Very low	132 Å²	132	135.7 Å²	135.7	81%	0.81	76%	0.76	S	S	*	*			trans	-107.3	-162.4	151.1	62	0	0	0	0	108.7
68	P	42.2	Very low	32.6	Very low	113 Å²	113	134.7 Å²	134.7	73%	0.734	76%	0.756	S	S	*	*			cis	-132.5	171.7	-17.5	39.2	-23.2	0	0	0	114.9
69	C	32	Very low	32.4	Very low	140 Å²	140	129.8 Å²	129.8	95%	0.946	75%	0.748	S	S	*	*			trans	-171.6	158.2	138.4	-119.5	0	0	0	0	112.7
70	G	29.9	Very low	32.3	Very low	64 Å²	64	135.6 Å²	135.6	66%	0.66	76%	0.758	S	S	*	*			trans	-158.5	-154.4	173.5	0	0	0	0	0	109.6
71	P	41.9	Very low	32.1	Very low	109 Å²	109	137 Å²	137	71%	0.708	76%	0.764	S	S	*	*			cis	-140.2	-172.5	-8.7	43.7	-26.1	0	0	0	114.9
72	N	29.3	Very low	32.1	Very low	131 Å²	131	137 Å²	137	70%	0.701	77%	0.768	S	S	*	*			trans	60.8	128	154.5	-60.1	-11.6	0	0	0	122
73	F	30.2	Very low	31.9	Very low	203 Å²	203	135.9 Å²	135.9	89%	0.89	77%	0.772	S	S	*	*				-174.3	-175.4	97.1	-106.9	-75.5	0	0	0	112.2
74	L	29.9	Very low	31.9	Very low	149 Å²	149	137.4 Å²	137.4	78%	0.78	78%	0.779	S	S	*	*			trans	-120.8	157.8	-161.4	-85.7	166.4	0	0	0	115.7
75	N	30.9	Very low	31.9	Very low	129 Å²	129	136.7 Å²	136.7	69%	0.69	78%	0.78	S	S	*	*			trans	86.4	122.5	147.8	-73.2	1.9	0	0	0	124.1
76	T	31.9	Very low	31.7	Very low	116 Å²	116	136.3 Å²	136.3	71%	0.712	77%	0.774	S	S	*	*			trans	64.9	120.8	135.6	56.5	0	0	0	0	123.5
77	E	31	Very low	31.8	Very low	184 Å²	184	136.4 Å²	136.4	86%	0.86	77%	0.77	S	S	*	*			trans	54.5	139.4	133.2	-60.9	-165.2	168.6	0	0	120.5
78	S	31.6	Very low	32	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	76%	0.762	S	S	*	*			cis	-163.7	169.4	21.3	45.7	0	0	0	0	114
79	S	30	Very low	31.5	Very low	108 Å²	108	136.8 Å²	136.8	76%	0.755	77%	0.765	S	S	*	*			trans	53.5	103.2	146.5	-61.7	0	0	0	0	123.5
80	Q	29.8	Very low	31.9	Very low	188 Å²	188	135.7 Å²	135.7	88%	0.879	76%	0.756	S	S	*	*			trans	36.6	123.8	135.4	-59	-175.6	0.7	0	0	121.8
81	Q	29.1	Very low	31.8	Very low	200 Å²	200	138.1 Å²	138.1	94%	0.935	76%	0.763	S	S	*	*				-153	142.4	121.4	-121.3	177.6	20.1	0	0	116.5
82	V	31.2	Very low	31.3	Very low	124 Å²	124	144.9 Å²	144.9	75%	0.752	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-62.7	155.8	178.1	169.8	0	0	0	0	114.2
83	S	30.6	Very low	31.4	Very low	113 Å²	113	145 Å²	145	79%	0.79	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-90.4	139	166.7	46.5	0	0	0	0	113.3
84	L	32.8	Very low	31.6	Very low	148 Å²	148	144.1 Å²	144.1	78%	0.775	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-81	170.1	-176.9	-73.1	139.4	0	0	0	111.9
85	L	32.2	Very low	31.6	Very low	152 Å²	152	140.2 Å²	140.2	80%	0.796	78%	0.779	S	S	*	*				-166.7	152.2	66.5	-70	151.2	0	0	0	107.7
86	N	30.6	Very low	31.6	Very low	111 Å²	111	139.8 Å²	139.8	59%	0.594	79%	0.787	S	S	*	*			cis	-157.1	-172.1	0.3	-129.3	-15.3	0	0	0	107.4
87	H	33.2	Very low	31.6	Very low	148 Å²	148	138.6 Å²	138.6	69%	0.685	78%	0.783	S	S	*	*			cis	-151.4	169.9	11	-141.6	-73.6	0	0	0	111.2
88	T	32.1	Very low	31.8	Very low	104 Å²	104	137.4 Å²	137.4	64%	0.638	78%	0.777	S	S	*	*			trans	-40.7	126.3	175.5	54.7	0	0	0	0	120.8
89	D	31.2	Very low	31.9	Very low	149 Å²	149	141.1 Å²	141.1	80%	0.797	78%	0.783	S	S	*	*				37.9	157.7	103.2	-75.8	-20.5	0	0	0	123
90	P	40.3	Very low	31.9	Very low	117 Å²	117	140.5 Å²	140.5	76%	0.76	78%	0.784	S	S	*	*			cis	-140.2	-162.8	-32.5	40.4	-21.4	0	0	0	113.9
91	S	28.8	Very low	32.1	Very low	115 Å²	115	138.2 Å²	138.2	80%	0.804	78%	0.783	S	S	*	*			trans	-62.1	151.3	-167.7	55.4	0	0	0	0	119.7
92	R	31.2	Very low	32.2	Very low	250 Å²	250	131.8 Å²	131.8	94%	0.943	77%	0.77	S	S	*	*			trans	-150.2	159.6	150.2	-117.9	-177.7	-173	-165.9	2.4	113.1
93	T	31.2	Very low	32.4	Very low	135 Å²	135	132.7 Å²	132.7	83%	0.828	78%	0.775	S	S	*	*			trans	-100.6	141.6	-165.2	49.3	0	0	0	0	115.6
94	L	33.8	Very low	32.4	Very low	183 Å²	183	130.5 Å²	130.5	96%	0.958	77%	0.771	S	S	*	*			trans	-158	152.8	151.9	-92.2	163.2	0	0	0	105.6
95	G	29.9	Very low	32.6	Very low	67 Å²	67	131.7 Å²	131.7	69%	0.691	78%	0.777	S	S	*	*			cis	156.9	131.3	0.3	0	0	0	0	0	108.2
96	S	31.5	Very low	32.6	Very low	121 Å²	121	130 Å²	130	85%	0.846	78%	0.778	S	S	*	*			trans	-85.5	174.2	175.6	71	0	0	0	0	110.4
97	S	32.3	Very low	32.7	Very low	90 Å²	90	128 Å²	128	63%	0.629	78%	0.783	S	S	*	*			cis	-159.5	-152.6	16	49.7	0	0	0	0	110.6
98	H	34.6	Very low	32.7	Very low	159 Å²	159	126.4 Å²	126.4	74%	0.736	79%	0.789	S	S	*	*			trans	80.5	139.8	-176.5	-55.8	-90.6	0	0	0	116
99	Q	33.4	Very low	32.6	Very low	182 Å²	182	127.5 Å²	127.5	85%	0.85	80%	0.796	S	S	*	*			cis	-152.5	172.9	-11.6	-129	166.9	5.4	0	0	110.8
100	A	30.4	Very low	32.7	Very low	94 Å²	94	132.4 Å²	132.4	78%	0.777	80%	0.803	S	S	*	*			trans	-118.2	142.2	-168.6	0	0	0	0	0	115.4
101	V	34.3	Very low	32.2	Very low	141 Å²	141	131.6 Å²	131.6	86%	0.855	80%	0.8	S	S	*	*			trans	-144.5	129.3	156.2	-167.7	0	0	0	0	104
102	G	30.2	Very low	32.3	Very low	64 Å²	64	133.2 Å²	133.2	66%	0.66	81%	0.805	S	S	*	*				72.1	127.4	72.4	0	0	0	0	0	110.5
103	V	35.8	Very low	32.3	Very low	144 Å²	144	124.9 Å²	124.9	87%	0.873	80%	0.797	S	S	*	*			cis	-155.4	140.8	17.2	173.9	0	0	0	0	111
104	G	31.1	Very low	32.2	Very low	67 Å²	67	127.3 Å²	127.3	69%	0.691	80%	0.804	S	S	*	*			trans	73.2	152.4	150.8	0	0	0	0	0	119.3
105	L	35.8	Very low	32	Very low	173 Å²	173	122.5 Å²	122.5	91%	0.906	80%	0.799	S	S	*	*			cis	-150.7	153	-7.5	-97	172.7	0	0	0	110.6
106	S	33.6	Very low	32.1	Very low	116 Å²	116	124.6 Å²	124.6	81%	0.811	80%	0.803	S	S	*	*			trans	-81	162.3	168.5	50.2	0	0	0	0	112.4
107	G	31.2	Very low	32.3	Very low	69 Å²	69	125.6 Å²	125.6	71%	0.711	80%	0.804	S	S	*	*			cis	159.9	-164.5	-1	0	0	0	0	0	112.7
108	S	34.2	Very low	32.2	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	81%	0.813	S	S	*	*			trans	60.5	99.3	158.5	-58.7	0	0	0	0	122
109	T	30.6	Very low	32.1	Very low	127 Å²	127	131.9 Å²	131.9	78%	0.779	82%	0.819	S	S	*	*				18	125.9	128.1	59.9	0	0	0	0	121.1
110	R	31.7	Very low	32.1	Very low	251 Å²	251	129.3 Å²	129.3	95%	0.947	82%	0.815	S	S	*	*				-172	-170.1	103.7	-107	-176.9	176.4	-171.1	-1.1	112.3
111	S	30.9	Very low	32.1	Very low	101 Å²	101	129.3 Å²	129.3	71%	0.706	81%	0.81	S	S	*	*			trans	-128.1	169.6	-150.9	52.8	0	0	0	0	115.4
112	V	31.2	Very low	32.1	Very low	148 Å²	148	129.6 Å²	129.6	90%	0.897	80%	0.804	S	S	*	*			trans	87.9	127.7	166.5	-170.3	0	0	0	0	116.4
113	G	29.7	Very low	32.2	Very low	76 Å²	76	135.8 Å²	135.8	78%	0.784	81%	0.813	S	S	*	*			trans	173.9	111.6	170.9	0	0	0	0	0	110.7
114	L	30.8	Very low	31.9	Very low	186 Å²	186	132.7 Å²	132.7	97%	0.974	81%	0.81	S	S	*	*			trans	-90.4	149.4	177.9	-77.5	158.8	0	0	0	110.9
115	G	29.2	Very low	32.1	Very low	82 Å²	82	135.9 Å²	135.9	85%	0.845	82%	0.816	S	S	*	*			trans	179.1	116.9	170.5	0	0	0	0	0	112.9
116	S	30.8	Very low	32.3	Very low	111 Å²	111	133.1 Å²	133.1	78%	0.776	81%	0.809	S	S	*	*			trans	-124.3	145.7	170.5	98.1	0	0	0	0	109.9
117	T	36.8	Very low	32.2	Very low	142 Å²	142	139.8 Å²	139.8	87%	0.871	82%	0.816	S	S	*	*			trans	-166.2	147.2	146.3	6.7	0	0	0	0	110.1
118	N	29.8	Very low	32.3	Very low	152 Å²	152	141.8 Å²	141.8	81%	0.813	82%	0.819	S	S	*	*			trans	-90.6	152.1	172.6	-69.8	-61.2	0	0	0	110.4
119	R	33.5	Very low	32.5	Very low	228 Å²	228	143.3 Å²	143.3	86%	0.86	82%	0.824	S	S	*	*				176.9	146.3	112	-100.4	-177.8	174.6	-166.4	-1.2	116.7
120	T	32.3	Very low	32.5	Very low	128 Å²	128	146 Å²	146	79%	0.785	83%	0.827	S	S	*	*			trans	64.4	130.6	145.5	51.4	0	0	0	0	122.7
121	S	31.5	Very low	32.6	Very low	94 Å²	94	143.5 Å²	143.5	66%	0.657	83%	0.826	S	S	*	*			trans	-72.3	164	166	52.5	0	0	0	0	115
122	M	33.4	Very low	32.7	Very low	148 Å²	148	150 Å²	150	73%	0.729	84%	0.836	S	S	*	*				-177.6	145.6	113.2	-94.4	-45.8	-170.6	0	0	114
123	F	32.5	Very low	32.7	Very low	193 Å²	193	155.3 Å²	155.3	85%	0.846	84%	0.839	S	S	*	*			trans	39.2	138.6	157.1	-66	-65.9	0	0	0	124.1
124	G	30	Very low	32.5	Very low	79 Å²	79	156.3 Å²	156.3	81%	0.814	84%	0.84	S	S	*	*			trans	164	82.9	165.1	0	0	0	0	0	115.5
125	T	34.2	Very low	32.6	Very low	134 Å²	134	155.4 Å²	155.4	82%	0.822	84%	0.835	S	S	*	*			trans	-107.3	179.3	175.6	60.4	0	0	0	0	110.9
126	P	40.1	Very low	32.6	Very low	115 Å²	115	161.7 Å²	161.7	75%	0.747	83%	0.833	S	S	*	*			cis	-129.3	179.9	-14.4	36.5	-19.5	0	0	0	113.7
127	R	32.2	Very low	32.4	Very low	256 Å²	256	164.1 Å²	164.1	97%	0.966	83%	0.834	S	S	*	*			trans	-146.1	139	144.6	-114.9	-177.4	-174.9	-174.5	1.9	110.8
128	S	32.3	Very low	32.1	Very low	111 Å²	111	164.4 Å²	164.4	78%	0.776	84%	0.836	S	S	*	*			trans	-131	147.1	179.4	57.2	0	0	0	0	111.1
129	T	38.4	Very low	32	Very low	148 Å²	148	167.8 Å²	167.8	91%	0.908	84%	0.837	S	S	*	*			trans	-156.8	135.7	157	2.4	0	0	0	0	108.7
130	H	32.1	Very low	31.8	Very low	183 Å²	183	166.1 Å²	166.1	85%	0.847	84%	0.837	S	S	*	*			trans	-78.7	150.4	177.9	-69.5	-79	0	0	0	111.8
131	Q	33.7	Very low	31.6	Very low	198 Å²	198	165.9 Å²	165.9	93%	0.925	84%	0.836	S	S	*	*				-150.2	149.9	119.5	-112.3	174.2	22.5	0	0	112
132	R	31.7	Very low	31.7	Very low	239 Å²	239	170 Å²	170	90%	0.902	85%	0.845	S	S	*	*			trans	-93	150.4	-178.5	-65.4	171.1	169.3	171.5	-5.5	110.5
133	R	30.7	Very low	31.4	Very low	259 Å²	259	170.4 Å²	170.4	98%	0.977	85%	0.849	S	S	*	*			trans	-153.2	121.9	137.5	-127.2	175.1	-176.7	179.5	0.7	113
134	A	27	Very low	31.2	Very low	96 Å²	96	172.8 Å²	172.8	79%	0.793	85%	0.853	S	S	*	*			trans	-153.8	118.5	167.3	0	0	0	0	0	108.7
135	L	31.8	Very low	31.1	Very low	167 Å²	167	175.8 Å²	175.8	87%	0.874	85%	0.85	S	S	*	*			trans	-176	113.8	173	-97.3	166.2	0	0	0	103.2
136	R	30	Very low	30.9	Very low	214 Å²	214	175.5 Å²	175.5	81%	0.808	85%	0.853	S	S	*	*			cis	98.4	101.4	34.7	-164.4	-175.7	-159.9	-166.3	7.9	112.4
137	M	26.1	Very low	30.3	Very low	162 Å²	162	178 Å²	178	80%	0.798	86%	0.859	S	S	*	*			trans	59.8	128.8	156.6	-69.6	179.3	162.6	0	0	121
138	T	31.3	Very low	30.5	Very low	148 Å²	148	171.3 Å²	171.3	91%	0.908	85%	0.848	S	S	*	*				-150	154.8	125.4	7.8	0	0	0	0	110.1
139	R	27	Very low	30.4	Very low	223 Å²	223	169.4 Å²	169.4	84%	0.842	85%	0.846	S	S	*	*			trans	-90.6	154.5	173	-69.1	175.6	174.5	157.9	-4.7	110.1
140	F	28.8	Very low	30	Very low	194 Å²	194	170.1 Å²	170.1	85%	0.851	84%	0.844	S	S	*	*			trans	-136	136.9	145.9	-108.2	-84.5	0	0	0	109.9
141	T	27.8	Very low	29.8	Very low	123 Å²	123	169.4 Å²	169.4	76%	0.755	85%	0.845	S	S	*	*			trans	-142.7	118.3	176.8	47.9	0	0	0	0	108
142	Q	34.1	Very low	29.5	Very low	181 Å²	181	164.8 Å²	164.8	85%	0.846	84%	0.835	S	S	*	*			trans	-141.5	126.9	164.3	-76.6	-167.4	-20.1	0	0	109.2
143	N	26.5	Very low	29.4	Very low	155 Å²	155	158.8 Å²	158.8	83%	0.829	83%	0.83	S	S	*	*			trans	-75.7	147.3	162.3	-74	-0.1	0	0	0	109.1
144	R	28.9	Very low	29.2	Very low	244 Å²	244	152.1 Å²	152.1	92%	0.921	82%	0.823	S	S	*	*				-159.5	152.4	127.8	-115.7	174.6	-178.1	-172.4	-0.5	112.4
145	D	27.9	Very low	29.3	Very low	142 Å²	142	153.4 Å²	153.4	76%	0.759	83%	0.826	S	S	*	*			trans	-85.7	148.3	-165.8	-42.2	-98.7	0	0	0	112.4
146	S	29.5	Very low	29	Very low	127 Å²	127	151.1 Å²	151.1	89%	0.888	82%	0.824	S	S	*	*			trans	-164.2	114.5	159.2	-80.4	0	0	0	0	112.4
147	I	29.1	Very low	29	Very low	167 Å²	167	148.5 Å²	148.5	86%	0.856	83%	0.826	S	S	*	*			trans	-149.6	149.3	176.2	-75.7	-179.9	0	0	0	104.3
148	P	36.6	Very low	29.2	Very low	116 Å²	116	145.2 Å²	145.2	75%	0.753	82%	0.819	S	S	*	*			cis	-132.7	-171.8	15.6	29.9	-6.1	0	0	0	116.1
149	G	29.4	Very low	29	Very low	71 Å²	71	143.2 Å²	143.2	73%	0.732	81%	0.811	S	S	*	*			trans	158.3	76.7	163.6	0	0	0	0	0	112.1
150	L	29	Very low	29.1	Very low	163 Å²	163	141 Å²	141	85%	0.853	82%	0.815	S	S	*	*				56.7	108.5	72.9	-80.4	176.1	0	0	0	116.1
151	L	29.5	Very low	28.9	Very low	168 Å²	168	140.1 Å²	140.1	88%	0.88	82%	0.818	S	S	*	*			trans	162.6	105.8	149.7	-88.5	175.8	0	0	0	105.3
152	S	26.6	Very low	28.9	Very low	102 Å²	102	137.6 Å²	137.6	71%	0.713	82%	0.817	S	S	*	*			cis	95.5	78.1	43.1	79.3	0	0	0	0	115.3
153	S	29.5	Very low	28.5	Very low	113 Å²	113	140.4 Å²	140.4	79%	0.79	82%	0.82	S	S	*	*			trans	-160.4	127.2	146.1	54.2	0	0	0	0	108
154	S	25.9	Very low	28.5	Very low	118 Å²	118	144.3 Å²	144.3	83%	0.825	82%	0.824	S	S	*	*			cis	77.4	77.1	27.1	90.3	0	0	0	0	115.1
155	S	30	Very low	28.5	Very low	124 Å²	124	143.7 Å²	143.7	87%	0.867	82%	0.822	S	S	*	*			trans	-136.8	104.7	160.2	50.4	0	0	0	0	110.1
156	S	25.9	Very low	28.3	Very low	119 Å²	119	143.4 Å²	143.4	83%	0.832	83%	0.825	S	S	*	*			trans	-94.5	129.4	175.7	-55.5	0	0	0	0	110
157	N	29.8	Very low	28.3	Very low	159 Å²	159	144.9 Å²	144.9	85%	0.85	82%	0.822	S	S	*	*			trans	-157.4	107.2	159.4	-92.9	-22.7	0	0	0	106.3
158	S	30.5	Very low	28.1	Very low	92 Å²	92	142.1 Å²	142.1	64%	0.643	82%	0.818	S	S	*	*				98.9	93.1	61.5	66.7	0	0	0	0	111.5
159	S	26.1	Very low	27.5	Very low	107 Å²	107	140.4 Å²	140.4	75%	0.748	82%	0.821	S	S	*	*			trans	47.6	112.7	148.8	59.5	0	0	0	0	120.2
160	L	29.1	Very low	27.5	Very low	177 Å²	177	143.3 Å²	143.3	93%	0.927	82%	0.824	S	S	*	*				-155.9	106	110.4	-108.3	169.3	0	0	0	110.5	G162	L160-G162 PolarHBondContact O-N 3.17Å
161	L	24.6	Very low	27.2	Very low	174 Å²	174	143.6 Å²	143.6	91%	0.911	83%	0.826	S	S	*	*			trans	-89.3	96.9	173.4	-92.2	114.9	0	0	0	110.6
162	G	27.7	Very low	27.3	Very low	70 Å²	70	141 Å²	141	72%	0.722	82%	0.822	S	S	*	*			trans	-77.4	129.3	162.5	0	0	0	0	0	110.6	L160 Y164	L160-G162 PolarHBondContact O-N 3.17Å; G162-Y164 PolarHBondContact O-N 3.26Å
163	R	26.9	Very low	27.2	Very low	241 Å²	241	147.6 Å²	147.6	91%	0.909	83%	0.832	S	S	*	*			trans	-79.5	119.5	-177.3	-65.9	174.5	178.7	165.1	-1.3	111.5
164	Y	26.6	Very low	27.2	Very low	236 Å²	236	148 Å²	148	93%	0.925	83%	0.832	S	S	*	*			trans	-117.3	116.3	148.1	-86.2	-86.6	0	0	0	109	G162	G162-Y164 PolarHBondContact O-N 3.26Å
165	R	28.9	Very low	27.4	Very low	231 Å²	231	151.1 Å²	151.1	87%	0.872	83%	0.833	S	S	*	*			trans	-88.7	126.4	167.6	-93	-173.8	170.5	179.1	-3.8	108.3
166	T	23.5	Very low	27.2	Very low	136 Å²	136	150.4 Å²	150.4	83%	0.834	83%	0.828	S	S	*	*			trans	-62.1	140.2	155.9	40.9	0	0	0	0	109.5
167	I	29.1	Very low	27.4	Very low	158 Å²	158	152.9 Å²	152.9	81%	0.81	83%	0.83	S	S	*	*			trans	-132	108.1	162.8	-60.3	-178.5	0	0	0	106.9
168	S	24	Very low	27.2	Very low	110 Å²	110	152.7 Å²	152.7	77%	0.769	83%	0.83	S	S	*	*			trans	-129.2	136.8	165.5	50.9	0	0	0	0	108.3
169	G	24	Very low	27.5	Very low	80 Å²	80	153.6 Å²	153.6	83%	0.825	83%	0.833	S	S	*	*			trans	57.8	96.4	166.5	0	0	0	0	0	118.1
170	V	29.2	Very low	27.6	Very low	132 Å²	132	153.9 Å²	153.9	80%	0.8	84%	0.835	S	S	*	*			trans	-124.9	118.6	152.8	178.2	0	0	0	0	109
171	N	24.4	Very low	27.6	Very low	168 Å²	168	151.2 Å²	151.2	90%	0.898	83%	0.826	S	S	*	*			trans	-76.8	127.7	169.1	-73	-59.9	0	0	0	109.8
172	S	30.7	Very low	27.7	Very low	114 Å²	114	147.9 Å²	147.9	80%	0.797	82%	0.816	S	S	*	*			trans	-117.5	103.3	168.9	48.4	0	0	0	0	111
173	R	25.3	Very low	27.6	Very low	240 Å²	240	152.7 Å²	152.7	91%	0.906	82%	0.82	S	S	*	*			trans	-74.7	147.7	160.2	-84.9	-177.9	169.2	178.7	-3.7	109.2
174	P	28.7	Very low	27.6	Very low	123 Å²	123	146 Å²	146	80%	0.799	81%	0.81	S	S	*	*			trans	-78.6	141.3	-179.4	31.8	-34.9	0	0	0	112.2
175	Q	30.2	Very low	27.7	Very low	182 Å²	182	143.5 Å²	143.5	85%	0.85	81%	0.806	S	S	*	*			trans	-139.1	96.1	161.6	-76.8	-167	-33.5	0	0	111
176	S	25.1	Very low	27.4	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	81%	0.81	S	S	*	*				20.8	113.5	129.3	56.7	0	0	0	0	119.1
177	I	31.2	Very low	27.5	Very low	170 Å²	170	139.5 Å²	139.5	87%	0.872	80%	0.804	S	S	*	*			trans	-134.3	133.8	147.3	-60.7	-178	0	0	0	106.7
178	D	25.7	Very low	27.3	Very low	156 Å²	156	143.5 Å²	143.5	83%	0.834	81%	0.809	S	S	*	*			trans	-89.4	166.1	-176	-99.8	-40	0	0	0	113.4
179	P	35.9	Very low	27.5	Very low	110 Å²	110	146.2 Å²	146.2	71%	0.714	81%	0.814	S	S	*	*			trans	-104.9	-163.9	-156	42.2	-40.7	0	0	0	116.4
180	S	28.6	Very low	27.5	Very low	114 Å²	114	150.2 Å²	150.2	80%	0.797	82%	0.815	S	S	*	*			trans	89.2	143.3	-178.9	80.4	0	0	0	0	114.4
181	V	29.6	Very low	27.3	Very low	121 Å²	121	154.6 Å²	154.6	73%	0.733	82%	0.818	S	S	*	*			cis	-141.2	140.4	20.7	166.2	0	0	0	0	111.6
182	C	26.7	Very low	27.4	Very low	104 Å²	104	156.8 Å²	156.8	70%	0.703	82%	0.82	S	S	*	*			trans	35.3	156.2	151.8	-61	0	0	0	0	123
183	E	24.7	Very low	27	Very low	170 Å²	170	156.4 Å²	156.4	79%	0.794	82%	0.817	S	S	*	*			cis	-161.5	-178.8	-7.2	-120.3	172.9	144.6	0	0	112.3
184	S	26.9	Very low	26.9	Very low	100 Å²	100	150.2 Å²	150.2	70%	0.699	81%	0.811	S	S	*	*			trans	57.3	101.6	167.2	68	0	0	0	0	119.2
185	H	28.6	Very low	26.8	Very low	185 Å²	185	152.8 Å²	152.8	86%	0.856	82%	0.817	S	S	*	*				-173.5	96.5	103.5	-105.9	-81.9	0	0	0	111.2
186	L	23.4	Very low	26.4	Very low	182 Å²	182	154.8 Å²	154.8	95%	0.953	82%	0.816	S	S	*	*			trans	-143.3	97.3	172.2	-106.7	173.6	0	0	0	110.7
187	S	24.8	Very low	26.5	Very low	101 Å²	101	159.5 Å²	159.5	71%	0.706	82%	0.823	S	S	*	*			trans	-168.1	147.1	161.1	66.7	0	0	0	0	110.9
188	R	26.6	Very low	26.1	Very low	241 Å²	241	158.5 Å²	158.5	91%	0.909	82%	0.82	S	S	*	*			trans	67.5	125.9	-172.5	-47.8	175.1	-179.8	-175.9	-1.5	111.6
189	L	26.7	Very low	26.2	Very low	167 Å²	167	159 Å²	159	87%	0.874	82%	0.822	S	S	*	*			cis	-128.6	155.8	27.1	-74.5	157.6	0	0	0	113.5
190	L	24.2	Very low	25.7	Very low	164 Å²	164	158.5 Å²	158.5	86%	0.859	82%	0.821	S	S	*	*			trans	-141.3	150.8	169.1	-88	173.9	0	0	0	108.8
191	R	24.7	Very low	25.8	Very low	225 Å²	225	159.2 Å²	159.2	85%	0.849	82%	0.821	S	S	*	*			trans	70.4	135.2	-172.7	-48.3	178.8	-177	-172.1	-0.3	111.6
192	F	26.6	Very low	25.7	Very low	214 Å²	214	158.2 Å²	158.2	94%	0.939	82%	0.819	S	S	*	*				-132.3	161.7	50.5	-82.9	-90.5	0	0	0	115.4
193	S	21.8	Very low	25.7	Very low	105 Å²	105	161.2 Å²	161.2	73%	0.734	83%	0.828	S	S	*	*			trans	-141.8	127.4	172.1	55.6	0	0	0	0	110.2
194	S	24.9	Very low	25.9	Very low	111 Å²	111	162.5 Å²	162.5	78%	0.776	83%	0.834	S	S	*	*			trans	54	134.3	154.9	-67.7	0	0	0	0	122.9
195	L	25.3	Very low	26.1	Very low	177 Å²	177	162 Å²	162	93%	0.927	84%	0.837	S	S	*	*			trans	78.5	148.2	148	-68.4	164.6	0	0	0	119.8
196	R	23.3	Very low	26	Very low	224 Å²	224	162 Å²	162	85%	0.845	84%	0.837	S	S	*	*			trans	-90.1	145.6	-178.1	-58.7	172.3	178.3	156.1	-2.7	110.2
197	F	27.3	Very low	26.3	Very low	209 Å²	209	160.4 Å²	160.4	92%	0.917	84%	0.835	S	S	*	*			trans	-143.7	143.7	131.4	-104.4	-79	0	0	0	107.8
198	D	22.5	Very low	26.5	Very low	149 Å²	149	161.1 Å²	161.1	80%	0.797	84%	0.84	S	S	*	*			trans	-75.5	138.4	172.9	-59.6	-77.9	0	0	0	109.9
199	D	28	Very low	26.7	Very low	165 Å²	165	156.8 Å²	156.8	88%	0.882	84%	0.84	S	S	*	*			trans	-153.6	144.4	138.6	-127.2	-27.4	0	0	0	110.4
200	S	24	Very low	26.7	Very low	100 Å²	100	158 Å²	158	70%	0.699	84%	0.838	S	S	*	*			trans	-97.1	147.2	-174.8	61.5	0	0	0	0	112.2
201	V	30.2	Very low	26.9	Very low	129 Å²	129	160.1 Å²	160.1	78%	0.782	84%	0.835	S	S	*	*				174.4	140.5	127.7	146	0	0	0	0	112.5
202	S	29.4	Very low	27.1	Very low	100 Å²	100	158.9 Å²	158.9	70%	0.699	84%	0.839	S	S	*	*			trans	49.9	104.4	164.4	65.2	0	0	0	0	120
203	D	25.5	Very low	27.2	Very low	167 Å²	167	155.5 Å²	155.5	89%	0.893	83%	0.826	S	S	*	*			trans	-71.7	137.9	134.7	-70.1	-63.8	0	0	0	109.5
204	E	29.9	Very low	27.7	Very low	197 Å²	197	155.8 Å²	155.8	92%	0.921	83%	0.828	S	S	*	*			trans	-138.8	155.3	148.3	-87.1	-145	144.6	0	0	109.6
205	A	30.8	Very low	28.5	Very low	91 Å²	91	155.5 Å²	155.5	75%	0.752	82%	0.823	S	S	*	*			trans	-103.6	166.7	-156.2	0	0	0	0	0	115.2
206	E	26.6	Very low	28.7	Very low	184 Å²	184	154.3 Å²	154.3	86%	0.86	82%	0.817	S	S	*	*			trans	16.7	117.9	153.4	-59.7	-170.6	134.5	0	0	119.3
207	T	29.6	Very low	29.1	Very low	148 Å²	148	147.4 Å²	147.4	91%	0.908	82%	0.815	S	S	*	*			trans	-129	131	134.2	24.2	0	0	0	0	110.2
208	S	28.8	Very low	29.2	Very low	117 Å²	117	144 Å²	144	82%	0.818	81%	0.806	S	S	*	*			trans	-108.8	139.4	-179.7	53.2	0	0	0	0	110.8
209	V	30.8	Very low	29.6	Very low	149 Å²	149	143.4 Å²	143.4	90%	0.903	81%	0.812	S	S	*	*			trans	-117.9	132.4	174.6	-179.7	0	0	0	0	108.6
210	K	27.4	Very low	29.6	Very low	193 Å²	193	140.3 Å²	140.3	84%	0.839	80%	0.804	S	S	*	*			trans	-149.8	146.9	-172.6	-144.5	175.2	-170.4	175	0	110.9
211	R	28	Very low	30	Very low	208 Å²	208	141.5 Å²	141.5	79%	0.785	80%	0.802	S	S	*	*			trans	70.8	135.1	179.1	-63.7	176.5	157.1	158.8	-3.2	114.1	E213	R211-E213 IonicContact NE-OE2 2.66Å
212	Q	28.8	Very low	30	Very low	200 Å²	200	141.3 Å²	141.3	94%	0.935	80%	0.797	S	S	*	*				-127.2	171.8	55.5	-110.4	169.7	-29.5	0	0	115.8
213	E	28.9	Very low	30	Very low	143 Å²	143	144 Å²	144	67%	0.668	80%	0.799	S	S	*	*			trans	-127.6	162.8	-167.2	-62.8	164.7	111.4	0	0	112.1	R211	R211-E213 IonicContact NE-OE2 2.66Å
214	S	32.3	Very low	30.2	Very low	111 Å²	111	145 Å²	145	78%	0.776	80%	0.795	S	S	*	*			trans	91.2	160.6	141.8	82.5	0	0	0	0	120.4
215	P	40.9	Very low	30.1	Very low	104 Å²	104	139.9 Å²	139.9	68%	0.675	79%	0.786	S	S	*	*				-147.6	-172.6	-55.5	44.1	-28.1	0	0	0	115.8
216	L	30.2	Very low	30	Very low	153 Å²	153	143.7 Å²	143.7	80%	0.801	79%	0.789	S	S	*	*			trans	79.2	146.4	152.5	-72.2	171.6	0	0	0	121.3
217	G	30.4	Very low	30	Very low	78 Å²	78	142 Å²	142	80%	0.804	79%	0.785	S	S	*	*			trans	160.1	77.7	178	0	0	0	0	0	112.5
218	D	30.9	Very low	30.5	Very low	138 Å²	138	140.3 Å²	140.3	74%	0.738	78%	0.776	S	S	*	*			trans	-79.9	154.9	-175	-62	-70.3	0	0	0	115.1
219	C	30.6	Very low	30.5	Very low	136 Å²	136	141.8 Å²	141.8	92%	0.919	78%	0.78	S	S	*	*				-172.8	161.8	121.9	-92.8	0	0	0	0	111.8
220	S	27.5	Very low	30.3	Very low	101 Å²	101	145.7 Å²	145.7	71%	0.706	78%	0.779	S	S	*	*			trans	-121	-163.9	-163	54.9	0	0	0	0	114.4
221	N	32	Very low	30.4	Very low	124 Å²	124	144.8 Å²	144.8	66%	0.663	78%	0.782	S	S	*	*			trans	86.7	142.1	168.7	-60.5	60.8	0	0	0	116.8
222	D	30.7	Very low	30.2	Very low	126 Å²	126	138 Å²	138	67%	0.674	78%	0.777	S	S	*	*			cis	-154.8	132.3	-19.2	-81.8	-33.2	0	0	0	105.4
223	E	30.2	Very low	30.8	Very low	157 Å²	157	134 Å²	134	73%	0.734	77%	0.768	S	S	*	*				96	140.4	74.2	-145.8	-166.9	-151.2	0	0	115.1
224	F	29.5	Very low	30.8	Very low	187 Å²	187	132.7 Å²	132.7	82%	0.82	77%	0.77	S	S	*	*			trans	71.5	168.8	167.7	-82.8	-64.7	0	0	0	123.1
225	A	27.4	Very low	30.6	Very low	89 Å²	89	134.3 Å²	134.3	74%	0.736	77%	0.765	S	S	*	*			trans	-154.4	-172.3	-158.7	0	0	0	0	0	112.9
226	E	28	Very low	30	Very low	171 Å²	171	140.7 Å²	140.7	80%	0.799	78%	0.778	S	S	*	*			trans	95.3	111.1	169.5	-62	-144.2	139	0	0	121
227	L	26.2	Very low	30	Very low	148 Å²	148	138.9 Å²	138.9	78%	0.775	77%	0.769	S	S	*	*				80.5	158.7	128.6	-64.5	176.5	0	0	0	121.1
228	P	40.4	Very low	29.9	Very low	113 Å²	113	145.2 Å²	145.2	73%	0.734	77%	0.774	S	S	*	*			trans	-122.4	171.6	-142.9	43.9	-34.2	0	0	0	116.6
229	V	29.4	Very low	29.7	Very low	148 Å²	148	146.3 Å²	146.3	90%	0.897	78%	0.779	S	S	*	*			trans	-134.9	149.2	171.6	179	0	0	0	0	111.9
230	R	25.9	Very low	30.3	Very low	231 Å²	231	145.6 Å²	145.6	87%	0.872	77%	0.773	S	S	*	*			trans	-116.4	146.1	173.5	-129.2	-170.7	-177.5	-163.4	1.9	109.1
231	L	29.7	Very low	30.4	Very low	174 Å²	174	145 Å²	145	91%	0.911	77%	0.774	S	S	*	*			trans	142.3	150.9	147.5	-76.6	163	0	0	0	113
232	G	25.3	Very low	30.4	Very low	67 Å²	67	145 Å²	145	69%	0.691	77%	0.774	S	S	*	*			trans	-114	-146.7	169.7	0	0	0	0	0	110.9
233	P	39.9	Very low	30.4	Very low	114 Å²	114	149.6 Å²	149.6	74%	0.74	78%	0.782	S	S	*	*			cis	-146.6	-160.3	5.8	42.4	-20.8	0	0	0	115.9
234	T	29.8	Very low	30.5	Very low	116 Å²	116	146.7 Å²	146.7	71%	0.712	78%	0.779	S	S	*	*			trans	83.8	121.8	149.5	44.9	0	0	0	0	124.7
235	H	27.5	Very low	30.6	Very low	145 Å²	145	142.5 Å²	142.5	67%	0.671	77%	0.773	S	S	*	*			trans	59.5	129.5	140.6	-74.5	-69.6	0	0	0	124.4	N237	H235-N237 PolarHBondContact ND1-OD1 3.31Å; H235-N237 VanDerWaalsContact ND1-OD1 3.15Å
236	Y	29	Very low	30.7	Very low	238 Å²	238	147 Å²	147	93%	0.933	78%	0.779	S	S	*	*				-144.2	160.6	112.3	-106.3	-79.4	0	0	0	110.4
237	N	29.5	Very low	30.8	Very low	115 Å²	115	147.8 Å²	147.8	62%	0.615	78%	0.782	S	S	*	*			trans	-117.4	158.9	-170	-64.3	-18.2	0	0	0	113.2	H235	H235-N237 PolarHBondContact ND1-OD1 3.31Å; H235-N237 VanDerWaalsContact ND1-OD1 3.15Å
238	F	29.1	Very low	30.9	Very low	211 Å²	211	148.4 Å²	148.4	93%	0.925	79%	0.785	S	S	*	*			trans	-143.8	139.1	154.3	-99	-79.9	0	0	0	111.8
239	L	27	Very low	30.9	Very low	161 Å²	161	148.2 Å²	148.2	84%	0.843	78%	0.784	S	S	*	*			trans	-163.4	175.1	-179.6	-88.6	178.9	0	0	0	107.5
240	P	41.7	Very low	30.8	Very low	121 Å²	121	149 Å²	149	79%	0.786	78%	0.782	S	S	*	*			cis	-108.1	-150.7	-3.1	33.3	-13.6	0	0	0	110.4
241	A	30.8	Very low	30.9	Very low	88 Å²	88	142.2 Å²	142.2	73%	0.727	77%	0.77	S	S	*	*			cis	-157.2	-158.8	9.6	0	0	0	0	0	108.5
242	N	31.8	Very low	30.9	Very low	125 Å²	125	142.2 Å²	142.2	67%	0.668	77%	0.765	S	S	*	*			cis	-162.1	117.3	4.3	-175.8	28.9	0	0	0	111.8
243	R	31.3	Very low	31	Very low	223 Å²	223	143.2 Å²	143.2	84%	0.842	76%	0.761	S	S	*	*			trans	59.4	144.5	162	-68.8	169.3	-169.3	-150.1	-1.1	118.9
244	S	30.6	Very low	30.6	Very low	95 Å²	95	145.5 Å²	145.5	66%	0.664	77%	0.766	S	S	*	*			cis	-171.9	152.6	-7.4	45.2	0	0	0	0	112.1
245	S	31.5	Very low	31.1	Very low	99 Å²	99	144.9 Å²	144.9	69%	0.692	76%	0.764	S	S	*	*			trans	59.9	143.1	147.2	54.3	0	0	0	0	121
246	E	31.3	Very low	31.2	Very low	185 Å²	185	143.9 Å²	143.9	86%	0.864	77%	0.769	S	S	*	*			cis	-162.5	-166.1	-11.5	-127.9	164.5	-161.7	0	0	113.3
247	Q	29.2	Very low	31.4	Very low	186 Å²	186	137 Å²	137	87%	0.869	76%	0.755	S	S	*	*			trans	-93.4	-166.2	-162.2	-66.3	175.6	-31.6	0	0	116.7
248	I	28.5	Very low	31.5	Very low	162 Å²	162	138.3 Å²	138.3	83%	0.831	76%	0.762	S	S	*	*			trans	-121.2	175	-178	1.6	174.4	0	0	0	108.5
249	P	39.8	Very low	31.7	Very low	108 Å²	108	133.1 Å²	133.1	70%	0.701	75%	0.752	S	S	*	*			cis	-136.9	-156.9	-14.3	32.1	-7	0	0	0	113.9
250	L	28.1	Very low	32.3	Very low	165 Å²	165	130.7 Å²	130.7	86%	0.864	75%	0.746	S	S	*	*			trans	97.5	176.9	160.3	-63.6	167.9	0	0	0	120
251	S	27.7	Very low	31.6	Very low	89 Å²	89	129.6 Å²	129.6	62%	0.622	74%	0.742	S	S	*	*			trans	-130.5	-178.5	-132.3	54.8	0	0	0	0	117.7
252	H	29	Very low	31.6	Very low	173 Å²	173	134.6 Å²	134.6	80%	0.801	75%	0.749	S	S	*	*			trans	104.9	157.2	171.2	-62.8	-73.7	0	0	0	117.5
253	S	29.2	Very low	31.4	Very low	88 Å²	88	137.1 Å²	137.1	62%	0.615	76%	0.757	S	S	*	*				-175.4	142.2	-69.4	47.9	0	0	0	0	114.1
254	L	29.6	Very low	32	Very low	162 Å²	162	131.7 Å²	131.7	85%	0.848	75%	0.751	S	S	*	*			trans	71.7	170	155.1	-79.2	166.1	0	0	0	117.4
255	P	40.7	Very low	32.4	Very low	103 Å²	103	133.2 Å²	133.2	67%	0.669	76%	0.759	S	S	*	*			cis	-149.4	173.9	28.5	44	-22.6	0	0	0	122.5
256	T	31	Very low	32.2	Very low	125 Å²	125	137.5 Å²	137.5	77%	0.767	77%	0.768	S	S	*	*			trans	67	149.5	150.4	40.9	0	0	0	0	121
257	S	32.8	Very low	32.1	Very low	93 Å²	93	138.2 Å²	138.2	65%	0.65	77%	0.771	S	S	*	*			cis	-164.7	159.7	-3.7	47.5	0	0	0	0	109.2
258	N	30.3	Very low	32	Very low	142 Å²	142	138 Å²	138	76%	0.759	77%	0.77	S	S	*	*			cis	-159.4	128.5	45.9	-91.1	-48.3	0	0	0	114.1
259	S	33.9	Very low	32.8	Very low	102 Å²	102	135.4 Å²	135.4	71%	0.713	76%	0.764	S	S	*	*				19.6	164.9	119.3	-45.3	0	0	0	0	123.8
260	P	39.1	Very low	32.5	Very low	110 Å²	110	135.6 Å²	135.6	71%	0.714	77%	0.765	S	S	*	*			cis	-149.5	168.6	-45.6	44.4	-26.9	0	0	0	117.5
261	S	26.9	Very low	32.6	Very low	99 Å²	99	135.3 Å²	135.3	69%	0.692	76%	0.763	S	S	*	*			trans	26.8	139.4	143.8	65.4	0	0	0	0	125.5
262	H	30.8	Very low	32.9	Very low	192 Å²	192	138.3 Å²	138.3	89%	0.889	77%	0.773	S	S	*	*				-164.8	169.2	120.9	-119.4	-80.7	0	0	0	115.1
263	E	27.4	Very low	33.4	Very low	179 Å²	179	135.5 Å²	135.5	84%	0.836	77%	0.77	S	S	*	*			trans	-101	171.4	-174.5	-102	-172.7	125.5	0	0	115.2
264	P	45.8	Very low	33.3	Very low	108 Å²	108	134.2 Å²	134.2	70%	0.701	77%	0.77	S	S	*	*			trans	-90.1	178	-168.8	38.4	-38.9	0	0	0	115.5
265	P	37.9	Very low	33.2	Very low	128 Å²	128	133.4 Å²	133.4	83%	0.831	77%	0.767	S	S	*	*				-144.6	-164.9	114	41.3	-27.1	0	0	0	115.3
266	Q	26.5	Very low	32.5	Very low	188 Å²	188	132.3 Å²	132.3	88%	0.879	76%	0.758	S	S	*	*			trans	-86	158.2	-171	-50.1	160.1	-71.3	0	0	114.1
267	E	29.4	Very low	32.6	Very low	201 Å²	201	134.7 Å²	134.7	94%	0.939	76%	0.76	S	S	*	*			trans	-154	173.8	134.7	-133.2	169.5	-158	0	0	112.5
268	Q	27.6	Very low	32.4	Very low	181 Å²	181	134.1 Å²	134.1	85%	0.846	75%	0.753	S	S	*	*			trans	-127.5	175.8	-169.9	-111.3	-161.2	-8.2	0	0	112.3
269	P	44.4	Very low	32.3	Very low	108 Å²	108	133.9 Å²	133.9	70%	0.701	75%	0.752	S	S	*	*			trans	-89.7	-178.1	-154.8	38.8	-41	0	0	0	114.5
270	P	34	Very low	32	Very low	111 Å²	111	134.9 Å²	134.9	72%	0.721	75%	0.749	S	S	*	*			trans	-126.5	138.1	135.3	5.2	16.8	0	0	0	115.7
271	L	31.4	Very low	31.5	Very low	160 Å²	160	136.9 Å²	136.9	84%	0.838	75%	0.753	S	S	*	*			trans	65.3	106.6	131.9	-60.7	170.5	0	0	0	121.9
272	N	32.4	Very low	31.4	Very low	152 Å²	152	135.9 Å²	135.9	81%	0.813	75%	0.746	S	S	*	*				-57.9	145.9	128.4	-98.1	-27.7	0	0	0	109.6
273	P	39.9	Very low	31.4	Very low	114 Å²	114	133.9 Å²	133.9	74%	0.74	74%	0.741	S	S	*	*				-127.3	169.8	81.3	38.9	-29.2	0	0	0	111.9
274	G	26.6	Very low	31.6	Very low	61 Å²	61	132.5 Å²	132.5	63%	0.629	74%	0.738	S	S	*	*			cis	87.7	140	31.7	0	0	0	0	0	110.2
275	N	27.6	Very low	31.3	Very low	145 Å²	145	132.3 Å²	132.3	78%	0.775	74%	0.736	S	S	*	*			cis	-161.2	169.2	5.9	-156.9	13.9	0	0	0	111.3
276	T	26.8	Very low	30.9	Very low	79 Å²	79	132.3 Å²	132.3	49%	0.485	73%	0.73	S	S	.	*			trans	36	125.4	151.5	49.7	0	0	0	0	120.9	T278	T276-T278 HydrophobicContact CG2-CG2 3.81Å
277	H	33.1	Very low	30.8	Very low	176 Å²	176	128 Å²	128	82%	0.815	72%	0.72	S	S	*	*				-164.3	96.2	99.4	-92.3	-60.8	0	0	0	108.9
278	T	29.6	Very low	30.7	Very low	81 Å²	81	123.4 Å²	123.4	50%	0.497	71%	0.706	S	S	.	*				76.3	129.9	72.1	64.1	0	0	0	0	114.9	T276	T276-T278 HydrophobicContact CG2-CG2 3.81Å
279	N	27.9	Very low	30.7	Very low	137 Å²	137	121.6 Å²	121.6	73%	0.733	70%	0.7	S	S	*	*			trans	72.7	142	141.8	-65.5	4.5	0	0	0	116.9
280	N	27.6	Very low	29.8	Very low	123 Å²	123	121.3 Å²	121.3	66%	0.658	70%	0.701	S	S	*	*			cis	-166.8	174	-4.1	-132	-16.9	0	0	0	111.7
281	L	28.4	Very low	29.6	Very low	152 Å²	152	121.1 Å²	121.1	80%	0.796	70%	0.697	S	S	*	*			trans	66.4	158.7	156.1	-65.4	157.7	0	0	0	115.5
282	S	25	Very low	29.6	Very low	77 Å²	77	119.5 Å²	119.5	54%	0.538	69%	0.69	S	S	.	*			cis	-176.4	160.4	-22.9	55.5	0	0	0	0	109.7
283	L	30.2	Very low	29.6	Very low	150 Å²	150	116.9 Å²	116.9	79%	0.785	68%	0.683	S	S	*	*			trans	69.7	142.3	166.8	-52.8	157.8	0	0	0	112.6
284	I	31.8	Very low	29.2	Very low	151 Å²	151	117.4 Å²	117.4	77%	0.774	68%	0.68	S	S	*	*			cis	71.1	132.3	28.6	-52.3	176	0	0	0	111.8
285	P	38.7	Very low	29.5	Very low	103 Å²	103	119 Å²	119	67%	0.669	68%	0.682	S	S	*	*			cis	-113.5	-126.4	-0.8	39.1	-21.6	0	0	0	110.8
286	D	29.2	Very low	29.7	Very low	129 Å²	129	118.7 Å²	118.7	69%	0.69	68%	0.68	S	S	*	*			trans	69	107.3	174.5	-60.7	-39.1	0	0	0	117
287	S	25.5	Very low	29.9	Very low	96 Å²	96	121.3 Å²	121.3	67%	0.671	69%	0.691	S	S	*	*			cis	67.9	148.3	29.4	115.1	0	0	0	0	113.3
288	V	26.4	Very low	29.7	Very low	106 Å²	106	119.4 Å²	119.4	64%	0.642	69%	0.687	S	S	*	*			cis	-166.2	144.7	-31.4	71.9	0	0	0	0	106.7
289	I	27.4	Very low	29.8	Very low	142 Å²	142	121.3 Å²	121.3	73%	0.728	69%	0.694	S	S	*	*			trans	62.8	153.1	168.7	-68.9	151.3	0	0	0	113.8	T291	I289-T291 HydrophobicContact CG2-CG2 4.04Å
290	S	27.5	Very low	30	Very low	102 Å²	102	122 Å²	122	71%	0.713	69%	0.693	S	S	*	*				161.8	145.5	107.4	-68.9	0	0	0	0	108.2
291	T	28.4	Very low	30.2	Very low	107 Å²	107	123.5 Å²	123.5	66%	0.656	70%	0.701	S	S	*	*			cis	-163.8	-173.4	-15.7	34.6	0	0	0	0	105	I289	I289-T291 HydrophobicContact CG2-CG2 4.04Å
292	N	30.8	Very low	30.4	Very low	127 Å²	127	119.9 Å²	119.9	68%	0.679	70%	0.7	S	S	*	*			cis	-128.4	170.5	6.1	-62.9	-71.9	0	0	0	107.1
293	S	32.9	Very low	30.7	Very low	96 Å²	96	124.1 Å²	124.1	67%	0.671	72%	0.716	S	S	*	*			cis	-152.4	132.7	29.1	53.5	0	0	0	0	114.1
294	D	32.6	Very low	30.5	Very low	125 Å²	125	122.5 Å²	122.5	67%	0.668	72%	0.717	S	S	*	*				56.5	153.9	112.9	-38	-24.6	0	0	0	119
295	S	32.9	Very low	30.9	Very low	96 Å²	96	120.8 Å²	120.8	67%	0.671	72%	0.715	S	S	*	*			cis	-174.2	166.8	-12	42	0	0	0	0	108.7
296	D	30.6	Very low	30.5	Very low	138 Å²	138	120.3 Å²	120.3	74%	0.738	72%	0.72	S	S	*	*			cis	-163.9	165.2	-25.9	-91.5	-28.4	0	0	0	109.2
297	N	31.7	Very low	30.6	Very low	134 Å²	134	120 Å²	120	72%	0.717	73%	0.727	S	S	*	*			trans	57.9	127.2	152.9	-70	-8.9	0	0	0	123.5
298	D	29.4	Very low	30.6	Very low	135 Å²	135	120 Å²	120	72%	0.722	73%	0.733	S	S	*	*				74.6	151.6	127.8	-68.1	-33.2	0	0	0	124.8
299	N	32.1	Very low	30.8	Very low	121 Å²	121	121.1 Å²	121.1	65%	0.647	74%	0.741	S	S	*	*			trans	80.9	103.8	154.7	-71.2	-45.5	0	0	0	121.5
300	Q	31.4	Very low	30.8	Very low	152 Å²	152	119.8 Å²	119.8	71%	0.71	74%	0.744	S	S	*	*				94.4	134.6	117.8	-72.7	167.5	18.9	0	0	120.7
301	D	32.1	Very low	30.6	Very low	155 Å²	155	118.2 Å²	118.2	83%	0.829	74%	0.744	S	S	*	*			trans	58.9	135.3	150.1	-56.2	-10.7	0	0	0	120.8
302	G	31.2	Very low	30.5	Very low	75 Å²	75	120.9 Å²	120.9	77%	0.773	75%	0.754	S	S	*	*			trans	167.7	12	171.4	0	0	0	0	0	122.1
303	N	31.3	Very low	30.4	Very low	166 Å²	166	124.4 Å²	124.4	89%	0.888	77%	0.766	S	S	*	*			trans	42.8	110.5	162.2	-87	-3.8	0	0	0	121
304	C	27.7	Very low	29.8	Very low	117 Å²	117	125.8 Å²	125.8	79%	0.791	77%	0.771	S	S	*	*			trans	-48.5	172.7	135.6	-72.1	0	0	0	0	112.4
305	P	39.5	Very low	29.4	Very low	115 Å²	115	124.7 Å²	124.7	75%	0.747	77%	0.773	S	S	*	*			cis	-150.3	-172.8	25.4	44.5	-24	0	0	0	118.2
306	A	30.3	Very low	29.1	Very low	92 Å²	92	127.1 Å²	127.1	76%	0.76	78%	0.777	S	S	*	*			trans	75.8	148.6	143.5	0	0	0	0	0	119.1
307	S	31.3	Very low	28.7	Very low	122 Å²	122	132 Å²	132	85%	0.853	79%	0.786	S	S	*	*			cis	-148.8	166.7	-3.5	37.2	0	0	0	0	111.5
308	A	24.8	Very low	28.5	Very low	96 Å²	96	133.3 Å²	133.3	79%	0.793	79%	0.791	S	S	*	*			trans	-118	143.5	173.9	0	0	0	0	0	111.9
309	T	30.9	Very low	28.3	Very low	130 Å²	130	131.7 Å²	131.7	80%	0.798	79%	0.787	S	S	*	*			trans	-150	127.3	162.1	39.2	0	0	0	0	105.6
310	S	27.1	Very low	28	Very low	115 Å²	115	131.5 Å²	131.5	80%	0.804	80%	0.796	S	S	*	*				54	123.4	61.6	76.6	0	0	0	0	112.8
311	G	24.6	Very low	27.8	Very low	68 Å²	68	129.9 Å²	129.9	70%	0.701	80%	0.796	S	S	*	*			cis	178.6	-168.2	2	0	0	0	0	0	109.5
312	D	24.9	Very low	27.7	Very low	163 Å²	163	127.5 Å²	127.5	87%	0.872	79%	0.789	S	S	*	*			trans	51.3	108.9	169.4	-60.9	-15.2	0	0	0	119.3
313	Q	28.3	Very low	27.9	Very low	201 Å²	201	132 Å²	132	94%	0.939	79%	0.788	S	S	*	*			trans	-132.6	134.4	132.3	-77.3	-160.4	-8.9	0	0	110.3
314	T	22.1	Very low	28.1	Very low	125 Å²	125	130.9 Å²	130.9	77%	0.767	78%	0.777	S	S	*	*			trans	-95.6	167.4	172.9	50.5	0	0	0	0	111.1
315	S	23.5	Very low	28.6	Very low	103 Å²	103	128.2 Å²	128.2	72%	0.72	76%	0.759	S	S	*	*			trans	90.8	165	154.6	83.9	0	0	0	0	119.9
316	I	27.1	Very low	28.6	Very low	147 Å²	147	126.4 Å²	126.4	75%	0.754	75%	0.745	S	S	*	*			trans	81.8	98.1	169.5	-58.9	160.8	0	0	0	116.7
317	W	21.8	Very low	29.3	Very low	241 Å²	241	123.8 Å²	123.8	91%	0.913	72%	0.72	S	S	*	*			trans	-9.3	136.2	140.8	-93.3	30.2	0	0	0	117.3
318	I	26.6	Very low	29.7	Very low	160 Å²	160	123.7 Å²	123.7	82%	0.821	70%	0.704	S	S	*	*			trans	-127.5	126.7	154.5	-59.2	179.6	0	0	0	107.3
319	P	25.9	Very low	30.4	Very low	101 Å²	101	123.7 Å²	123.7	66%	0.656	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-73	161.3	-178.2	30.6	-35.6	0	0	0	112.6	T321	P319-T321 PolarHBondContact O-N 2.85Å
320	S	25.1	Very low	30.5	Very low	117 Å²	117	123 Å²	123	82%	0.818	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-58.8	128.7	178.8	49.8	0	0	0	0	113.2
321	T	27.8	Very low	30.9	Very low	119 Å²	119	124.7 Å²	124.7	73%	0.73	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-74.5	141.1	162	44.6	0	0	0	0	110.6	P319 K323	P319-T321 PolarHBondContact O-N 2.85Å; T321-K323 PolarHBondContact O-N 3.07Å
322	P	29.2	Very low	31.1	Very low	104 Å²	104	132.9 Å²	132.9	68%	0.675	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-67.9	123.9	176.7	27.3	-33.4	0	0	0	110.1	Q324	P322-Q324 PolarHBondContact O-N 3.2Å
323	K	36.2	Very low	31.4	Very low	170 Å²	170	128 Å²	128	74%	0.739	68%	0.676	S	S	*	*			trans	-77.2	104.9	179.3	-69.5	179.7	-178.6	173.3	0	110.1	T321 C325	T321-K323 PolarHBondContact O-N 3.07Å; K323-C325 PolarHBondContact O-N 2.7Å
324	Q	35.8	Very low	31.6	Very low	143 Å²	143	125.6 Å²	125.6	67%	0.668	67%	0.669	S	S	*	*			trans	-62.3	115.3	165.6	-68.3	-174.7	-8.9	0	0	109.6	P322 V326	P322-Q324 PolarHBondContact O-N 3.2Å; Q324-V326 PolarHBondContact O-N 2.67Å
325	C	37.4	Very low	31.9	Very low	60 Å²	60	127.3 Å²	127.3	41%	0.405	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90	83.2	-177.2	-155	0	0	0	0	110.6	K323 V327 N455	K323-C325 PolarHBondContact O-N 2.7Å; C325-V327 PolarHBondContact O-N 3.47Å; C325-V327 VanDerWaalsContact O-N 3.1Å; C325-N455 PolarHBondContact O-OD1 2.79Å
326	V	41	Very low	32.3	Very low	77 Å²	77	129.4 Å²	129.4	47%	0.467	68%	0.676	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.9	87.3	175	-175.9	0	0	0	0	109.2	Q324 K328	Q324-V326 PolarHBondContact O-N 2.67Å; V326-K328 HydrophobicContact CG1-CG 4.33Å; V326-K328 PolarHBondContact O-N 2.97Å; V326-K328 VanDerWaalsContact O-N 3.1Å
327	V	43.8	Very low	32.5	Very low	37 Å²	37	130.9 Å²	130.9	22%	0.224	68%	0.679	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.6	100.9	-178.9	-176.2	0	0	0	0	109.9	C325 F329 I454 I479	C325-V327 PolarHBondContact O-N 3.47Å; C325-V327 VanDerWaalsContact O-N 3.1Å; V327-F329 HydrophobicContact CG1-CE2 4.44Å; V327-I454 PolarHBondContact N-O 3.37Å; V327-I479 HydrophobicContact CB-CD1 4.31Å; V327-I479 HydrophobicContact CG1-CD1 3.94Å; V327-I479 HydrophobicContact CG2-CD1 4.49Å; V327-I479 HydrophobicContact CG2-CG2 3.97Å
328	K	40.3	Very low	33	Very low	121 Å²	121	130.9 Å²	130.9	53%	0.526	68%	0.679	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.5	122.3	166.8	-64.6	-175.7	-177.3	-72.3	0	109.3	V326 E453	V326-K328 HydrophobicContact CG1-CG 4.33Å; V326-K328 PolarHBondContact O-N 2.97Å; V326-K328 VanDerWaalsContact O-N 3.1Å; K328-E453 HydrophobicContact CG-CG 4.36Å; K328-E453 IonicContact NZ-OE1 3.58Å; K328-E453 PolarHBondContact NZ-OE1 2.98Å; K328-E453 IonicContact NZ-OE2 2.7Å; K328-E453 PolarHBondContact NZ-OE2 3.03Å
329	F	39.3	Very low	33.2	Very low	95 Å²	95	135.3 Å²	135.3	42%	0.417	69%	0.685	S	S	.	*	P	Polyproline II helix	trans	-67.8	127.3	177.1	-68.9	-101.8	0	0	0	110.3	V327 F448 N452 I479	V327-F329 HydrophobicContact CG1-CE2 4.44Å; F329-F448 HydrophobicContact CE2-CE2 4.11Å; F329-N452 WeakPolarHBondContact CD2-ND2 3.44Å; F329-N452 WeakPolarHBondContact CD2-O 3.23Å; F329-N452 VanDerWaalsContact CG-ND2 3.29Å; F329-N452 WeakPolarHBondContact CG-ND2 3.28Å; F329-I479 HydrophobicContact CZ-CD1 4.25Å
330	P	33.1	Very low	33.4	Very low	115 Å²	115	135.6 Å²	135.6	75%	0.747	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-67.7	146.6	179.2	27.7	-34.3	0	0	0	111	R332	P330-R332 PolarHBondContact O-N 2.66Å
331	K	34.8	Very low	33.8	Very low	151 Å²	151	135.4 Å²	135.4	66%	0.657	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-59	124.8	166.5	-69.4	-170.2	178.7	-170.4	0	108.5	G333 D372	K331-G333 VanDerWaalsContact C-N 3.34Å; K331-G333 PolarHBondContact O-N 3.48Å; K331-D372 WeakPolarHBondContact CE-OD1 3.26Å; K331-D372 IonicContact NZ-OD1 3.87Å; K331-D372 PolarHBondContact NZ-OD1 3.09Å; K331-D372 IonicContact NZ-OD2 3.9Å; K331-D372 PolarHBondContact NZ-OD2 2.81Å
332	R	28.8	Very low	34.1	Very low	240 Å²	240	136.7 Å²	136.7	91%	0.906	69%	0.691	S	S	*	*			trans	-71.1	88.5	178.5	-158.8	-179.6	-160.3	175.7	6.3	109.6	P330	P330-R332 PolarHBondContact O-N 2.66Å
333	G	31.9	Very low	34.2	Very low	62 Å²	62	135.4 Å²	135.4	64%	0.639	70%	0.697	S	S	*	*			trans	-82.2	136.5	169.6	0	0	0	0	0	110.5	K331 L335	K331-G333 VanDerWaalsContact C-N 3.34Å; K331-G333 PolarHBondContact O-N 3.48Å; G333-L335 PolarHBondContact O-N 2.95Å
334	D	32.8	Very low	34	Very low	150 Å²	150	132.1 Å²	132.1	80%	0.802	70%	0.701	S	S	*	*			trans	-74.2	124.4	-174	-63.2	-59.8	0	0	0	112.3	D336	D334-D336 VanDerWaalsContact C-N 3.29Å; D334-D336 PolarHBondContact O-N 3.08Å
335	L	27.7	Very low	33.8	Very low	161 Å²	161	130.1 Å²	130.1	84%	0.843	70%	0.703	S	S	*	*			trans	-88.1	58.5	175.6	-90.4	167.9	0	0	0	111.5	G333 H337	G333-L335 PolarHBondContact O-N 2.95Å; L335-H337 PolarHBondContact O-N 3.11Å; L335-H337 VanDerWaalsContact O-N 3.13Å
336	D	31.9	Very low	33.6	Very low	146 Å²	146	132.2 Å²	132.2	78%	0.781	72%	0.718	S	S	*	*			trans	-89	70.1	-178.1	-128.4	-23.2	0	0	0	112	D334 R338	D334-D336 VanDerWaalsContact C-N 3.29Å; D334-D336 PolarHBondContact O-N 3.08Å; D336-R338 PolarHBondContact O-N 3.25Å
337	H	31.6	Very low	33.1	Very low	179 Å²	179	132.8 Å²	132.8	83%	0.829	73%	0.726	S	S	*	*			trans	-82.7	91.3	175.3	-89.6	-30.7	0	0	0	112.2	L335	L335-H337 PolarHBondContact O-N 3.11Å; L335-H337 VanDerWaalsContact O-N 3.13Å
338	R	32.6	Very low	32.5	Very low	241 Å²	241	141 Å²	141	91%	0.909	75%	0.754	S	S	*	*			trans	-117.6	128.6	162.6	-104.9	-175.9	173.4	-162.6	-1.6	112.5	D336	D336-R338 PolarHBondContact O-N 3.25Å
339	R	29.8	Very low	32.2	Very low	252 Å²	252	143.3 Å²	143.3	95%	0.951	77%	0.767	S	S	*	*			trans	-85.7	131.6	178.4	-70	175.2	169.5	175.9	-4	112.1
340	S	31.5	Very low	32.4	Very low	108 Å²	108	144 Å²	144	76%	0.755	78%	0.781	S	S	*	*			trans	-167.5	111.6	141	-162.6	0	0	0	0	106.8
341	V	32.6	Very low	32.4	Very low	113 Å²	113	147.3 Å²	147.3	69%	0.685	79%	0.786	S	S	*	*				70.4	104.8	67.5	-179	0	0	0	0	112.8
342	T	33.8	Very low	32.4	Very low	146 Å²	146	144 Å²	144	90%	0.896	79%	0.788	S	S	*	*			trans	61	147.1	168.5	56	0	0	0	0	118.1
343	G	31.4	Very low	32.7	Very low	76 Å²	76	138.9 Å²	138.9	78%	0.784	78%	0.778	S	S	*	*			cis	-170.6	-173.5	0.8	0	0	0	0	0	113.1
344	A	31.8	Very low	32.9	Very low	101 Å²	101	143 Å²	143	84%	0.835	78%	0.78	S	S	*	*			trans	-67.5	166.1	-179.9	0	0	0	0	0	114.3
345	S	33	Very low	33.2	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	77%	0.769	S	S	*	*			cis	-169.4	164.9	-2.4	40.3	0	0	0	0	111.4
346	S	32	Very low	33.7	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	76%	0.758	S	S	*	*			trans	42.1	147.9	145	62.1	0	0	0	0	123.1
347	S	31.3	Very low	34.1	Very low	90 Å²	90	140.3 Å²	140.3	63%	0.629	75%	0.75	S	S	*	*			cis	173.9	148.1	-17.1	54.8	0	0	0	0	109.6
348	Y	31.2	Very low	34.2	Very low	208 Å²	208	138.8 Å²	138.8	82%	0.816	74%	0.743	S	S	*	*			trans	64.5	149.6	178.5	-61.4	-102.7	0	0	0	114.6
349	Q	33.8	Very low	34.3	Very low	170 Å²	170	134 Å²	134	79%	0.794	74%	0.736	S	S	*	*			cis	-150.3	169.5	-11	-125	175.8	-69.8	0	0	108.7
350	P	43.3	Very low	34.5	Very low	109 Å²	109	126.8 Å²	126.8	71%	0.708	72%	0.724	S	S	*	*			trans	-103.2	164.7	-174.3	40	-32.7	0	0	0	114.3
351	E	32.7	Very low	34.7	Very low	185 Å²	185	127.7 Å²	127.7	86%	0.864	73%	0.729	S	S	*	*				-175.4	150.5	125.2	-105.4	173.2	-161.2	0	0	112
352	A	35.6	Very low	34.9	Very low	83 Å²	83	132.9 Å²	132.9	69%	0.686	74%	0.742	S	S	*	*			trans	37.6	148.5	149.1	0	0	0	0	0	123
353	D	34.3	Very low	35.4	Very low	131 Å²	131	130.3 Å²	130.3	70%	0.701	74%	0.736	S	S	*	*			cis	-174.6	147.9	-27.5	-111	-10.7	0	0	0	108.4
354	H	37.1	Very low	36	Very low	148 Å²	148	132.1 Å²	132.1	69%	0.685	74%	0.737	S	S	*	*			trans	55.2	147.1	151.9	-67.9	-63.5	0	0	0	120.5
355	D	38.7	Very low	36.9	Very low	105 Å²	105	137.1 Å²	137.1	56%	0.561	74%	0.74	S	S	*	*			cis	-161.6	169.2	-3.5	-126.2	-15.7	0	0	0	114.5
356	F	37.6	Very low	38.1	Very low	139 Å²	139	137.9 Å²	137.9	61%	0.61	75%	0.745	S	S	*	*			trans	69.2	145.6	151.3	-69.1	-177.4	0	0	0	119.9
357	Y	40.6	Very low	39.6	Very low	158 Å²	158	137.9 Å²	137.9	62%	0.62	75%	0.745	S	S	*	*			cis	-151.3	149.2	-4	-121.2	-27.7	0	0	0	112.3
358	Q	33.6	Very low	41.6	Very low	147 Å²	147	141.8 Å²	141.8	69%	0.687	75%	0.753	S	S	*	*			trans	33.3	141.3	144.5	-77.7	160.9	-6.5	0	0	120.8
359	D	34.7	Very low	43.8	Very low	140 Å²	140	142.5 Å²	142.5	75%	0.749	75%	0.754	S	S	*	*			cis	-156.8	164.6	45.7	-145.5	-12.4	0	0	0	117
360	S	34	Very low	46	Very low	101 Å²	101	137.8 Å²	137.8	71%	0.706	74%	0.74	S	S	*	*			trans	48	88.3	156.7	69.2	0	0	0	0	120.3
361	C	35.3	Very low	47.8	Very low	126 Å²	126	137.5 Å²	137.5	85%	0.851	74%	0.74	S	S	*	*			trans	-157.3	105.6	140.2	-144.8	0	0	0	0	112.4	A363	C361-A363 VanDerWaalsContact C-N 3.33Å; C361-A363 PolarHBondContact O-N 2.89Å
362	F	36.6	Very low	50.3	Low	222 Å²	222	130.5 Å²	130.5	97%	0.974	71%	0.709	S	S	*	*			trans	-77.2	79.3	176.5	-101.8	-89.3	0	0	0	111.1
363	A	45.7	Very low	52.9	Low	92 Å²	92	132.3 Å²	132.3	76%	0.76	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-66	139	172.1	0	0	0	0	0	111.4	C361	C361-A363 VanDerWaalsContact C-N 3.33Å; C361-A363 PolarHBondContact O-N 2.89Å
364	S	43.3	Very low	55.5	Low	115 Å²	115	130.5 Å²	130.5	80%	0.804	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-66.8	137.1	-172.8	56.1	0	0	0	0	113.4
365	K	51.5	Low	57.9	Low	205 Å²	205	130.5 Å²	130.5	89%	0.891	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-54.5	139	163.1	-72.5	-176.8	176.3	179.7	0	110.2
366	S	56.8	Low	60.3	Low	119 Å²	119	131.9 Å²	131.9	83%	0.832	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-61.3	132.8	179.6	40.4	0	0	0	0	112.1	H368	S366-H368 PolarHBondContact O-N 2.75Å
367	S	63.4	Low	62.9	Low	103 Å²	103	128 Å²	128	72%	0.72	68%	0.68	S	S	*	*			trans	-79.7	110	179.8	-173.4	0	0	0	0	110.6
368	H	74.2	Confident	65.4	Low	172 Å²	172	123.6 Å²	123.6	80%	0.796	66%	0.664	S	S	*	*			trans	-81.6	125.9	171.8	-178.6	79.8	0	0	0	110.5	S366	S366-H368 PolarHBondContact O-N 2.75Å
369	R	76.6	Confident	68.2	Low	223 Å²	223	118.8 Å²	118.8	84%	0.842	65%	0.65	S	S	*	*			trans	-116.7	124.3	174.9	-67.8	-175.7	174.5	-164.5	-2.1	109.9
370	S	80.3	Confident	71.1	Confident	70 Å²	70	117.1 Å²	117.1	49%	0.49	64%	0.636	S	S	.	*			trans	-96.4	111.9	174.3	-174.3	0	0	0	0	110.2	D372 H373	S370-D372 VanDerWaalsContact C-N 3.3Å; S370-D372 PolarHBondContact O-N 2.89Å; S370-H373 PolarHBondContact O-N 2.9Å
371	S	80.7	Confident	74.1	Confident	103 Å²	103	114.4 Å²	114.4	72%	0.72	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	-37.7	-179.9	49.9	0	0	0	0	113.3
372	D	86.8	Confident	76.9	Confident	39 Å²	39	109.9 Å²	109.9	21%	0.209	58%	0.581	C	S	.	*	T	Hydrogen-bonded Turn	trans	-82.7	-9.9	-175.7	-86.3	30.1	0	0	0	114.3	K331 S370 V374 Y375 K376	K331-D372 WeakPolarHBondContact CE-OD1 3.26Å; K331-D372 IonicContact NZ-OD1 3.87Å; K331-D372 PolarHBondContact NZ-OD1 3.09Å; K331-D372 IonicContact NZ-OD2 3.9Å; K331-D372 PolarHBondContact NZ-OD2 2.81Å; S370-D372 VanDerWaalsContact C-N 3.3Å; S370-D372 PolarHBondContact O-N 2.89Å; D372-V374 PolarHBondContact O-N 3.46Å; D372-Y375 PolarHBondContact O-N 2.83Å; D372-K376 HydrophobicContact CB-CD 4.4Å; D372-K376 WeakPolarHBondContact O-CG 3.49Å; D372-K376 PolarHBondContact O-N 2.88Å; D372-K376 VanDerWaalsContact O-N 3.08Å
373	H	90	Very high	79.7	Confident	120 Å²	120	103.3 Å²	103.3	56%	0.556	55%	0.553	S	S	*	*	H	α-helix	trans	-62.5	-42	-173.6	176.8	60.5	0	0	0	112.4	S370 K376 T377	S370-H373 PolarHBondContact O-N 2.9Å; H373-K376 PolarHBondContact O-N 2.95Å; H373-T377 PolarHBondContact CE1-OG1 2.93Å; H373-T377 VanDerWaalsContact CE1-OG1 3.29Å; H373-T377 WeakPolarHBondContact O-CB 3.38Å; H373-T377 PolarHBondContact O-N 3.38Å; H373-T377 PolarHBondContact O-OG1 2.96Å
374	V	87.6	Confident	82.1	Confident	93 Å²	93	100.8 Å²	100.8	56%	0.564	53%	0.526	S	S	*	.	H	α-helix	trans	-61.2	-50.4	179.7	-177.4	0	0	0	0	110.8	D372 K376 T377 F378	D372-V374 PolarHBondContact O-N 3.46Å; V374-K376 PolarHBondContact O-N 3.43Å; V374-T377 PolarHBondContact O-N 3.37Å; V374-F378 HydrophobicContact CG1-CD2 3.96Å; V374-F378 HydrophobicContact CG1-CE2 4.2Å; V374-F378 PolarHBondContact O-N 3.24Å
375	Y	87.9	Confident	84.7	Confident	149 Å²	149	96.1 Å²	96.1	58%	0.584	49%	0.491	S	S	*	.	H	α-helix	trans	-59.9	-45.6	179.5	-179.5	-93.3	0	0	0	112.2	D372 T377 F378 A379	D372-Y375 PolarHBondContact O-N 2.83Å; Y375-T377 VanDerWaalsContact C-N 3.34Å; Y375-T377 PolarHBondContact O-N 2.91Å; Y375-F378 PolarHBondContact O-N 3.27Å; Y375-A379 VanDerWaalsContact O-CB 3.31Å; Y375-A379 WeakPolarHBondContact O-CB 3.3Å; Y375-A379 PolarHBondContact O-N 3.43Å
376	K	89.9	Confident	86.7	Confident	134 Å²	134	90.6 Å²	90.6	58%	0.583	48%	0.478	S	S	*	.	H	α-helix	trans	-63.8	-38.2	178.5	-70.9	175.4	-179.2	176.3	0	112.3	D372 H373 V374 K380	D372-K376 HydrophobicContact CB-CD 4.4Å; D372-K376 WeakPolarHBondContact O-CG 3.49Å; D372-K376 PolarHBondContact O-N 2.88Å; D372-K376 VanDerWaalsContact O-N 3.08Å; H373-K376 PolarHBondContact O-N 2.95Å; V374-K376 PolarHBondContact O-N 3.43Å; K376-K380 PolarHBondContact O-N 2.75Å
377	T	92.3	Very high	88.5	Confident	56 Å²	56	91.3 Å²	91.3	34%	0.344	47%	0.467	S	S	.	.	H	α-helix	trans	-68.1	-47.2	176.8	-61.3	0	0	0	0	111.6	H373 V374 Y375 K380 L381	H373-T377 PolarHBondContact CE1-OG1 2.93Å; H373-T377 VanDerWaalsContact CE1-OG1 3.29Å; H373-T377 WeakPolarHBondContact O-CB 3.38Å; H373-T377 PolarHBondContact O-N 3.38Å; H373-T377 PolarHBondContact O-OG1 2.96Å; V374-T377 PolarHBondContact O-N 3.37Å; Y375-T377 VanDerWaalsContact C-N 3.34Å; Y375-T377 PolarHBondContact O-N 2.91Å; T377-K380 PolarHBondContact O-N 3Å; T377-L381 HydrophobicContact CG2-CD1 4.19Å; T377-L381 WeakPolarHBondContact O-CG 3.46Å; T377-L381 PolarHBondContact O-N 3.32Å
378	F	92.9	Very high	89.9	Confident	66 Å²	66	88.3 Å²	88.3	29%	0.289	45%	0.453	S	S	.	.	H	α-helix	trans	-64.2	-40.5	177	-91.8	-95.7	0	0	0	112.8	V374 Y375 K380 L381 N382 V408	V374-F378 HydrophobicContact CG1-CD2 3.96Å; V374-F378 HydrophobicContact CG1-CE2 4.2Å; V374-F378 PolarHBondContact O-N 3.24Å; Y375-F378 PolarHBondContact O-N 3.27Å; F378-K380 VanDerWaalsContact C-N 3.29Å; F378-K380 PolarHBondContact O-N 3.37Å; F378-L381 PolarHBondContact O-N 3.06Å; F378-N382 PolarHBondContact O-N 2.97Å; F378-V408 HydrophobicContact CE1-CG1 3.94Å
379	A	92.7	Very high	90.8	Very high	47 Å²	47	84.1 Å²	84.1	39%	0.388	44%	0.436	S	S	.	.	H	α-helix	trans	-57.4	-41.5	173.3	0	0	0	0	0	112.1	Y375 N382 E383	Y375-A379 VanDerWaalsContact O-CB 3.31Å; Y375-A379 WeakPolarHBondContact O-CB 3.3Å; Y375-A379 PolarHBondContact O-N 3.43Å; A379-N382 WeakPolarHBondContact O-CB 3.48Å; A379-N382 PolarHBondContact O-N 3.48Å; A379-E383 PolarHBondContact O-N 2.84Å
380	K	95.2	Very high	91.6	Very high	105 Å²	105	81.2 Å²	81.2	46%	0.457	43%	0.43	S	S	.	.	H	α-helix	trans	-73.4	-34.5	177.2	-166.4	53.4	160.3	-179.3	0	113.1	K376 T377 F378 N382 E383 L384	K376-K380 PolarHBondContact O-N 2.75Å; T377-K380 PolarHBondContact O-N 3Å; F378-K380 VanDerWaalsContact C-N 3.29Å; F378-K380 PolarHBondContact O-N 3.37Å; K380-N382 VanDerWaalsContact C-N 3.3Å; K380-N382 PolarHBondContact O-N 3.37Å; K380-E383 HydrophobicContact CD-CB 4.25Å; K380-E383 WeakPolarHBondContact CD-OE2 3.48Å; K380-E383 IonicContact NZ-OE1 2.75Å; K380-E383 PolarHBondContact NZ-OE1 3.35Å; K380-E383 IonicContact NZ-OE2 3.67Å; K380-E383 PolarHBondContact NZ-OE2 3.49Å; K380-E383 WeakPolarHBondContact O-CB 3.38Å; K380-E383 PolarHBondContact O-N 3.24Å; K380-L384 WeakPolarHBondContact O-CG 3.35Å; K380-L384 PolarHBondContact O-N 3.34Å
381	L	95.6	Very high	92.4	Very high	43 Å²	43	79.6 Å²	79.6	23%	0.225	42%	0.418	C	S	.	.	H	α-helix	trans	-63.3	-36.3	170.8	-71.7	169.5	0	0	0	111.8	T377 F378 R385 V408 Y450	T377-L381 HydrophobicContact CG2-CD1 4.19Å; T377-L381 WeakPolarHBondContact O-CG 3.46Å; T377-L381 PolarHBondContact O-N 3.32Å; F378-L381 PolarHBondContact O-N 3.06Å; L381-R385 WeakPolarHBondContact O-CB 3.38Å; L381-R385 PolarHBondContact O-N 2.8Å; L381-V408 HydrophobicContact CD1-CG2 4.18Å; L381-Y450 HydrophobicContact CB-CD1 4.26Å; L381-Y450 HydrophobicContact CB-CE1 4.17Å
382	N	95.1	Very high	93	Very high	31 Å²	31	78.4 Å²	78.4	17%	0.166	40%	0.404	C	S	.	.	H	α-helix	trans	-67.3	-42.3	174.1	-164.8	34.9	0	0	0	111.7	F378 A379 K380 R385 C386 Y450	F378-N382 PolarHBondContact O-N 2.97Å; A379-N382 WeakPolarHBondContact O-CB 3.48Å; A379-N382 PolarHBondContact O-N 3.48Å; K380-N382 VanDerWaalsContact C-N 3.3Å; K380-N382 PolarHBondContact O-N 3.37Å; N382-R385 WeakPolarHBondContact O-CB 3.38Å; N382-R385 PolarHBondContact O-N 3.01Å; N382-R385 PolarHBondContact OD1-NE 3.39Å; N382-R385 PolarHBondContact OD1-NH2 3.47Å; N382-C386 PolarHBondContact O-N 2.8Å; N382-C386 PolarHBondContact O-SG 3.14Å; N382-Y450 HydrophobicContact CB-CD1 4.15Å; N382-Y450 HydrophobicContact CB-CG 4.45Å; N382-Y450 WeakPolarHBondContact OD1-CB 3.23Å
383	E	95.7	Very high	93.4	Very high	84 Å²	84	76.7 Å²	76.7	39%	0.393	39%	0.394	S	S	.	.	H	α-helix	trans	-59.2	-47.3	174.9	-164.3	-155.1	112.8	0	0	111.7	A379 K380 R385 C386 H387	A379-E383 PolarHBondContact O-N 2.84Å; K380-E383 HydrophobicContact CD-CB 4.25Å; K380-E383 WeakPolarHBondContact CD-OE2 3.48Å; K380-E383 IonicContact NZ-OE1 2.75Å; K380-E383 PolarHBondContact NZ-OE1 3.35Å; K380-E383 IonicContact NZ-OE2 3.67Å; K380-E383 PolarHBondContact NZ-OE2 3.49Å; K380-E383 WeakPolarHBondContact O-CB 3.38Å; K380-E383 PolarHBondContact O-N 3.24Å; E383-R385 VanDerWaalsContact C-N 3.34Å; E383-R385 PolarHBondContact O-N 3.23Å; E383-C386 PolarHBondContact O-N 3.05Å; E383-H387 PolarHBondContact O-CD2 2.72Å; E383-H387 VanDerWaalsContact O-CD2 3.24Å; E383-H387 PolarHBondContact O-N 3.43Å; E383-H387 VanDerWaalsContact O-N 3.11Å
384	L	96.5	Very high	93.7	Very high	39 Å²	39	73 Å²	73	20%	0.204	38%	0.38	C	S	.	.	H	α-helix	trans	-58.4	-44.3	175.2	-70	172	0	0	0	111.7	K380 C386 H387 G388 L389 F390	K380-L384 WeakPolarHBondContact O-CG 3.35Å; K380-L384 PolarHBondContact O-N 3.34Å; L384-C386 PolarHBondContact O-N 3.32Å; L384-H387 CarbonylContact O-C 3.55Å; L384-H387 PolarHBondContact O-N 3.22Å; L384-G388 PolarHBondContact O-N 3.07Å; L384-G388 VanDerWaalsContact O-N 3.14Å; L384-L389 HydrophobicContact CB-CB 4.41Å; L384-L389 HydrophobicContact CD2-CB 4.04Å; L384-L389 HydrophobicContact CD2-CD1 3.83Å; L384-L389 PolarHBondContact O-N 3.46Å; L384-F390 HydrophobicContact CD1-CD2 4.28Å; L384-F390 HydrophobicContact CD2-CD2 4.22Å; L384-F390 HydrophobicContact CD2-CE2 4.13Å
385	R	96.3	Very high	94.1	Very high	17 Å²	17	68.6 Å²	68.6	6%	0.064	35%	0.354	C	S	.	.	H	α-helix	trans	-59.3	-45.8	175.4	-177.5	-172.5	66.3	106.9	-6.8	112.1	L381 N382 E383 H387 G388 P403 N447 Y450	L381-R385 WeakPolarHBondContact O-CB 3.38Å; L381-R385 PolarHBondContact O-N 2.8Å; N382-R385 WeakPolarHBondContact O-CB 3.38Å; N382-R385 PolarHBondContact O-N 3.01Å; N382-R385 PolarHBondContact OD1-NE 3.39Å; N382-R385 PolarHBondContact OD1-NH2 3.47Å; E383-R385 VanDerWaalsContact C-N 3.34Å; E383-R385 PolarHBondContact O-N 3.23Å; R385-H387 PolarHBondContact O-N 2.93Å; R385-G388 PolarHBondContact O-N 3.45Å; R385-P403 WeakPolarHBondContact CD-O 3.3Å; R385-P403 WeakPolarHBondContact CG-O 3.24Å; R385-N447 PolarHBondContact NH1-OD1 3.18Å; R385-N447 PolarHBondContact NH2-OD1 2.64Å; R385-Y450 HydrophobicContact CB-CE1 4.23Å
386	C	93.5	Very high	94.4	Very high	90 Å²	90	63.6 Å²	63.6	61%	0.608	34%	0.335	S	S	*	.	H	α-helix	trans	-63.6	-27.9	178.8	-70.3	0	0	0	0	112.8	N382 E383 L384	N382-C386 PolarHBondContact O-N 2.8Å; N382-C386 PolarHBondContact O-SG 3.14Å; E383-C386 PolarHBondContact O-N 3.05Å; L384-C386 PolarHBondContact O-N 3.32Å
387	H	94.8	Very high	94.5	Very high	133 Å²	133	57.2 Å²	57.2	62%	0.616	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	1.5	170.8	-69.7	-62.1	0	0	0	114.3	E383 L384 R385 L389	E383-H387 PolarHBondContact O-CD2 2.72Å; E383-H387 VanDerWaalsContact O-CD2 3.24Å; E383-H387 PolarHBondContact O-N 3.43Å; E383-H387 VanDerWaalsContact O-N 3.11Å; L384-H387 CarbonylContact O-C 3.55Å; L384-H387 PolarHBondContact O-N 3.22Å; R385-H387 PolarHBondContact O-N 2.93Å; H387-L389 HydrophobicContact CB-CD1 3.98Å; H387-L389 HydrophobicContact CB-CG 3.92Å; H387-L389 PolarHBondContact O-N 3.14Å
388	G	93.1	Very high	94.4	Very high	40 Å²	40	57 Å²	57	41%	0.412	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	11.3	-176.9	0	0	0	0	0	114.5	L384 R385	L384-G388 PolarHBondContact O-N 3.07Å; L384-G388 VanDerWaalsContact O-N 3.14Å; R385-G388 PolarHBondContact O-N 3.45Å
389	L	93.9	Very high	94.2	Very high	84 Å²	84	59.3 Å²	59.3	44%	0.44	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	134.5	-177.1	-62.5	174.7	0	0	0	110.2	L384 H387 C391 H405	L384-L389 HydrophobicContact CB-CB 4.41Å; L384-L389 HydrophobicContact CD2-CB 4.04Å; L384-L389 HydrophobicContact CD2-CD1 3.83Å; L384-L389 PolarHBondContact O-N 3.46Å; H387-L389 HydrophobicContact CB-CD1 3.98Å; H387-L389 HydrophobicContact CB-CG 3.92Å; H387-L389 PolarHBondContact O-N 3.14Å; L389-C391 PolarHBondContact O-N 3.21Å; L389-H405 PolarHBondContact O-NE2 3.06Å; L389-H405 VanDerWaalsContact O-NE2 3.17Å
390	F	94.1	Very high	94.3	Very high	163 Å²	163	59.2 Å²	59.2	72%	0.715	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	8.4	179.5	-48	-75.3	0	0	0	116.4	L384 D392 H405	L384-F390 HydrophobicContact CD1-CD2 4.28Å; L384-F390 HydrophobicContact CD2-CD2 4.22Å; L384-F390 HydrophobicContact CD2-CE2 4.13Å; F390-D392 PolarHBondContact O-N 2.98Å; F390-H405 PolarHBondContact O-CD2 3.13Å; F390-H405 VanDerWaalsContact O-CD2 3.32Å
391	C	95.1	Very high	94.3	Very high	35 Å²	35	60.6 Å²	60.6	24%	0.236	34%	0.342	C	S	.	.			trans	-68.7	119.2	174.6	-65.8	0	0	0	0	111.3	L389 P403 A404	L389-C391 PolarHBondContact O-N 3.21Å; C391-P403 HydrophobicContact CB-CB 3.98Å; C391-A404 CarbonylContact C-O 3.59Å; C391-A404 VanDerWaalsContact CA-O 3.26Å; C391-A404 WeakPolarHBondContact CA-O 3.4Å; C391-A404 WeakPolarHBondContact CB-O 3.38Å
392	D	94.7	Very high	94.3	Very high	79 Å²	79	59.1 Å²	59.1	42%	0.422	33%	0.334	S	S	.	.			trans	-109.5	5.3	-175.7	67.9	-29.9	0	0	0	113.3	F390 A404 H405 R406	F390-D392 PolarHBondContact O-N 2.98Å; D392-A404 PolarHBondContact N-O 3.02Å; D392-H405 VanDerWaalsContact OD1-CA 3.28Å; D392-H405 WeakPolarHBondContact OD1-CA 3.44Å; D392-R406 PolarHBondContact O-NE 3.33Å; D392-R406 VanDerWaalsContact O-NE 3.09Å; D392-R406 PolarHBondContact O-NH2 3.15Å; D392-R406 PolarHBondContact OD1-N 3.42Å; D392-R406 WeakPolarHBondContact OD2-CB 3.28Å; D392-R406 VanDerWaalsContact OD2-CD 3.24Å; D392-R406 WeakPolarHBondContact OD2-CD 3.33Å; D392-R406 VanDerWaalsContact OD2-CG 3.3Å; D392-R406 WeakPolarHBondContact OD2-CG 3.26Å; D392-R406 IonicContact OD2-NE 3.7Å
393	V	95.4	Very high	94.3	Very high	2 Å²	2	60 Å²	60	1%	0.012	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	145	170.3	67.5	0	0	0	0	111.3	L395 A404 R406 L409 F420 V432	V393-L395 HydrophobicContact CG1-CD2 4.27Å; V393-L395 HydrophobicContact CG2-CD2 3.97Å; V393-A404 HydrophobicContact CG1-CB 4.21Å; V393-A404 PolarHBondContact N-O 2.93Å; V393-A404 PolarHBondContact O-N 3.14Å; V393-A404 VanDerWaalsContact O-O 3.11Å; V393-R406 HydrophobicContact CB-CG 3.84Å; V393-R406 HydrophobicContact CG1-CG 3.75Å; V393-L409 HydrophobicContact CG1-CD1 3.9Å; V393-F420 HydrophobicContact CG1-CZ 4.3Å; V393-F420 HydrophobicContact CG2-CE1 4.38Å; V393-F420 HydrophobicContact CG2-CZ 4.26Å; V393-V432 HydrophobicContact CG2-CG2 3.91Å
394	V	96	Very high	94.4	Very high	44 Å²	44	56 Å²	56	27%	0.267	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.5	166.5	178.9	0	0	0	0	108.5	K401 I402 P430 C431 V432	V394-K401 HydrophobicContact CG1-CB 3.73Å; V394-K401 HydrophobicContact CG1-CD 4.41Å; V394-K401 HydrophobicContact CG1-CG 4.07Å; V394-I402 WeakPolarHBondContact CA-O 3.24Å; V394-P430 PolarHBondContact N-O 2.93Å; V394-C431 CarbonylContact O-C 3.59Å; V394-C431 VanDerWaalsContact O-CA 3.26Å; V394-C431 WeakPolarHBondContact O-CA 3.43Å; V394-V432 PolarHBondContact O-N 3.42Å
395	L	95.5	Very high	94.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.8	170.9	-46	-176.7	0	0	0	108.2	V393 I402 L409 F416 V432 F434 L442 V446	V393-L395 HydrophobicContact CG1-CD2 4.27Å; V393-L395 HydrophobicContact CG2-CD2 3.97Å; L395-I402 PolarHBondContact N-O 3.17Å; L395-I402 PolarHBondContact O-N 3.04Å; L395-L409 HydrophobicContact CD1-CD1 3.98Å; L395-L409 HydrophobicContact CD1-CD2 4.36Å; L395-L409 HydrophobicContact CD2-CD1 4.11Å; L395-L409 HydrophobicContact CG-CD1 4.36Å; L395-F416 HydrophobicContact CD1-CE1 4.05Å; L395-F416 HydrophobicContact CD1-CZ 3.75Å; L395-F416 HydrophobicContact CD2-CE1 4.09Å; L395-V432 HydrophobicContact CD2-CB 4.38Å; L395-F434 HydrophobicContact CB-CE2 4.33Å; L395-F434 HydrophobicContact CD2-CE2 4.1Å; L395-L442 HydrophobicContact CB-CD2 4.23Å; L395-V446 HydrophobicContact CD1-CG2 3.76Å
396	Q	94.6	Very high	94.4	Very high	43 Å²	43	55.3 Å²	55.3	20%	0.201	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.9	179	-178.1	174.6	-20.2	0	0	110.8	G398 V400 K401 V432 E433 F434	Q396-G398 WeakPolarHBondContact CG-O 3.44Å; Q396-G398 PolarHBondContact NE2-O 3.06Å; Q396-V400 VanDerWaalsContact CA-O 3.31Å; Q396-V400 WeakPolarHBondContact CA-O 3.17Å; Q396-K401 HydrophobicContact CB-CG 4.22Å; Q396-K401 HydrophobicContact CG-CG 4.03Å; Q396-V432 PolarHBondContact N-O 3.24Å; Q396-E433 WeakPolarHBondContact O-CA 3.46Å; Q396-F434 PolarHBondContact O-N 3.27Å
397	A	92.5	Very high	94.4	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.008	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	111	169.5	0	0	0	0	0	108.7	S399 V400 S439 L442	A397-S399 PolarHBondContact O-N 2.94Å; A397-V400 PolarHBondContact N-O 2.97Å; A397-V400 PolarHBondContact O-N 2.64Å; A397-V400 VanDerWaalsContact O-N 3.14Å; A397-S439 PolarHBondContact O-OG 3.26Å; A397-L442 HydrophobicContact CB-CB 4.46Å; A397-L442 HydrophobicContact CB-CD2 3.67Å
398	G	88.6	Confident	94.5	Very high	52 Å²	52	50.3 Å²	50.3	54%	0.536	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	-124.5	-170.1	0	0	0	0	0	111.6	Q396	Q396-G398 WeakPolarHBondContact CG-O 3.44Å; Q396-G398 PolarHBondContact NE2-O 3.06Å
399	S	90.3	Very high	94.6	Very high	114 Å²	114	48.4 Å²	48.4	80%	0.797	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-18.1	176	53.4	0	0	0	0	114.1	A397	A397-S399 PolarHBondContact O-N 2.94Å
400	V	94	Very high	94.7	Very high	44 Å²	44	45.2 Å²	45.2	27%	0.267	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	132.9	-175.5	175.4	0	0	0	0	110.6	Q396 A397 I402 I443	Q396-V400 VanDerWaalsContact CA-O 3.31Å; Q396-V400 WeakPolarHBondContact CA-O 3.17Å; A397-V400 PolarHBondContact N-O 2.97Å; A397-V400 PolarHBondContact O-N 2.64Å; A397-V400 VanDerWaalsContact O-N 3.14Å; V400-I402 HydrophobicContact CG1-CD1 4.4Å; V400-I402 HydrophobicContact CG1-CG1 3.9Å; V400-I443 HydrophobicContact CG1-CD1 4.03Å; V400-I443 HydrophobicContact CG1-CG1 4.19Å
401	K	94.5	Very high	94.7	Very high	134 Å²	134	41.3 Å²	41.3	58%	0.583	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.2	174.6	-74.3	-179.6	174.9	-179.8	0	110	V394 Q396	V394-K401 HydrophobicContact CG1-CB 3.73Å; V394-K401 HydrophobicContact CG1-CD 4.41Å; V394-K401 HydrophobicContact CG1-CG 4.07Å; Q396-K401 HydrophobicContact CB-CG 4.22Å; Q396-K401 HydrophobicContact CG-CG 4.03Å
402	I	96.1	Very high	94.7	Very high	12 Å²	12	42 Å²	42	6%	0.062	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	107.9	-174.4	-49	174.1	0	0	0	108.3	V394 L395 V400 L442 I443 V446	V394-I402 WeakPolarHBondContact CA-O 3.24Å; L395-I402 PolarHBondContact N-O 3.17Å; L395-I402 PolarHBondContact O-N 3.04Å; V400-I402 HydrophobicContact CG1-CD1 4.4Å; V400-I402 HydrophobicContact CG1-CG1 3.9Å; I402-L442 HydrophobicContact CD1-CB 4.34Å; I402-L442 HydrophobicContact CD1-CD2 4.02Å; I402-L442 HydrophobicContact CD1-CG 3.86Å; I402-I443 HydrophobicContact CD1-CB 4.49Å; I402-I443 HydrophobicContact CD1-CG1 3.77Å; I402-I443 HydrophobicContact CG1-CG1 4.38Å; I402-V446 HydrophobicContact CD1-CG2 4.44Å; I402-V446 HydrophobicContact CG2-CB 4.38Å; I402-V446 HydrophobicContact CG2-CG1 3.9Å
403	P	96.3	Very high	94.8	Very high	51 Å²	51	38.5 Å²	38.5	33%	0.331	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	138	171.9	30.4	-34	0	0	0	109.9	R385 C391	R385-P403 WeakPolarHBondContact CD-O 3.3Å; R385-P403 WeakPolarHBondContact CG-O 3.24Å; C391-P403 HydrophobicContact CB-CB 3.98Å
404	A	97	Very high	94.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	172.6	-178.7	0	0	0	0	0	111.4	C391 D392 V393 L409	C391-A404 CarbonylContact C-O 3.59Å; C391-A404 VanDerWaalsContact CA-O 3.26Å; C391-A404 WeakPolarHBondContact CA-O 3.4Å; C391-A404 WeakPolarHBondContact CB-O 3.38Å; D392-A404 PolarHBondContact N-O 3.02Å; V393-A404 HydrophobicContact CG1-CB 4.21Å; V393-A404 PolarHBondContact N-O 2.93Å; V393-A404 PolarHBondContact O-N 3.14Å; V393-A404 VanDerWaalsContact O-O 3.11Å; A404-L409 HydrophobicContact CB-CD1 3.77Å; A404-L409 HydrophobicContact CB-CD2 4.49Å; A404-L409 HydrophobicContact CB-CG 4.25Å
405	H	96.6	Very high	94.7	Very high	10 Å²	10	46.2 Å²	46.2	5%	0.046	27%	0.272	C	S	.	.			trans	-109.9	124	176	-51.7	70.4	0	0	0	109.7	L389 F390 D392 N407 V408 L409 Y450	L389-H405 PolarHBondContact O-NE2 3.06Å; L389-H405 VanDerWaalsContact O-NE2 3.17Å; F390-H405 PolarHBondContact O-CD2 3.13Å; F390-H405 VanDerWaalsContact O-CD2 3.32Å; D392-H405 VanDerWaalsContact OD1-CA 3.28Å; D392-H405 WeakPolarHBondContact OD1-CA 3.44Å; H405-N407 VanDerWaalsContact C-N 3.26Å; H405-N407 VanDerWaalsContact CB-OD1 3.25Å; H405-N407 WeakPolarHBondContact CB-OD1 3.39Å; H405-N407 PolarHBondContact O-N 3.45Å; H405-V408 HydrophobicContact CB-CB 4.49Å; H405-V408 HydrophobicContact CB-CG2 4.1Å; H405-V408 PolarHBondContact O-N 3.39Å; H405-L409 WeakPolarHBondContact O-CG 3.22Å; H405-L409 PolarHBondContact O-N 3.06Å; H405-L409 VanDerWaalsContact O-N 3.13Å; H405-Y450 WeakPolarHBondContact CB-OH 3.48Å; H405-Y450 PolarHBondContact N-OH 2.83Å; H405-Y450 AromaticContact ND1-CZ 3.88Å; H405-Y450 PolarHBondContact ND1-OH 3.48Å
406	R	95	Very high	94.7	Very high	31 Å²	31	46.2 Å²	46.2	12%	0.117	27%	0.272	C	S	.	.	H	α-helix	trans	-56.5	-39.7	-178.3	-68.4	177.9	-162.6	-93.7	-12.4	112.4	D392 V393 L409 A410 F420 E426 A427 S429	D392-R406 PolarHBondContact O-NE 3.33Å; D392-R406 VanDerWaalsContact O-NE 3.09Å; D392-R406 PolarHBondContact O-NH2 3.15Å; D392-R406 PolarHBondContact OD1-N 3.42Å; D392-R406 WeakPolarHBondContact OD2-CB 3.28Å; D392-R406 VanDerWaalsContact OD2-CD 3.24Å; D392-R406 WeakPolarHBondContact OD2-CD 3.33Å; D392-R406 VanDerWaalsContact OD2-CG 3.3Å; D392-R406 WeakPolarHBondContact OD2-CG 3.26Å; D392-R406 IonicContact OD2-NE 3.7Å; V393-R406 HydrophobicContact CB-CG 3.84Å; V393-R406 HydrophobicContact CG1-CG 3.75Å; R406-L409 PolarHBondContact O-N 3.21Å; R406-A410 WeakPolarHBondContact O-CB 3.31Å; R406-A410 PolarHBondContact O-N 2.86Å; R406-F420 HydrophobicContact CB-CD2 3.67Å; R406-F420 HydrophobicContact CB-CE2 4Å; R406-F420 HydrophobicContact CB-CG 4.15Å; R406-F420 HydrophobicContact CG-CD1 4.26Å; R406-F420 HydrophobicContact CG-CD2 3.86Å; R406-F420 HydrophobicContact CG-CE1 4.3Å; R406-F420 HydrophobicContact CG-CE2 3.91Å; R406-F420 HydrophobicContact CG-CG 4.06Å; R406-F420 HydrophobicContact CG-CZ 4.13Å; R406-E426 PolarHBondContact NH1-O 3.49Å; R406-E426 VanDerWaalsContact NH1-O 3.08Å; R406-A427 PolarHBondContact NH1-O 3.39Å; R406-A427 VanDerWaalsContact NH1-O 3.11Å; R406-S429 PolarHBondContact NH2-O 3.05Å
407	N	94.3	Very high	94.7	Very high	109 Å²	109	48.9 Å²	48.9	58%	0.583	28%	0.284	S	S	*	.	H	α-helix	trans	-64.6	-38.5	-178.9	64.4	-16.2	0	0	0	113	H405 A411	H405-N407 VanDerWaalsContact C-N 3.26Å; H405-N407 VanDerWaalsContact CB-OD1 3.25Å; H405-N407 WeakPolarHBondContact CB-OD1 3.39Å; H405-N407 PolarHBondContact O-N 3.45Å; N407-A411 VanDerWaalsContact O-CB 3.24Å; N407-A411 WeakPolarHBondContact O-CB 3.44Å; N407-A411 PolarHBondContact O-N 3.48Å
408	V	96	Very high	94.7	Very high	8 Å²	8	51.7 Å²	51.7	5%	0.048	31%	0.307	C	S	.	.	H	α-helix	trans	-71.8	-45.5	176.2	-175.4	0	0	0	0	110.2	F378 L381 H405 A410 A411 S412 I449 Y450	F378-V408 HydrophobicContact CE1-CG1 3.94Å; L381-V408 HydrophobicContact CD1-CG2 4.18Å; H405-V408 HydrophobicContact CB-CB 4.49Å; H405-V408 HydrophobicContact CB-CG2 4.1Å; H405-V408 PolarHBondContact O-N 3.39Å; V408-A410 PolarHBondContact O-N 3.05Å; V408-A411 PolarHBondContact O-N 3.21Å; V408-S412 PolarHBondContact O-N 2.95Å; V408-S412 VanDerWaalsContact O-N 3.14Å; V408-S412 PolarHBondContact O-OG 3.46Å; V408-I449 HydrophobicContact CG1-CG2 3.88Å; V408-Y450 HydrophobicContact CB-CE1 4.13Å; V408-Y450 HydrophobicContact CB-CE2 4.39Å; V408-Y450 HydrophobicContact CG1-CD1 4.26Å; V408-Y450 HydrophobicContact CG1-CD2 4.45Å; V408-Y450 HydrophobicContact CG1-CE1 3.84Å; V408-Y450 HydrophobicContact CG1-CE2 4.04Å; V408-Y450 HydrophobicContact CG2-CE1 4.04Å
409	L	96.3	Very high	94.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-57.8	-48	176	-67.4	174.8	0	0	0	111.9	V393 L395 A404 H405 R406 A411 S412 S413 F416 F420 I449	V393-L409 HydrophobicContact CG1-CD1 3.9Å; L395-L409 HydrophobicContact CD1-CD1 3.98Å; L395-L409 HydrophobicContact CD1-CD2 4.36Å; L395-L409 HydrophobicContact CD2-CD1 4.11Å; L395-L409 HydrophobicContact CG-CD1 4.36Å; A404-L409 HydrophobicContact CB-CD1 3.77Å; A404-L409 HydrophobicContact CB-CD2 4.49Å; A404-L409 HydrophobicContact CB-CG 4.25Å; H405-L409 WeakPolarHBondContact O-CG 3.22Å; H405-L409 PolarHBondContact O-N 3.06Å; H405-L409 VanDerWaalsContact O-N 3.13Å; R406-L409 PolarHBondContact O-N 3.21Å; L409-A411 VanDerWaalsContact C-N 3.31Å; L409-A411 PolarHBondContact O-N 2.85Å; L409-S412 PolarHBondContact O-N 3.03Å; L409-S413 PolarHBondContact O-N 2.83Å; L409-F416 HydrophobicContact CB-CB 3.89Å; L409-F416 HydrophobicContact CB-CD1 4.33Å; L409-F416 HydrophobicContact CB-CD2 3.95Å; L409-F416 HydrophobicContact CB-CG 3.82Å; L409-F416 HydrophobicContact CD1-CD1 4.34Å; L409-F416 HydrophobicContact CD1-CE1 4.33Å; L409-F416 HydrophobicContact CD2-CD2 4.14Å; L409-F416 HydrophobicContact CD2-CE2 3.99Å; L409-F416 HydrophobicContact CD2-CZ 4.37Å; L409-F420 HydrophobicContact CB-CE2 3.97Å; L409-F420 HydrophobicContact CD1-CE2 3.86Å; L409-F420 HydrophobicContact CD1-CZ 4.19Å; L409-I449 HydrophobicContact CD2-CD1 3.81Å; L409-I449 HydrophobicContact CD2-CG2 4.35Å
410	A	95.5	Very high	95.1	Very high	18 Å²	18	46.4 Å²	46.4	15%	0.149	26%	0.256	C	S	.	.	H	α-helix	trans	-73.5	-14.8	179.3	0	0	0	0	0	114.7	R406 V408 H417 F420	R406-A410 WeakPolarHBondContact O-CB 3.31Å; R406-A410 PolarHBondContact O-N 2.86Å; V408-A410 PolarHBondContact O-N 3.05Å; A410-H417 HydrophobicContact CB-CB 4.31Å; A410-H417 PolarHBondContact O-ND1 3.38Å; A410-F420 HydrophobicContact CB-CD2 4.32Å
411	A	95.3	Very high	95	Very high	81 Å²	81	48.9 Å²	48.9	67%	0.669	27%	0.271	S	S	*	.	H	α-helix	trans	-83.3	-31.9	171.2	0	0	0	0	0	111.9	N407 V408 L409	N407-A411 VanDerWaalsContact O-CB 3.24Å; N407-A411 WeakPolarHBondContact O-CB 3.44Å; N407-A411 PolarHBondContact O-N 3.48Å; V408-A411 PolarHBondContact O-N 3.21Å; L409-A411 VanDerWaalsContact C-N 3.31Å; L409-A411 PolarHBondContact O-N 2.85Å
412	S	94.2	Very high	94.5	Very high	49 Å²	49	44.1 Å²	44.1	34%	0.343	26%	0.26	S	S	.	.	H	α-helix	trans	-98.5	-9.1	-176.1	-61.4	0	0	0	0	114.8	V408 L409 L473	V408-S412 PolarHBondContact O-N 2.95Å; V408-S412 VanDerWaalsContact O-N 3.14Å; V408-S412 PolarHBondContact O-OG 3.46Å; L409-S412 PolarHBondContact O-N 3.03Å; S412-L473 WeakPolarHBondContact O-CD2 3.42Å
413	S	96.4	Very high	93.8	Very high	5 Å²	5	49.9 Å²	49.9	4%	0.035	30%	0.301	C	S	.	.			trans	-145.4	130.1	-177.3	161.3	0	0	0	0	111.8	L409 Y415 F416 H417 L471	L409-S413 PolarHBondContact O-N 2.83Å; S413-Y415 VanDerWaalsContact C-N 3.31Å; S413-Y415 PolarHBondContact O-N 3.17Å; S413-Y415 PolarHBondContact OG-N 3Å; S413-F416 PolarHBondContact O-N 2.96Å; S413-F416 PolarHBondContact OG-N 3.48Å; S413-H417 WeakPolarHBondContact O-CB 3.24Å; S413-H417 PolarHBondContact O-N 3.08Å; S413-L471 PolarHBondContact OG-O 3.45Å
414	Q	94.7	Very high	93	Very high	149 Å²	149	54 Å²	54	70%	0.696	32%	0.318	S	S	*	.	H	α-helix	trans	-68.2	-29.7	174.8	-69.7	-176.2	9.3	0	0	112.4	H417 A418	Q414-H417 WeakPolarHBondContact O-CB 3.46Å; Q414-H417 PolarHBondContact O-N 2.92Å; Q414-A418 WeakPolarHBondContact O-CB 3.25Å; Q414-A418 PolarHBondContact O-N 3.14Å
415	Y	94.8	Very high	92.1	Very high	60 Å²	60	59.3 Å²	59.3	24%	0.235	35%	0.35	C	S	.	.	H	α-helix	trans	-64	-51.1	173.7	177.9	-87.6	0	0	0	111.4	S413 H417 A418 M419 F434 L470 L471 Q472	S413-Y415 VanDerWaalsContact C-N 3.31Å; S413-Y415 PolarHBondContact O-N 3.17Å; S413-Y415 PolarHBondContact OG-N 3Å; Y415-H417 VanDerWaalsContact C-N 3.29Å; Y415-H417 PolarHBondContact O-N 3.24Å; Y415-A418 PolarHBondContact O-N 3.21Å; Y415-M419 HydrophobicContact CE1-CE 3.53Å; Y415-M419 HydrophobicContact CE1-SD 4.38Å; Y415-M419 WeakPolarHBondContact O-CB 3.22Å; Y415-M419 PolarHBondContact O-N 2.78Å; Y415-M419 WeakPolarHBondContact OH-CE 3.48Å; Y415-F434 AromaticContact CE1-CE1 3.73Å; Y415-F434 HydrophobicContact CE1-CE1 3.73Å; Y415-F434 HydrophobicContact CE1-CZ 4.07Å; Y415-L470 VanDerWaalsContact CD2-O 3.22Å; Y415-L470 WeakPolarHBondContact CD2-O 3.38Å; Y415-L470 HydrophobicContact CE2-CD1 4.32Å; Y415-L471 HydrophobicContact CD1-CD2 3.62Å; Y415-L471 HydrophobicContact CE1-CD2 3.72Å; Y415-L471 HydrophobicContact CG-CD2 4.33Å; Y415-Q472 VanDerWaalsContact N-OE1 3.15Å
416	F	95.1	Very high	91.2	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-66.6	-32.1	176.2	-74.6	-60.2	0	0	0	112	L395 L409 S413 M419 F420 F434 I449 L471	L395-F416 HydrophobicContact CD1-CE1 4.05Å; L395-F416 HydrophobicContact CD1-CZ 3.75Å; L395-F416 HydrophobicContact CD2-CE1 4.09Å; L409-F416 HydrophobicContact CB-CB 3.89Å; L409-F416 HydrophobicContact CB-CD1 4.33Å; L409-F416 HydrophobicContact CB-CD2 3.95Å; L409-F416 HydrophobicContact CB-CG 3.82Å; L409-F416 HydrophobicContact CD1-CD1 4.34Å; L409-F416 HydrophobicContact CD1-CE1 4.33Å; L409-F416 HydrophobicContact CD2-CD2 4.14Å; L409-F416 HydrophobicContact CD2-CE2 3.99Å; L409-F416 HydrophobicContact CD2-CZ 4.37Å; S413-F416 PolarHBondContact O-N 2.96Å; S413-F416 PolarHBondContact OG-N 3.48Å; F416-M419 HydrophobicContact CD1-SD 4.38Å; F416-F420 HydrophobicContact CB-CD2 4.25Å; F416-F420 HydrophobicContact CB-CE2 3.99Å; F416-F420 AromaticContact CD1-CE2 3.71Å; F416-F420 HydrophobicContact CD1-CE2 3.71Å; F416-F420 AromaticContact CD1-CZ 3.76Å; F416-F420 HydrophobicContact CD1-CZ 3.76Å; F416-F420 HydrophobicContact CE1-CZ 4.35Å; F416-F420 HydrophobicContact CG-CE2 4.19Å; F416-F420 WeakPolarHBondContact O-CB 3.26Å; F416-F420 VanDerWaalsContact O-CD2 3.24Å; F416-F420 WeakPolarHBondContact O-CD2 3.19Å; F416-F420 WeakPolarHBondContact O-CG 3.34Å; F416-F420 PolarHBondContact O-N 3.2Å; F416-F434 HydrophobicContact CE1-CE2 4.29Å; F416-F434 AromaticContact CE1-CZ 3.72Å; F416-F434 HydrophobicContact CE1-CZ 3.72Å; F416-F434 HydrophobicContact CZ-CZ 4.12Å; F416-I449 HydrophobicContact CE2-CD1 4.3Å; F416-L471 HydrophobicContact CE2-CD1 4.19Å; F416-L471 HydrophobicContact CE2-CD2 4.1Å; F416-L471 HydrophobicContact CZ-CD1 4.28Å; F416-L471 HydrophobicContact CZ-CD2 3.91Å
417	H	94.8	Very high	90.6	Very high	98 Å²	98	61.7 Å²	61.7	45%	0.454	37%	0.366	S	S	.	.	H	α-helix	trans	-59.5	-54.2	172.2	-168.1	92.4	0	0	0	111.8	A410 S413 Q414 Y415 M419 F420 T421	A410-H417 HydrophobicContact CB-CB 4.31Å; A410-H417 PolarHBondContact O-ND1 3.38Å; S413-H417 WeakPolarHBondContact O-CB 3.24Å; S413-H417 PolarHBondContact O-N 3.08Å; Q414-H417 WeakPolarHBondContact O-CB 3.46Å; Q414-H417 PolarHBondContact O-N 2.92Å; Y415-H417 VanDerWaalsContact C-N 3.29Å; Y415-H417 PolarHBondContact O-N 3.24Å; H417-M419 VanDerWaalsContact C-N 3.35Å; H417-M419 PolarHBondContact O-N 3.49Å; H417-F420 PolarHBondContact O-N 3.43Å; H417-T421 WeakPolarHBondContact O-CB 3.38Å; H417-T421 WeakPolarHBondContact O-CG2 3.34Å; H417-T421 PolarHBondContact O-N 2.93Å; H417-T421 PolarHBondContact O-OG1 3.23Å
418	A	93.5	Very high	90.2	Very high	61 Å²	61	67.4 Å²	67.4	50%	0.504	38%	0.379	S	S	.	.	H	α-helix	trans	-61.3	-41.8	178	0	0	0	0	0	112.1	Q414 Y415 F420 G422	Q414-A418 WeakPolarHBondContact O-CB 3.25Å; Q414-A418 PolarHBondContact O-N 3.14Å; Y415-A418 PolarHBondContact O-N 3.21Å; A418-F420 PolarHBondContact O-N 2.8Å; A418-G422 WeakPolarHBondContact O-CA 3.36Å; A418-G422 PolarHBondContact O-N 3.49Å
419	M	92.8	Very high	89.9	Confident	25 Å²	25	69.1 Å²	69.1	12%	0.123	39%	0.391	C	S	.	.	H	α-helix	trans	-61.8	-41.6	178	179.1	179.7	-82.6	0	0	113.1	Y415 F416 H417 E426 A427 V432 F434	Y415-M419 HydrophobicContact CE1-CE 3.53Å; Y415-M419 HydrophobicContact CE1-SD 4.38Å; Y415-M419 WeakPolarHBondContact O-CB 3.22Å; Y415-M419 PolarHBondContact O-N 2.78Å; Y415-M419 WeakPolarHBondContact OH-CE 3.48Å; F416-M419 HydrophobicContact CD1-SD 4.38Å; H417-M419 VanDerWaalsContact C-N 3.35Å; H417-M419 PolarHBondContact O-N 3.49Å; M419-E426 HydrophobicContact CG-CB 3.92Å; M419-E426 HydrophobicContact SD-CB 4.28Å; M419-A427 WeakPolarHBondContact O-CA 3.24Å; M419-A427 VanDerWaalsContact O-CB 3.3Å; M419-A427 WeakPolarHBondContact O-CB 3.22Å; M419-V432 HydrophobicContact CE-CG1 3.97Å; M419-V432 HydrophobicContact SD-CG1 3.82Å; M419-V432 HydrophobicContact SD-CG2 4.39Å; M419-F434 HydrophobicContact CE-CZ 4.17Å; M419-F434 HydrophobicContact SD-CZ 4.5Å
420	F	93.3	Very high	89.6	Confident	30 Å²	30	73.8 Å²	73.8	13%	0.132	42%	0.422	C	S	.	.	H	α-helix	trans	-93.8	-14.8	-174.9	-57.9	-34.4	0	0	0	114.4	V393 R406 L409 A410 F416 H417 A418 V432	V393-F420 HydrophobicContact CG1-CZ 4.3Å; V393-F420 HydrophobicContact CG2-CE1 4.38Å; V393-F420 HydrophobicContact CG2-CZ 4.26Å; R406-F420 HydrophobicContact CB-CD2 3.67Å; R406-F420 HydrophobicContact CB-CE2 4Å; R406-F420 HydrophobicContact CB-CG 4.15Å; R406-F420 HydrophobicContact CG-CD1 4.26Å; R406-F420 HydrophobicContact CG-CD2 3.86Å; R406-F420 HydrophobicContact CG-CE1 4.3Å; R406-F420 HydrophobicContact CG-CE2 3.91Å; R406-F420 HydrophobicContact CG-CG 4.06Å; R406-F420 HydrophobicContact CG-CZ 4.13Å; L409-F420 HydrophobicContact CB-CE2 3.97Å; L409-F420 HydrophobicContact CD1-CE2 3.86Å; L409-F420 HydrophobicContact CD1-CZ 4.19Å; A410-F420 HydrophobicContact CB-CD2 4.32Å; F416-F420 HydrophobicContact CB-CD2 4.25Å; F416-F420 HydrophobicContact CB-CE2 3.99Å; F416-F420 AromaticContact CD1-CE2 3.71Å; F416-F420 HydrophobicContact CD1-CE2 3.71Å; F416-F420 AromaticContact CD1-CZ 3.76Å; F416-F420 HydrophobicContact CD1-CZ 3.76Å; F416-F420 HydrophobicContact CE1-CZ 4.35Å; F416-F420 HydrophobicContact CG-CE2 4.19Å; F416-F420 WeakPolarHBondContact O-CB 3.26Å; F416-F420 VanDerWaalsContact O-CD2 3.24Å; F416-F420 WeakPolarHBondContact O-CD2 3.19Å; F416-F420 WeakPolarHBondContact O-CG 3.34Å; F416-F420 PolarHBondContact O-N 3.2Å; H417-F420 PolarHBondContact O-N 3.43Å; A418-F420 PolarHBondContact O-N 2.8Å; F420-V432 HydrophobicContact CE1-CG2 4.37Å
421	T	91.6	Very high	89.5	Confident	95 Å²	95	74.9 Å²	74.9	58%	0.583	43%	0.428	S	S	*	.	H	α-helix	trans	-95.8	-18.4	171.1	58.4	0	0	0	0	113.4	H417	H417-T421 WeakPolarHBondContact O-CB 3.38Å; H417-T421 WeakPolarHBondContact O-CG2 3.34Å; H417-T421 PolarHBondContact O-N 2.93Å; H417-T421 PolarHBondContact O-OG1 3.23Å
422	G	86.1	Confident	89.4	Confident	34 Å²	34	71.2 Å²	71.2	35%	0.351	40%	0.397	S	S	.	.	S	Bend	trans	-71.2	172.9	178.8	0	0	0	0	0	114.7	A418 A427	A418-G422 WeakPolarHBondContact O-CA 3.36Å; A418-G422 PolarHBondContact O-N 3.49Å; G422-A427 VanDerWaalsContact O-CB 3.23Å; G422-A427 WeakPolarHBondContact O-CB 3.35Å
423	S	80.6	Confident	89.3	Confident	133 Å²	133	73.7 Å²	73.7	93%	0.93	40%	0.403	S	S	*	.	S	Bend	trans	-89.3	5.5	179.5	49.8	0	0	0	0	114.5
424	M	78.2	Confident	89	Confident	137 Å²	137	74 Å²	74	68%	0.675	40%	0.404	S	S	*	.	S	Bend	trans	-72.9	161.2	-179	-66.5	179.3	175.9	0	0	112.7	E426 A427	M424-E426 PolarHBondContact O-N 3.32Å; M424-A427 VanDerWaalsContact O-CB 3.28Å; M424-A427 WeakPolarHBondContact O-CB 3.42Å; M424-A427 PolarHBondContact O-N 3.28Å
425	T	78.1	Confident	88.6	Confident	112 Å²	112	76.5 Å²	76.5	69%	0.687	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-53.7	-39.7	177.7	19.9	0	0	0	0	113.3	A427 R428 S429	T425-A427 VanDerWaalsContact C-N 3.25Å; T425-A427 PolarHBondContact O-N 3.27Å; T425-R428 PolarHBondContact O-N 3.11Å; T425-R428 VanDerWaalsContact O-N 3.07Å; T425-S429 PolarHBondContact O-N 3.2Å
426	E	79.2	Confident	88.1	Confident	74 Å²	74	77.9 Å²	77.9	35%	0.346	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-63.3	-29	-177.5	-71.1	73.7	-176.4	0	0	112.2	R406 M419 M424 R428 V432	R406-E426 PolarHBondContact NH1-O 3.49Å; R406-E426 VanDerWaalsContact NH1-O 3.08Å; M419-E426 HydrophobicContact CG-CB 3.92Å; M419-E426 HydrophobicContact SD-CB 4.28Å; M424-E426 PolarHBondContact O-N 3.32Å; E426-R428 PolarHBondContact O-N 2.89Å; E426-V432 HydrophobicContact CB-CG2 4.49Å; E426-V432 HydrophobicContact CG-CG1 4.38Å
427	A	81.8	Confident	87.9	Confident	17 Å²	17	78.6 Å²	78.6	14%	0.14	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-61.3	-26	174.6	0	0	0	0	0	112.6	R406 M419 G422 M424 T425	R406-A427 PolarHBondContact NH1-O 3.39Å; R406-A427 VanDerWaalsContact NH1-O 3.11Å; M419-A427 WeakPolarHBondContact O-CA 3.24Å; M419-A427 VanDerWaalsContact O-CB 3.3Å; M419-A427 WeakPolarHBondContact O-CB 3.22Å; G422-A427 VanDerWaalsContact O-CB 3.23Å; G422-A427 WeakPolarHBondContact O-CB 3.35Å; M424-A427 VanDerWaalsContact O-CB 3.28Å; M424-A427 WeakPolarHBondContact O-CB 3.42Å; M424-A427 PolarHBondContact O-N 3.28Å; T425-A427 VanDerWaalsContact C-N 3.25Å; T425-A427 PolarHBondContact O-N 3.27Å
428	R	85.1	Confident	87.9	Confident	230 Å²	230	79 Å²	79	87%	0.868	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	-15.7	-178.9	-62.3	-177.9	-177.5	169.8	2	114.3	T425 E426	T425-R428 PolarHBondContact O-N 3.11Å; T425-R428 VanDerWaalsContact O-N 3.07Å; E426-R428 PolarHBondContact O-N 2.89Å
429	S	89.8	Confident	87.9	Confident	43 Å²	43	77.5 Å²	77.5	30%	0.301	43%	0.431	S	S	.	.			trans	-64.9	128.6	178.7	-176.2	0	0	0	0	110.9	R406 T425 C431	R406-S429 PolarHBondContact NH2-O 3.05Å; T425-S429 PolarHBondContact O-N 3.2Å; S429-C431 WeakPolarHBondContact CB-O 3.27Å; S429-C431 PolarHBondContact O-N 3.32Å; S429-C431 PolarHBondContact OG-N 3.22Å; S429-C431 PolarHBondContact OG-O 2.99Å
430	P	90.4	Very high	88	Confident	98 Å²	98	78.2 Å²	78.2	64%	0.636	44%	0.439	S	S	*	.	S	Bend	trans	-68.4	-16.3	178	29.1	-35.5	0	0	0	113	V394	V394-P430 PolarHBondContact N-O 2.93Å
431	C	93.7	Very high	88.2	Confident	41 Å²	41	76.8 Å²	76.8	28%	0.277	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	134.9	173.6	-163.1	0	0	0	0	110.5	V394 S429	V394-C431 CarbonylContact O-C 3.59Å; V394-C431 VanDerWaalsContact O-CA 3.26Å; V394-C431 WeakPolarHBondContact O-CA 3.43Å; S429-C431 WeakPolarHBondContact CB-O 3.27Å; S429-C431 PolarHBondContact O-N 3.32Å; S429-C431 PolarHBondContact OG-N 3.22Å; S429-C431 PolarHBondContact OG-O 2.99Å
432	V	93.4	Very high	88.4	Confident	5 Å²	5	72.3 Å²	72.3	3%	0.03	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	119.3	177.1	-179.1	0	0	0	0	108.7	V393 V394 L395 Q396 M419 F420 E426 F434	V393-V432 HydrophobicContact CG2-CG2 3.91Å; V394-V432 PolarHBondContact O-N 3.42Å; L395-V432 HydrophobicContact CD2-CB 4.38Å; Q396-V432 PolarHBondContact N-O 3.24Å; M419-V432 HydrophobicContact CE-CG1 3.97Å; M419-V432 HydrophobicContact SD-CG1 3.82Å; M419-V432 HydrophobicContact SD-CG2 4.39Å; F420-V432 HydrophobicContact CE1-CG2 4.37Å; E426-V432 HydrophobicContact CB-CG2 4.49Å; E426-V432 HydrophobicContact CG-CG1 4.38Å; V432-F434 HydrophobicContact CB-CE2 4.17Å; V432-F434 HydrophobicContact CG1-CD2 4.29Å; V432-F434 HydrophobicContact CG1-CE2 3.57Å; V432-F434 HydrophobicContact CG1-CZ 3.94Å
433	E	91.9	Very high	88.9	Confident	100 Å²	100	73.8 Å²	73.8	47%	0.467	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	121.9	-178.7	-171.4	-171.5	-158.6	0	0	111.5	Q396 R435	Q396-E433 WeakPolarHBondContact O-CA 3.46Å; E433-R435 HydrophobicContact CG-CG 4.21Å; E433-R435 IonicContact OE1-NE 2.79Å; E433-R435 IonicContact OE2-CZ 3.8Å; E433-R435 IonicContact OE2-NE 2.7Å; E433-R435 PolarHBondContact OE2-NE 3.31Å; E433-R435 IonicContact OE2-NH2 3.17Å; E433-R435 PolarHBondContact OE2-NH2 3.4Å
434	F	90.5	Very high	89.6	Confident	12 Å²	12	70 Å²	70	5%	0.053	37%	0.371	C	S	.	.			trans	-96.3	105.5	174.6	-74	-88.9	0	0	0	110.4	L395 Q396 Y415 F416 M419 V432 I437 L442 L471	L395-F434 HydrophobicContact CB-CE2 4.33Å; L395-F434 HydrophobicContact CD2-CE2 4.1Å; Q396-F434 PolarHBondContact O-N 3.27Å; Y415-F434 AromaticContact CE1-CE1 3.73Å; Y415-F434 HydrophobicContact CE1-CE1 3.73Å; Y415-F434 HydrophobicContact CE1-CZ 4.07Å; F416-F434 HydrophobicContact CE1-CE2 4.29Å; F416-F434 AromaticContact CE1-CZ 3.72Å; F416-F434 HydrophobicContact CE1-CZ 3.72Å; F416-F434 HydrophobicContact CZ-CZ 4.12Å; M419-F434 HydrophobicContact CE-CZ 4.17Å; M419-F434 HydrophobicContact SD-CZ 4.5Å; V432-F434 HydrophobicContact CB-CE2 4.17Å; V432-F434 HydrophobicContact CG1-CD2 4.29Å; V432-F434 HydrophobicContact CG1-CE2 3.57Å; V432-F434 HydrophobicContact CG1-CZ 3.94Å; F434-I437 HydrophobicContact CB-CB 4.34Å; F434-I437 HydrophobicContact CB-CD1 4.19Å; F434-I437 HydrophobicContact CB-CG1 4.38Å; F434-I437 HydrophobicContact CD1-CD1 3.56Å; F434-I437 HydrophobicContact CD1-CG1 4.46Å; F434-I437 HydrophobicContact CE1-CD1 4.36Å; F434-I437 HydrophobicContact CG-CD1 4.15Å; F434-L442 HydrophobicContact CD2-CD2 4.26Å; F434-L471 HydrophobicContact CD1-CD2 4.37Å; F434-L471 HydrophobicContact CE1-CD2 3.69Å; F434-L471 HydrophobicContact CZ-CD2 4.28Å
435	R	85.7	Confident	90.5	Very high	202 Å²	202	63.4 Å²	63.4	76%	0.762	34%	0.339	S	S	*	.	S	Bend	trans	-92.5	121.2	175.1	-60.8	-177.4	-177.5	179.1	2.5	109.3	E433	E433-R435 HydrophobicContact CG-CG 4.21Å; E433-R435 IonicContact OE1-NE 2.79Å; E433-R435 IonicContact OE2-CZ 3.8Å; E433-R435 IonicContact OE2-NE 2.7Å; E433-R435 PolarHBondContact OE2-NE 3.31Å; E433-R435 IonicContact OE2-NH2 3.17Å; E433-R435 PolarHBondContact OE2-NH2 3.4Å
436	G	84	Confident	91.4	Very high	88 Å²	88	58.1 Å²	58.1	91%	0.907	31%	0.307	S	S	*	.	S	Bend	trans	96.9	-1.2	-179.6	0	0	0	0	0	115.8
437	I	92.3	Very high	92.2	Very high	16 Å²	16	57.4 Å²	57.4	8%	0.082	31%	0.305	C	S	.	.	S	Bend	trans	-99.4	133.4	165.9	-55.5	-176.5	0	0	0	108.5	F434 L442 A467 L470 L471	F434-I437 HydrophobicContact CB-CB 4.34Å; F434-I437 HydrophobicContact CB-CD1 4.19Å; F434-I437 HydrophobicContact CB-CG1 4.38Å; F434-I437 HydrophobicContact CD1-CD1 3.56Å; F434-I437 HydrophobicContact CD1-CG1 4.46Å; F434-I437 HydrophobicContact CE1-CD1 4.36Å; F434-I437 HydrophobicContact CG-CD1 4.15Å; I437-L442 HydrophobicContact CG2-CB 4.01Å; I437-A467 HydrophobicContact CG2-CB 3.81Å; I437-L470 HydrophobicContact CD1-CD2 3.86Å; I437-L470 HydrophobicContact CG1-CD2 3.91Å; I437-L471 HydrophobicContact CD1-CD1 4.32Å; I437-L471 HydrophobicContact CD1-CD2 4.23Å; I437-L471 HydrophobicContact CD1-CG 4.2Å
438	E	93.1	Very high	92.9	Very high	107 Å²	107	57.3 Å²	57.3	50%	0.5	30%	0.302	S	S	.	.			trans	-72	139.2	173	-161	-169.8	124.6	0	0	111.1	S440 A441 L442 T463	E438-S440 PolarHBondContact O-N 2.94Å; E438-S440 WeakPolarHBondContact OE1-CB 3.4Å; E438-S440 PolarHBondContact OE1-OG 3.27Å; E438-A441 PolarHBondContact O-N 3.16Å; E438-A441 VanDerWaalsContact O-N 3.14Å; E438-L442 PolarHBondContact O-N 3.02Å; E438-T463 WeakPolarHBondContact OE2-CG2 3.43Å
439	S	94.7	Very high	93.5	Very high	28 Å²	28	46.7 Å²	46.7	20%	0.196	26%	0.262	C	S	.	.	H	α-helix	trans	-54.7	-35.9	-179.9	-43.8	0	0	0	0	113.2	A397 L442 I443	A397-S439 PolarHBondContact O-OG 3.26Å; S439-L442 PolarHBondContact O-N 3.3Å; S439-I443 WeakPolarHBondContact O-CD1 3.49Å; S439-I443 WeakPolarHBondContact O-CG1 3.38Å; S439-I443 PolarHBondContact O-N 3.28Å
440	S	95.3	Very high	93.8	Very high	41 Å²	41	44.8 Å²	44.8	29%	0.287	25%	0.248	S	C	.	.	H	α-helix	trans	-63.9	-45.1	178.1	65.4	0	0	0	0	112.4	E438 Q444	E438-S440 PolarHBondContact O-N 2.94Å; E438-S440 WeakPolarHBondContact OE1-CB 3.4Å; E438-S440 PolarHBondContact OE1-OG 3.27Å; S440-Q444 WeakPolarHBondContact O-CG 3.44Å; S440-Q444 PolarHBondContact O-N 3.32Å; S440-Q444 VanDerWaalsContact O-N 3.14Å; S440-Q444 PolarHBondContact O-NE2 2.82Å
441	A	96.4	Very high	94	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.8	-42.7	176.9	0	0	0	0	0	111	E438 I443 Q444 L445 T463 A467	E438-A441 PolarHBondContact O-N 3.16Å; E438-A441 VanDerWaalsContact O-N 3.14Å; A441-I443 PolarHBondContact O-N 3.28Å; A441-Q444 PolarHBondContact O-N 2.99Å; A441-L445 WeakPolarHBondContact O-CG 3.39Å; A441-L445 PolarHBondContact O-N 3.48Å; A441-T463 WeakPolarHBondContact CB-O 3.5Å; A441-A467 HydrophobicContact CB-CB 4.05Å
442	L	96.3	Very high	93.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.6	-40.3	177.6	-170.9	64.7	0	0	0	112.2	L395 A397 I402 F434 I437 E438 S439 L445 V446 L471	L395-L442 HydrophobicContact CB-CD2 4.23Å; A397-L442 HydrophobicContact CB-CB 4.46Å; A397-L442 HydrophobicContact CB-CD2 3.67Å; I402-L442 HydrophobicContact CD1-CB 4.34Å; I402-L442 HydrophobicContact CD1-CD2 4.02Å; I402-L442 HydrophobicContact CD1-CG 3.86Å; F434-L442 HydrophobicContact CD2-CD2 4.26Å; I437-L442 HydrophobicContact CG2-CB 4.01Å; E438-L442 PolarHBondContact O-N 3.02Å; S439-L442 PolarHBondContact O-N 3.3Å; L442-L445 PolarHBondContact O-N 3.1Å; L442-V446 HydrophobicContact CD1-CG2 4.26Å; L442-V446 HydrophobicContact CG-CG2 4.38Å; L442-V446 WeakPolarHBondContact O-CB 3.49Å; L442-V446 VanDerWaalsContact O-CG2 3.27Å; L442-V446 WeakPolarHBondContact O-CG2 3.41Å; L442-V446 PolarHBondContact O-N 3.48Å; L442-L471 HydrophobicContact CD1-CD1 3.84Å
443	I	95.9	Very high	93.9	Very high	66 Å²	66	47.2 Å²	47.2	34%	0.338	25%	0.253	S	S	.	.	H	α-helix	trans	-59.8	-46.2	173.3	-68	161.3	0	0	0	110.8	V400 I402 S439 A441 N447	V400-I443 HydrophobicContact CG1-CD1 4.03Å; V400-I443 HydrophobicContact CG1-CG1 4.19Å; I402-I443 HydrophobicContact CD1-CB 4.49Å; I402-I443 HydrophobicContact CD1-CG1 3.77Å; I402-I443 HydrophobicContact CG1-CG1 4.38Å; S439-I443 WeakPolarHBondContact O-CD1 3.49Å; S439-I443 WeakPolarHBondContact O-CG1 3.38Å; S439-I443 PolarHBondContact O-N 3.28Å; A441-I443 PolarHBondContact O-N 3.28Å; I443-N447 VanDerWaalsContact O-CB 3.32Å; I443-N447 WeakPolarHBondContact O-CB 3.36Å; I443-N447 VanDerWaalsContact O-CG 3.22Å; I443-N447 PolarHBondContact O-N 2.89Å; I443-N447 PolarHBondContact O-ND2 3.27Å
444	Q	96.8	Very high	94.1	Very high	52 Å²	52	43.1 Å²	43.1	24%	0.243	23%	0.234	C	C	.	.	H	α-helix	trans	-63.3	-44.5	-180	-73.4	168.8	99.7	0	0	112.1	S440 A441 N447 F448 I454 N460 L464	S440-Q444 WeakPolarHBondContact O-CG 3.44Å; S440-Q444 PolarHBondContact O-N 3.32Å; S440-Q444 VanDerWaalsContact O-N 3.14Å; S440-Q444 PolarHBondContact O-NE2 2.82Å; A441-Q444 PolarHBondContact O-N 2.99Å; Q444-N447 PolarHBondContact O-N 3.48Å; Q444-F448 WeakPolarHBondContact O-CB 3.29Å; Q444-F448 PolarHBondContact O-N 2.85Å; Q444-I454 HydrophobicContact CB-CD1 4.36Å; Q444-N460 PolarHBondContact OE1-ND2 2.97Å; Q444-L464 HydrophobicContact CB-CD1 4.32Å
445	L	97.3	Very high	94.3	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-68.5	-39.4	179	-66.3	174	0	0	0	112.8	A441 L442 F448 I449 I454 L464 A467 A468 L471 L473 V476	A441-L445 WeakPolarHBondContact O-CG 3.39Å; A441-L445 PolarHBondContact O-N 3.48Å; L442-L445 PolarHBondContact O-N 3.1Å; L445-F448 PolarHBondContact O-N 2.9Å; L445-I449 WeakPolarHBondContact O-CG1 3.37Å; L445-I449 PolarHBondContact O-N 3.27Å; L445-I449 VanDerWaalsContact O-N 3.08Å; L445-I454 HydrophobicContact CD2-CD1 4.4Å; L445-L464 HydrophobicContact CD1-CD1 4.31Å; L445-L464 HydrophobicContact CD2-CD1 3.56Å; L445-L464 HydrophobicContact CG-CD1 3.72Å; L445-A467 HydrophobicContact CD1-CB 3.56Å; L445-A468 HydrophobicContact CD1-CB 4.46Å; L445-A468 HydrophobicContact CD2-CB 4.03Å; L445-L471 HydrophobicContact CD1-CD1 4Å; L445-L473 HydrophobicContact CB-CD1 3.9Å; L445-L473 HydrophobicContact CD1-CD1 4.39Å; L445-L473 HydrophobicContact CD2-CD1 3.84Å; L445-L473 HydrophobicContact CG-CD1 4.25Å; L445-V476 HydrophobicContact CD2-CB 4.15Å; L445-V476 HydrophobicContact CD2-CG1 3.74Å; L445-V476 HydrophobicContact CD2-CG2 4.11Å
446	V	96.5	Very high	94.8	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-67.8	-39.4	173.9	176.5	0	0	0	0	110.9	L395 I402 L442 I449 Y450	L395-V446 HydrophobicContact CD1-CG2 3.76Å; I402-V446 HydrophobicContact CD1-CG2 4.44Å; I402-V446 HydrophobicContact CG2-CB 4.38Å; I402-V446 HydrophobicContact CG2-CG1 3.9Å; L442-V446 HydrophobicContact CD1-CG2 4.26Å; L442-V446 HydrophobicContact CG-CG2 4.38Å; L442-V446 WeakPolarHBondContact O-CB 3.49Å; L442-V446 VanDerWaalsContact O-CG2 3.27Å; L442-V446 WeakPolarHBondContact O-CG2 3.41Å; L442-V446 PolarHBondContact O-N 3.48Å; V446-I449 PolarHBondContact O-N 3.22Å; V446-Y450 HydrophobicContact CG1-CD2 4.45Å; V446-Y450 HydrophobicContact CG1-CE2 4.48Å; V446-Y450 WeakPolarHBondContact O-CD2 3.27Å
447	N	96.1	Very high	95.3	Very high	59 Å²	59	33.1 Å²	33.1	32%	0.316	18%	0.175	S	C	.	.	H	α-helix	trans	-62	-46.7	174.2	-75.2	-18.1	0	0	0	111	R385 I443 Q444 I449 Y450 T451	R385-N447 PolarHBondContact NH1-OD1 3.18Å; R385-N447 PolarHBondContact NH2-OD1 2.64Å; I443-N447 VanDerWaalsContact O-CB 3.32Å; I443-N447 WeakPolarHBondContact O-CB 3.36Å; I443-N447 VanDerWaalsContact O-CG 3.22Å; I443-N447 PolarHBondContact O-N 2.89Å; I443-N447 PolarHBondContact O-ND2 3.27Å; Q444-N447 PolarHBondContact O-N 3.48Å; N447-I449 VanDerWaalsContact C-N 3.32Å; N447-I449 PolarHBondContact O-N 2.68Å; N447-Y450 CarbonylContact O-C 3.57Å; N447-Y450 PolarHBondContact O-N 3.36Å; N447-T451 PolarHBondContact O-N 3.49Å; N447-T451 PolarHBondContact O-OG1 2.93Å
448	F	96.8	Very high	95.4	Very high	15 Å²	15	38 Å²	38	7%	0.066	20%	0.198	C	C	.	.	H	α-helix	trans	-54.2	-43.2	175.7	169.9	-95.5	0	0	0	112.9	F329 Q444 L445 Y450 T451 N452 I454 A475 V476	F329-F448 HydrophobicContact CE2-CE2 4.11Å; Q444-F448 WeakPolarHBondContact O-CB 3.29Å; Q444-F448 PolarHBondContact O-N 2.85Å; L445-F448 PolarHBondContact O-N 2.9Å; F448-Y450 PolarHBondContact O-N 2.8Å; F448-Y450 VanDerWaalsContact O-N 3.13Å; F448-T451 PolarHBondContact O-N 3.45Å; F448-N452 VanDerWaalsContact O-CA 3.29Å; F448-N452 WeakPolarHBondContact O-CA 3.3Å; F448-N452 PolarHBondContact O-N 3.41Å; F448-I454 HydrophobicContact CB-CB 4.42Å; F448-I454 HydrophobicContact CB-CD1 4.24Å; F448-I454 HydrophobicContact CD2-CB 3.93Å; F448-I454 HydrophobicContact CD2-CG2 4.01Å; F448-I454 HydrophobicContact CE2-CG2 4.4Å; F448-A475 HydrophobicContact CZ-CB 4.31Å; F448-V476 HydrophobicContact CD1-CG2 3.45Å; F448-V476 VanDerWaalsContact CD1-CG2 3.45Å; F448-V476 HydrophobicContact CD2-CG2 4.04Å; F448-V476 HydrophobicContact CE1-CG2 3.41Å; F448-V476 VanDerWaalsContact CE1-CG2 3.41Å; F448-V476 HydrophobicContact CE2-CG2 3.99Å; F448-V476 HydrophobicContact CG-CG2 3.77Å; F448-V476 HydrophobicContact CZ-CG2 3.7Å
449	I	96.5	Very high	95.5	Very high	7 Å²	7	41 Å²	41	4%	0.036	21%	0.212	C	C	.	.	H	α-helix	trans	-56.8	-28.8	176.2	-74.4	169.2	0	0	0	112.6	V408 L409 F416 L445 V446 N447 L473	V408-I449 HydrophobicContact CG1-CG2 3.88Å; L409-I449 HydrophobicContact CD2-CD1 3.81Å; L409-I449 HydrophobicContact CD2-CG2 4.35Å; F416-I449 HydrophobicContact CE2-CD1 4.3Å; L445-I449 WeakPolarHBondContact O-CG1 3.37Å; L445-I449 PolarHBondContact O-N 3.27Å; L445-I449 VanDerWaalsContact O-N 3.08Å; V446-I449 PolarHBondContact O-N 3.22Å; N447-I449 VanDerWaalsContact C-N 3.32Å; N447-I449 PolarHBondContact O-N 2.68Å; I449-L473 HydrophobicContact CD1-CD1 4.21Å; I449-L473 HydrophobicContact CD1-CD2 4.13Å; I449-L473 HydrophobicContact CG1-CD1 4.45Å; I449-L473 HydrophobicContact CG1-CD2 4.02Å
450	Y	96	Very high	95.5	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-102.3	-25.3	-178.2	-79.7	-93.3	0	0	0	114.8	L381 N382 R385 H405 V408 V446 N447 F448	L381-Y450 HydrophobicContact CB-CD1 4.26Å; L381-Y450 HydrophobicContact CB-CE1 4.17Å; N382-Y450 HydrophobicContact CB-CD1 4.15Å; N382-Y450 HydrophobicContact CB-CG 4.45Å; N382-Y450 WeakPolarHBondContact OD1-CB 3.23Å; R385-Y450 HydrophobicContact CB-CE1 4.23Å; H405-Y450 WeakPolarHBondContact CB-OH 3.48Å; H405-Y450 PolarHBondContact N-OH 2.83Å; H405-Y450 AromaticContact ND1-CZ 3.88Å; H405-Y450 PolarHBondContact ND1-OH 3.48Å; V408-Y450 HydrophobicContact CB-CE1 4.13Å; V408-Y450 HydrophobicContact CB-CE2 4.39Å; V408-Y450 HydrophobicContact CG1-CD1 4.26Å; V408-Y450 HydrophobicContact CG1-CD2 4.45Å; V408-Y450 HydrophobicContact CG1-CE1 3.84Å; V408-Y450 HydrophobicContact CG1-CE2 4.04Å; V408-Y450 HydrophobicContact CG2-CE1 4.04Å; V446-Y450 HydrophobicContact CG1-CD2 4.45Å; V446-Y450 HydrophobicContact CG1-CE2 4.48Å; V446-Y450 WeakPolarHBondContact O-CD2 3.27Å; N447-Y450 CarbonylContact O-C 3.57Å; N447-Y450 PolarHBondContact O-N 3.36Å; F448-Y450 PolarHBondContact O-N 2.8Å; F448-Y450 VanDerWaalsContact O-N 3.13Å
451	T	94.2	Very high	95.5	Very high	50 Å²	50	38.7 Å²	38.7	31%	0.307	19%	0.194	S	C	.	.	H	α-helix	trans	-103	-24.6	-178.9	60.2	0	0	0	0	113.7	N447 F448 E453	N447-T451 PolarHBondContact O-N 3.49Å; N447-T451 PolarHBondContact O-OG1 2.93Å; F448-T451 PolarHBondContact O-N 3.45Å; T451-E453 PolarHBondContact O-N 3.5Å; T451-E453 PolarHBondContact OG1-N 3.25Å; T451-E453 VanDerWaalsContact OG1-N 3.13Å; T451-E453 PolarHBondContact OG1-O 2.93Å
452	N	91.3	Very high	95.4	Very high	76 Å²	76	45 Å²	45	41%	0.406	22%	0.224	S	C	.	.	S	Bend	trans	54.1	32.5	-164	-162.8	56.8	0	0	0	113.3	F329 F448	F329-N452 WeakPolarHBondContact CD2-ND2 3.44Å; F329-N452 WeakPolarHBondContact CD2-O 3.23Å; F329-N452 VanDerWaalsContact CG-ND2 3.29Å; F329-N452 WeakPolarHBondContact CG-ND2 3.28Å; F448-N452 VanDerWaalsContact O-CA 3.29Å; F448-N452 WeakPolarHBondContact O-CA 3.3Å; F448-N452 PolarHBondContact O-N 3.41Å
453	E	94.2	Very high	95.4	Very high	70 Å²	70	47.1 Å²	47.1	33%	0.327	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136	175.4	-61.7	-166.6	172.1	0	0	110.5	K328 T451	K328-E453 HydrophobicContact CG-CG 4.36Å; K328-E453 IonicContact NZ-OE1 3.58Å; K328-E453 PolarHBondContact NZ-OE1 2.98Å; K328-E453 IonicContact NZ-OE2 2.7Å; K328-E453 PolarHBondContact NZ-OE2 3.03Å; T451-E453 PolarHBondContact O-N 3.5Å; T451-E453 PolarHBondContact OG1-N 3.25Å; T451-E453 VanDerWaalsContact OG1-N 3.13Å; T451-E453 PolarHBondContact OG1-O 2.93Å
454	I	95.7	Very high	95.4	Very high	14 Å²	14	44 Å²	44	7%	0.072	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	154.8	173	-162.4	156.9	0	0	0	110.2	V327 Q444 L445 F448 L464 V476	V327-I454 PolarHBondContact N-O 3.37Å; Q444-I454 HydrophobicContact CB-CD1 4.36Å; L445-I454 HydrophobicContact CD2-CD1 4.4Å; F448-I454 HydrophobicContact CB-CB 4.42Å; F448-I454 HydrophobicContact CB-CD1 4.24Å; F448-I454 HydrophobicContact CD2-CB 3.93Å; F448-I454 HydrophobicContact CD2-CG2 4.01Å; F448-I454 HydrophobicContact CE2-CG2 4.4Å; I454-L464 HydrophobicContact CD1-CD1 3.92Å; I454-L464 HydrophobicContact CD1-CD2 3.77Å; I454-L464 HydrophobicContact CD1-CG 4.41Å; I454-L464 HydrophobicContact CG1-CD2 4.3Å; I454-V476 HydrophobicContact CD1-CG1 3.88Å; I454-V476 HydrophobicContact CD1-CG2 4.4Å
455	N	95.5	Very high	95.4	Very high	51 Å²	51	41.5 Å²	41.5	27%	0.273	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.6	177.2	-172.9	12.6	0	0	0	107.5	C325 N460	C325-N455 PolarHBondContact O-OD1 2.79Å; N455-N460 PolarHBondContact O-ND2 2.8Å
456	V	95.9	Very high	95.3	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	132.4	-179.4	-175.2	0	0	0	0	109	V461 L464 I479 F483	V456-V461 HydrophobicContact CG1-CB 3.94Å; V456-V461 HydrophobicContact CG1-CG2 3.94Å; V456-L464 HydrophobicContact CG2-CD2 3.97Å; V456-I479 HydrophobicContact CG2-CG2 3.85Å; V456-F483 HydrophobicContact CG1-CB 3.97Å; V456-F483 HydrophobicContact CG1-CD1 4Å; V456-F483 HydrophobicContact CG1-CD2 4.3Å; V456-F483 HydrophobicContact CG1-CG 3.82Å
457	N	95.6	Very high	95.3	Very high	39 Å²	39	43.3 Å²	43.3	21%	0.209	22%	0.221	C	C	.	.			trans	-146.1	175.4	-177.7	70.4	13.4	0	0	0	111.4	E459 N460 V461	N457-E459 VanDerWaalsContact C-N 3.25Å; N457-E459 PolarHBondContact O-N 2.87Å; N457-E459 PolarHBondContact OD1-N 3.29Å; N457-N460 PolarHBondContact N-OD1 3.36Å; N457-N460 PolarHBondContact O-N 3.05Å; N457-N460 PolarHBondContact O-OD1 2.85Å; N457-N460 WeakPolarHBondContact OD1-CB 3.4Å; N457-N460 PolarHBondContact OD1-N 3.2Å; N457-N460 PolarHBondContact OD1-OD1 3.19Å; N457-N460 VanDerWaalsContact OD1-OD1 3.13Å; N457-V461 WeakPolarHBondContact O-CB 3.46Å; N457-V461 WeakPolarHBondContact O-CG1 3.44Å; N457-V461 PolarHBondContact O-N 3.02Å
458	E	93.3	Very high	95.3	Very high	118 Å²	118	40.5 Å²	40.5	55%	0.551	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-30.2	-177.8	-68.7	159.7	-140	0	0	113	F483 Q487	E458-F483 HydrophobicContact CG-CE1 4.29Å; E458-F483 HydrophobicContact CG-CZ 4.04Å; E458-Q487 PolarHBondContact OE1-NE2 3.22Å
459	E	94.5	Very high	95.1	Very high	171 Å²	171	42.2 Å²	42.2	80%	0.799	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-37.4	-179.7	-59	177.6	158.8	0	0	112.7	N457	N457-E459 VanDerWaalsContact C-N 3.25Å; N457-E459 PolarHBondContact O-N 2.87Å; N457-E459 PolarHBondContact OD1-N 3.29Å
460	N	95.5	Very high	95	Very high	14 Å²	14	45.9 Å²	45.9	8%	0.075	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-22.5	-172	78.9	-1.2	0	0	0	114.7	Q444 N455 N457 Q462 T463 L464	Q444-N460 PolarHBondContact OE1-ND2 2.97Å; N455-N460 PolarHBondContact O-ND2 2.8Å; N457-N460 PolarHBondContact N-OD1 3.36Å; N457-N460 PolarHBondContact O-N 3.05Å; N457-N460 PolarHBondContact O-OD1 2.85Å; N457-N460 WeakPolarHBondContact OD1-CB 3.4Å; N457-N460 PolarHBondContact OD1-N 3.2Å; N457-N460 PolarHBondContact OD1-OD1 3.19Å; N457-N460 VanDerWaalsContact OD1-OD1 3.13Å; N460-Q462 PolarHBondContact O-N 2.86Å; N460-Q462 VanDerWaalsContact O-N 3.17Å; N460-T463 PolarHBondContact O-N 3.44Å; N460-T463 VanDerWaalsContact O-N 3.09Å; N460-T463 PolarHBondContact O-OG1 3.22Å; N460-L464 WeakPolarHBondContact O-CB 3.24Å; N460-L464 PolarHBondContact O-N 2.54Å
461	V	95.9	Very high	94.9	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.03	24%	0.235	C	C	.	.	H	α-helix	trans	-60.1	-34.3	-172.1	68.5	0	0	0	0	113.1	V456 N457 T463 L465 C480 F483 L484	V456-V461 HydrophobicContact CG1-CB 3.94Å; V456-V461 HydrophobicContact CG1-CG2 3.94Å; N457-V461 WeakPolarHBondContact O-CB 3.46Å; N457-V461 WeakPolarHBondContact O-CG1 3.44Å; N457-V461 PolarHBondContact O-N 3.02Å; V461-T463 VanDerWaalsContact C-N 3.34Å; V461-T463 PolarHBondContact O-N 3.09Å; V461-L465 WeakPolarHBondContact O-CB 3.41Å; V461-L465 PolarHBondContact O-N 3.1Å; V461-C480 HydrophobicContact CG2-CB 3.97Å; V461-F483 HydrophobicContact CB-CD1 4.21Å; V461-F483 HydrophobicContact CB-CE1 4.42Å; V461-F483 HydrophobicContact CG1-CD1 4.27Å; V461-F483 HydrophobicContact CG1-CE1 4.18Å; V461-F483 HydrophobicContact CG2-CD1 4.14Å; V461-L484 HydrophobicContact CG1-CD2 4.06Å; V461-L484 HydrophobicContact CG2-CD1 4.09Å; V461-L484 HydrophobicContact CG2-CD2 4.19Å; V461-L484 HydrophobicContact CG2-CG 3.93Å
462	Q	93.8	Very high	95	Very high	133 Å²	133	47.8 Å²	47.8	62%	0.621	24%	0.241	S	C	*	.	H	α-helix	trans	-68.4	-29.1	179.6	-65.3	-169.7	13.9	0	0	113.7	N460 P466 F499	N460-Q462 PolarHBondContact O-N 2.86Å; N460-Q462 VanDerWaalsContact O-N 3.17Å; Q462-P466 WeakPolarHBondContact O-CD 3.41Å; Q462-P466 VanDerWaalsContact O-CG 3.26Å; Q462-P466 WeakPolarHBondContact O-CG 3.28Å; Q462-F499 HydrophobicContact CB-CZ 4.36Å
463	T	95.5	Very high	95.2	Very high	44 Å²	44	44.5 Å²	44.5	27%	0.27	22%	0.223	S	C	.	.	H	α-helix	trans	-98	-24.8	178.8	64.8	0	0	0	0	111.8	E438 A441 N460 V461 A467	E438-T463 WeakPolarHBondContact OE2-CG2 3.43Å; A441-T463 WeakPolarHBondContact CB-O 3.5Å; N460-T463 PolarHBondContact O-N 3.44Å; N460-T463 VanDerWaalsContact O-N 3.09Å; N460-T463 PolarHBondContact O-OG1 3.22Å; V461-T463 VanDerWaalsContact C-N 3.34Å; V461-T463 PolarHBondContact O-N 3.09Å; T463-A467 WeakPolarHBondContact O-CB 3.35Å
464	L	96.8	Very high	95.2	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-79.6	-45.2	-179.8	-172.2	64.3	0	0	0	113.1	Q444 L445 I454 V456 N460 A467 A468 V476	Q444-L464 HydrophobicContact CB-CD1 4.32Å; L445-L464 HydrophobicContact CD1-CD1 4.31Å; L445-L464 HydrophobicContact CD2-CD1 3.56Å; L445-L464 HydrophobicContact CG-CD1 3.72Å; I454-L464 HydrophobicContact CD1-CD1 3.92Å; I454-L464 HydrophobicContact CD1-CD2 3.77Å; I454-L464 HydrophobicContact CD1-CG 4.41Å; I454-L464 HydrophobicContact CG1-CD2 4.3Å; V456-L464 HydrophobicContact CG2-CD2 3.97Å; N460-L464 WeakPolarHBondContact O-CB 3.24Å; N460-L464 PolarHBondContact O-N 2.54Å; L464-A467 PolarHBondContact O-N 3.15Å; L464-A468 VanDerWaalsContact O-CB 3.27Å; L464-A468 WeakPolarHBondContact O-CB 3.17Å; L464-A468 PolarHBondContact O-N 3.37Å; L464-V476 HydrophobicContact CD1-CG1 4.34Å; L464-V476 HydrophobicContact CD2-CG1 4.17Å; L464-V476 HydrophobicContact CG-CG1 4.09Å
465	L	96.2	Very high	95.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-58.9	-47.7	-179.9	179.5	69.3	0	0	0	112.7	V461 A467 A468 N469 R477 C480 L484 F499	V461-L465 WeakPolarHBondContact O-CB 3.41Å; V461-L465 PolarHBondContact O-N 3.1Å; L465-A467 VanDerWaalsContact C-N 3.35Å; L465-A467 PolarHBondContact O-N 3.02Å; L465-A468 PolarHBondContact O-N 3.05Å; L465-N469 WeakPolarHBondContact O-CB 3.25Å; L465-N469 PolarHBondContact O-N 2.96Å; L465-R477 HydrophobicContact CD1-CB 4.17Å; L465-R477 HydrophobicContact CD1-CG 3.6Å; L465-C480 HydrophobicContact CB-CB 4.05Å; L465-C480 HydrophobicContact CD1-CB 3.75Å; L465-C480 HydrophobicContact CG-CB 4.44Å; L465-L484 HydrophobicContact CD2-CD1 4.11Å; L465-F499 HydrophobicContact CB-CE1 4.16Å; L465-F499 HydrophobicContact CB-CZ 4.28Å; L465-F499 HydrophobicContact CD2-CD1 4.05Å; L465-F499 HydrophobicContact CD2-CE1 3.46Å; L465-F499 VanDerWaalsContact CD2-CE1 3.46Å; L465-F499 HydrophobicContact CD2-CZ 4.17Å; L465-F499 HydrophobicContact CG-CE1 4.37Å
466	P	95.2	Very high	95.2	Very high	35 Å²	35	43.9 Å²	43.9	23%	0.227	23%	0.231	C	C	.	.	H	α-helix	trans	-67	-37.9	-178.6	-19.2	33.8	0	0	0	111.8	Q462 N469 L470 F499	Q462-P466 WeakPolarHBondContact O-CD 3.41Å; Q462-P466 VanDerWaalsContact O-CG 3.26Å; Q462-P466 WeakPolarHBondContact O-CG 3.28Å; P466-N469 PolarHBondContact O-N 3.14Å; P466-L470 WeakPolarHBondContact O-CB 3.44Å; P466-L470 PolarHBondContact O-N 3.26Å; P466-F499 HydrophobicContact CG-CE2 4.23Å; P466-F499 HydrophobicContact CG-CZ 4.05Å
467	A	96	Very high	95.2	Very high	4 Å²	4	47 Å²	47	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-67.9	-40.8	176.8	0	0	0	0	0	112.1	I437 A441 L445 T463 L464 L465 L471	I437-A467 HydrophobicContact CG2-CB 3.81Å; A441-A467 HydrophobicContact CB-CB 4.05Å; L445-A467 HydrophobicContact CD1-CB 3.56Å; T463-A467 WeakPolarHBondContact O-CB 3.35Å; L464-A467 PolarHBondContact O-N 3.15Å; L465-A467 VanDerWaalsContact C-N 3.35Å; L465-A467 PolarHBondContact O-N 3.02Å; A467-L471 WeakPolarHBondContact O-CB 3.35Å; A467-L471 WeakPolarHBondContact O-CG 3.49Å; A467-L471 PolarHBondContact O-N 2.81Å
468	A	96.4	Very high	95.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.9	-41.1	175.1	0	0	0	0	0	111.6	L445 L464 L465 L471 Q472 L473 V476 R477	L445-A468 HydrophobicContact CD1-CB 4.46Å; L445-A468 HydrophobicContact CD2-CB 4.03Å; L464-A468 VanDerWaalsContact O-CB 3.27Å; L464-A468 WeakPolarHBondContact O-CB 3.17Å; L464-A468 PolarHBondContact O-N 3.37Å; L465-A468 PolarHBondContact O-N 3.05Å; A468-L471 CarbonylContact O-C 3.58Å; A468-Q472 PolarHBondContact O-N 2.88Å; A468-L473 PolarHBondContact O-N 3.41Å; A468-V476 HydrophobicContact CB-CB 3.99Å; A468-V476 HydrophobicContact CB-CG1 3.91Å; A468-R477 HydrophobicContact CB-CB 4.48Å
469	N	94.1	Very high	95.3	Very high	51 Å²	51	43.8 Å²	43.8	27%	0.273	23%	0.229	S	C	.	.	H	α-helix	trans	-67.8	-45.6	178.4	-159.2	35.6	0	0	0	111.6	L465 P466 L471 Q472 H503	L465-N469 WeakPolarHBondContact O-CB 3.25Å; L465-N469 PolarHBondContact O-N 2.96Å; P466-N469 PolarHBondContact O-N 3.14Å; N469-L471 PolarHBondContact O-N 3.4Å; N469-Q472 PolarHBondContact O-N 2.9Å; N469-H503 PolarHBondContact ND2-O 2.73Å
470	L	93.7	Very high	95.4	Very high	84 Å²	84	35.6 Å²	35.6	44%	0.44	19%	0.19	S	C	.	.	H	α-helix	trans	-61.1	-42.7	175.6	176.3	57.2	0	0	0	112.4	Y415 I437 P466 Q472	Y415-L470 VanDerWaalsContact CD2-O 3.22Å; Y415-L470 WeakPolarHBondContact CD2-O 3.38Å; Y415-L470 HydrophobicContact CE2-CD1 4.32Å; I437-L470 HydrophobicContact CD1-CD2 3.86Å; I437-L470 HydrophobicContact CG1-CD2 3.91Å; P466-L470 WeakPolarHBondContact O-CB 3.44Å; P466-L470 PolarHBondContact O-N 3.26Å; L470-Q472 PolarHBondContact O-N 3.33Å
471	L	94.7	Very high	95.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	6.4	175.7	-60.9	-178.9	0	0	0	113.5	S413 Y415 F416 F434 I437 L442 L445 A467 A468 N469 L473	S413-L471 PolarHBondContact OG-O 3.45Å; Y415-L471 HydrophobicContact CD1-CD2 3.62Å; Y415-L471 HydrophobicContact CE1-CD2 3.72Å; Y415-L471 HydrophobicContact CG-CD2 4.33Å; F416-L471 HydrophobicContact CE2-CD1 4.19Å; F416-L471 HydrophobicContact CE2-CD2 4.1Å; F416-L471 HydrophobicContact CZ-CD1 4.28Å; F416-L471 HydrophobicContact CZ-CD2 3.91Å; F434-L471 HydrophobicContact CD1-CD2 4.37Å; F434-L471 HydrophobicContact CE1-CD2 3.69Å; F434-L471 HydrophobicContact CZ-CD2 4.28Å; I437-L471 HydrophobicContact CD1-CD1 4.32Å; I437-L471 HydrophobicContact CD1-CD2 4.23Å; I437-L471 HydrophobicContact CD1-CG 4.2Å; L442-L471 HydrophobicContact CD1-CD1 3.84Å; L445-L471 HydrophobicContact CD1-CD1 4Å; A467-L471 WeakPolarHBondContact O-CB 3.35Å; A467-L471 WeakPolarHBondContact O-CG 3.49Å; A467-L471 PolarHBondContact O-N 2.81Å; A468-L471 CarbonylContact O-C 3.58Å; N469-L471 PolarHBondContact O-N 3.4Å; L471-L473 HydrophobicContact CB-CD1 4.15Å; L471-L473 HydrophobicContact CB-CG 4.3Å; L471-L473 PolarHBondContact O-N 3Å
472	Q	95.4	Very high	95.4	Very high	93 Å²	93	41.6 Å²	41.6	44%	0.435	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	35.5	176.8	-59.8	175.7	-1.2	0	0	114	Y415 A468 N469 L470 T474	Y415-Q472 VanDerWaalsContact N-OE1 3.15Å; A468-Q472 PolarHBondContact O-N 2.88Å; N469-Q472 PolarHBondContact O-N 2.9Å; L470-Q472 PolarHBondContact O-N 3.33Å; Q472-T474 PolarHBondContact O-N 3.13Å
473	L	96.2	Very high	95.5	Very high	7 Å²	7	36.5 Å²	36.5	4%	0.037	20%	0.195	C	C	.	.			trans	-89.5	72.8	176.2	-69	169.4	0	0	0	109.7	S412 L445 I449 A468 L471 A475 V476 R477	S412-L473 WeakPolarHBondContact O-CD2 3.42Å; L445-L473 HydrophobicContact CB-CD1 3.9Å; L445-L473 HydrophobicContact CD1-CD1 4.39Å; L445-L473 HydrophobicContact CD2-CD1 3.84Å; L445-L473 HydrophobicContact CG-CD1 4.25Å; I449-L473 HydrophobicContact CD1-CD1 4.21Å; I449-L473 HydrophobicContact CD1-CD2 4.13Å; I449-L473 HydrophobicContact CG1-CD1 4.45Å; I449-L473 HydrophobicContact CG1-CD2 4.02Å; A468-L473 PolarHBondContact O-N 3.41Å; L471-L473 HydrophobicContact CB-CD1 4.15Å; L471-L473 HydrophobicContact CB-CG 4.3Å; L471-L473 PolarHBondContact O-N 3Å; L473-A475 VanDerWaalsContact C-N 3.33Å; L473-A475 PolarHBondContact O-N 2.96Å; L473-V476 HydrophobicContact CB-CB 4.46Å; L473-V476 HydrophobicContact CB-CG2 4.41Å; L473-V476 PolarHBondContact O-N 2.94Å; L473-R477 PolarHBondContact O-N 3.43Å; L473-R477 VanDerWaalsContact O-N 3.1Å
474	T	94.1	Very high	95.5	Very high	80 Å²	80	35 Å²	35	49%	0.491	19%	0.185	S	C	.	.	H	α-helix	trans	-51.2	-47	-173.8	52.5	0	0	0	0	113	Q472 V476 R477 D478	Q472-T474 PolarHBondContact O-N 3.13Å; T474-V476 PolarHBondContact O-N 2.85Å; T474-V476 VanDerWaalsContact O-N 3.15Å; T474-R477 WeakPolarHBondContact O-CA 3.33Å; T474-R477 WeakPolarHBondContact O-CB 3.37Å; T474-R477 PolarHBondContact O-N 3.22Å; T474-D478 WeakPolarHBondContact O-CB 3.4Å; T474-D478 PolarHBondContact O-N 3.26Å
475	A	94.7	Very high	95.4	Very high	41 Å²	41	38 Å²	38	34%	0.339	20%	0.199	S	C	.	.	H	α-helix	trans	-56.3	-34.6	179.2	0	0	0	0	0	113.8	F448 L473 I479	F448-A475 HydrophobicContact CZ-CB 4.31Å; L473-A475 VanDerWaalsContact C-N 3.33Å; L473-A475 PolarHBondContact O-N 2.96Å; A475-I479 VanDerWaalsContact O-CD1 3.31Å; A475-I479 WeakPolarHBondContact O-CD1 3.49Å; A475-I479 VanDerWaalsContact O-CG1 3.24Å; A475-I479 WeakPolarHBondContact O-CG1 3.48Å; A475-I479 PolarHBondContact O-N 2.91Å
476	V	96.5	Very high	95.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-77.9	-41.2	175.8	-178.3	0	0	0	0	111.1	L445 F448 I454 L464 A468 L473 T474 D478 I479 C480	L445-V476 HydrophobicContact CD2-CB 4.15Å; L445-V476 HydrophobicContact CD2-CG1 3.74Å; L445-V476 HydrophobicContact CD2-CG2 4.11Å; F448-V476 HydrophobicContact CD1-CG2 3.45Å; F448-V476 VanDerWaalsContact CD1-CG2 3.45Å; F448-V476 HydrophobicContact CD2-CG2 4.04Å; F448-V476 HydrophobicContact CE1-CG2 3.41Å; F448-V476 VanDerWaalsContact CE1-CG2 3.41Å; F448-V476 HydrophobicContact CE2-CG2 3.99Å; F448-V476 HydrophobicContact CG-CG2 3.77Å; F448-V476 HydrophobicContact CZ-CG2 3.7Å; I454-V476 HydrophobicContact CD1-CG1 3.88Å; I454-V476 HydrophobicContact CD1-CG2 4.4Å; L464-V476 HydrophobicContact CD1-CG1 4.34Å; L464-V476 HydrophobicContact CD2-CG1 4.17Å; L464-V476 HydrophobicContact CG-CG1 4.09Å; A468-V476 HydrophobicContact CB-CB 3.99Å; A468-V476 HydrophobicContact CB-CG1 3.91Å; L473-V476 HydrophobicContact CB-CB 4.46Å; L473-V476 HydrophobicContact CB-CG2 4.41Å; L473-V476 PolarHBondContact O-N 2.94Å; T474-V476 PolarHBondContact O-N 2.85Å; T474-V476 VanDerWaalsContact O-N 3.15Å; V476-D478 VanDerWaalsContact C-N 3.27Å; V476-D478 PolarHBondContact O-N 3.34Å; V476-I479 PolarHBondContact O-N 3.42Å; V476-C480 WeakPolarHBondContact O-CB 3.27Å; V476-C480 PolarHBondContact O-N 2.95Å; V476-C480 PolarHBondContact O-SG 2.98Å
477	R	95.5	Very high	95.1	Very high	67 Å²	67	47.3 Å²	47.3	25%	0.253	24%	0.237	S	C	.	.	H	α-helix	trans	-55.1	-45.9	173.9	179.2	-157.5	67	175	2.2	110.6	L465 A468 L473 T474 C480 C481	L465-R477 HydrophobicContact CD1-CB 4.17Å; L465-R477 HydrophobicContact CD1-CG 3.6Å; A468-R477 HydrophobicContact CB-CB 4.48Å; L473-R477 PolarHBondContact O-N 3.43Å; L473-R477 VanDerWaalsContact O-N 3.1Å; T474-R477 WeakPolarHBondContact O-CA 3.33Å; T474-R477 WeakPolarHBondContact O-CB 3.37Å; T474-R477 PolarHBondContact O-N 3.22Å; R477-C480 WeakPolarHBondContact O-CB 3.49Å; R477-C480 PolarHBondContact O-N 3.45Å; R477-C481 PolarHBondContact O-N 3.43Å; R477-C481 PolarHBondContact O-SG 2.96Å; R477-C481 VanDerWaalsContact O-SG 3.36Å
478	D	95	Very high	94.9	Very high	71 Å²	71	48.2 Å²	48.2	38%	0.38	24%	0.242	S	C	.	.	H	α-helix	trans	-68.3	-41.9	-175	-58.5	-17.9	0	0	0	111.1	T474 V476 C480 C481 E482	T474-D478 WeakPolarHBondContact O-CB 3.4Å; T474-D478 PolarHBondContact O-N 3.26Å; V476-D478 VanDerWaalsContact C-N 3.27Å; V476-D478 PolarHBondContact O-N 3.34Å; D478-C480 PolarHBondContact O-N 3.19Å; D478-C481 PolarHBondContact O-N 2.7Å; D478-E482 PolarHBondContact O-N 3.05Å
479	I	95.3	Very high	94.7	Very high	19 Å²	19	52.9 Å²	52.9	10%	0.097	26%	0.263	C	S	.	.	H	α-helix	trans	-62.2	-40.1	171.2	-66.1	164.4	0	0	0	111.5	V327 F329 V456 A475 V476 C481 E482 F483	V327-I479 HydrophobicContact CB-CD1 4.31Å; V327-I479 HydrophobicContact CG1-CD1 3.94Å; V327-I479 HydrophobicContact CG2-CD1 4.49Å; V327-I479 HydrophobicContact CG2-CG2 3.97Å; F329-I479 HydrophobicContact CZ-CD1 4.25Å; V456-I479 HydrophobicContact CG2-CG2 3.85Å; A475-I479 VanDerWaalsContact O-CD1 3.31Å; A475-I479 WeakPolarHBondContact O-CD1 3.49Å; A475-I479 VanDerWaalsContact O-CG1 3.24Å; A475-I479 WeakPolarHBondContact O-CG1 3.48Å; A475-I479 PolarHBondContact O-N 2.91Å; V476-I479 PolarHBondContact O-N 3.42Å; I479-C481 VanDerWaalsContact C-N 3.35Å; I479-E482 PolarHBondContact O-N 3.17Å; I479-F483 WeakPolarHBondContact O-CB 3.39Å; I479-F483 PolarHBondContact O-N 3.16Å
480	C	96.8	Very high	94.4	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.1	-37	176.1	-68.2	0	0	0	0	112.1	V461 L465 V476 R477 D478 L484	V461-C480 HydrophobicContact CG2-CB 3.97Å; L465-C480 HydrophobicContact CB-CB 4.05Å; L465-C480 HydrophobicContact CD1-CB 3.75Å; L465-C480 HydrophobicContact CG-CB 4.44Å; V476-C480 WeakPolarHBondContact O-CB 3.27Å; V476-C480 PolarHBondContact O-N 2.95Å; V476-C480 PolarHBondContact O-SG 2.98Å; R477-C480 WeakPolarHBondContact O-CB 3.49Å; R477-C480 PolarHBondContact O-N 3.45Å; D478-C480 PolarHBondContact O-N 3.19Å; C480-L484 WeakPolarHBondContact O-CG 3.42Å; C480-L484 PolarHBondContact O-N 3.29Å; C480-L484 VanDerWaalsContact O-N 3.09Å
481	C	96.1	Very high	94.3	Very high	14 Å²	14	49.3 Å²	49.3	10%	0.095	25%	0.249	C	C	.	.	H	α-helix	trans	-66.7	-42.9	172.8	-71.6	0	0	0	0	112.1	R477 D478 I479 L484 Q485 L508	R477-C481 PolarHBondContact O-N 3.43Å; R477-C481 PolarHBondContact O-SG 2.96Å; R477-C481 VanDerWaalsContact O-SG 3.36Å; D478-C481 PolarHBondContact O-N 2.7Å; I479-C481 VanDerWaalsContact C-N 3.35Å; C481-L484 PolarHBondContact O-N 2.62Å; C481-Q485 WeakPolarHBondContact O-CG 3.32Å; C481-Q485 PolarHBondContact O-N 3.29Å; C481-L508 HydrophobicContact CB-CB 4.37Å
482	E	95.1	Very high	94.1	Very high	131 Å²	131	51.8 Å²	51.8	61%	0.612	26%	0.262	S	S	*	.	H	α-helix	trans	-60.7	-43.8	175.3	-174.5	178.8	-171.5	0	0	111.5	D478 I479 L484 Q485 F486	D478-E482 PolarHBondContact O-N 3.05Å; I479-E482 PolarHBondContact O-N 3.17Å; E482-L484 PolarHBondContact O-N 3.06Å; E482-Q485 PolarHBondContact O-N 3.11Å; E482-F486 PolarHBondContact O-N 3.22Å
483	F	95.9	Very high	94	Very high	26 Å²	26	47.3 Å²	47.3	11%	0.114	24%	0.241	C	C	.	.	H	α-helix	trans	-59.1	-44	174.3	-177.7	-94.1	0	0	0	112.4	V456 E458 V461 I479 F486 Q487	V456-F483 HydrophobicContact CG1-CB 3.97Å; V456-F483 HydrophobicContact CG1-CD1 4Å; V456-F483 HydrophobicContact CG1-CD2 4.3Å; V456-F483 HydrophobicContact CG1-CG 3.82Å; E458-F483 HydrophobicContact CG-CE1 4.29Å; E458-F483 HydrophobicContact CG-CZ 4.04Å; V461-F483 HydrophobicContact CB-CD1 4.21Å; V461-F483 HydrophobicContact CB-CE1 4.42Å; V461-F483 HydrophobicContact CG1-CD1 4.27Å; V461-F483 HydrophobicContact CG1-CE1 4.18Å; V461-F483 HydrophobicContact CG2-CD1 4.14Å; I479-F483 WeakPolarHBondContact O-CB 3.39Å; I479-F483 PolarHBondContact O-N 3.16Å; F483-F486 PolarHBondContact O-N 2.85Å; F483-Q487 HydrophobicContact CD1-CG 4.38Å; F483-Q487 HydrophobicContact CE1-CG 3.98Å; F483-Q487 HydrophobicContact CE2-CG 4.4Å; F483-Q487 HydrophobicContact CZ-CG 3.99Å; F483-Q487 WeakPolarHBondContact O-CG 3.43Å; F483-Q487 PolarHBondContact O-N 3.26Å
484	L	96	Very high	93.9	Very high	13 Å²	13	47.3 Å²	47.3	7%	0.068	24%	0.241	C	C	.	.	H	α-helix	trans	-68.5	-32.9	177.2	-71.4	169.7	0	0	0	113	V461 L465 C480 C481 E482 Q487 I496 F499 L508	V461-L484 HydrophobicContact CG1-CD2 4.06Å; V461-L484 HydrophobicContact CG2-CD1 4.09Å; V461-L484 HydrophobicContact CG2-CD2 4.19Å; V461-L484 HydrophobicContact CG2-CG 3.93Å; L465-L484 HydrophobicContact CD2-CD1 4.11Å; C480-L484 WeakPolarHBondContact O-CG 3.42Å; C480-L484 PolarHBondContact O-N 3.29Å; C480-L484 VanDerWaalsContact O-N 3.09Å; C481-L484 PolarHBondContact O-N 2.62Å; E482-L484 PolarHBondContact O-N 3.06Å; L484-Q487 PolarHBondContact O-N 2.81Å; L484-I496 HydrophobicContact CB-CG2 4.09Å; L484-I496 HydrophobicContact CD2-CD1 4.41Å; L484-I496 HydrophobicContact CD2-CG1 4.49Å; L484-I496 HydrophobicContact CD2-CG2 4.41Å; L484-F499 HydrophobicContact CD1-CD1 3.96Å; L484-F499 HydrophobicContact CD1-CE1 3.97Å; L484-L508 HydrophobicContact CB-CD1 3.99Å; L484-L508 HydrophobicContact CB-CD2 4.08Å; L484-L508 HydrophobicContact CD1-CD2 3.75Å
485	Q	94.1	Very high	93.7	Very high	62 Å²	62	44.7 Å²	44.7	29%	0.29	23%	0.23	S	C	.	.	H	α-helix	trans	-65.1	-39.6	172	-71.1	173.4	26.2	0	0	111.6	C481 E482 Q487 L508 F511	C481-Q485 WeakPolarHBondContact O-CG 3.32Å; C481-Q485 PolarHBondContact O-N 3.29Å; E482-Q485 PolarHBondContact O-N 3.11Å; Q485-Q487 VanDerWaalsContact C-N 3.28Å; Q485-Q487 PolarHBondContact O-N 3.18Å; Q485-L508 HydrophobicContact CG-CD1 3.64Å; Q485-F511 HydrophobicContact CB-CD1 4.29Å; Q485-F511 HydrophobicContact CB-CE1 4.17Å; Q485-F511 HydrophobicContact CG-CB 4.4Å; Q485-F511 HydrophobicContact CG-CD1 3.88Å; Q485-F511 HydrophobicContact CG-CD2 4.48Å; Q485-F511 HydrophobicContact CG-CE1 4.25Å; Q485-F511 HydrophobicContact CG-CG 4.01Å
486	F	93.5	Very high	93.7	Very high	165 Å²	165	43.6 Å²	43.6	72%	0.724	22%	0.218	S	C	*	.	H	α-helix	trans	-71.7	-21.4	179.5	-156.6	-86.5	0	0	0	113.5	E482 F483	E482-F486 PolarHBondContact O-N 3.22Å; F483-F486 PolarHBondContact O-N 2.85Å
487	Q	92.3	Very high	93.6	Very high	66 Å²	66	45.1 Å²	45.1	31%	0.308	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	15.5	-177.9	-66.3	-78.3	27.9	0	0	113.5	E458 F483 L484 Q485 N492	E458-Q487 PolarHBondContact OE1-NE2 3.22Å; F483-Q487 HydrophobicContact CD1-CG 4.38Å; F483-Q487 HydrophobicContact CE1-CG 3.98Å; F483-Q487 HydrophobicContact CE2-CG 4.4Å; F483-Q487 HydrophobicContact CZ-CG 3.99Å; F483-Q487 WeakPolarHBondContact O-CG 3.43Å; F483-Q487 PolarHBondContact O-N 3.26Å; L484-Q487 PolarHBondContact O-N 2.81Å; Q485-Q487 VanDerWaalsContact C-N 3.28Å; Q485-Q487 PolarHBondContact O-N 3.18Å; Q487-N492 PolarHBondContact O-ND2 3.3Å
488	L	91.6	Very high	93.4	Very high	23 Å²	23	45.6 Å²	45.6	12%	0.12	23%	0.227	C	C	.	.			trans	-71.2	131	179.1	-96.4	165.1	0	0	0	112.7	C493 I496 F511 T512 F515	L488-C493 HydrophobicContact CD2-CB 3.5Å; L488-C493 VanDerWaalsContact CD2-CB 3.5Å; L488-I496 HydrophobicContact CD2-CD1 4.1Å; L488-I496 HydrophobicContact CG-CD1 4.29Å; L488-F511 HydrophobicContact CD1-CD1 3.53Å; L488-F511 HydrophobicContact CD1-CE1 3.66Å; L488-T512 HydrophobicContact CD1-CG2 3.9Å; L488-T512 HydrophobicContact CD2-CG2 4.13Å; L488-T512 HydrophobicContact CG-CG2 4.42Å; L488-F515 HydrophobicContact CB-CD1 4.4Å; L488-F515 HydrophobicContact CB-CD2 4.26Å; L488-F515 HydrophobicContact CB-CE1 4.35Å; L488-F515 HydrophobicContact CB-CE2 4.2Å; L488-F515 HydrophobicContact CB-CG 4.35Å; L488-F515 HydrophobicContact CB-CZ 4.25Å; L488-F515 HydrophobicContact CD1-CB 4.25Å; L488-F515 HydrophobicContact CD1-CG 4.28Å; L488-F515 HydrophobicContact CD2-CD1 3.98Å; L488-F515 HydrophobicContact CD2-CE1 4.39Å; L488-F515 HydrophobicContact CD2-CG 4.32Å
489	H	91.6	Very high	93.3	Very high	97 Å²	97	43.9 Å²	43.9	45%	0.449	22%	0.217	S	C	.	.			trans	-144.9	150.1	179.5	-172	-107.1	0	0	0	109.8	S491 N492 C493	H489-S491 PolarHBondContact ND1-N 2.68Å; H489-S491 PolarHBondContact ND1-OG 3.44Å; H489-S491 PolarHBondContact O-N 3.29Å; H489-N492 PolarHBondContact N-OD1 3.04Å; H489-N492 PolarHBondContact O-N 2.95Å; H489-N492 PolarHBondContact O-OD1 3.07Å; H489-C493 PolarHBondContact O-N 3.31Å
490	P	89.2	Confident	93.3	Very high	9 Å²	9	43 Å²	43	6%	0.058	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.3	-178.8	-28.3	37.2	0	0	0	114.6	F515 H519 E522 L523	P490-F515 HydrophobicContact CG-CE1 4.41Å; P490-H519 HydrophobicContact CG-CB 4.07Å; P490-E522 HydrophobicContact CB-CB 3.88Å; P490-E522 HydrophobicContact CG-CB 3.81Å; P490-L523 HydrophobicContact CB-CB 4.33Å
491	S	90.5	Very high	93.1	Very high	52 Å²	52	47.5 Å²	47.5	36%	0.364	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-6.2	176.9	72.7	0	0	0	0	115.8	H489	H489-S491 PolarHBondContact ND1-N 2.68Å; H489-S491 PolarHBondContact ND1-OG 3.44Å; H489-S491 PolarHBondContact O-N 3.29Å
492	N	91.6	Very high	92.9	Very high	51 Å²	51	53.1 Å²	53.1	27%	0.273	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	-9.8	-179.8	74.1	13.9	0	0	0	114.2	Q487 H489 L494 G495 I496	Q487-N492 PolarHBondContact O-ND2 3.3Å; H489-N492 PolarHBondContact N-OD1 3.04Å; H489-N492 PolarHBondContact O-N 2.95Å; H489-N492 PolarHBondContact O-OD1 3.07Å; N492-L494 VanDerWaalsContact C-N 3.32Å; N492-L494 PolarHBondContact O-N 2.99Å; N492-G495 PolarHBondContact O-N 2.81Å; N492-G495 VanDerWaalsContact O-N 3.13Å; N492-I496 HydrophobicContact CB-CD1 4.47Å; N492-I496 WeakPolarHBondContact O-CG1 3.29Å; N492-I496 PolarHBondContact O-N 3.18Å; N492-I496 WeakPolarHBondContact OD1-CD1 3.38Å
493	C	92.8	Very high	92.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-33.4	-171.2	60.1	0	0	0	0	113.8	L488 H489 Q497 F515	L488-C493 HydrophobicContact CD2-CB 3.5Å; L488-C493 VanDerWaalsContact CD2-CB 3.5Å; H489-C493 PolarHBondContact O-N 3.31Å; C493-Q497 WeakPolarHBondContact O-CB 3.4Å; C493-Q497 PolarHBondContact O-N 3.1Å; C493-F515 HydrophobicContact CB-CD1 3.73Å; C493-F515 HydrophobicContact CB-CE1 4.03Å
494	L	92.8	Very high	92.7	Very high	6 Å²	6	53.6 Å²	53.6	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-69.4	-41	174.7	-63.8	178.1	0	0	0	111.6	N492 Q497 R498 T516 L523 E529 F530 L533	N492-L494 VanDerWaalsContact C-N 3.32Å; N492-L494 PolarHBondContact O-N 2.99Å; L494-Q497 PolarHBondContact O-N 2.97Å; L494-R498 WeakPolarHBondContact O-CB 3.19Å; L494-R498 WeakPolarHBondContact O-CD 3.44Å; L494-R498 VanDerWaalsContact O-CG 3.25Å; L494-R498 WeakPolarHBondContact O-CG 3.4Å; L494-R498 PolarHBondContact O-N 2.97Å; L494-T516 HydrophobicContact CD2-CG2 3.67Å; L494-L523 HydrophobicContact CD1-CD1 3.94Å; L494-L523 HydrophobicContact CD2-CD1 4.12Å; L494-L523 HydrophobicContact CG-CD1 3.81Å; L494-E529 HydrophobicContact CB-CB 4.26Å; L494-E529 HydrophobicContact CD1-CB 4.02Å; L494-F530 HydrophobicContact CD1-CB 4.4Å; L494-L533 HydrophobicContact CD1-CD1 4.21Å; L494-L533 HydrophobicContact CD1-CD2 4.11Å; L494-L533 HydrophobicContact CD1-CG 4.21Å; L494-L533 HydrophobicContact CD2-CD2 4.3Å
495	G	91.5	Very high	92.6	Very high	25 Å²	25	53.3 Å²	53.3	26%	0.258	27%	0.27	S	S	.	.	H	α-helix	trans	-60.1	-48.6	172.6	0	0	0	0	0	112.5	N492 R498 F499 E529	N492-G495 PolarHBondContact O-N 2.81Å; N492-G495 VanDerWaalsContact O-N 3.13Å; G495-R498 PolarHBondContact O-N 2.85Å; G495-F499 WeakPolarHBondContact O-CB 3.49Å; G495-F499 PolarHBondContact O-N 3.2Å; G495-E529 WeakPolarHBondContact CA-OE1 3.31Å; G495-E529 PolarHBondContact N-OE1 3.44Å; G495-E529 PolarHBondContact N-OE2 3.14Å
496	I	93.9	Very high	92.5	Very high	18 Å²	18	55 Å²	55	9%	0.092	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-39.5	177.3	-58.2	176.3	0	0	0	110.8	L484 L488 N492 R498 F499 A500 L508 T512	L484-I496 HydrophobicContact CB-CG2 4.09Å; L484-I496 HydrophobicContact CD2-CD1 4.41Å; L484-I496 HydrophobicContact CD2-CG1 4.49Å; L484-I496 HydrophobicContact CD2-CG2 4.41Å; L488-I496 HydrophobicContact CD2-CD1 4.1Å; L488-I496 HydrophobicContact CG-CD1 4.29Å; N492-I496 HydrophobicContact CB-CD1 4.47Å; N492-I496 WeakPolarHBondContact O-CG1 3.29Å; N492-I496 PolarHBondContact O-N 3.18Å; N492-I496 WeakPolarHBondContact OD1-CD1 3.38Å; I496-R498 PolarHBondContact O-N 3.31Å; I496-F499 PolarHBondContact O-N 3.1Å; I496-A500 WeakPolarHBondContact O-CB 3.22Å; I496-A500 PolarHBondContact O-N 3.45Å; I496-L508 HydrophobicContact CG2-CD1 4.27Å; I496-L508 HydrophobicContact CG2-CD2 4.33Å; I496-L508 HydrophobicContact CG2-CG 4.49Å; I496-T512 HydrophobicContact CB-CG2 4.2Å; I496-T512 HydrophobicContact CG2-CG2 3.63Å
497	Q	93.6	Very high	92.5	Very high	32 Å²	32	53.1 Å²	53.1	15%	0.15	28%	0.276	C	S	.	.	H	α-helix	trans	-59.9	-46.5	175.5	-172	-177.5	-47.9	0	0	111.6	C493 L494 F499 A500 D501 L509 T512 R513 T516	C493-Q497 WeakPolarHBondContact O-CB 3.4Å; C493-Q497 PolarHBondContact O-N 3.1Å; L494-Q497 PolarHBondContact O-N 2.97Å; Q497-F499 VanDerWaalsContact C-N 3.35Å; Q497-F499 PolarHBondContact O-N 3.17Å; Q497-A500 PolarHBondContact O-N 3.28Å; Q497-D501 WeakPolarHBondContact O-CB 3.48Å; Q497-D501 PolarHBondContact O-N 2.69Å; Q497-L509 HydrophobicContact CG-CD1 3.67Å; Q497-T512 WeakPolarHBondContact CA-OG1 3.31Å; Q497-R513 HydrophobicContact CG-CG 4.02Å; Q497-T516 PolarHBondContact OE1-OG1 3.32Å
498	R	91.2	Very high	92.6	Very high	77 Å²	77	50 Å²	50	29%	0.291	26%	0.261	S	S	.	.	H	α-helix	trans	-64	-37.3	175.5	-74.1	164.5	163.2	-172.8	-12.2	112.6	L494 G495 I496 L502 K532	L494-R498 WeakPolarHBondContact O-CB 3.19Å; L494-R498 WeakPolarHBondContact O-CD 3.44Å; L494-R498 VanDerWaalsContact O-CG 3.25Å; L494-R498 WeakPolarHBondContact O-CG 3.4Å; L494-R498 PolarHBondContact O-N 2.97Å; G495-R498 PolarHBondContact O-N 2.85Å; I496-R498 PolarHBondContact O-N 3.31Å; R498-L502 VanDerWaalsContact O-CB 3.28Å; R498-L502 WeakPolarHBondContact O-CB 3.41Å; R498-L502 PolarHBondContact O-N 3.29Å; R498-K532 PolarHBondContact NH2-O 3.41Å
499	F	93.3	Very high	92.8	Very high	36 Å²	36	49.3 Å²	49.3	16%	0.158	26%	0.257	C	S	.	.	H	α-helix	trans	-69	-38.7	176.7	-172.9	-113.7	0	0	0	112	Q462 L465 P466 L484 G495 I496 Q497 H503	Q462-F499 HydrophobicContact CB-CZ 4.36Å; L465-F499 HydrophobicContact CB-CE1 4.16Å; L465-F499 HydrophobicContact CB-CZ 4.28Å; L465-F499 HydrophobicContact CD2-CD1 4.05Å; L465-F499 HydrophobicContact CD2-CE1 3.46Å; L465-F499 VanDerWaalsContact CD2-CE1 3.46Å; L465-F499 HydrophobicContact CD2-CZ 4.17Å; L465-F499 HydrophobicContact CG-CE1 4.37Å; P466-F499 HydrophobicContact CG-CE2 4.23Å; P466-F499 HydrophobicContact CG-CZ 4.05Å; L484-F499 HydrophobicContact CD1-CD1 3.96Å; L484-F499 HydrophobicContact CD1-CE1 3.97Å; G495-F499 WeakPolarHBondContact O-CB 3.49Å; G495-F499 PolarHBondContact O-N 3.2Å; I496-F499 PolarHBondContact O-N 3.1Å; Q497-F499 VanDerWaalsContact C-N 3.35Å; Q497-F499 PolarHBondContact O-N 3.17Å; F499-H503 AromaticContact CD2-CD2 3.56Å; F499-H503 AromaticContact CD2-NE2 3.6Å; F499-H503 AromaticContact CE2-CD2 3.35Å; F499-H503 WeakPolarHBondContact CE2-CD2 3.27Å; F499-H503 AromaticContact CE2-NE2 3.24Å; F499-H503 WeakPolarHBondContact CE2-NE2 3.27Å; F499-H503 AromaticContact CZ-CD2 3.69Å; F499-H503 AromaticContact CZ-NE2 3.94Å; F499-H503 PolarHBondContact O-CD2 3.05Å; F499-H503 PolarHBondContact O-N 2.73Å
500	A	95.5	Very high	92.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-64.8	-42.7	174.5	0	0	0	0	0	112.3	I496 Q497 H503 N504 C505 L508 L509	I496-A500 WeakPolarHBondContact O-CB 3.22Å; I496-A500 PolarHBondContact O-N 3.45Å; Q497-A500 PolarHBondContact O-N 3.28Å; A500-H503 CarbonylContact O-C 3.52Å; A500-H503 PolarHBondContact O-N 3.37Å; A500-N504 PolarHBondContact O-N 3.49Å; A500-C505 HydrophobicContact CB-CB 4.44Å; A500-C505 PolarHBondContact O-N 2.59Å; A500-L508 HydrophobicContact CB-CB 4.05Å; A500-L508 HydrophobicContact CB-CD2 3.71Å; A500-L508 HydrophobicContact CB-CG 3.7Å; A500-L509 HydrophobicContact CB-CB 4.05Å
501	D	93.2	Very high	92.9	Very high	95 Å²	95	51 Å²	51	51%	0.508	27%	0.265	S	S	.	.	H	α-helix	trans	-62.4	-52.5	175.6	-169.2	43.7	0	0	0	111.6	Q497 H503 N504 L509	Q497-D501 WeakPolarHBondContact O-CB 3.48Å; Q497-D501 PolarHBondContact O-N 2.69Å; D501-H503 PolarHBondContact O-N 3.48Å; D501-N504 PolarHBondContact O-N 3.38Å; D501-L509 HydrophobicContact CB-CD1 4Å; D501-L509 HydrophobicContact CB-CD2 4.19Å
502	L	92.5	Very high	93.1	Very high	131 Å²	131	48.5 Å²	48.5	69%	0.686	25%	0.248	S	C	*	.	H	α-helix	trans	-56.6	-26.5	177.6	-177.8	62.6	0	0	0	113.7	R498	R498-L502 VanDerWaalsContact O-CB 3.28Å; R498-L502 WeakPolarHBondContact O-CB 3.41Å; R498-L502 PolarHBondContact O-N 3.29Å
503	H	92.9	Very high	93.1	Very high	36 Å²	36	49.2 Å²	49.2	17%	0.167	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	15.2	179.1	-60	-44.3	0	0	0	113.7	N469 F499 A500 D501 C505	N469-H503 PolarHBondContact ND2-O 2.73Å; F499-H503 AromaticContact CD2-CD2 3.56Å; F499-H503 AromaticContact CD2-NE2 3.6Å; F499-H503 AromaticContact CE2-CD2 3.35Å; F499-H503 WeakPolarHBondContact CE2-CD2 3.27Å; F499-H503 AromaticContact CE2-NE2 3.24Å; F499-H503 WeakPolarHBondContact CE2-NE2 3.27Å; F499-H503 AromaticContact CZ-CD2 3.69Å; F499-H503 AromaticContact CZ-NE2 3.94Å; F499-H503 PolarHBondContact O-CD2 3.05Å; F499-H503 PolarHBondContact O-N 2.73Å; A500-H503 CarbonylContact O-C 3.52Å; A500-H503 PolarHBondContact O-N 3.37Å; D501-H503 PolarHBondContact O-N 3.48Å; H503-C505 PolarHBondContact O-N 3.22Å; H503-C505 VanDerWaalsContact O-N 3.15Å; H503-C505 PolarHBondContact O-SG 2.95Å; H503-C505 VanDerWaalsContact O-SG 3.33Å
504	N	92.2	Very high	92.9	Very high	132 Å²	132	55.4 Å²	55.4	71%	0.706	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	37.1	174.4	-163	92.3	0	0	0	113	A500 D501 Q506	A500-N504 PolarHBondContact O-N 3.49Å; D501-N504 PolarHBondContact O-N 3.38Å; N504-Q506 PolarHBondContact O-N 2.92Å
505	C	93.8	Very high	92.8	Very high	7 Å²	7	56.7 Å²	56.7	5%	0.047	28%	0.276	C	S	.	.			trans	-93.1	70.8	-179.2	-69.9	0	0	0	0	109.8	A500 H503 D507 L508 L509	A500-C505 HydrophobicContact CB-CB 4.44Å; A500-C505 PolarHBondContact O-N 2.59Å; H503-C505 PolarHBondContact O-N 3.22Å; H503-C505 VanDerWaalsContact O-N 3.15Å; H503-C505 PolarHBondContact O-SG 2.95Å; H503-C505 VanDerWaalsContact O-SG 3.33Å; C505-D507 VanDerWaalsContact C-N 3.33Å; C505-D507 PolarHBondContact O-N 3.45Å; C505-L508 HydrophobicContact CB-CB 4.25Å; C505-L508 WeakPolarHBondContact O-CB 3.44Å; C505-L508 PolarHBondContact O-N 2.86Å; C505-L509 PolarHBondContact O-N 2.81Å
506	Q	93.7	Very high	92.8	Very high	96 Å²	96	55.5 Å²	55.5	45%	0.449	26%	0.264	S	S	.	.	H	α-helix	trans	-54.4	-42	-167.3	-168.9	63.8	46.9	0	0	113.9	N504 L508 L509 D510	N504-Q506 PolarHBondContact O-N 2.92Å; Q506-L508 VanDerWaalsContact C-N 3.31Å; Q506-L508 PolarHBondContact O-N 2.77Å; Q506-L509 WeakPolarHBondContact O-CB 3.33Å; Q506-L509 PolarHBondContact O-N 3.14Å; Q506-L509 VanDerWaalsContact O-N 3.14Å; Q506-D510 PolarHBondContact NE2-OD1 3.13Å; Q506-D510 WeakPolarHBondContact O-CB 3.48Å; Q506-D510 PolarHBondContact O-N 2.93Å
507	D	92.8	Very high	92.6	Very high	126 Å²	126	55.4 Å²	55.4	67%	0.674	26%	0.263	S	S	*	.	H	α-helix	trans	-64	-36.5	-179.1	-53.8	-66.9	0	0	0	112.3	C505 F511	C505-D507 VanDerWaalsContact C-N 3.33Å; C505-D507 PolarHBondContact O-N 3.45Å; D507-F511 WeakPolarHBondContact O-CB 3.29Å; D507-F511 PolarHBondContact O-N 3.38Å; D507-F511 VanDerWaalsContact O-N 3.07Å
508	L	94.9	Very high	92.2	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-72.8	-38.3	173.1	178.4	66.9	0	0	0	111.2	C481 L484 Q485 I496 A500 C505 Q506 F511 T512	C481-L508 HydrophobicContact CB-CB 4.37Å; L484-L508 HydrophobicContact CB-CD1 3.99Å; L484-L508 HydrophobicContact CB-CD2 4.08Å; L484-L508 HydrophobicContact CD1-CD2 3.75Å; Q485-L508 HydrophobicContact CG-CD1 3.64Å; I496-L508 HydrophobicContact CG2-CD1 4.27Å; I496-L508 HydrophobicContact CG2-CD2 4.33Å; I496-L508 HydrophobicContact CG2-CG 4.49Å; A500-L508 HydrophobicContact CB-CB 4.05Å; A500-L508 HydrophobicContact CB-CD2 3.71Å; A500-L508 HydrophobicContact CB-CG 3.7Å; C505-L508 HydrophobicContact CB-CB 4.25Å; C505-L508 WeakPolarHBondContact O-CB 3.44Å; C505-L508 PolarHBondContact O-N 2.86Å; Q506-L508 VanDerWaalsContact C-N 3.31Å; Q506-L508 PolarHBondContact O-N 2.77Å; L508-F511 PolarHBondContact O-N 2.99Å; L508-T512 HydrophobicContact CD1-CG2 3.86Å; L508-T512 HydrophobicContact CG-CG2 4.11Å; L508-T512 VanDerWaalsContact O-CB 3.31Å; L508-T512 WeakPolarHBondContact O-CB 3.13Å; L508-T512 WeakPolarHBondContact O-CG2 3.39Å; L508-T512 PolarHBondContact O-N 2.75Å; L508-T512 PolarHBondContact O-OG1 3.37Å
509	L	94.8	Very high	92	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-43.6	175.9	179.8	57.3	0	0	0	111	Q497 A500 D501 C505 Q506 T512 R513	Q497-L509 HydrophobicContact CG-CD1 3.67Å; A500-L509 HydrophobicContact CB-CB 4.05Å; D501-L509 HydrophobicContact CB-CD1 4Å; D501-L509 HydrophobicContact CB-CD2 4.19Å; C505-L509 PolarHBondContact O-N 2.81Å; Q506-L509 WeakPolarHBondContact O-CB 3.33Å; Q506-L509 PolarHBondContact O-N 3.14Å; Q506-L509 VanDerWaalsContact O-N 3.14Å; L509-T512 WeakPolarHBondContact CA-OG1 3.19Å; L509-T512 PolarHBondContact O-OG1 3.36Å; L509-R513 HydrophobicContact CD1-CG 4.24Å; L509-R513 VanDerWaalsContact O-CB 3.23Å; L509-R513 WeakPolarHBondContact O-CB 3.48Å; L509-R513 VanDerWaalsContact O-CD 3.32Å; L509-R513 WeakPolarHBondContact O-CD 3.38Å; L509-R513 WeakPolarHBondContact O-CG 3.27Å; L509-R513 PolarHBondContact O-N 3.09Å
510	D	92	Very high	91.8	Very high	55 Å²	55	54 Å²	54	29%	0.294	26%	0.26	S	S	.	.	H	α-helix	trans	-64.3	-43	175.5	-100.7	54.4	0	0	0	112.4	Q506 R514	Q506-D510 PolarHBondContact NE2-OD1 3.13Å; Q506-D510 WeakPolarHBondContact O-CB 3.48Å; Q506-D510 PolarHBondContact O-N 2.93Å; D510-R514 WeakPolarHBondContact O-CD 3.39Å; D510-R514 VanDerWaalsContact O-CG 3.23Å; D510-R514 WeakPolarHBondContact O-CG 3.42Å; D510-R514 PolarHBondContact O-N 3.39Å; D510-R514 PolarHBondContact O-NE 3.32Å; D510-R514 IonicContact OD2-CZ 2.63Å; D510-R514 IonicContact OD2-NH2 3.14Å; D510-R514 PolarHBondContact OD2-NH2 2.85Å
511	F	91.6	Very high	91.3	Very high	86 Å²	86	54.8 Å²	54.8	38%	0.377	27%	0.268	S	S	.	.	H	α-helix	trans	-67.8	-47.5	178.4	-168.3	-79.6	0	0	0	111.8	Q485 L488 D507 L508 R514 F515	Q485-F511 HydrophobicContact CB-CD1 4.29Å; Q485-F511 HydrophobicContact CB-CE1 4.17Å; Q485-F511 HydrophobicContact CG-CB 4.4Å; Q485-F511 HydrophobicContact CG-CD1 3.88Å; Q485-F511 HydrophobicContact CG-CD2 4.48Å; Q485-F511 HydrophobicContact CG-CE1 4.25Å; Q485-F511 HydrophobicContact CG-CG 4.01Å; L488-F511 HydrophobicContact CD1-CD1 3.53Å; L488-F511 HydrophobicContact CD1-CE1 3.66Å; D507-F511 WeakPolarHBondContact O-CB 3.29Å; D507-F511 PolarHBondContact O-N 3.38Å; D507-F511 VanDerWaalsContact O-N 3.07Å; L508-F511 PolarHBondContact O-N 2.99Å; F511-R514 PolarHBondContact O-N 3.25Å; F511-F515 PolarHBondContact O-N 3.42Å
512	T	93.5	Very high	91	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-42.2	178.1	53.5	0	0	0	0	111.5	L488 I496 Q497 L508 L509 R514 F515 T516	L488-T512 HydrophobicContact CD1-CG2 3.9Å; L488-T512 HydrophobicContact CD2-CG2 4.13Å; L488-T512 HydrophobicContact CG-CG2 4.42Å; I496-T512 HydrophobicContact CB-CG2 4.2Å; I496-T512 HydrophobicContact CG2-CG2 3.63Å; Q497-T512 WeakPolarHBondContact CA-OG1 3.31Å; L508-T512 HydrophobicContact CD1-CG2 3.86Å; L508-T512 HydrophobicContact CG-CG2 4.11Å; L508-T512 VanDerWaalsContact O-CB 3.31Å; L508-T512 WeakPolarHBondContact O-CB 3.13Å; L508-T512 WeakPolarHBondContact O-CG2 3.39Å; L508-T512 PolarHBondContact O-N 2.75Å; L508-T512 PolarHBondContact O-OG1 3.37Å; L509-T512 WeakPolarHBondContact CA-OG1 3.19Å; L509-T512 PolarHBondContact O-OG1 3.36Å; T512-R514 PolarHBondContact O-N 2.88Å; T512-F515 PolarHBondContact O-N 2.9Å; T512-T516 WeakPolarHBondContact O-CB 3.38Å; T512-T516 PolarHBondContact O-N 3.48Å; T512-T516 PolarHBondContact O-OG1 2.82Å
513	R	92.3	Very high	90.8	Very high	67 Å²	67	48.6 Å²	48.6	25%	0.253	23%	0.232	S	C	.	.	H	α-helix	trans	-56.1	-48.2	172.7	-78.6	165.7	170.8	-99.8	-4.4	112	Q497 L509 F515 T516 E517 E540	Q497-R513 HydrophobicContact CG-CG 4.02Å; L509-R513 HydrophobicContact CD1-CG 4.24Å; L509-R513 VanDerWaalsContact O-CB 3.23Å; L509-R513 WeakPolarHBondContact O-CB 3.48Å; L509-R513 VanDerWaalsContact O-CD 3.32Å; L509-R513 WeakPolarHBondContact O-CD 3.38Å; L509-R513 WeakPolarHBondContact O-CG 3.27Å; L509-R513 PolarHBondContact O-N 3.09Å; R513-F515 PolarHBondContact O-N 3.17Å; R513-T516 PolarHBondContact O-N 3.05Å; R513-E517 WeakPolarHBondContact O-CB 3.28Å; R513-E517 VanDerWaalsContact O-CG 3.3Å; R513-E517 WeakPolarHBondContact O-CG 3.32Å; R513-E517 PolarHBondContact O-N 2.84Å; R513-E540 IonicContact CZ-OE1 2.71Å; R513-E540 IonicContact NH1-OE1 3.25Å; R513-E540 PolarHBondContact NH1-OE1 3.13Å; R513-E540 IonicContact NH2-OE1 3.66Å; R513-E540 PolarHBondContact NH2-OE1 3.19Å; R513-E540 IonicContact NH2-OE2 3.55Å; R513-E540 PolarHBondContact NH2-OE2 2.84Å
514	R	89.6	Confident	90.4	Very high	129 Å²	129	47.5 Å²	47.5	49%	0.487	23%	0.227	S	C	.	.	H	α-helix	trans	-63.9	-40.6	178.3	-67.1	165.8	-151.9	173	6.8	111.9	D510 F511 T512 E517 Q518	D510-R514 WeakPolarHBondContact O-CD 3.39Å; D510-R514 VanDerWaalsContact O-CG 3.23Å; D510-R514 WeakPolarHBondContact O-CG 3.42Å; D510-R514 PolarHBondContact O-N 3.39Å; D510-R514 PolarHBondContact O-NE 3.32Å; D510-R514 IonicContact OD2-CZ 2.63Å; D510-R514 IonicContact OD2-NH2 3.14Å; D510-R514 PolarHBondContact OD2-NH2 2.85Å; F511-R514 PolarHBondContact O-N 3.25Å; T512-R514 PolarHBondContact O-N 2.88Å; R514-E517 PolarHBondContact O-N 3.4Å; R514-Q518 WeakPolarHBondContact O-CB 3.23Å; R514-Q518 VanDerWaalsContact O-CG 3.26Å; R514-Q518 WeakPolarHBondContact O-CG 3.12Å; R514-Q518 PolarHBondContact O-N 3.16Å
515	F	90.2	Very high	90.1	Very high	33 Å²	33	47.7 Å²	47.7	15%	0.145	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-45.8	175.1	-175.1	-84.8	0	0	0	111.6	L488 P490 C493 F511 T512 R513 E517 Q518 H519	L488-F515 HydrophobicContact CB-CD1 4.4Å; L488-F515 HydrophobicContact CB-CD2 4.26Å; L488-F515 HydrophobicContact CB-CE1 4.35Å; L488-F515 HydrophobicContact CB-CE2 4.2Å; L488-F515 HydrophobicContact CB-CG 4.35Å; L488-F515 HydrophobicContact CB-CZ 4.25Å; L488-F515 HydrophobicContact CD1-CB 4.25Å; L488-F515 HydrophobicContact CD1-CG 4.28Å; L488-F515 HydrophobicContact CD2-CD1 3.98Å; L488-F515 HydrophobicContact CD2-CE1 4.39Å; L488-F515 HydrophobicContact CD2-CG 4.32Å; P490-F515 HydrophobicContact CG-CE1 4.41Å; C493-F515 HydrophobicContact CB-CD1 3.73Å; C493-F515 HydrophobicContact CB-CE1 4.03Å; F511-F515 PolarHBondContact O-N 3.42Å; T512-F515 PolarHBondContact O-N 2.9Å; R513-F515 PolarHBondContact O-N 3.17Å; F515-E517 VanDerWaalsContact C-N 3.34Å; F515-E517 PolarHBondContact O-N 3.21Å; F515-Q518 PolarHBondContact O-N 2.95Å; F515-H519 AromaticContact CD2-CD2 3.65Å; F515-H519 HydrophobicContact CE1-CB 4.25Å; F515-H519 AromaticContact CE1-CD2 3.96Å; F515-H519 AromaticContact CE2-CD2 3.47Å; F515-H519 VanDerWaalsContact CE2-CD2 3.47Å; F515-H519 WeakPolarHBondContact CE2-CD2 3.48Å; F515-H519 AromaticContact CE2-NE2 3.64Å; F515-H519 AromaticContact CG-CD2 3.98Å; F515-H519 AromaticContact CZ-CD2 3.64Å; F515-H519 PolarHBondContact O-CD2 3.27Å; F515-H519 PolarHBondContact O-N 2.9Å
516	T	91.4	Very high	89.4	Confident	1 Å²	1	51 Å²	51	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-40.8	174.9	-56.7	0	0	0	0	111.7	L494 Q497 T512 R513 Q518 F520 L523 L541	L494-T516 HydrophobicContact CD2-CG2 3.67Å; Q497-T516 PolarHBondContact OE1-OG1 3.32Å; T512-T516 WeakPolarHBondContact O-CB 3.38Å; T512-T516 PolarHBondContact O-N 3.48Å; T512-T516 PolarHBondContact O-OG1 2.82Å; R513-T516 PolarHBondContact O-N 3.05Å; T516-Q518 VanDerWaalsContact C-N 3.35Å; T516-F520 PolarHBondContact O-N 3.13Å; T516-L523 HydrophobicContact CG2-CD1 3.98Å; T516-L541 HydrophobicContact CG2-CD1 4.06Å; T516-L541 HydrophobicContact CG2-CD2 4.18Å
517	E	90.4	Very high	88.1	Confident	15 Å²	15	52.2 Å²	52.2	7%	0.07	25%	0.247	C	C	.	.	H	α-helix	trans	-64.2	-37.6	174.6	-74.8	174	150.9	0	0	112	R513 R514 F515 S544 R546 A548	R513-E517 WeakPolarHBondContact O-CB 3.28Å; R513-E517 VanDerWaalsContact O-CG 3.3Å; R513-E517 WeakPolarHBondContact O-CG 3.32Å; R513-E517 PolarHBondContact O-N 2.84Å; R514-E517 PolarHBondContact O-N 3.4Å; F515-E517 VanDerWaalsContact C-N 3.34Å; F515-E517 PolarHBondContact O-N 3.21Å; E517-S544 WeakPolarHBondContact OE1-CB 3.48Å; E517-S544 PolarHBondContact OE1-OG 2.96Å; E517-R546 HydrophobicContact CB-CB 4.39Å; E517-R546 HydrophobicContact CG-CB 4.36Å; E517-R546 IonicContact OE1-CZ 2.7Å; E517-R546 IonicContact OE1-NE 3.24Å; E517-R546 PolarHBondContact OE1-NE 2.6Å; E517-R546 IonicContact OE1-NH2 2.68Å; E517-R546 PolarHBondContact OE1-NH2 3.07Å; E517-R546 WeakPolarHBondContact OE2-CB 3.45Å; E517-R546 IonicContact OE2-CZ 3.2Å; E517-R546 IonicContact OE2-NE 2.84Å; E517-R546 PolarHBondContact OE2-NE 3.35Å; E517-R546 IonicContact OE2-NH2 3.41Å; E517-R546 PolarHBondContact OE2-NH2 3.25Å; E517-A548 VanDerWaalsContact O-CB 3.23Å; E517-A548 WeakPolarHBondContact O-CB 3.44Å; E517-A548 PolarHBondContact O-N 2.9Å
518	Q	84.6	Confident	87.4	Confident	59 Å²	59	51.7 Å²	51.7	28%	0.276	24%	0.244	S	C	.	.	H	α-helix	trans	-78.7	-37.8	-178.7	-75.8	175.3	-9.2	0	0	114.4	R514 F515 T516 A548 V638	R514-Q518 WeakPolarHBondContact O-CB 3.23Å; R514-Q518 VanDerWaalsContact O-CG 3.26Å; R514-Q518 WeakPolarHBondContact O-CG 3.12Å; R514-Q518 PolarHBondContact O-N 3.16Å; F515-Q518 PolarHBondContact O-N 2.95Å; T516-Q518 VanDerWaalsContact C-N 3.35Å; Q518-A548 WeakPolarHBondContact O-CB 3.37Å; Q518-V638 PolarHBondContact NE2-O 3.03Å
519	H	86.3	Confident	86.8	Confident	57 Å²	57	54 Å²	54	26%	0.264	25%	0.254	S	S	.	.	S	Bend	trans	-104.7	18.4	-175.5	-67.8	-84.1	0	0	0	113.6	P490 F515 G521 E522 L523	P490-H519 HydrophobicContact CG-CB 4.07Å; F515-H519 AromaticContact CD2-CD2 3.65Å; F515-H519 HydrophobicContact CE1-CB 4.25Å; F515-H519 AromaticContact CE1-CD2 3.96Å; F515-H519 AromaticContact CE2-CD2 3.47Å; F515-H519 VanDerWaalsContact CE2-CD2 3.47Å; F515-H519 WeakPolarHBondContact CE2-CD2 3.48Å; F515-H519 AromaticContact CE2-NE2 3.64Å; F515-H519 AromaticContact CG-CD2 3.98Å; F515-H519 AromaticContact CZ-CD2 3.64Å; F515-H519 PolarHBondContact O-CD2 3.27Å; F515-H519 PolarHBondContact O-N 2.9Å; H519-G521 VanDerWaalsContact C-N 3.3Å; H519-G521 PolarHBondContact O-N 3.38Å; H519-E522 IonicContact CE1-OE1 2.67Å; H519-E522 IonicContact CG-OE1 2.74Å; H519-E522 IonicContact ND1-OE1 3.23Å; H519-E522 PolarHBondContact ND1-OE1 3.4Å; H519-E522 WeakPolarHBondContact O-CB 3.17Å; H519-E522 PolarHBondContact O-N 2.86Å; H519-L523 PolarHBondContact O-N 2.87Å
520	F	89.4	Confident	86.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-53.7	-43.1	-175.8	-173.7	-104.7	0	0	0	113	T516 E522 L523 L524 F530 L541 L547 V549 A557	T516-F520 PolarHBondContact O-N 3.13Å; F520-E522 PolarHBondContact O-N 3.38Å; F520-L523 HydrophobicContact CD2-CD2 4Å; F520-L523 HydrophobicContact CE2-CD2 4.16Å; F520-L523 CarbonylContact O-C 3.49Å; F520-L523 WeakPolarHBondContact O-CB 3.35Å; F520-L523 PolarHBondContact O-N 3.43Å; F520-L523 VanDerWaalsContact O-N 3.11Å; F520-L524 HydrophobicContact CD1-CD1 4.02Å; F520-L524 HydrophobicContact CD1-CD2 4.46Å; F520-L524 HydrophobicContact CD1-CG 4.11Å; F520-L524 HydrophobicContact CE1-CD1 3.74Å; F520-L524 HydrophobicContact CE1-CD2 3.9Å; F520-L524 HydrophobicContact CE1-CG 3.95Å; F520-L524 HydrophobicContact CE2-CD2 4.29Å; F520-L524 HydrophobicContact CZ-CD1 4.48Å; F520-L524 HydrophobicContact CZ-CD2 3.81Å; F520-L524 HydrophobicContact CZ-CG 4.34Å; F520-L524 WeakPolarHBondContact O-CG 3.41Å; F520-L524 PolarHBondContact O-N 3.44Å; F520-F530 HydrophobicContact CE2-CE2 4.03Å; F520-F530 HydrophobicContact CZ-CE2 4.19Å; F520-L541 HydrophobicContact CD2-CD1 4.42Å; F520-L541 HydrophobicContact CD2-CD2 3.93Å; F520-L541 HydrophobicContact CD2-CG 4.17Å; F520-L541 HydrophobicContact CE2-CD2 3.58Å; F520-L541 HydrophobicContact CE2-CG 3.86Å; F520-L547 HydrophobicContact CB-CD2 3.41Å; F520-L547 VanDerWaalsContact CB-CD2 3.41Å; F520-L547 HydrophobicContact CD1-CD2 3.76Å; F520-L547 HydrophobicContact CD2-CD2 3.64Å; F520-L547 HydrophobicContact CE1-CD2 4.37Å; F520-L547 HydrophobicContact CE2-CD2 4.29Å; F520-L547 HydrophobicContact CG-CD2 3.33Å; F520-V549 HydrophobicContact CB-CG1 4.23Å; F520-V549 HydrophobicContact CD1-CB 4.35Å; F520-V549 HydrophobicContact CD1-CG1 3.85Å; F520-V549 HydrophobicContact CD1-CG2 3.6Å; F520-V549 HydrophobicContact CE1-CG2 4.17Å; F520-A557 HydrophobicContact CE1-CB 4Å; F520-A557 HydrophobicContact CZ-CB 3.81Å
521	G	85.9	Confident	86.4	Confident	16 Å²	16	51.9 Å²	51.9	17%	0.165	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-21.6	178.3	0	0	0	0	0	115	H519	H519-G521 VanDerWaalsContact C-N 3.3Å; H519-G521 PolarHBondContact O-N 3.38Å
522	E	86.4	Confident	86.3	Confident	93 Å²	93	53.2 Å²	53.2	44%	0.435	25%	0.249	S	C	.	.	H	α-helix	trans	-84.2	-38.7	170.8	-65.3	177.1	-112.4	0	0	111.5	P490 H519 F520 L524 K525	P490-E522 HydrophobicContact CB-CB 3.88Å; P490-E522 HydrophobicContact CG-CB 3.81Å; H519-E522 IonicContact CE1-OE1 2.67Å; H519-E522 IonicContact CG-OE1 2.74Å; H519-E522 IonicContact ND1-OE1 3.23Å; H519-E522 PolarHBondContact ND1-OE1 3.4Å; H519-E522 WeakPolarHBondContact O-CB 3.17Å; H519-E522 PolarHBondContact O-N 2.86Å; F520-E522 PolarHBondContact O-N 3.38Å; E522-L524 VanDerWaalsContact C-N 3.28Å; E522-L524 PolarHBondContact O-N 3.35Å; E522-K525 VanDerWaalsContact O-CB 3.31Å; E522-K525 WeakPolarHBondContact O-CB 3.45Å; E522-K525 PolarHBondContact O-N 2.69Å
523	L	88.1	Confident	86.2	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-32.5	173.6	163.6	162.9	0	0	0	112.1	P490 L494 T516 H519 F520 K525 Q526 F530	P490-L523 HydrophobicContact CB-CB 4.33Å; L494-L523 HydrophobicContact CD1-CD1 3.94Å; L494-L523 HydrophobicContact CD2-CD1 4.12Å; L494-L523 HydrophobicContact CG-CD1 3.81Å; T516-L523 HydrophobicContact CG2-CD1 3.98Å; H519-L523 PolarHBondContact O-N 2.87Å; F520-L523 HydrophobicContact CD2-CD2 4Å; F520-L523 HydrophobicContact CE2-CD2 4.16Å; F520-L523 CarbonylContact O-C 3.49Å; F520-L523 WeakPolarHBondContact O-CB 3.35Å; F520-L523 PolarHBondContact O-N 3.43Å; F520-L523 VanDerWaalsContact O-N 3.11Å; L523-K525 PolarHBondContact O-N 2.9Å; L523-Q526 WeakPolarHBondContact O-CB 3.4Å; L523-Q526 PolarHBondContact O-N 3.08Å; L523-F530 HydrophobicContact CD2-CB 4.08Å; L523-F530 HydrophobicContact CD2-CD2 3.68Å; L523-F530 HydrophobicContact CD2-CE2 4.48Å; L523-F530 HydrophobicContact CD2-CG 4.08Å
524	L	85.5	Confident	86.2	Confident	12 Å²	12	52.7 Å²	52.7	6%	0.063	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.7	172.2	-65.6	-175.2	0	0	0	114.4	F520 E522 F530 Q553 A557 R560	F520-L524 HydrophobicContact CD1-CD1 4.02Å; F520-L524 HydrophobicContact CD1-CD2 4.46Å; F520-L524 HydrophobicContact CD1-CG 4.11Å; F520-L524 HydrophobicContact CE1-CD1 3.74Å; F520-L524 HydrophobicContact CE1-CD2 3.9Å; F520-L524 HydrophobicContact CE1-CG 3.95Å; F520-L524 HydrophobicContact CE2-CD2 4.29Å; F520-L524 HydrophobicContact CZ-CD1 4.48Å; F520-L524 HydrophobicContact CZ-CD2 3.81Å; F520-L524 HydrophobicContact CZ-CG 4.34Å; F520-L524 WeakPolarHBondContact O-CG 3.41Å; F520-L524 PolarHBondContact O-N 3.44Å; E522-L524 VanDerWaalsContact C-N 3.28Å; E522-L524 PolarHBondContact O-N 3.35Å; L524-F530 HydrophobicContact CD2-CD1 4.4Å; L524-F530 HydrophobicContact CD2-CD2 4.46Å; L524-F530 HydrophobicContact CD2-CE1 4.17Å; L524-F530 HydrophobicContact CD2-CE2 4.22Å; L524-F530 HydrophobicContact CD2-CZ 4.08Å; L524-Q553 HydrophobicContact CD1-CB 4.09Å; L524-Q553 VanDerWaalsContact CD1-O 3.31Å; L524-Q553 WeakPolarHBondContact CD1-O 3.47Å; L524-A557 HydrophobicContact CD1-CB 3.88Å; L524-A557 HydrophobicContact CD2-CB 3.35Å; L524-A557 HydrophobicContact CG-CB 4.26Å; L524-R560 PolarHBondContact O-NH2 2.76Å
525	K	84.9	Confident	86.4	Confident	137 Å²	137	47.5 Å²	47.5	60%	0.596	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-2.5	171.9	-52	179.1	-176.1	-178	0	112.5	E522 L523	E522-K525 VanDerWaalsContact O-CB 3.31Å; E522-K525 WeakPolarHBondContact O-CB 3.45Å; E522-K525 PolarHBondContact O-N 2.69Å; L523-K525 PolarHBondContact O-N 2.9Å
526	Q	80.1	Confident	86.5	Confident	75 Å²	75	51.8 Å²	51.8	35%	0.35	26%	0.263	S	S	.	.			trans	-106.1	109.8	-179.3	-52.9	-61.1	-39.5	0	0	109.7	L523 D528	L523-Q526 WeakPolarHBondContact O-CB 3.4Å; L523-Q526 PolarHBondContact O-N 3.08Å; Q526-D528 VanDerWaalsContact C-N 3.33Å; Q526-D528 PolarHBondContact O-N 3.47Å
527	D	65.1	Low	86.6	Confident	123 Å²	123	54.8 Å²	54.8	66%	0.658	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.5	-170	-77.4	-38.3	0	0	0	115	V531	D527-V531 WeakPolarHBondContact O-CG2 3.13Å
528	D	78.1	Confident	86.7	Confident	115 Å²	115	54.1 Å²	54.1	62%	0.615	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-45	-159.7	-126.4	-44.6	0	0	0	115.3	Q526 K532	Q526-D528 VanDerWaalsContact C-N 3.33Å; Q526-D528 PolarHBondContact O-N 3.47Å; D528-K532 WeakPolarHBondContact O-CD 3.33Å; D528-K532 VanDerWaalsContact O-CE 3.28Å; D528-K532 WeakPolarHBondContact O-CE 3.45Å; D528-K532 WeakPolarHBondContact O-CG 3.37Å; D528-K532 PolarHBondContact O-NZ 3.49Å; D528-K532 IonicContact OD1-NZ 3.63Å; D528-K532 PolarHBondContact OD1-NZ 2.94Å
529	E	83.3	Confident	87.2	Confident	48 Å²	48	52.7 Å²	52.7	22%	0.224	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-39.3	-175.7	-68.4	-140.9	108.9	0	0	113.7	L494 G495 V531 K532	L494-E529 HydrophobicContact CB-CB 4.26Å; L494-E529 HydrophobicContact CD1-CB 4.02Å; G495-E529 WeakPolarHBondContact CA-OE1 3.31Å; G495-E529 PolarHBondContact N-OE1 3.44Å; G495-E529 PolarHBondContact N-OE2 3.14Å; E529-V531 PolarHBondContact O-N 3.32Å; E529-K532 WeakPolarHBondContact O-CB 3.4Å; E529-K532 PolarHBondContact O-N 3.47Å
530	F	89.5	Confident	87.6	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.018	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-63.6	-43.7	-170.9	173.8	-102.3	0	0	0	113.4	L494 F520 L523 L524 K532 L533 L538 A557 W561	L494-F530 HydrophobicContact CD1-CB 4.4Å; F520-F530 HydrophobicContact CE2-CE2 4.03Å; F520-F530 HydrophobicContact CZ-CE2 4.19Å; L523-F530 HydrophobicContact CD2-CB 4.08Å; L523-F530 HydrophobicContact CD2-CD2 3.68Å; L523-F530 HydrophobicContact CD2-CE2 4.48Å; L523-F530 HydrophobicContact CD2-CG 4.08Å; L524-F530 HydrophobicContact CD2-CD1 4.4Å; L524-F530 HydrophobicContact CD2-CD2 4.46Å; L524-F530 HydrophobicContact CD2-CE1 4.17Å; L524-F530 HydrophobicContact CD2-CE2 4.22Å; L524-F530 HydrophobicContact CD2-CZ 4.08Å; F530-K532 PolarHBondContact O-N 3.38Å; F530-L533 HydrophobicContact CD2-CD1 3.62Å; F530-L533 HydrophobicContact CE2-CD1 3.86Å; F530-L533 WeakPolarHBondContact O-CB 3.36Å; F530-L533 VanDerWaalsContact O-CG 3.27Å; F530-L533 WeakPolarHBondContact O-CG 3.15Å; F530-L533 PolarHBondContact O-N 3.37Å; F530-L533 VanDerWaalsContact O-N 3.1Å; F530-L538 HydrophobicContact CE2-CD1 3.54Å; F530-L538 HydrophobicContact CZ-CD1 3.63Å; F530-A557 HydrophobicContact CE1-CB 4.28Å; F530-A557 WeakPolarHBondContact CE1-O 3.48Å; F530-A557 HydrophobicContact CZ-CB 3.77Å; F530-W561 HydrophobicContact CE1-CB 4.02Å; F530-W561 HydrophobicContact CZ-CB 4.38Å
531	V	89.1	Confident	87.7	Confident	15 Å²	15	55.2 Å²	55.2	9%	0.091	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-68	-12.7	176.2	-75.7	0	0	0	0	113.7	D527 E529 H564 R569	D527-V531 WeakPolarHBondContact O-CG2 3.13Å; E529-V531 PolarHBondContact O-N 3.32Å; V531-H564 HydrophobicContact CB-CB 4.16Å; V531-H564 HydrophobicContact CG1-CB 3.89Å; V531-R569 PolarHBondContact O-NH1 3.29Å; V531-R569 VanDerWaalsContact O-NH1 3.1Å; V531-R569 PolarHBondContact O-NH2 3.02Å
532	K	88.5	Confident	88.2	Confident	114 Å²	114	54.5 Å²	54.5	50%	0.496	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-88.9	5.3	173.2	-57.2	-178.7	-173.1	113.9	0	113.4	R498 D528 E529 F530	R498-K532 PolarHBondContact NH2-O 3.41Å; D528-K532 WeakPolarHBondContact O-CD 3.33Å; D528-K532 VanDerWaalsContact O-CE 3.28Å; D528-K532 WeakPolarHBondContact O-CE 3.45Å; D528-K532 WeakPolarHBondContact O-CG 3.37Å; D528-K532 PolarHBondContact O-NZ 3.49Å; D528-K532 IonicContact OD1-NZ 3.63Å; D528-K532 PolarHBondContact OD1-NZ 2.94Å; E529-K532 WeakPolarHBondContact O-CB 3.4Å; E529-K532 PolarHBondContact O-N 3.47Å; F530-K532 PolarHBondContact O-N 3.38Å
533	L	90.9	Very high	88.5	Confident	9 Å²	9	52.3 Å²	52.3	5%	0.047	27%	0.268	C	S	.	.			trans	-67	146	167.4	-66.2	173.2	0	0	0	110.9	L494 F530 Q537 L538 L541 W561	L494-L533 HydrophobicContact CD1-CD1 4.21Å; L494-L533 HydrophobicContact CD1-CD2 4.11Å; L494-L533 HydrophobicContact CD1-CG 4.21Å; L494-L533 HydrophobicContact CD2-CD2 4.3Å; F530-L533 HydrophobicContact CD2-CD1 3.62Å; F530-L533 HydrophobicContact CE2-CD1 3.86Å; F530-L533 WeakPolarHBondContact O-CB 3.36Å; F530-L533 VanDerWaalsContact O-CG 3.27Å; F530-L533 WeakPolarHBondContact O-CG 3.15Å; F530-L533 PolarHBondContact O-N 3.37Å; F530-L533 VanDerWaalsContact O-N 3.1Å; L533-Q537 HydrophobicContact CB-CB 4.4Å; L533-Q537 HydrophobicContact CD2-CB 4.05Å; L533-L538 HydrophobicContact CD1-CD1 4.26Å; L533-L541 HydrophobicContact CD1-CD2 4.29Å; L533-W561 WeakPolarHBondContact O-CZ2 3.32Å; L533-W561 PolarHBondContact O-NE1 3.18Å
534	S	92	Very high	88.7	Confident	47 Å²	47	52.9 Å²	52.9	33%	0.329	27%	0.272	S	S	.	.			trans	-73.8	165.5	163.1	66.5	0	0	0	0	110.5	D536 Q537 L538	S534-D536 VanDerWaalsContact C-N 3.34Å; S534-D536 PolarHBondContact O-N 2.9Å; S534-Q537 PolarHBondContact O-N 2.7Å; S534-Q537 WeakPolarHBondContact OG-CB 3.24Å; S534-Q537 WeakPolarHBondContact OG-CG 3.46Å; S534-Q537 PolarHBondContact OG-N 2.84Å; S534-L538 WeakPolarHBondContact O-CB 3.47Å; S534-L538 PolarHBondContact O-N 3.31Å
535	S	93.9	Very high	88.8	Confident	21 Å²	21	54.3 Å²	54.3	15%	0.147	28%	0.28	C	S	.	.	H	α-helix	trans	-59.4	-43.5	174.2	28.9	0	0	0	0	111.6	Q537 L538 I539 E572	S535-Q537 PolarHBondContact O-N 3.19Å; S535-L538 PolarHBondContact O-N 2.93Å; S535-I539 WeakPolarHBondContact O-CB 3.31Å; S535-I539 VanDerWaalsContact O-CG1 3.24Å; S535-I539 WeakPolarHBondContact O-CG1 3.33Å; S535-I539 PolarHBondContact O-N 3.49Å; S535-E572 VanDerWaalsContact CB-OE1 3.22Å; S535-E572 WeakPolarHBondContact CB-OE1 3.3Å; S535-E572 PolarHBondContact OG-OE1 3.24Å
536	D	93.4	Very high	88.9	Confident	122 Å²	122	53 Å²	53	65%	0.652	27%	0.271	S	S	*	.	H	α-helix	trans	-61.1	-44.5	176	-53.4	-58.4	0	0	0	112.9	S534 L538 I539 E540	S534-D536 VanDerWaalsContact C-N 3.34Å; S534-D536 PolarHBondContact O-N 2.9Å; D536-L538 VanDerWaalsContact C-N 3.33Å; D536-L538 PolarHBondContact O-N 2.98Å; D536-I539 PolarHBondContact O-N 3.32Å; D536-E540 PolarHBondContact O-N 3.24Å
537	Q	92.3	Very high	89.3	Confident	65 Å²	65	49.5 Å²	49.5	30%	0.304	25%	0.254	S	S	.	.	H	α-helix	trans	-66.2	-36.1	177.5	-73.7	176.7	-16.4	0	0	111.9	L533 S534 S535 L541	L533-Q537 HydrophobicContact CB-CB 4.4Å; L533-Q537 HydrophobicContact CD2-CB 4.05Å; S534-Q537 PolarHBondContact O-N 2.7Å; S534-Q537 WeakPolarHBondContact OG-CB 3.24Å; S534-Q537 WeakPolarHBondContact OG-CG 3.46Å; S534-Q537 PolarHBondContact OG-N 2.84Å; S535-Q537 PolarHBondContact O-N 3.19Å; Q537-L541 PolarHBondContact O-N 3Å
538	L	94.1	Very high	90.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-69.1	-39.6	174.6	-176.8	59.9	0	0	0	111.1	F530 L533 S534 S535 D536 L541 I542 W561 L576	F530-L538 HydrophobicContact CE2-CD1 3.54Å; F530-L538 HydrophobicContact CZ-CD1 3.63Å; L533-L538 HydrophobicContact CD1-CD1 4.26Å; S534-L538 WeakPolarHBondContact O-CB 3.47Å; S534-L538 PolarHBondContact O-N 3.31Å; S535-L538 PolarHBondContact O-N 2.93Å; D536-L538 VanDerWaalsContact C-N 3.33Å; D536-L538 PolarHBondContact O-N 2.98Å; L538-L541 PolarHBondContact O-N 3.46Å; L538-I542 HydrophobicContact CD1-CG2 3.74Å; L538-I542 HydrophobicContact CG-CG2 4.24Å; L538-I542 WeakPolarHBondContact O-CG1 3.41Å; L538-I542 WeakPolarHBondContact O-CG2 3.07Å; L538-I542 PolarHBondContact O-N 3.27Å; L538-W561 HydrophobicContact CD2-CB 3.77Å; L538-W561 HydrophobicContact CD2-CD2 3.58Å; L538-W561 HydrophobicContact CD2-CE3 4.03Å; L538-W561 HydrophobicContact CD2-CG 3.46Å; L538-W561 VanDerWaalsContact CD2-CG 3.46Å; L538-L576 HydrophobicContact CB-CD2 4.18Å; L538-L576 HydrophobicContact CD2-CD1 4.27Å; L538-L576 HydrophobicContact CD2-CD2 3.69Å; L538-L576 HydrophobicContact CG-CD2 3.85Å
539	I	95.3	Very high	90.5	Very high	30 Å²	30	38.8 Å²	38.8	15%	0.154	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-46.4	175	-72.2	166.4	0	0	0	111.2	S535 D536 L541 S543 N575 L576 H579	S535-I539 WeakPolarHBondContact O-CB 3.31Å; S535-I539 VanDerWaalsContact O-CG1 3.24Å; S535-I539 WeakPolarHBondContact O-CG1 3.33Å; S535-I539 PolarHBondContact O-N 3.49Å; D536-I539 PolarHBondContact O-N 3.32Å; I539-L541 PolarHBondContact O-N 2.9Å; I539-S543 WeakPolarHBondContact O-CB 3.27Å; I539-S543 PolarHBondContact O-N 3.28Å; I539-S543 PolarHBondContact O-OG 2.94Å; I539-N575 WeakPolarHBondContact CD1-ND2 3.47Å; I539-L576 HydrophobicContact CD1-CD2 4.43Å; I539-L576 HydrophobicContact CG1-CD2 3.73Å; I539-H579 WeakPolarHBondContact CG2-NE2 3.34Å
540	E	93.4	Very high	90.6	Very high	91 Å²	91	38.2 Å²	38.2	43%	0.425	20%	0.199	S	C	.	.	H	α-helix	trans	-55.3	-42.1	175.2	-173.1	-179	-160.8	0	0	111.1	R513 D536 S543	R513-E540 IonicContact CZ-OE1 2.71Å; R513-E540 IonicContact NH1-OE1 3.25Å; R513-E540 PolarHBondContact NH1-OE1 3.13Å; R513-E540 IonicContact NH2-OE1 3.66Å; R513-E540 PolarHBondContact NH2-OE1 3.19Å; R513-E540 IonicContact NH2-OE2 3.55Å; R513-E540 PolarHBondContact NH2-OE2 2.84Å; D536-E540 PolarHBondContact O-N 3.24Å; E540-S543 PolarHBondContact O-OG 2.88Å
541	L	93	Very high	90.6	Very high	19 Å²	19	38.6 Å²	38.6	10%	0.099	20%	0.201	C	C	.	.	H	α-helix	trans	-72.5	-55.1	179.5	-172.2	52.2	0	0	0	112.5	T516 F520 L533 Q537 L538 I539 S543 S544 L547	T516-L541 HydrophobicContact CG2-CD1 4.06Å; T516-L541 HydrophobicContact CG2-CD2 4.18Å; F520-L541 HydrophobicContact CD2-CD1 4.42Å; F520-L541 HydrophobicContact CD2-CD2 3.93Å; F520-L541 HydrophobicContact CD2-CG 4.17Å; F520-L541 HydrophobicContact CE2-CD2 3.58Å; F520-L541 HydrophobicContact CE2-CG 3.86Å; L533-L541 HydrophobicContact CD1-CD2 4.29Å; Q537-L541 PolarHBondContact O-N 3Å; L538-L541 PolarHBondContact O-N 3.46Å; I539-L541 PolarHBondContact O-N 2.9Å; L541-S543 VanDerWaalsContact C-N 3.29Å; L541-S543 PolarHBondContact O-N 3.06Å; L541-S544 WeakPolarHBondContact O-CB 3.29Å; L541-S544 PolarHBondContact O-N 3.42Å; L541-L547 HydrophobicContact CD1-CD2 4.16Å; L541-L547 WeakPolarHBondContact O-CD1 3.34Å
542	I	94.7	Very high	90.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-71.7	-18.8	-175.4	72.1	-177	0	0	0	114	L538 V554 V558 L576 H579 R635	L538-I542 HydrophobicContact CD1-CG2 3.74Å; L538-I542 HydrophobicContact CG-CG2 4.24Å; L538-I542 WeakPolarHBondContact O-CG1 3.41Å; L538-I542 WeakPolarHBondContact O-CG2 3.07Å; L538-I542 PolarHBondContact O-N 3.27Å; I542-V554 HydrophobicContact CB-CG1 3.9Å; I542-V554 HydrophobicContact CG2-CG1 3.98Å; I542-V558 HydrophobicContact CD1-CG2 3.64Å; I542-V558 HydrophobicContact CG2-CG2 4.39Å; I542-L576 HydrophobicContact CD1-CB 4.38Å; I542-L576 HydrophobicContact CD1-CD2 3.97Å; I542-L576 WeakPolarHBondContact CD1-O 3.46Å; I542-H579 HydrophobicContact CD1-CB 4.14Å; I542-H579 HydrophobicContact CG1-CB 3.9Å; I542-R635 PolarHBondContact O-NH1 3.39Å; I542-R635 PolarHBondContact O-NH2 3.06Å; I542-R635 VanDerWaalsContact O-NH2 3.12Å
543	S	93.7	Very high	90.7	Very high	48 Å²	48	37.7 Å²	37.7	34%	0.336	20%	0.199	S	C	.	.	H	α-helix	trans	-77.3	-25.4	172.5	61.3	0	0	0	0	112.9	I539 E540 L541 D545 R581	I539-S543 WeakPolarHBondContact O-CB 3.27Å; I539-S543 PolarHBondContact O-N 3.28Å; I539-S543 PolarHBondContact O-OG 2.94Å; E540-S543 PolarHBondContact O-OG 2.88Å; L541-S543 VanDerWaalsContact C-N 3.29Å; L541-S543 PolarHBondContact O-N 3.06Å; S543-D545 PolarHBondContact O-N 3.49Å; S543-R581 PolarHBondContact O-NH2 2.66Å
544	S	92.1	Very high	90.9	Very high	15 Å²	15	37.3 Å²	37.3	11%	0.105	20%	0.197	C	C	.	.			trans	-58.1	124.5	-173.9	-174.9	0	0	0	0	113.2	E517 L541 R546 L547 R635	E517-S544 WeakPolarHBondContact OE1-CB 3.48Å; E517-S544 PolarHBondContact OE1-OG 2.96Å; L541-S544 WeakPolarHBondContact O-CB 3.29Å; L541-S544 PolarHBondContact O-N 3.42Å; S544-R546 PolarHBondContact O-N 3.07Å; S544-R546 PolarHBondContact OG-N 3.23Å; S544-R546 VanDerWaalsContact OG-N 3.16Å; S544-L547 PolarHBondContact O-N 3.43Å; S544-R635 PolarHBondContact O-NH1 3.49Å
545	D	87.6	Confident	91	Very high	42 Å²	42	35 Å²	35	23%	0.225	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-20.9	168.9	-85.7	-36.1	0	0	0	113	S543 L547 R581 K633 R635 T636	S543-D545 PolarHBondContact O-N 3.49Å; D545-L547 VanDerWaalsContact C-N 3.34Å; D545-R581 IonicContact OD1-CZ 2.62Å; D545-R581 VanDerWaalsContact OD1-CZ 3.24Å; D545-R581 IonicContact OD1-NH1 2.59Å; D545-R581 PolarHBondContact OD1-NH1 2.65Å; D545-R581 IonicContact OD1-NH2 3.8Å; D545-R581 PolarHBondContact OD1-NH2 2.69Å; D545-K633 IonicContact OD1-NZ 3.24Å; D545-K633 WeakPolarHBondContact OD2-CE 3.39Å; D545-K633 IonicContact OD2-NZ 2.77Å; D545-K633 PolarHBondContact OD2-NZ 3.2Å; D545-R635 CarbonylContact O-C 3.47Å; D545-R635 WeakPolarHBondContact O-CB 2.82Å; D545-T636 CarbonylContact O-C 3.54Å; D545-T636 VanDerWaalsContact O-C 3.26Å; D545-T636 PolarHBondContact O-N 2.96Å
546	R	87.1	Confident	90.9	Very high	110 Å²	110	37.3 Å²	37.3	42%	0.415	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.2	-175.9	-66.8	-174.3	-59.7	-86	-18.2	114	E517 S544 A548 P637 V638	E517-R546 HydrophobicContact CB-CB 4.39Å; E517-R546 HydrophobicContact CG-CB 4.36Å; E517-R546 IonicContact OE1-CZ 2.7Å; E517-R546 IonicContact OE1-NE 3.24Å; E517-R546 PolarHBondContact OE1-NE 2.6Å; E517-R546 IonicContact OE1-NH2 2.68Å; E517-R546 PolarHBondContact OE1-NH2 3.07Å; E517-R546 WeakPolarHBondContact OE2-CB 3.45Å; E517-R546 IonicContact OE2-CZ 3.2Å; E517-R546 IonicContact OE2-NE 2.84Å; E517-R546 PolarHBondContact OE2-NE 3.35Å; E517-R546 IonicContact OE2-NH2 3.41Å; E517-R546 PolarHBondContact OE2-NH2 3.25Å; S544-R546 PolarHBondContact O-N 3.07Å; S544-R546 PolarHBondContact OG-N 3.23Å; S544-R546 VanDerWaalsContact OG-N 3.16Å; R546-A548 PolarHBondContact O-N 3.1Å; R546-P637 WeakPolarHBondContact O-CA 3.24Å; R546-P637 WeakPolarHBondContact O-CB 3.41Å; R546-V638 HydrophobicContact CG-CB 4.43Å; R546-V638 HydrophobicContact CG-CG2 3.97Å
547	L	89.3	Confident	90.9	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.158	C	C	.	.			trans	-59.8	125.7	178.3	-99.2	179.4	0	0	0	111.8	F520 L541 S544 D545 V549 R635	F520-L547 HydrophobicContact CB-CD2 3.41Å; F520-L547 VanDerWaalsContact CB-CD2 3.41Å; F520-L547 HydrophobicContact CD1-CD2 3.76Å; F520-L547 HydrophobicContact CD2-CD2 3.64Å; F520-L547 HydrophobicContact CE1-CD2 4.37Å; F520-L547 HydrophobicContact CE2-CD2 4.29Å; F520-L547 HydrophobicContact CG-CD2 3.33Å; L541-L547 HydrophobicContact CD1-CD2 4.16Å; L541-L547 WeakPolarHBondContact O-CD1 3.34Å; S544-L547 PolarHBondContact O-N 3.43Å; D545-L547 VanDerWaalsContact C-N 3.34Å; L547-V549 HydrophobicContact CB-CG2 4.4Å; L547-V549 HydrophobicContact CD2-CG2 4.44Å; L547-V549 PolarHBondContact O-N 3.07Å; L547-R635 WeakPolarHBondContact O-CD 3.45Å
548	A	82.9	Confident	91	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.008	14%	0.144	C	C	.	.			trans	-96.3	64.1	-175.1	0	0	0	0	0	111.5	E517 Q518 R546 P637 L640 F980	E517-A548 VanDerWaalsContact O-CB 3.23Å; E517-A548 WeakPolarHBondContact O-CB 3.44Å; E517-A548 PolarHBondContact O-N 2.9Å; Q518-A548 WeakPolarHBondContact O-CB 3.37Å; R546-A548 PolarHBondContact O-N 3.1Å; A548-P637 HydrophobicContact CB-CB 3.95Å; A548-L640 HydrophobicContact CB-CD2 4.02Å; A548-F980 HydrophobicContact CB-CE2 3.55Å; A548-F980 HydrophobicContact CB-CZ 3.72Å; A548-F980 WeakPolarHBondContact O-CE1 3.44Å; A548-F980 VanDerWaalsContact O-CE2 3.29Å; A548-F980 WeakPolarHBondContact O-CE2 3.25Å; A548-F980 WeakPolarHBondContact O-CZ 3.5Å
549	V	84.7	Confident	91	Very high	12 Å²	12	29.7 Å²	29.7	7%	0.073	15%	0.151	C	C	.	.	S	Bend	trans	-154	163.9	177.4	-79.3	0	0	0	0	111.3	F520 L547 Q553 V554	F520-V549 HydrophobicContact CB-CG1 4.23Å; F520-V549 HydrophobicContact CD1-CB 4.35Å; F520-V549 HydrophobicContact CD1-CG1 3.85Å; F520-V549 HydrophobicContact CD1-CG2 3.6Å; F520-V549 HydrophobicContact CE1-CG2 4.17Å; L547-V549 HydrophobicContact CB-CG2 4.4Å; L547-V549 HydrophobicContact CD2-CG2 4.44Å; L547-V549 PolarHBondContact O-N 3.07Å; V549-Q553 HydrophobicContact CB-CB 4.17Å; V549-Q553 HydrophobicContact CG1-CB 4.37Å; V549-V554 HydrophobicContact CG2-CG2 3.47Å; V549-V554 VanDerWaalsContact CG2-CG2 3.47Å
550	S	84.8	Confident	90.8	Very high	37 Å²	37	33 Å²	33	26%	0.259	16%	0.161	S	C	.	.			trans	-74.5	151.8	166.2	59.3	0	0	0	0	111.8	D552 Q553 V554	S550-D552 WeakPolarHBondContact CB-OD1 3.38Å; S550-D552 PolarHBondContact O-N 3.44Å; S550-D552 PolarHBondContact OG-OD1 3.19Å; S550-Q553 WeakPolarHBondContact O-CB 3.47Å; S550-Q553 PolarHBondContact O-N 2.94Å; S550-Q553 VanDerWaalsContact O-N 3.09Å; S550-Q553 PolarHBondContact OG-NE2 3.38Å; S550-V554 PolarHBondContact O-N 2.77Å
551	E	89.7	Confident	90.8	Very high	12 Å²	12	28.9 Å²	28.9	6%	0.056	14%	0.142	C	C	.	.	H	α-helix	trans	-65.1	-23.9	-175.6	-70.5	-64.5	147.4	0	0	114.2	V554 F555 R581 L584 L585 R635	E551-V554 PolarHBondContact O-N 3.27Å; E551-F555 WeakPolarHBondContact O-CB 3.42Å; E551-F555 PolarHBondContact O-N 2.99Å; E551-R581 VanDerWaalsContact CD-CB 3.46Å; E551-R581 HydrophobicContact CG-CB 3.92Å; E551-R581 WeakPolarHBondContact OE1-CD 3.34Å; E551-R581 WeakPolarHBondContact OE1-CG 3.38Å; E551-R581 IonicContact OE1-NE 3.48Å; E551-R581 PolarHBondContact OE2-N 3.1Å; E551-L584 HydrophobicContact CG-CB 4.05Å; E551-L585 VanDerWaalsContact C-CD2 3.46Å; E551-L585 HydrophobicContact CB-CD2 3.83Å; E551-L585 HydrophobicContact CB-CG 4.35Å; E551-R635 IonicContact OE1-CZ 2.73Å; E551-R635 IonicContact OE1-NE 2.77Å; E551-R635 PolarHBondContact OE1-NE 2.87Å; E551-R635 IonicContact OE1-NH2 3.8Å; E551-R635 PolarHBondContact OE1-NH2 3.38Å; E551-R635 IonicContact OE2-CZ 2.76Å; E551-R635 IonicContact OE2-NE 3.18Å; E551-R635 IonicContact OE2-NH2 2.75Å; E551-R635 PolarHBondContact OE2-NH2 2.89Å
552	D	89.2	Confident	90.8	Very high	42 Å²	42	28.3 Å²	28.3	23%	0.225	14%	0.139	C	C	.	.	H	α-helix	trans	-67.6	-39	173.9	61.7	-48.8	0	0	0	110.5	S550 V554 F555 E556 L585 P586 Y589	S550-D552 WeakPolarHBondContact CB-OD1 3.38Å; S550-D552 PolarHBondContact O-N 3.44Å; S550-D552 PolarHBondContact OG-OD1 3.19Å; D552-V554 VanDerWaalsContact C-N 3.35Å; D552-V554 PolarHBondContact O-N 2.83Å; D552-F555 PolarHBondContact O-N 2.75Å; D552-E556 WeakPolarHBondContact O-CB 3.34Å; D552-E556 VanDerWaalsContact O-CG 3.29Å; D552-E556 WeakPolarHBondContact O-CG 3.48Å; D552-E556 PolarHBondContact O-N 3.28Å; D552-L585 VanDerWaalsContact CA-CD2 3.49Å; D552-L585 HydrophobicContact CB-CD2 3.91Å; D552-L585 VanDerWaalsContact N-CD2 3.34Å; D552-P586 HydrophobicContact CB-CG 4.43Å; D552-Y589 HydrophobicContact CB-CD2 3.96Å; D552-Y589 HydrophobicContact CB-CE2 4.15Å; D552-Y589 HydrophobicContact CB-CG 4.38Å
553	Q	90.8	Very high	90.7	Very high	68 Å²	68	31.8 Å²	31.8	32%	0.318	17%	0.168	S	C	.	.	H	α-helix	trans	-64.6	-37.5	170.7	-65.5	-178.8	45.2	0	0	112.1	L524 V549 S550 F555 A557	L524-Q553 HydrophobicContact CD1-CB 4.09Å; L524-Q553 VanDerWaalsContact CD1-O 3.31Å; L524-Q553 WeakPolarHBondContact CD1-O 3.47Å; V549-Q553 HydrophobicContact CB-CB 4.17Å; V549-Q553 HydrophobicContact CG1-CB 4.37Å; S550-Q553 WeakPolarHBondContact O-CB 3.47Å; S550-Q553 PolarHBondContact O-N 2.94Å; S550-Q553 VanDerWaalsContact O-N 3.09Å; S550-Q553 PolarHBondContact OG-NE2 3.38Å; Q553-F555 VanDerWaalsContact C-N 3.34Å; Q553-A557 VanDerWaalsContact O-CB 3.32Å; Q553-A557 WeakPolarHBondContact O-CB 3.48Å; Q553-A557 PolarHBondContact O-N 3.31Å
554	V	94.1	Very high	90.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.4	-38.7	173.6	-173.3	0	0	0	0	111.2	I542 V549 S550 E551 D552 A557 V558 V580	I542-V554 HydrophobicContact CB-CG1 3.9Å; I542-V554 HydrophobicContact CG2-CG1 3.98Å; V549-V554 HydrophobicContact CG2-CG2 3.47Å; V549-V554 VanDerWaalsContact CG2-CG2 3.47Å; S550-V554 PolarHBondContact O-N 2.77Å; E551-V554 PolarHBondContact O-N 3.27Å; D552-V554 VanDerWaalsContact C-N 3.35Å; D552-V554 PolarHBondContact O-N 2.83Å; V554-A557 WeakPolarHBondContact O-CB 3.28Å; V554-A557 PolarHBondContact O-N 2.77Å; V554-V558 PolarHBondContact O-N 3.12Å; V554-V580 HydrophobicContact CG1-CG2 4.31Å
555	F	94.8	Very high	90.4	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-70.2	-46.5	177.4	-173.1	-126.4	0	0	0	111.9	E551 D552 Q553 A557 V558 L559 V580 F582 L585 Y589 L593 F599	E551-F555 WeakPolarHBondContact O-CB 3.42Å; E551-F555 PolarHBondContact O-N 2.99Å; D552-F555 PolarHBondContact O-N 2.75Å; Q553-F555 VanDerWaalsContact C-N 3.34Å; F555-A557 PolarHBondContact O-N 2.81Å; F555-V558 PolarHBondContact O-N 3.17Å; F555-L559 HydrophobicContact CD1-CD1 4.14Å; F555-L559 HydrophobicContact CE1-CD1 3.78Å; F555-L559 HydrophobicContact CE1-CG 4.33Å; F555-L559 HydrophobicContact CE2-CD2 4.15Å; F555-L559 HydrophobicContact CE2-CG 4.32Å; F555-L559 HydrophobicContact CZ-CD1 4.04Å; F555-L559 HydrophobicContact CZ-CD2 4.07Å; F555-L559 HydrophobicContact CZ-CG 4.21Å; F555-L559 WeakPolarHBondContact O-CG 3.35Å; F555-L559 PolarHBondContact O-N 3.17Å; F555-V580 HydrophobicContact CB-CG1 3.92Å; F555-V580 HydrophobicContact CD2-CG1 4.13Å; F555-V580 HydrophobicContact CD2-CG2 4.44Å; F555-V580 HydrophobicContact CG-CG1 4.35Å; F555-F582 HydrophobicContact CD2-CE2 4.14Å; F555-F582 AromaticContact CD2-CZ 3.99Å; F555-F582 HydrophobicContact CD2-CZ 3.99Å; F555-F582 HydrophobicContact CE2-CE2 4.06Å; F555-F582 AromaticContact CE2-CZ 3.54Å; F555-F582 HydrophobicContact CE2-CZ 3.54Å; F555-F582 HydrophobicContact CZ-CE1 4.48Å; F555-F582 AromaticContact CZ-CZ 3.89Å; F555-F582 HydrophobicContact CZ-CZ 3.89Å; F555-L585 HydrophobicContact CB-CD2 4.5Å; F555-Y589 AromaticContact CD1-CE1 3.64Å; F555-Y589 HydrophobicContact CD1-CE1 3.64Å; F555-Y589 AromaticContact CD1-CZ 3.85Å; F555-Y589 WeakPolarHBondContact CD1-OH 3.23Å; F555-Y589 AromaticContact CE1-CE1 3.91Å; F555-Y589 HydrophobicContact CE1-CE1 3.91Å; F555-L593 HydrophobicContact CE1-CD1 4.04Å; F555-L593 HydrophobicContact CE1-CD2 3.67Å; F555-L593 HydrophobicContact CZ-CD1 4.39Å; F555-L593 HydrophobicContact CZ-CD2 3.92Å; F555-F599 HydrophobicContact CZ-CE1 4.37Å; F555-F599 AromaticContact CZ-CZ 3.89Å; F555-F599 HydrophobicContact CZ-CZ 3.89Å
556	E	91.9	Very high	90.5	Very high	69 Å²	69	39.3 Å²	39.3	32%	0.322	20%	0.202	S	C	.	.	H	α-helix	trans	-60.4	-30.2	173.2	-67.3	-63.5	167.6	0	0	112.2	D552 R560 Y589	D552-E556 WeakPolarHBondContact O-CB 3.34Å; D552-E556 VanDerWaalsContact O-CG 3.29Å; D552-E556 WeakPolarHBondContact O-CG 3.48Å; D552-E556 PolarHBondContact O-N 3.28Å; E556-R560 WeakPolarHBondContact O-CB 3.21Å; E556-R560 PolarHBondContact O-N 3.33Å; E556-Y589 WeakPolarHBondContact OE1-CE2 3.33Å; E556-Y589 PolarHBondContact OE1-OH 2.95Å
557	A	93.8	Very high	90.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-48.2	170.8	0	0	0	0	0	111.9	F520 L524 F530 Q553 V554 F555 R560 W561	F520-A557 HydrophobicContact CE1-CB 4Å; F520-A557 HydrophobicContact CZ-CB 3.81Å; L524-A557 HydrophobicContact CD1-CB 3.88Å; L524-A557 HydrophobicContact CD2-CB 3.35Å; L524-A557 HydrophobicContact CG-CB 4.26Å; F530-A557 HydrophobicContact CE1-CB 4.28Å; F530-A557 WeakPolarHBondContact CE1-O 3.48Å; F530-A557 HydrophobicContact CZ-CB 3.77Å; Q553-A557 VanDerWaalsContact O-CB 3.32Å; Q553-A557 WeakPolarHBondContact O-CB 3.48Å; Q553-A557 PolarHBondContact O-N 3.31Å; V554-A557 WeakPolarHBondContact O-CB 3.28Å; V554-A557 PolarHBondContact O-N 2.77Å; F555-A557 PolarHBondContact O-N 2.81Å; A557-R560 PolarHBondContact O-N 2.82Å; A557-W561 WeakPolarHBondContact O-CB 3.32Å; A557-W561 PolarHBondContact O-N 2.6Å
558	V	95.1	Very high	90.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-43.7	176.5	172.5	0	0	0	0	110.8	I542 V554 F555 W561 I562 L576 V580	I542-V558 HydrophobicContact CD1-CG2 3.64Å; I542-V558 HydrophobicContact CG2-CG2 4.39Å; V554-V558 PolarHBondContact O-N 3.12Å; F555-V558 PolarHBondContact O-N 3.17Å; V558-W561 PolarHBondContact O-N 3.16Å; V558-I562 HydrophobicContact CG1-CD1 3.74Å; V558-I562 HydrophobicContact CG1-CG1 4.49Å; V558-I562 WeakPolarHBondContact O-CD1 3.29Å; V558-I562 VanDerWaalsContact O-CG1 3.29Å; V558-I562 WeakPolarHBondContact O-CG1 3.18Å; V558-I562 PolarHBondContact O-N 3.27Å; V558-L576 HydrophobicContact CG1-CB 3.72Å; V558-L576 HydrophobicContact CG1-CD1 4.32Å; V558-L576 HydrophobicContact CG2-CB 4.43Å; V558-V580 HydrophobicContact CG2-CG2 4.07Å
559	L	92.4	Very high	91	Very high	27 Å²	27	46.6 Å²	46.6	14%	0.141	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-45.7	176.7	-64.4	-173.9	0	0	0	112.2	F555 W561 I562 A563 F599	F555-L559 HydrophobicContact CD1-CD1 4.14Å; F555-L559 HydrophobicContact CE1-CD1 3.78Å; F555-L559 HydrophobicContact CE1-CG 4.33Å; F555-L559 HydrophobicContact CE2-CD2 4.15Å; F555-L559 HydrophobicContact CE2-CG 4.32Å; F555-L559 HydrophobicContact CZ-CD1 4.04Å; F555-L559 HydrophobicContact CZ-CD2 4.07Å; F555-L559 HydrophobicContact CZ-CG 4.21Å; F555-L559 WeakPolarHBondContact O-CG 3.35Å; F555-L559 PolarHBondContact O-N 3.17Å; L559-W561 VanDerWaalsContact C-N 3.32Å; L559-W561 PolarHBondContact O-N 2.61Å; L559-I562 PolarHBondContact O-N 3.46Å; L559-A563 WeakPolarHBondContact O-CB 3.38Å; L559-A563 PolarHBondContact O-N 3.5Å; L559-F599 HydrophobicContact CD1-CE2 4.39Å; L559-F599 HydrophobicContact CD2-CE2 3.69Å; L559-F599 HydrophobicContact CD2-CZ 4Å
560	R	91.5	Very high	91.3	Very high	99 Å²	99	48.9 Å²	48.9	37%	0.374	27%	0.267	S	S	.	.	H	α-helix	trans	-58.6	-42	174.1	178.4	-174.5	-91.4	95.5	-9.9	111.7	L524 E556 A557 A563	L524-R560 PolarHBondContact O-NH2 2.76Å; E556-R560 WeakPolarHBondContact O-CB 3.21Å; E556-R560 PolarHBondContact O-N 3.33Å; A557-R560 PolarHBondContact O-N 2.82Å; R560-A563 PolarHBondContact O-N 3.47Å
561	W	94.2	Very high	91.6	Very high	4 Å²	4	53 Å²	53	2%	0.015	29%	0.291	C	S	.	.	H	α-helix	trans	-65.3	-43.5	178	-172.2	93.9	0	0	0	112.3	F530 L533 L538 A557 V558 L559 R569 E572 L576	F530-W561 HydrophobicContact CE1-CB 4.02Å; F530-W561 HydrophobicContact CZ-CB 4.38Å; L533-W561 WeakPolarHBondContact O-CZ2 3.32Å; L533-W561 PolarHBondContact O-NE1 3.18Å; L538-W561 HydrophobicContact CD2-CB 3.77Å; L538-W561 HydrophobicContact CD2-CD2 3.58Å; L538-W561 HydrophobicContact CD2-CE3 4.03Å; L538-W561 HydrophobicContact CD2-CG 3.46Å; L538-W561 VanDerWaalsContact CD2-CG 3.46Å; A557-W561 WeakPolarHBondContact O-CB 3.32Å; A557-W561 PolarHBondContact O-N 2.6Å; V558-W561 PolarHBondContact O-N 3.16Å; L559-W561 VanDerWaalsContact C-N 3.32Å; L559-W561 PolarHBondContact O-N 2.61Å; W561-R569 HydrophobicContact CE3-CB 4.18Å; W561-R569 HydrophobicContact CE3-CG 4.04Å; W561-R569 HydrophobicContact CH2-CB 4.45Å; W561-R569 HydrophobicContact CH2-CG 3.76Å; W561-R569 VanDerWaalsContact CZ2-CZ 3.49Å; W561-R569 VanDerWaalsContact CZ2-NE 3.34Å; W561-R569 HydrophobicContact CZ3-CB 3.72Å; W561-R569 VanDerWaalsContact CZ3-CD 3.45Å; W561-R569 HydrophobicContact CZ3-CG 3.48Å; W561-R569 VanDerWaalsContact CZ3-CG 3.48Å; W561-R569 WeakPolarHBondContact O-CD 3.5Å; W561-R569 PolarHBondContact O-NH1 3.25Å; W561-E572 VanDerWaalsContact CH2-OE2 3.3Å; W561-E572 WeakPolarHBondContact CH2-OE2 3.45Å; W561-L576 HydrophobicContact CE3-CD1 3.71Å; W561-L576 HydrophobicContact CZ3-CD1 3.6Å
562	I	93.2	Very high	91.8	Very high	8 Å²	8	55.5 Å²	55.5	4%	0.041	30%	0.302	C	S	.	.	H	α-helix	trans	-63.3	-45.9	176.6	-65	158.7	0	0	0	110.9	V558 L559 H564 N565 R569 Q570 A573	V558-I562 HydrophobicContact CG1-CD1 3.74Å; V558-I562 HydrophobicContact CG1-CG1 4.49Å; V558-I562 WeakPolarHBondContact O-CD1 3.29Å; V558-I562 VanDerWaalsContact O-CG1 3.29Å; V558-I562 WeakPolarHBondContact O-CG1 3.18Å; V558-I562 PolarHBondContact O-N 3.27Å; L559-I562 PolarHBondContact O-N 3.46Å; I562-H564 PolarHBondContact O-N 2.87Å; I562-H564 VanDerWaalsContact O-N 3.07Å; I562-N565 CarbonylContact O-C 3.57Å; I562-N565 VanDerWaalsContact O-C 3.26Å; I562-N565 PolarHBondContact O-N 3.33Å; I562-R569 HydrophobicContact CB-CB 4.39Å; I562-R569 HydrophobicContact CG1-CB 4.44Å; I562-R569 HydrophobicContact CG2-CB 4.23Å; I562-Q570 VanDerWaalsContact CG2-OE1 3.3Å; I562-A573 HydrophobicContact CD1-CB 3.51Å; I562-A573 HydrophobicContact CG1-CB 4.32Å
563	A	91.2	Very high	91.9	Very high	73 Å²	73	53.5 Å²	53.5	60%	0.603	29%	0.291	S	S	*	.	H	α-helix	trans	-58.9	-23.5	-175.5	0	0	0	0	0	114.4	L559 R560 N565	L559-A563 WeakPolarHBondContact O-CB 3.38Å; L559-A563 PolarHBondContact O-N 3.5Å; R560-A563 PolarHBondContact O-N 3.47Å; A563-N565 VanDerWaalsContact C-N 3.35Å
564	H	90.1	Very high	92	Very high	122 Å²	122	55 Å²	55	57%	0.565	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-26.6	176.6	-173.4	88.5	0	0	0	113.6	V531 I562	V531-H564 HydrophobicContact CB-CB 4.16Å; V531-H564 HydrophobicContact CG1-CB 3.89Å; I562-H564 PolarHBondContact O-N 2.87Å; I562-H564 VanDerWaalsContact O-N 3.07Å
565	N	91	Very high	92.1	Very high	71 Å²	71	59.4 Å²	59.4	38%	0.38	32%	0.322	S	S	.	.	S	Bend	trans	-154	73.8	172.6	-171.6	-22.4	0	0	0	110.4	I562 A563 G567 K568 R569	I562-N565 CarbonylContact O-C 3.57Å; I562-N565 VanDerWaalsContact O-C 3.26Å; I562-N565 PolarHBondContact O-N 3.33Å; A563-N565 VanDerWaalsContact C-N 3.35Å; N565-G567 VanDerWaalsContact C-N 3.27Å; N565-G567 PolarHBondContact O-N 2.93Å; N565-K568 PolarHBondContact O-N 2.87Å; N565-K568 PolarHBondContact OD1-N 3.27Å; N565-R569 HydrophobicContact CB-CG 4.32Å; N565-R569 VanDerWaalsContact O-CB 3.23Å; N565-R569 WeakPolarHBondContact O-CB 3.12Å; N565-R569 WeakPolarHBondContact O-CG 3.43Å; N565-R569 PolarHBondContact O-N 2.94Å
566	P	87.8	Confident	92.1	Very high	69 Å²	69	59.4 Å²	59.4	45%	0.448	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-37.9	-173.2	22.6	-33.1	0	0	0	111.9	K568 R569 Q570	P566-K568 VanDerWaalsContact C-N 3.26Å; P566-K568 PolarHBondContact O-N 2.97Å; P566-K568 VanDerWaalsContact O-N 3.16Å; P566-R569 PolarHBondContact O-N 3.35Å; P566-Q570 VanDerWaalsContact O-CB 3.27Å; P566-Q570 WeakPolarHBondContact O-CB 3.47Å; P566-Q570 PolarHBondContact O-N 2.95Å
567	G	87.7	Confident	92.2	Very high	74 Å²	74	56.1 Å²	56.1	76%	0.763	31%	0.307	S	S	*	.	H	α-helix	trans	-58.3	-30.6	-178.2	0	0	0	0	0	115	N565	N565-G567 VanDerWaalsContact C-N 3.27Å; N565-G567 PolarHBondContact O-N 2.93Å
568	K	88.9	Confident	92.1	Very high	160 Å²	160	57.9 Å²	57.9	70%	0.696	32%	0.319	S	S	*	.	H	α-helix	trans	-103.1	-27.9	172.3	-75.5	-169.1	174.1	-175.1	0	114.3	N565 P566 T571	N565-K568 PolarHBondContact O-N 2.87Å; N565-K568 PolarHBondContact OD1-N 3.27Å; P566-K568 VanDerWaalsContact C-N 3.26Å; P566-K568 PolarHBondContact O-N 2.97Å; P566-K568 VanDerWaalsContact O-N 3.16Å; K568-T571 PolarHBondContact O-OG1 3.34Å; K568-T571 VanDerWaalsContact O-OG1 3.06Å
569	R	93.2	Very high	92.1	Very high	32 Å²	32	60.7 Å²	60.7	12%	0.121	33%	0.332	C	S	.	.	H	α-helix	trans	-91.1	-19.6	-172.2	-65.3	-179.5	163.5	178.8	-3.1	113.8	V531 W561 I562 N565 P566 T571 E572 A573	V531-R569 PolarHBondContact O-NH1 3.29Å; V531-R569 VanDerWaalsContact O-NH1 3.1Å; V531-R569 PolarHBondContact O-NH2 3.02Å; W561-R569 HydrophobicContact CE3-CB 4.18Å; W561-R569 HydrophobicContact CE3-CG 4.04Å; W561-R569 HydrophobicContact CH2-CB 4.45Å; W561-R569 HydrophobicContact CH2-CG 3.76Å; W561-R569 VanDerWaalsContact CZ2-CZ 3.49Å; W561-R569 VanDerWaalsContact CZ2-NE 3.34Å; W561-R569 HydrophobicContact CZ3-CB 3.72Å; W561-R569 VanDerWaalsContact CZ3-CD 3.45Å; W561-R569 HydrophobicContact CZ3-CG 3.48Å; W561-R569 VanDerWaalsContact CZ3-CG 3.48Å; W561-R569 WeakPolarHBondContact O-CD 3.5Å; W561-R569 PolarHBondContact O-NH1 3.25Å; I562-R569 HydrophobicContact CB-CB 4.39Å; I562-R569 HydrophobicContact CG1-CB 4.44Å; I562-R569 HydrophobicContact CG2-CB 4.23Å; N565-R569 HydrophobicContact CB-CG 4.32Å; N565-R569 VanDerWaalsContact O-CB 3.23Å; N565-R569 WeakPolarHBondContact O-CB 3.12Å; N565-R569 WeakPolarHBondContact O-CG 3.43Å; N565-R569 PolarHBondContact O-N 2.94Å; P566-R569 PolarHBondContact O-N 3.35Å; R569-T571 PolarHBondContact O-N 2.95Å; R569-E572 PolarHBondContact O-N 3.07Å; R569-E572 VanDerWaalsContact O-N 3.1Å; R569-A573 PolarHBondContact O-N 2.93Å
570	Q	92.2	Very high	92.2	Very high	60 Å²	60	59.4 Å²	59.4	28%	0.28	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-31	179.3	-152.8	70.1	38.3	0	0	112.7	I562 P566 E572 A573 V602 N603	I562-Q570 VanDerWaalsContact CG2-OE1 3.3Å; P566-Q570 VanDerWaalsContact O-CB 3.27Å; P566-Q570 WeakPolarHBondContact O-CB 3.47Å; P566-Q570 PolarHBondContact O-N 2.95Å; Q570-E572 VanDerWaalsContact C-N 3.26Å; Q570-E572 PolarHBondContact O-N 2.87Å; Q570-A573 VanDerWaalsContact O-CB 3.29Å; Q570-A573 WeakPolarHBondContact O-CB 3.42Å; Q570-A573 PolarHBondContact O-N 2.86Å; Q570-V602 HydrophobicContact CG-CG1 4.41Å; Q570-N603 PolarHBondContact NE2-OD1 3.28Å
571	T	91	Very high	92.3	Very high	123 Å²	123	55 Å²	55	76%	0.755	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.2	176.7	45.3	0	0	0	0	113.5	K568 R569	K568-T571 PolarHBondContact O-OG1 3.34Å; K568-T571 VanDerWaalsContact O-OG1 3.06Å; R569-T571 PolarHBondContact O-N 2.95Å
572	E	92.8	Very high	92.2	Very high	64 Å²	64	54.8 Å²	54.8	30%	0.299	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-11.3	177.7	-61.3	178.4	129.7	0	0	112.4	S535 W561 R569 Q570 Q574 N575 L576	S535-E572 VanDerWaalsContact CB-OE1 3.22Å; S535-E572 WeakPolarHBondContact CB-OE1 3.3Å; S535-E572 PolarHBondContact OG-OE1 3.24Å; W561-E572 VanDerWaalsContact CH2-OE2 3.3Å; W561-E572 WeakPolarHBondContact CH2-OE2 3.45Å; R569-E572 PolarHBondContact O-N 3.07Å; R569-E572 VanDerWaalsContact O-N 3.1Å; Q570-E572 VanDerWaalsContact C-N 3.26Å; Q570-E572 PolarHBondContact O-N 2.87Å; E572-Q574 VanDerWaalsContact C-N 3.32Å; E572-Q574 PolarHBondContact O-N 3.44Å; E572-N575 WeakPolarHBondContact O-CB 3.46Å; E572-N575 PolarHBondContact O-N 3.26Å; E572-L576 HydrophobicContact CB-CD1 4.37Å; E572-L576 PolarHBondContact O-N 3.44Å
573	A	92.6	Very high	92	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-57.4	-39.9	-172.7	0	0	0	0	0	113.6	I562 R569 Q570 N575 C577 W605	I562-A573 HydrophobicContact CD1-CB 3.51Å; I562-A573 HydrophobicContact CG1-CB 4.32Å; R569-A573 PolarHBondContact O-N 2.93Å; Q570-A573 VanDerWaalsContact O-CB 3.29Å; Q570-A573 WeakPolarHBondContact O-CB 3.42Å; Q570-A573 PolarHBondContact O-N 2.86Å; A573-N575 VanDerWaalsContact C-N 3.33Å; A573-N575 PolarHBondContact O-N 3.19Å; A573-C577 VanDerWaalsContact O-CB 3.27Å; A573-C577 WeakPolarHBondContact O-CB 3.43Å; A573-C577 PolarHBondContact O-N 3.2Å; A573-C577 PolarHBondContact O-SG 3.03Å; A573-W605 HydrophobicContact CB-CZ2 3.81Å
574	Q	93.5	Very high	91.8	Very high	101 Å²	101	52.4 Å²	52.4	47%	0.472	29%	0.285	S	S	.	.	H	α-helix	trans	-64.7	-37.5	176.5	-174.9	175.8	-0	0	0	112	E572 S578 W605 Y609	E572-Q574 VanDerWaalsContact C-N 3.32Å; E572-Q574 PolarHBondContact O-N 3.44Å; Q574-S578 PolarHBondContact O-N 3.38Å; Q574-W605 HydrophobicContact CB-CB 4.47Å; Q574-W605 HydrophobicContact CB-CD2 3.9Å; Q574-W605 HydrophobicContact CB-CG 3.83Å; Q574-W605 HydrophobicContact CG-CB 3.86Å; Q574-W605 HydrophobicContact CG-CD2 4.03Å; Q574-W605 HydrophobicContact CG-CE3 4.43Å; Q574-W605 HydrophobicContact CG-CG 3.75Å; Q574-Y609 PolarHBondContact O-OH 3.25Å
575	N	94.3	Very high	91.8	Very high	91 Å²	91	46.7 Å²	46.7	49%	0.487	26%	0.258	S	S	.	.	H	α-helix	trans	-69.4	-48.6	179.1	-166.7	40.2	0	0	0	110.5	I539 E572 A573 C577 S578 H579	I539-N575 WeakPolarHBondContact CD1-ND2 3.47Å; E572-N575 WeakPolarHBondContact O-CB 3.46Å; E572-N575 PolarHBondContact O-N 3.26Å; A573-N575 VanDerWaalsContact C-N 3.33Å; A573-N575 PolarHBondContact O-N 3.19Å; N575-C577 PolarHBondContact O-N 3.3Å; N575-S578 VanDerWaalsContact O-CB 3.27Å; N575-S578 WeakPolarHBondContact O-CB 3.23Å; N575-S578 PolarHBondContact O-N 2.94Å; N575-S578 VanDerWaalsContact O-N 3.11Å; N575-S578 PolarHBondContact O-OG 3.2Å; N575-H579 PolarHBondContact O-CD2 3.31Å; N575-H579 VanDerWaalsContact O-CD2 3.29Å
576	L	94.8	Very high	91.5	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-56.8	-48.1	175.4	-72.5	164.2	0	0	0	112	L538 I539 I542 V558 W561 E572 S578 H579	L538-L576 HydrophobicContact CB-CD2 4.18Å; L538-L576 HydrophobicContact CD2-CD1 4.27Å; L538-L576 HydrophobicContact CD2-CD2 3.69Å; L538-L576 HydrophobicContact CG-CD2 3.85Å; I539-L576 HydrophobicContact CD1-CD2 4.43Å; I539-L576 HydrophobicContact CG1-CD2 3.73Å; I542-L576 HydrophobicContact CD1-CB 4.38Å; I542-L576 HydrophobicContact CD1-CD2 3.97Å; I542-L576 WeakPolarHBondContact CD1-O 3.46Å; V558-L576 HydrophobicContact CG1-CB 3.72Å; V558-L576 HydrophobicContact CG1-CD1 4.32Å; V558-L576 HydrophobicContact CG2-CB 4.43Å; W561-L576 HydrophobicContact CE3-CD1 3.71Å; W561-L576 HydrophobicContact CZ3-CD1 3.6Å; E572-L576 HydrophobicContact CB-CD1 4.37Å; E572-L576 PolarHBondContact O-N 3.44Å; L576-S578 PolarHBondContact O-N 3.4Å; L576-H579 PolarHBondContact O-N 3.1Å
577	C	94.1	Very high	91.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-71.1	-9.3	179.3	-68.6	0	0	0	0	114.4	A573 N575 H579 V580 F582 W605 Y609 R631	A573-C577 VanDerWaalsContact O-CB 3.27Å; A573-C577 WeakPolarHBondContact O-CB 3.43Å; A573-C577 PolarHBondContact O-N 3.2Å; A573-C577 PolarHBondContact O-SG 3.03Å; N575-C577 PolarHBondContact O-N 3.3Å; C577-H579 VanDerWaalsContact C-N 3.27Å; C577-V580 PolarHBondContact O-N 3.13Å; C577-F582 HydrophobicContact CB-CE2 4.17Å; C577-W605 HydrophobicContact CB-CE3 4.4Å; C577-W605 HydrophobicContact CB-CH2 3.71Å; C577-W605 HydrophobicContact CB-CZ3 3.47Å; C577-W605 VanDerWaalsContact CB-CZ3 3.47Å; C577-W605 VanDerWaalsContact SG-CH2 3.52Å; C577-Y609 HydrophobicContact CB-CD2 4.4Å; C577-Y609 HydrophobicContact CB-CE2 3.93Å; C577-R631 PolarHBondContact O-NH1 3.5Å
578	S	93	Very high	91.3	Very high	37 Å²	37	49.5 Å²	49.5	26%	0.259	25%	0.245	S	C	.	.	H	α-helix	trans	-67.6	-30.2	170.3	82.7	0	0	0	0	112.1	Q574 N575 L576 Y609 R631	Q574-S578 PolarHBondContact O-N 3.38Å; N575-S578 VanDerWaalsContact O-CB 3.27Å; N575-S578 WeakPolarHBondContact O-CB 3.23Å; N575-S578 PolarHBondContact O-N 2.94Å; N575-S578 VanDerWaalsContact O-N 3.11Å; N575-S578 PolarHBondContact O-OG 3.2Å; L576-S578 PolarHBondContact O-N 3.4Å; S578-Y609 WeakPolarHBondContact CB-OH 3.39Å; S578-R631 PolarHBondContact O-NH1 3.14Å
579	H	94.8	Very high	91.4	Very high	59 Å²	59	42.9 Å²	42.9	27%	0.273	22%	0.215	S	C	.	.	S	Bend	trans	-88.2	-9.3	178.9	-57.2	-74.5	0	0	0	114	I539 I542 N575 L576 C577	I539-H579 WeakPolarHBondContact CG2-NE2 3.34Å; I542-H579 HydrophobicContact CD1-CB 4.14Å; I542-H579 HydrophobicContact CG1-CB 3.9Å; N575-H579 PolarHBondContact O-CD2 3.31Å; N575-H579 VanDerWaalsContact O-CD2 3.29Å; L576-H579 PolarHBondContact O-N 3.1Å; C577-H579 VanDerWaalsContact C-N 3.27Å
580	V	94.8	Very high	91.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-80.5	130.6	171.9	177.3	0	0	0	0	108.8	V554 F555 V558 C577 F582 R631	V554-V580 HydrophobicContact CG1-CG2 4.31Å; F555-V580 HydrophobicContact CB-CG1 3.92Å; F555-V580 HydrophobicContact CD2-CG1 4.13Å; F555-V580 HydrophobicContact CD2-CG2 4.44Å; F555-V580 HydrophobicContact CG-CG1 4.35Å; V558-V580 HydrophobicContact CG2-CG2 4.07Å; C577-V580 PolarHBondContact O-N 3.13Å; V580-F582 VanDerWaalsContact C-N 3.3Å; V580-F582 HydrophobicContact CB-CD2 4.01Å; V580-F582 HydrophobicContact CB-CE2 3.96Å; V580-F582 HydrophobicContact CG1-CD2 3.79Å; V580-F582 HydrophobicContact CG1-CE2 3.83Å; V580-F582 PolarHBondContact O-N 3.45Å; V580-R631 PolarHBondContact O-NH1 3.4Å; V580-R631 VanDerWaalsContact O-NH1 3.13Å
581	R	92.2	Very high	91.3	Very high	6 Å²	6	41.3 Å²	41.3	2%	0.023	21%	0.213	C	C	.	.			trans	-89.8	69	-170.6	-47.2	-177.3	-170.9	-163.7	-2.4	109.9	S543 D545 E551 A583 L584 E630 R631 K633	S543-R581 PolarHBondContact O-NH2 2.66Å; D545-R581 IonicContact OD1-CZ 2.62Å; D545-R581 VanDerWaalsContact OD1-CZ 3.24Å; D545-R581 IonicContact OD1-NH1 2.59Å; D545-R581 PolarHBondContact OD1-NH1 2.65Å; D545-R581 IonicContact OD1-NH2 3.8Å; D545-R581 PolarHBondContact OD1-NH2 2.69Å; E551-R581 VanDerWaalsContact CD-CB 3.46Å; E551-R581 HydrophobicContact CG-CB 3.92Å; E551-R581 WeakPolarHBondContact OE1-CD 3.34Å; E551-R581 WeakPolarHBondContact OE1-CG 3.38Å; E551-R581 IonicContact OE1-NE 3.48Å; E551-R581 PolarHBondContact OE2-N 3.1Å; R581-A583 PolarHBondContact O-N 3.19Å; R581-L584 HydrophobicContact CB-CD1 4.1Å; R581-L584 HydrophobicContact CB-CG 4.44Å; R581-L584 WeakPolarHBondContact O-CB 3.49Å; R581-L584 PolarHBondContact O-N 3.03Å; R581-E630 WeakPolarHBondContact CD-O 3.49Å; R581-R631 WeakPolarHBondContact CB-O 3.22Å; R581-K633 VanDerWaalsContact CD-O 3.29Å; R581-K633 WeakPolarHBondContact CD-O 3.46Å; R581-K633 PolarHBondContact NH1-O 3.22Å
582	F	92.5	Very high	91.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-49.1	-33.5	-173.5	-92	-108.3	0	0	0	114.1	F555 C577 V580 L584 L585 L590 L593 Y609 A613	F555-F582 HydrophobicContact CD2-CE2 4.14Å; F555-F582 AromaticContact CD2-CZ 3.99Å; F555-F582 HydrophobicContact CD2-CZ 3.99Å; F555-F582 HydrophobicContact CE2-CE2 4.06Å; F555-F582 AromaticContact CE2-CZ 3.54Å; F555-F582 HydrophobicContact CE2-CZ 3.54Å; F555-F582 HydrophobicContact CZ-CE1 4.48Å; F555-F582 AromaticContact CZ-CZ 3.89Å; F555-F582 HydrophobicContact CZ-CZ 3.89Å; C577-F582 HydrophobicContact CB-CE2 4.17Å; V580-F582 VanDerWaalsContact C-N 3.3Å; V580-F582 HydrophobicContact CB-CD2 4.01Å; V580-F582 HydrophobicContact CB-CE2 3.96Å; V580-F582 HydrophobicContact CG1-CD2 3.79Å; V580-F582 HydrophobicContact CG1-CE2 3.83Å; V580-F582 PolarHBondContact O-N 3.45Å; F582-L584 PolarHBondContact O-N 3.18Å; F582-L584 VanDerWaalsContact O-N 3.16Å; F582-L585 HydrophobicContact CB-CD1 4.29Å; F582-L585 HydrophobicContact CD1-CD1 3.74Å; F582-L585 HydrophobicContact CE1-CD1 4.2Å; F582-L585 HydrophobicContact CG-CD1 3.95Å; F582-L585 WeakPolarHBondContact O-CB 3.45Å; F582-L585 PolarHBondContact O-N 2.83Å; F582-L590 HydrophobicContact CD1-CD2 4.45Å; F582-L593 HydrophobicContact CE1-CD2 3.87Å; F582-Y609 HydrophobicContact CD2-CD2 4.25Å; F582-Y609 HydrophobicContact CD2-CG 4.47Å; F582-Y609 AromaticContact CE2-CD2 3.98Å; F582-Y609 HydrophobicContact CE2-CD2 3.98Å; F582-Y609 HydrophobicContact CZ-CD2 4.23Å; F582-A613 HydrophobicContact CB-CB 4.14Å; F582-A613 VanDerWaalsContact O-CB 3.31Å; F582-A613 WeakPolarHBondContact O-CB 3.36Å
583	A	89.1	Confident	91.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-68.2	-5.8	177.2	0	0	0	0	0	114.9	R581 Y616 H617 T632	R581-A583 PolarHBondContact O-N 3.19Å; A583-Y616 HydrophobicContact CB-CD1 3.77Å; A583-Y616 HydrophobicContact CB-CD2 4.45Å; A583-Y616 HydrophobicContact CB-CE1 4.34Å; A583-Y616 HydrophobicContact CB-CG 3.82Å; A583-Y616 WeakPolarHBondContact O-CD1 3.26Å; A583-Y616 WeakPolarHBondContact O-CE1 3.38Å; A583-H617 PolarHBondContact O-NE2 2.94Å; A583-T632 HydrophobicContact CB-CG2 3.8Å
584	L	87.4	Confident	91.2	Very high	30 Å²	30	41 Å²	41	16%	0.157	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-115.1	2.5	177.9	-57.2	178	0	0	0	113	E551 R581 F582 Y616 P634 R764	E551-L584 HydrophobicContact CG-CB 4.05Å; R581-L584 HydrophobicContact CB-CD1 4.1Å; R581-L584 HydrophobicContact CB-CG 4.44Å; R581-L584 WeakPolarHBondContact O-CB 3.49Å; R581-L584 PolarHBondContact O-N 3.03Å; F582-L584 PolarHBondContact O-N 3.18Å; F582-L584 VanDerWaalsContact O-N 3.16Å; L584-Y616 HydrophobicContact CD2-CE1 4.13Å; L584-P634 HydrophobicContact CD1-CB 4.31Å; L584-P634 HydrophobicContact CD1-CG 4.28Å; L584-R764 VanDerWaalsContact CD2-NH2 3.33Å
585	L	89.5	Confident	91.1	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	21%	0.212	C	C	.	.	S	Bend	trans	-64.2	152.4	173.3	-72.9	170.8	0	0	0	111.7	E551 D552 F555 F582 Y589 L590 H617	E551-L585 VanDerWaalsContact C-CD2 3.46Å; E551-L585 HydrophobicContact CB-CD2 3.83Å; E551-L585 HydrophobicContact CB-CG 4.35Å; D552-L585 VanDerWaalsContact CA-CD2 3.49Å; D552-L585 HydrophobicContact CB-CD2 3.91Å; D552-L585 VanDerWaalsContact N-CD2 3.34Å; F555-L585 HydrophobicContact CB-CD2 4.5Å; F582-L585 HydrophobicContact CB-CD1 4.29Å; F582-L585 HydrophobicContact CD1-CD1 3.74Å; F582-L585 HydrophobicContact CE1-CD1 4.2Å; F582-L585 HydrophobicContact CG-CD1 3.95Å; F582-L585 WeakPolarHBondContact O-CB 3.45Å; F582-L585 PolarHBondContact O-N 2.83Å; L585-Y589 HydrophobicContact CD1-CD1 4.48Å; L585-Y589 HydrophobicContact CD2-CD1 4.49Å; L585-L590 HydrophobicContact CB-CD1 4.26Å; L585-L590 HydrophobicContact CB-CD2 3.96Å; L585-L590 HydrophobicContact CB-CG 3.82Å; L585-L590 HydrophobicContact CD1-CD2 3.8Å; L585-L590 HydrophobicContact CG-CD2 4.5Å; L585-H617 PolarHBondContact O-CE1 3.5Å; L585-H617 VanDerWaalsContact O-CE1 3.28Å; L585-H617 PolarHBondContact O-NE2 2.87Å
586	P	84.9	Confident	91.1	Very high	47 Å²	47	40.7 Å²	40.7	31%	0.305	20%	0.204	S	C	.	.			trans	-56.6	141.1	171.5	-24.2	34.4	0	0	0	111.9	D552 D588 Y589 L590	D552-P586 HydrophobicContact CB-CG 4.43Å; P586-D588 VanDerWaalsContact C-N 3.31Å; P586-D588 VanDerWaalsContact CB-OD1 3.24Å; P586-D588 WeakPolarHBondContact CB-OD1 3.45Å; P586-D588 PolarHBondContact O-N 3.31Å; P586-Y589 WeakPolarHBondContact O-CA 3.49Å; P586-Y589 WeakPolarHBondContact O-CB 3.48Å; P586-Y589 PolarHBondContact O-N 3.18Å; P586-L590 PolarHBondContact O-N 3.23Å
587	R	85.5	Confident	90.8	Very high	139 Å²	139	46.6 Å²	46.6	53%	0.525	24%	0.236	S	C	.	.	H	α-helix	trans	-66.6	-34.7	-172.1	-160.8	-176.2	-161.4	179.2	6.8	112.4	V591	R587-V591 VanDerWaalsContact O-CG2 3.3Å; R587-V591 WeakPolarHBondContact O-CG2 3.31Å; R587-V591 PolarHBondContact O-N 3.33Å
588	D	87	Confident	90.6	Very high	88 Å²	88	51.9 Å²	51.9	47%	0.471	26%	0.264	S	S	.	.	H	α-helix	trans	-68.7	-33.5	172.5	65.9	-69.6	0	0	0	112	P586 V591 R592	P586-D588 VanDerWaalsContact C-N 3.31Å; P586-D588 VanDerWaalsContact CB-OD1 3.24Å; P586-D588 WeakPolarHBondContact CB-OD1 3.45Å; P586-D588 PolarHBondContact O-N 3.31Å; D588-V591 PolarHBondContact O-N 2.88Å; D588-R592 WeakPolarHBondContact O-CB 3.31Å; D588-R592 VanDerWaalsContact O-CG 3.3Å; D588-R592 WeakPolarHBondContact O-CG 3.42Å; D588-R592 PolarHBondContact O-N 3.21Å; D588-R592 PolarHBondContact O-NE 3.27Å; D588-R592 IonicContact OD2-CZ 2.99Å; D588-R592 IonicContact OD2-NE 3.5Å; D588-R592 IonicContact OD2-NH2 2.6Å; D588-R592 PolarHBondContact OD2-NH2 3.49Å
589	Y	89.6	Confident	90.5	Very high	20 Å²	20	51.3 Å²	51.3	8%	0.078	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-47.7	174.7	-167.6	-72.3	0	0	0	110	D552 F555 E556 L585 P586 V591 R592 L593	D552-Y589 HydrophobicContact CB-CD2 3.96Å; D552-Y589 HydrophobicContact CB-CE2 4.15Å; D552-Y589 HydrophobicContact CB-CG 4.38Å; F555-Y589 AromaticContact CD1-CE1 3.64Å; F555-Y589 HydrophobicContact CD1-CE1 3.64Å; F555-Y589 AromaticContact CD1-CZ 3.85Å; F555-Y589 WeakPolarHBondContact CD1-OH 3.23Å; F555-Y589 AromaticContact CE1-CE1 3.91Å; F555-Y589 HydrophobicContact CE1-CE1 3.91Å; E556-Y589 WeakPolarHBondContact OE1-CE2 3.33Å; E556-Y589 PolarHBondContact OE1-OH 2.95Å; L585-Y589 HydrophobicContact CD1-CD1 4.48Å; L585-Y589 HydrophobicContact CD2-CD1 4.49Å; P586-Y589 WeakPolarHBondContact O-CA 3.49Å; P586-Y589 WeakPolarHBondContact O-CB 3.48Å; P586-Y589 PolarHBondContact O-N 3.18Å; Y589-V591 VanDerWaalsContact C-N 3.32Å; Y589-V591 PolarHBondContact O-N 3.22Å; Y589-R592 PolarHBondContact O-N 3.45Å; Y589-L593 HydrophobicContact CE1-CD2 4.44Å; Y589-L593 WeakPolarHBondContact O-CB 3.3Å; Y589-L593 PolarHBondContact O-N 3.39Å
590	L	92.3	Very high	90.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.1	-42.6	173.9	-72	170.1	0	0	0	112.3	F582 L585 P586 L593 S594 L610 A613 L614	F582-L590 HydrophobicContact CD1-CD2 4.45Å; L585-L590 HydrophobicContact CB-CD1 4.26Å; L585-L590 HydrophobicContact CB-CD2 3.96Å; L585-L590 HydrophobicContact CB-CG 3.82Å; L585-L590 HydrophobicContact CD1-CD2 3.8Å; L585-L590 HydrophobicContact CG-CD2 4.5Å; P586-L590 PolarHBondContact O-N 3.23Å; L590-L593 PolarHBondContact O-N 3.43Å; L590-S594 WeakPolarHBondContact O-CB 3.06Å; L590-S594 PolarHBondContact O-N 2.96Å; L590-S594 PolarHBondContact O-OG 3.24Å; L590-L610 HydrophobicContact CD2-CD2 3.78Å; L590-A613 HydrophobicContact CD1-CB 3.96Å; L590-A613 HydrophobicContact CD2-CB 3.78Å; L590-L614 HydrophobicContact CB-CD2 4.45Å
591	V	91	Very high	90.1	Very high	60 Å²	60	54.2 Å²	54.2	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-47.6	176	168.7	0	0	0	0	111.2	R587 D588 Y589 L593 S594 Q595	R587-V591 VanDerWaalsContact O-CG2 3.3Å; R587-V591 WeakPolarHBondContact O-CG2 3.31Å; R587-V591 PolarHBondContact O-N 3.33Å; D588-V591 PolarHBondContact O-N 2.88Å; Y589-V591 VanDerWaalsContact C-N 3.32Å; Y589-V591 PolarHBondContact O-N 3.22Å; V591-L593 VanDerWaalsContact C-N 3.32Å; V591-L593 PolarHBondContact O-N 2.91Å; V591-S594 PolarHBondContact O-N 2.84Å; V591-S594 PolarHBondContact O-OG 2.87Å; V591-Q595 WeakPolarHBondContact O-CG 3.47Å; V591-Q595 PolarHBondContact O-N 2.67Å; V591-Q595 VanDerWaalsContact O-N 3.14Å
592	R	92.2	Very high	90.1	Very high	119 Å²	119	57.7 Å²	57.7	45%	0.449	30%	0.3	S	S	.	.	H	α-helix	trans	-58.2	-43.1	176.1	-76.6	-178.3	-74.9	151.1	-8.9	112	D588 Y589 Q595 S596	D588-R592 WeakPolarHBondContact O-CB 3.31Å; D588-R592 VanDerWaalsContact O-CG 3.3Å; D588-R592 WeakPolarHBondContact O-CG 3.42Å; D588-R592 PolarHBondContact O-N 3.21Å; D588-R592 PolarHBondContact O-NE 3.27Å; D588-R592 IonicContact OD2-CZ 2.99Å; D588-R592 IonicContact OD2-NE 3.5Å; D588-R592 IonicContact OD2-NH2 2.6Å; D588-R592 PolarHBondContact OD2-NH2 3.49Å; Y589-R592 PolarHBondContact O-N 3.45Å; R592-Q595 PolarHBondContact O-N 3.43Å; R592-S596 PolarHBondContact O-N 3.16Å
593	L	91.9	Very high	90.1	Very high	14 Å²	14	58 Å²	58	7%	0.073	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-39	177.5	-167.5	64.1	0	0	0	112	F555 F582 Y589 L590 V591 Q595 S596 F599 L610	F555-L593 HydrophobicContact CE1-CD1 4.04Å; F555-L593 HydrophobicContact CE1-CD2 3.67Å; F555-L593 HydrophobicContact CZ-CD1 4.39Å; F555-L593 HydrophobicContact CZ-CD2 3.92Å; F582-L593 HydrophobicContact CE1-CD2 3.87Å; Y589-L593 HydrophobicContact CE1-CD2 4.44Å; Y589-L593 WeakPolarHBondContact O-CB 3.3Å; Y589-L593 PolarHBondContact O-N 3.39Å; L590-L593 PolarHBondContact O-N 3.43Å; V591-L593 VanDerWaalsContact C-N 3.32Å; V591-L593 PolarHBondContact O-N 2.91Å; L593-Q595 PolarHBondContact O-N 3.37Å; L593-S596 PolarHBondContact O-N 2.84Å; L593-F599 HydrophobicContact CD1-CD1 3.65Å; L593-F599 HydrophobicContact CD1-CE1 3.8Å; L593-F599 HydrophobicContact CD1-CG 4.14Å; L593-F599 HydrophobicContact CD1-CZ 4.38Å; L593-F599 HydrophobicContact CG-CD1 4.46Å; L593-L610 HydrophobicContact CB-CD2 4.4Å; L593-L610 HydrophobicContact CD2-CD2 4.15Å; L593-L610 HydrophobicContact CG-CD2 4.47Å
594	S	90.4	Very high	90.3	Very high	47 Å²	47	61.7 Å²	61.7	33%	0.329	33%	0.326	S	S	.	.	H	α-helix	trans	-66.6	-21	175.9	77.2	0	0	0	0	114.5	L590 V591 L600	L590-S594 WeakPolarHBondContact O-CB 3.06Å; L590-S594 PolarHBondContact O-N 2.96Å; L590-S594 PolarHBondContact O-OG 3.24Å; V591-S594 PolarHBondContact O-N 2.84Å; V591-S594 PolarHBondContact O-OG 2.87Å; S594-L600 WeakPolarHBondContact O-CD1 3.16Å
595	Q	92.5	Very high	90.5	Very high	139 Å²	139	61.7 Å²	61.7	65%	0.65	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-4.6	178	-70	172.3	-11.7	0	0	112.9	V591 R592 L593 D597	V591-Q595 WeakPolarHBondContact O-CG 3.47Å; V591-Q595 PolarHBondContact O-N 2.67Å; V591-Q595 VanDerWaalsContact O-N 3.14Å; R592-Q595 PolarHBondContact O-N 3.43Å; L593-Q595 PolarHBondContact O-N 3.37Å; Q595-D597 PolarHBondContact O-N 2.58Å
596	S	93	Very high	90.7	Very high	46 Å²	46	61.6 Å²	61.6	32%	0.322	32%	0.324	S	S	.	.			trans	-90	78.6	-176.1	-169.1	0	0	0	0	111.5	R592 L593 N598 F599 L600	R592-S596 PolarHBondContact O-N 3.16Å; L593-S596 PolarHBondContact O-N 2.84Å; S596-N598 PolarHBondContact O-N 3.29Å; S596-F599 PolarHBondContact O-N 3Å; S596-F599 WeakPolarHBondContact OG-CB 3.2Å; S596-L600 WeakPolarHBondContact O-CG 3.35Å; S596-L600 PolarHBondContact O-N 3.24Å
597	D	89	Confident	91.1	Very high	126 Å²	126	64.2 Å²	64.2	67%	0.674	33%	0.33	S	S	*	.	H	α-helix	trans	-51.4	-40.5	-179.7	-78.6	-38.9	0	0	0	112.9	Q595 L600 T601	Q595-D597 PolarHBondContact O-N 2.58Å; D597-L600 PolarHBondContact O-N 2.84Å; D597-T601 VanDerWaalsContact O-CB 3.27Å; D597-T601 WeakPolarHBondContact O-CB 3.44Å; D597-T601 PolarHBondContact O-N 3.12Å; D597-T601 PolarHBondContact O-OG1 3.03Å
598	N	90.4	Very high	91.5	Very high	111 Å²	111	62.8 Å²	62.8	59%	0.594	33%	0.333	S	S	*	.	H	α-helix	trans	-61.8	-48.6	177.2	-170.4	18.3	0	0	0	111.3	S596 L600 T601 V602	S596-N598 PolarHBondContact O-N 3.29Å; N598-L600 PolarHBondContact O-N 3.35Å; N598-T601 PolarHBondContact O-N 3.36Å; N598-V602 WeakPolarHBondContact O-CG2 3.29Å; N598-V602 PolarHBondContact O-N 3.23Å; N598-V602 VanDerWaalsContact O-N 3.14Å
599	F	90.4	Very high	91.8	Very high	25 Å²	25	60.2 Å²	60.2	11%	0.11	32%	0.317	C	S	.	.	H	α-helix	trans	-63.5	-42.5	178.3	-176.6	-89.1	0	0	0	112.2	F555 L559 L593 S596 T601 V602 N603 C606	F555-F599 HydrophobicContact CZ-CE1 4.37Å; F555-F599 AromaticContact CZ-CZ 3.89Å; F555-F599 HydrophobicContact CZ-CZ 3.89Å; L559-F599 HydrophobicContact CD1-CE2 4.39Å; L559-F599 HydrophobicContact CD2-CE2 3.69Å; L559-F599 HydrophobicContact CD2-CZ 4Å; L593-F599 HydrophobicContact CD1-CD1 3.65Å; L593-F599 HydrophobicContact CD1-CE1 3.8Å; L593-F599 HydrophobicContact CD1-CG 4.14Å; L593-F599 HydrophobicContact CD1-CZ 4.38Å; L593-F599 HydrophobicContact CG-CD1 4.46Å; S596-F599 PolarHBondContact O-N 3Å; S596-F599 WeakPolarHBondContact OG-CB 3.2Å; F599-T601 VanDerWaalsContact C-N 3.31Å; F599-T601 PolarHBondContact O-N 3.14Å; F599-V602 PolarHBondContact O-N 2.85Å; F599-N603 HydrophobicContact CD1-CB 4.45Å; F599-N603 HydrophobicContact CE1-CB 3.99Å; F599-N603 WeakPolarHBondContact CE2-ND2 3.43Å; F599-N603 HydrophobicContact CZ-CB 4.23Å; F599-N603 WeakPolarHBondContact CZ-ND2 3.48Å; F599-N603 WeakPolarHBondContact O-CB 3.45Å; F599-N603 PolarHBondContact O-N 3.48Å; F599-N603 PolarHBondContact O-ND2 3.3Å; F599-C606 HydrophobicContact CE1-CB 4.11Å
600	L	90.9	Very high	92	Very high	14 Å²	14	59.6 Å²	59.6	7%	0.073	32%	0.315	C	S	.	.	H	α-helix	trans	-75.4	-16.7	-179.5	-65.1	178.7	0	0	0	114	S594 S596 D597 N598 C606 K607 L610	S594-L600 WeakPolarHBondContact O-CD1 3.16Å; S596-L600 WeakPolarHBondContact O-CG 3.35Å; S596-L600 PolarHBondContact O-N 3.24Å; D597-L600 PolarHBondContact O-N 2.84Å; N598-L600 PolarHBondContact O-N 3.35Å; L600-C606 HydrophobicContact CD2-CB 4.18Å; L600-K607 HydrophobicContact CD2-CG 4.27Å; L600-L610 HydrophobicContact CD1-CD1 4.49Å; L600-L610 HydrophobicContact CD2-CD1 3.78Å
601	T	91.2	Very high	91.9	Very high	105 Å²	105	64.6 Å²	64.6	64%	0.644	34%	0.341	S	S	*	.	H	α-helix	trans	-79.7	-40.4	170.4	-59.7	0	0	0	0	110.8	D597 N598 F599	D597-T601 VanDerWaalsContact O-CB 3.27Å; D597-T601 WeakPolarHBondContact O-CB 3.44Å; D597-T601 PolarHBondContact O-N 3.12Å; D597-T601 PolarHBondContact O-OG1 3.03Å; N598-T601 PolarHBondContact O-N 3.36Å; F599-T601 VanDerWaalsContact C-N 3.31Å; F599-T601 PolarHBondContact O-N 3.14Å
602	V	91.1	Very high	91.9	Very high	79 Å²	79	64.5 Å²	64.5	48%	0.479	34%	0.336	S	S	.	.	H	α-helix	trans	-72.2	-31.5	173.6	177.6	0	0	0	0	112	Q570 N598 F599 P604	Q570-V602 HydrophobicContact CG-CG1 4.41Å; N598-V602 WeakPolarHBondContact O-CG2 3.29Å; N598-V602 PolarHBondContact O-N 3.23Å; N598-V602 VanDerWaalsContact O-N 3.14Å; F599-V602 PolarHBondContact O-N 2.85Å; V602-P604 WeakPolarHBondContact O-CD 3.1Å
603	N	92.9	Very high	91.9	Very high	6 Å²	6	58.9 Å²	58.9	3%	0.032	32%	0.315	C	S	.	.			trans	-125.2	70.9	-175.8	-58.7	-69.1	0	0	0	113	Q570 F599 W605 C606	Q570-N603 PolarHBondContact NE2-OD1 3.28Å; F599-N603 HydrophobicContact CD1-CB 4.45Å; F599-N603 HydrophobicContact CE1-CB 3.99Å; F599-N603 WeakPolarHBondContact CE2-ND2 3.43Å; F599-N603 HydrophobicContact CZ-CB 4.23Å; F599-N603 WeakPolarHBondContact CZ-ND2 3.48Å; F599-N603 WeakPolarHBondContact O-CB 3.45Å; F599-N603 PolarHBondContact O-N 3.48Å; F599-N603 PolarHBondContact O-ND2 3.3Å; N603-W605 HydrophobicContact CB-CD2 4.4Å; N603-W605 HydrophobicContact CB-CH2 4.25Å; N603-W605 HydrophobicContact CB-CZ2 3.64Å; N603-W605 PolarHBondContact O-N 2.91Å; N603-W605 WeakPolarHBondContact OD1-CZ2 3.42Å; N603-C606 HydrophobicContact CB-CB 4.28Å; N603-C606 WeakPolarHBondContact O-CB 3.26Å; N603-C606 PolarHBondContact O-N 3.48Å
604	P	92.5	Very high	91.9	Very high	78 Å²	78	61 Å²	61	51%	0.506	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-35.9	-178.7	-26.2	35.5	0	0	0	113.9	V602 C606 K607	V602-P604 WeakPolarHBondContact O-CD 3.1Å; P604-C606 PolarHBondContact O-N 3.48Å; P604-C606 VanDerWaalsContact O-N 3.17Å; P604-K607 WeakPolarHBondContact O-CB 3.31Å; P604-K607 WeakPolarHBondContact O-CG 3.46Å; P604-K607 PolarHBondContact O-N 3.21Å; P604-K607 VanDerWaalsContact O-N 3.16Å
605	W	91.9	Very high	91.8	Very high	31 Å²	31	61.8 Å²	61.8	12%	0.117	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-21	177.8	53.8	-102.6	0	0	0	114	A573 Q574 C577 N603 K607 D608 Y609	A573-W605 HydrophobicContact CB-CZ2 3.81Å; Q574-W605 HydrophobicContact CB-CB 4.47Å; Q574-W605 HydrophobicContact CB-CD2 3.9Å; Q574-W605 HydrophobicContact CB-CG 3.83Å; Q574-W605 HydrophobicContact CG-CB 3.86Å; Q574-W605 HydrophobicContact CG-CD2 4.03Å; Q574-W605 HydrophobicContact CG-CE3 4.43Å; Q574-W605 HydrophobicContact CG-CG 3.75Å; C577-W605 HydrophobicContact CB-CE3 4.4Å; C577-W605 HydrophobicContact CB-CH2 3.71Å; C577-W605 HydrophobicContact CB-CZ3 3.47Å; C577-W605 VanDerWaalsContact CB-CZ3 3.47Å; C577-W605 VanDerWaalsContact SG-CH2 3.52Å; N603-W605 HydrophobicContact CB-CD2 4.4Å; N603-W605 HydrophobicContact CB-CH2 4.25Å; N603-W605 HydrophobicContact CB-CZ2 3.64Å; N603-W605 PolarHBondContact O-N 2.91Å; N603-W605 WeakPolarHBondContact OD1-CZ2 3.42Å; W605-K607 PolarHBondContact O-N 2.61Å; W605-D608 PolarHBondContact O-N 3.38Å; W605-Y609 AromaticContact CE3-CD2 3.83Å; W605-Y609 HydrophobicContact CE3-CD2 3.83Å; W605-Y609 AromaticContact CE3-CE2 3.63Å; W605-Y609 HydrophobicContact CE3-CE2 3.63Å; W605-Y609 AromaticContact CZ3-CD2 3.9Å; W605-Y609 HydrophobicContact CZ3-CD2 3.9Å; W605-Y609 AromaticContact CZ3-CE2 3.86Å; W605-Y609 HydrophobicContact CZ3-CE2 3.86Å
606	C	94.2	Very high	91.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-69.5	-20.9	179.2	-171.4	0	0	0	0	111.9	F599 L600 N603 P604 D608 Y609 L610	F599-C606 HydrophobicContact CE1-CB 4.11Å; L600-C606 HydrophobicContact CD2-CB 4.18Å; N603-C606 HydrophobicContact CB-CB 4.28Å; N603-C606 WeakPolarHBondContact O-CB 3.26Å; N603-C606 PolarHBondContact O-N 3.48Å; P604-C606 PolarHBondContact O-N 3.48Å; P604-C606 VanDerWaalsContact O-N 3.17Å; C606-D608 VanDerWaalsContact C-N 3.33Å; C606-D608 PolarHBondContact O-N 2.97Å; C606-Y609 PolarHBondContact O-N 3.42Å; C606-L610 WeakPolarHBondContact O-CB 3.38Å; C606-L610 WeakPolarHBondContact O-CG 3.45Å; C606-L610 PolarHBondContact O-N 3.11Å
607	K	93.2	Very high	91.3	Very high	101 Å²	101	54.8 Å²	54.8	44%	0.439	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-38.6	179	-64.6	178.5	-177.7	-179.2	0	112.1	L600 P604 W605 L610 I611	L600-K607 HydrophobicContact CD2-CG 4.27Å; P604-K607 WeakPolarHBondContact O-CB 3.31Å; P604-K607 WeakPolarHBondContact O-CG 3.46Å; P604-K607 PolarHBondContact O-N 3.21Å; P604-K607 VanDerWaalsContact O-N 3.16Å; W605-K607 PolarHBondContact O-N 2.61Å; K607-L610 PolarHBondContact O-N 2.83Å; K607-I611 WeakPolarHBondContact O-CD1 3.43Å; K607-I611 VanDerWaalsContact O-CG1 3.24Å; K607-I611 WeakPolarHBondContact O-CG1 3.43Å; K607-I611 PolarHBondContact O-N 2.82Å
608	D	93.1	Very high	91.2	Very high	109 Å²	109	54.8 Å²	54.8	58%	0.583	29%	0.293	S	S	*	.	H	α-helix	trans	-67.3	-43	178.4	-58.4	-43.7	0	0	0	111.2	W605 C606 L610 I611 E612	W605-D608 PolarHBondContact O-N 3.38Å; C606-D608 VanDerWaalsContact C-N 3.33Å; C606-D608 PolarHBondContact O-N 2.97Å; D608-L610 PolarHBondContact O-N 2.9Å; D608-I611 PolarHBondContact O-N 3.17Å; D608-E612 WeakPolarHBondContact O-CB 3.4Å; D608-E612 PolarHBondContact O-N 3.02Å
609	Y	93.6	Very high	90.9	Very high	34 Å²	34	51.8 Å²	51.8	13%	0.133	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-35.3	175.1	-60.2	-21.5	0	0	0	112.8	Q574 C577 S578 F582 W605 C606 A613	Q574-Y609 PolarHBondContact O-OH 3.25Å; C577-Y609 HydrophobicContact CB-CD2 4.4Å; C577-Y609 HydrophobicContact CB-CE2 3.93Å; S578-Y609 WeakPolarHBondContact CB-OH 3.39Å; F582-Y609 HydrophobicContact CD2-CD2 4.25Å; F582-Y609 HydrophobicContact CD2-CG 4.47Å; F582-Y609 AromaticContact CE2-CD2 3.98Å; F582-Y609 HydrophobicContact CE2-CD2 3.98Å; F582-Y609 HydrophobicContact CZ-CD2 4.23Å; W605-Y609 AromaticContact CE3-CD2 3.83Å; W605-Y609 HydrophobicContact CE3-CD2 3.83Å; W605-Y609 AromaticContact CE3-CE2 3.63Å; W605-Y609 HydrophobicContact CE3-CE2 3.63Å; W605-Y609 AromaticContact CZ3-CD2 3.9Å; W605-Y609 HydrophobicContact CZ3-CD2 3.9Å; W605-Y609 AromaticContact CZ3-CE2 3.86Å; W605-Y609 HydrophobicContact CZ3-CE2 3.86Å; C606-Y609 PolarHBondContact O-N 3.42Å; Y609-A613 VanDerWaalsContact O-CB 3.28Å; Y609-A613 WeakPolarHBondContact O-CB 3.47Å; Y609-A613 PolarHBondContact O-N 2.67Å
610	L	93.7	Very high	90.3	Very high	8 Å²	8	53.5 Å²	53.5	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-67.4	-40.9	172.3	-78.7	173.2	0	0	0	112.1	L590 L593 L600 C606 K607 D608 A613 L614	L590-L610 HydrophobicContact CD2-CD2 3.78Å; L593-L610 HydrophobicContact CB-CD2 4.4Å; L593-L610 HydrophobicContact CD2-CD2 4.15Å; L593-L610 HydrophobicContact CG-CD2 4.47Å; L600-L610 HydrophobicContact CD1-CD1 4.49Å; L600-L610 HydrophobicContact CD2-CD1 3.78Å; C606-L610 WeakPolarHBondContact O-CB 3.38Å; C606-L610 WeakPolarHBondContact O-CG 3.45Å; C606-L610 PolarHBondContact O-N 3.11Å; K607-L610 PolarHBondContact O-N 2.83Å; D608-L610 PolarHBondContact O-N 2.9Å; L610-A613 PolarHBondContact O-N 2.96Å; L610-L614 VanDerWaalsContact O-CB 3.31Å; L610-L614 WeakPolarHBondContact O-CB 3.23Å; L610-L614 VanDerWaalsContact O-CG 3.23Å; L610-L614 WeakPolarHBondContact O-CG 3.47Å; L610-L614 PolarHBondContact O-N 2.87Å
611	I	91.9	Very high	89.2	Confident	105 Å²	105	55.5 Å²	55.5	54%	0.538	30%	0.297	S	S	.	.	H	α-helix	trans	-65.2	-45	176.9	-70.1	162.4	0	0	0	110.5	K607 D608 S615	K607-I611 WeakPolarHBondContact O-CD1 3.43Å; K607-I611 VanDerWaalsContact O-CG1 3.24Å; K607-I611 WeakPolarHBondContact O-CG1 3.43Å; K607-I611 PolarHBondContact O-N 2.82Å; D608-I611 PolarHBondContact O-N 3.17Å; I611-S615 VanDerWaalsContact O-CB 3.23Å; I611-S615 WeakPolarHBondContact O-CB 3.39Å; I611-S615 PolarHBondContact O-N 3.25Å; I611-S615 PolarHBondContact O-OG 3.47Å
612	E	90.9	Very high	88.1	Confident	58 Å²	58	53 Å²	53	27%	0.271	28%	0.279	S	S	.	.	H	α-helix	trans	-55.3	-52.5	172.7	179.7	-169.1	-164.5	0	0	111.1	D608 S615 Y616 R631	D608-E612 WeakPolarHBondContact O-CB 3.4Å; D608-E612 PolarHBondContact O-N 3.02Å; E612-S615 PolarHBondContact O-N 2.98Å; E612-Y616 PolarHBondContact O-N 2.84Å; E612-R631 IonicContact OE1-NE 3.54Å; E612-R631 PolarHBondContact OE1-NE 3.4Å; E612-R631 IonicContact OE2-CZ 3.22Å; E612-R631 IonicContact OE2-NE 2.7Å; E612-R631 PolarHBondContact OE2-NE 2.71Å; E612-R631 IonicContact OE2-NH2 2.83Å; E612-R631 PolarHBondContact OE2-NH2 3.47Å
613	A	92.2	Very high	87.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-48.4	-178	0	0	0	0	0	112.9	F582 L590 Y609 L610 S615 Y616 H617	F582-A613 HydrophobicContact CB-CB 4.14Å; F582-A613 VanDerWaalsContact O-CB 3.31Å; F582-A613 WeakPolarHBondContact O-CB 3.36Å; L590-A613 HydrophobicContact CD1-CB 3.96Å; L590-A613 HydrophobicContact CD2-CB 3.78Å; Y609-A613 VanDerWaalsContact O-CB 3.28Å; Y609-A613 WeakPolarHBondContact O-CB 3.47Å; Y609-A613 PolarHBondContact O-N 2.67Å; L610-A613 PolarHBondContact O-N 2.96Å; A613-S615 VanDerWaalsContact C-N 3.29Å; A613-S615 PolarHBondContact O-N 3.05Å; A613-Y616 PolarHBondContact O-N 2.92Å; A613-H617 PolarHBondContact O-CD2 3.31Å; A613-H617 VanDerWaalsContact O-CD2 3.24Å; A613-H617 PolarHBondContact O-N 2.77Å
614	L	90.7	Very high	86.6	Confident	59 Å²	59	55 Å²	55	31%	0.309	28%	0.283	S	S	.	.	H	α-helix	trans	-62.3	-38.6	178.2	-70.1	170.9	0	0	0	111.3	L590 L610 H617 L618	L590-L614 HydrophobicContact CB-CD2 4.45Å; L610-L614 VanDerWaalsContact O-CB 3.31Å; L610-L614 WeakPolarHBondContact O-CB 3.23Å; L610-L614 VanDerWaalsContact O-CG 3.23Å; L610-L614 WeakPolarHBondContact O-CG 3.47Å; L610-L614 PolarHBondContact O-N 2.87Å; L614-H617 PolarHBondContact O-N 3.22Å; L614-L618 VanDerWaalsContact O-CG 3.3Å; L614-L618 WeakPolarHBondContact O-CG 3.37Å; L614-L618 PolarHBondContact O-N 2.85Å; L614-L618 VanDerWaalsContact O-N 3.13Å
615	S	89.7	Confident	85.3	Confident	64 Å²	64	53 Å²	53	45%	0.448	27%	0.267	S	S	.	.	H	α-helix	trans	-61.4	-49.4	173.5	-58.9	0	0	0	0	111.3	I611 E612 A613 H617 L618 L619	I611-S615 VanDerWaalsContact O-CB 3.23Å; I611-S615 WeakPolarHBondContact O-CB 3.39Å; I611-S615 PolarHBondContact O-N 3.25Å; I611-S615 PolarHBondContact O-OG 3.47Å; E612-S615 PolarHBondContact O-N 2.98Å; A613-S615 VanDerWaalsContact C-N 3.29Å; A613-S615 PolarHBondContact O-N 3.05Å; S615-H617 PolarHBondContact O-N 3.48Å; S615-L618 PolarHBondContact O-N 2.98Å; S615-L619 PolarHBondContact O-N 3.16Å
616	Y	88.6	Confident	84.2	Confident	12 Å²	12	57.4 Å²	57.4	5%	0.047	28%	0.284	C	S	.	.	H	α-helix	trans	-58.4	-46.5	175.3	176.1	-92.7	0	0	0	111.5	A583 L584 E612 A613 L618 L619 K624 M627 T632	A583-Y616 HydrophobicContact CB-CD1 3.77Å; A583-Y616 HydrophobicContact CB-CD2 4.45Å; A583-Y616 HydrophobicContact CB-CE1 4.34Å; A583-Y616 HydrophobicContact CB-CG 3.82Å; A583-Y616 WeakPolarHBondContact O-CD1 3.26Å; A583-Y616 WeakPolarHBondContact O-CE1 3.38Å; L584-Y616 HydrophobicContact CD2-CE1 4.13Å; E612-Y616 PolarHBondContact O-N 2.84Å; A613-Y616 PolarHBondContact O-N 2.92Å; Y616-L618 PolarHBondContact O-N 2.97Å; Y616-L619 WeakPolarHBondContact O-CB 3.47Å; Y616-L619 PolarHBondContact O-N 2.85Å; Y616-K624 HydrophobicContact CD2-CG 4.26Å; Y616-K624 HydrophobicContact CE1-CD 4.11Å; Y616-K624 HydrophobicContact CE1-CG 4.15Å; Y616-K624 HydrophobicContact CE2-CB 3.92Å; Y616-K624 HydrophobicContact CE2-CG 3.81Å; Y616-K624 WeakPolarHBondContact O-CE 3.39Å; Y616-M627 HydrophobicContact CD2-CB 4.32Å; Y616-M627 HydrophobicContact CD2-SD 3.87Å; Y616-M627 HydrophobicContact CE2-CB 4.18Å; Y616-T632 HydrophobicContact CD2-CG2 3.61Å; Y616-T632 HydrophobicContact CE2-CG2 3.76Å; Y616-T632 HydrophobicContact CG-CG2 4.27Å
617	H	85.4	Confident	83	Confident	26 Å²	26	61.3 Å²	61.3	12%	0.12	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-31.3	179.3	-89.1	-99.2	0	0	0	113.4	A583 L585 A613 L614 S615 L619 K624	A583-H617 PolarHBondContact O-NE2 2.94Å; L585-H617 PolarHBondContact O-CE1 3.5Å; L585-H617 VanDerWaalsContact O-CE1 3.28Å; L585-H617 PolarHBondContact O-NE2 2.87Å; A613-H617 PolarHBondContact O-CD2 3.31Å; A613-H617 VanDerWaalsContact O-CD2 3.24Å; A613-H617 PolarHBondContact O-N 2.77Å; L614-H617 PolarHBondContact O-N 3.22Å; S615-H617 PolarHBondContact O-N 3.48Å; H617-L619 VanDerWaalsContact C-N 3.33Å; H617-K624 PolarHBondContact O-NZ 3.19Å
618	L	87.8	Confident	81.6	Confident	126 Å²	126	60.4 Å²	60.4	66%	0.66	31%	0.314	S	S	*	.	H	α-helix	trans	-73.4	-17.4	176.2	-71.1	166.4	0	0	0	114.1	L614 S615 Y616	L614-L618 VanDerWaalsContact O-CG 3.3Å; L614-L618 WeakPolarHBondContact O-CG 3.37Å; L614-L618 PolarHBondContact O-N 2.85Å; L614-L618 VanDerWaalsContact O-N 3.13Å; S615-L618 PolarHBondContact O-N 2.98Å; Y616-L618 PolarHBondContact O-N 2.97Å
619	L	83.2	Confident	80.9	Confident	47 Å²	47	57.3 Å²	57.3	25%	0.246	30%	0.302	C	S	.	.	S	Bend	trans	-70	147.9	-177.3	-64.9	177.4	0	0	0	113.5	S615 Y616 H617 Q623 K624 M627	S615-L619 PolarHBondContact O-N 3.16Å; Y616-L619 WeakPolarHBondContact O-CB 3.47Å; Y616-L619 PolarHBondContact O-N 2.85Å; H617-L619 VanDerWaalsContact C-N 3.33Å; L619-Q623 HydrophobicContact CB-CB 4.33Å; L619-K624 HydrophobicContact CB-CG 4.04Å; L619-K624 WeakPolarHBondContact O-CE 3.36Å; L619-K624 PolarHBondContact O-NZ 3.5Å; L619-M627 HydrophobicContact CD1-CG 4.17Å; L619-M627 HydrophobicContact CD1-SD 3.3Å; L619-M627 WeakPolarHBondContact CD1-SD 3.3Å
620	P	77	Confident	80	Confident	62 Å²	62	61.7 Å²	61.7	40%	0.403	32%	0.323	S	S	.	.			trans	-52.6	148.5	161.7	-26.7	36.8	0	0	0	112.6	D622 Q623 K624	P620-D622 VanDerWaalsContact C-N 3.3Å; P620-D622 WeakPolarHBondContact CB-OD1 3.04Å; P620-D622 PolarHBondContact O-N 2.98Å; P620-Q623 HydrophobicContact CB-CG 4.24Å; P620-Q623 HydrophobicContact CG-CG 4.43Å; P620-Q623 PolarHBondContact O-N 3.38Å; P620-K624 PolarHBondContact O-N 3.14Å
621	W	68.9	Low	79.7	Confident	56 Å²	56	63 Å²	63	21%	0.212	33%	0.328	C	S	.	.	H	α-helix	trans	-63.5	-34.5	-174.1	81.2	-82.5	0	0	0	112.7	Q623 K624 L625 V759 H768 S769	W621-Q623 VanDerWaalsContact C-N 3.28Å; W621-Q623 PolarHBondContact O-N 2.91Å; W621-K624 WeakPolarHBondContact O-CB 3.49Å; W621-K624 PolarHBondContact O-N 3.12Å; W621-L625 HydrophobicContact CE3-CD1 3.54Å; W621-L625 HydrophobicContact CZ3-CD1 3.65Å; W621-L625 HydrophobicContact CZ3-CD2 4.15Å; W621-L625 WeakPolarHBondContact O-CD1 3.48Å; W621-L625 PolarHBondContact O-N 3.2Å; W621-V759 HydrophobicContact CH2-CG2 3.99Å; W621-V759 HydrophobicContact CZ3-CB 4.45Å; W621-V759 HydrophobicContact CZ3-CG1 4.21Å; W621-V759 HydrophobicContact CZ3-CG2 4.25Å; W621-H768 HydrophobicContact CD2-CB 4.18Å; W621-H768 HydrophobicContact CG-CB 4.02Å; W621-S769 PolarHBondContact NE1-O 2.91Å
622	D	68.2	Low	79.2	Confident	53 Å²	53	58.1 Å²	58.1	28%	0.283	30%	0.303	S	S	.	.	H	α-helix	trans	-66.8	-28.8	175.5	65.9	-68.9	0	0	0	112.5	P620 R626	P620-D622 VanDerWaalsContact C-N 3.3Å; P620-D622 WeakPolarHBondContact CB-OD1 3.04Å; P620-D622 PolarHBondContact O-N 2.98Å; D622-R626 IonicContact OD2-NH1 2.77Å; D622-R626 PolarHBondContact OD2-NH1 3.18Å
623	Q	76.4	Confident	78.6	Confident	84 Å²	84	58.9 Å²	58.9	39%	0.393	31%	0.305	S	S	.	.	H	α-helix	trans	-79.8	-30.9	173.7	-61.2	-175.8	13.2	0	0	111.4	L619 P620 W621 R626 M627	L619-Q623 HydrophobicContact CB-CB 4.33Å; P620-Q623 HydrophobicContact CB-CG 4.24Å; P620-Q623 HydrophobicContact CG-CG 4.43Å; P620-Q623 PolarHBondContact O-N 3.38Å; W621-Q623 VanDerWaalsContact C-N 3.28Å; W621-Q623 PolarHBondContact O-N 2.91Å; Q623-R626 PolarHBondContact O-N 3.42Å; Q623-R626 VanDerWaalsContact O-N 3.14Å; Q623-M627 PolarHBondContact O-N 3.21Å; Q623-M627 VanDerWaalsContact O-N 3.12Å
624	K	74.8	Confident	77.8	Confident	43 Å²	43	61.1 Å²	61.1	19%	0.187	32%	0.32	C	S	.	.	H	α-helix	trans	-62.4	-40.7	173.3	-71.9	173.5	172	138.3	0	112.5	Y616 H617 L619 P620 W621 R626 M627	Y616-K624 HydrophobicContact CD2-CG 4.26Å; Y616-K624 HydrophobicContact CE1-CD 4.11Å; Y616-K624 HydrophobicContact CE1-CG 4.15Å; Y616-K624 HydrophobicContact CE2-CB 3.92Å; Y616-K624 HydrophobicContact CE2-CG 3.81Å; Y616-K624 WeakPolarHBondContact O-CE 3.39Å; H617-K624 PolarHBondContact O-NZ 3.19Å; L619-K624 HydrophobicContact CB-CG 4.04Å; L619-K624 WeakPolarHBondContact O-CE 3.36Å; L619-K624 PolarHBondContact O-NZ 3.5Å; P620-K624 PolarHBondContact O-N 3.14Å; W621-K624 WeakPolarHBondContact O-CB 3.49Å; W621-K624 PolarHBondContact O-N 3.12Å; K624-R626 PolarHBondContact O-N 2.99Å; K624-M627 PolarHBondContact O-N 3.2Å
625	L	66.7	Low	77.4	Confident	35 Å²	35	59.4 Å²	59.4	18%	0.183	31%	0.309	C	S	.	.	H	α-helix	trans	-62.1	-31.6	173.3	-87.4	78.6	0	0	0	112.7	W621 L741 I809 W810	W621-L625 HydrophobicContact CE3-CD1 3.54Å; W621-L625 HydrophobicContact CZ3-CD1 3.65Å; W621-L625 HydrophobicContact CZ3-CD2 4.15Å; W621-L625 WeakPolarHBondContact O-CD1 3.48Å; W621-L625 PolarHBondContact O-N 3.2Å; L625-L741 HydrophobicContact CD1-CD1 3.99Å; L625-L741 HydrophobicContact CD2-CD1 4.2Å; L625-L741 HydrophobicContact CG-CD1 4.37Å; L625-I809 HydrophobicContact CD2-CB 4.26Å; L625-W810 WeakPolarHBondContact O-CZ3 3.12Å
626	R	67.9	Low	76.8	Confident	124 Å²	124	60.4 Å²	60.4	47%	0.468	31%	0.313	S	S	.	.	H	α-helix	trans	-80.5	-20.1	179.5	-68.6	177.4	-172.4	134.7	-2.6	113.7	D622 Q623 K624 A628 W810 S811	D622-R626 IonicContact OD2-NH1 2.77Å; D622-R626 PolarHBondContact OD2-NH1 3.18Å; Q623-R626 PolarHBondContact O-N 3.42Å; Q623-R626 VanDerWaalsContact O-N 3.14Å; K624-R626 PolarHBondContact O-N 2.99Å; R626-A628 PolarHBondContact O-N 3.31Å; R626-W810 VanDerWaalsContact CG-O 3.26Å; R626-W810 WeakPolarHBondContact CG-O 3.23Å; R626-W810 PolarHBondContact NE-O 2.66Å; R626-S811 PolarHBondContact NH2-O 3.22Å
627	M	69.9	Low	76	Confident	81 Å²	81	60.8 Å²	60.8	40%	0.399	32%	0.317	S	S	.	.			trans	-77.1	77.3	171.1	-75.6	-161.8	72.6	0	0	110.4	Y616 L619 Q623 K624 S629 T632	Y616-M627 HydrophobicContact CD2-CB 4.32Å; Y616-M627 HydrophobicContact CD2-SD 3.87Å; Y616-M627 HydrophobicContact CE2-CB 4.18Å; L619-M627 HydrophobicContact CD1-CG 4.17Å; L619-M627 HydrophobicContact CD1-SD 3.3Å; L619-M627 WeakPolarHBondContact CD1-SD 3.3Å; Q623-M627 PolarHBondContact O-N 3.21Å; Q623-M627 VanDerWaalsContact O-N 3.12Å; K624-M627 PolarHBondContact O-N 3.2Å; M627-S629 PolarHBondContact O-N 3.48Å; M627-T632 HydrophobicContact CB-CG2 4.49Å; M627-T632 HydrophobicContact CE-CG2 4.36Å; M627-T632 WeakPolarHBondContact O-CB 3.39Å; M627-T632 PolarHBondContact O-OG1 3.24Å
628	A	64	Low	75.3	Confident	82 Å²	82	63.9 Å²	63.9	68%	0.678	34%	0.337	S	S	*	.			trans	-83.9	98.3	170.9	0	0	0	0	0	110.5	R626	R626-A628 PolarHBondContact O-N 3.31Å
629	S	77.6	Confident	74.2	Confident	45 Å²	45	60.3 Å²	60.3	32%	0.315	33%	0.331	S	S	.	.	S	Bend	trans	-139.7	158.9	165.9	89.5	0	0	0	0	109.3	M627 R631 T632 K633	M627-S629 PolarHBondContact O-N 3.48Å; S629-R631 PolarHBondContact O-N 2.89Å; S629-R631 PolarHBondContact OG-N 3.13Å; S629-T632 PolarHBondContact N-OG1 2.92Å; S629-T632 VanDerWaalsContact N-OG1 3.1Å; S629-T632 PolarHBondContact O-N 3.26Å; S629-T632 VanDerWaalsContact O-N 3.07Å; S629-T632 PolarHBondContact O-OG1 3.01Å; S629-T632 PolarHBondContact OG-N 2.87Å; S629-T632 PolarHBondContact OG-OG1 3.13Å; S629-T632 VanDerWaalsContact OG-OG1 3.07Å; S629-K633 WeakPolarHBondContact O-CB 3.42Å; S629-K633 PolarHBondContact O-N 3.2Å
630	E	75	Confident	73.6	Confident	126 Å²	126	58.7 Å²	58.7	59%	0.589	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.7	177.8	-59.9	-52.7	124.9	0	0	113.3	R581 K633	R581-E630 WeakPolarHBondContact CD-O 3.49Å; E630-K633 IonicContact OE2-NZ 3.76Å
631	R	86.1	Confident	73.4	Confident	35 Å²	35	57.8 Å²	57.8	13%	0.132	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-11.8	179	-67.5	174.7	57.9	78	1.6	114.2	C577 S578 V580 R581 E612 S629	C577-R631 PolarHBondContact O-NH1 3.5Å; S578-R631 PolarHBondContact O-NH1 3.14Å; V580-R631 PolarHBondContact O-NH1 3.4Å; V580-R631 VanDerWaalsContact O-NH1 3.13Å; R581-R631 WeakPolarHBondContact CB-O 3.22Å; E612-R631 IonicContact OE1-NE 3.54Å; E612-R631 PolarHBondContact OE1-NE 3.4Å; E612-R631 IonicContact OE2-CZ 3.22Å; E612-R631 IonicContact OE2-NE 2.7Å; E612-R631 PolarHBondContact OE2-NE 2.71Å; E612-R631 IonicContact OE2-NH2 2.83Å; E612-R631 PolarHBondContact OE2-NH2 3.47Å; S629-R631 PolarHBondContact O-N 2.89Å; S629-R631 PolarHBondContact OG-N 3.13Å
632	T	81.7	Confident	74.1	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.018	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-15.6	177.9	52.4	0	0	0	0	113.7	A583 Y616 M627 S629	A583-T632 HydrophobicContact CB-CG2 3.8Å; Y616-T632 HydrophobicContact CD2-CG2 3.61Å; Y616-T632 HydrophobicContact CE2-CG2 3.76Å; Y616-T632 HydrophobicContact CG-CG2 4.27Å; M627-T632 HydrophobicContact CB-CG2 4.49Å; M627-T632 HydrophobicContact CE-CG2 4.36Å; M627-T632 WeakPolarHBondContact O-CB 3.39Å; M627-T632 PolarHBondContact O-OG1 3.24Å; S629-T632 PolarHBondContact N-OG1 2.92Å; S629-T632 VanDerWaalsContact N-OG1 3.1Å; S629-T632 PolarHBondContact O-N 3.26Å; S629-T632 VanDerWaalsContact O-N 3.07Å; S629-T632 PolarHBondContact O-OG1 3.01Å; S629-T632 PolarHBondContact OG-N 2.87Å; S629-T632 PolarHBondContact OG-OG1 3.13Å; S629-T632 VanDerWaalsContact OG-OG1 3.07Å
633	K	78.2	Confident	75	Confident	73 Å²	73	56.2 Å²	56.2	32%	0.317	31%	0.308	S	S	.	.	S	Bend	trans	-72.3	122.6	175.1	178.8	-164.4	179.6	-168.8	0	111	D545 R581 S629 E630	D545-K633 IonicContact OD1-NZ 3.24Å; D545-K633 WeakPolarHBondContact OD2-CE 3.39Å; D545-K633 IonicContact OD2-NZ 2.77Å; D545-K633 PolarHBondContact OD2-NZ 3.2Å; R581-K633 VanDerWaalsContact CD-O 3.29Å; R581-K633 WeakPolarHBondContact CD-O 3.46Å; R581-K633 PolarHBondContact NH1-O 3.22Å; S629-K633 WeakPolarHBondContact O-CB 3.42Å; S629-K633 PolarHBondContact O-N 3.2Å; E630-K633 IonicContact OE2-NZ 3.76Å
634	P	76.1	Confident	75.7	Confident	48 Å²	48	52.3 Å²	52.3	31%	0.312	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-61	152.4	173.2	-23.4	34.9	0	0	0	113.2	L584 L763	L584-P634 HydrophobicContact CD1-CB 4.31Å; L584-P634 HydrophobicContact CD1-CG 4.28Å; P634-L763 HydrophobicContact CB-CD1 3.78Å; P634-L763 HydrophobicContact CG-CD1 4.4Å
635	R	82.2	Confident	76.5	Confident	23 Å²	23	50.2 Å²	50.2	9%	0.087	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-66.5	148.9	169.5	-65.3	-169.7	-163.6	-95.4	-8.7	110.3	I542 S544 D545 L547 E551 P637	I542-R635 PolarHBondContact O-NH1 3.39Å; I542-R635 PolarHBondContact O-NH2 3.06Å; I542-R635 VanDerWaalsContact O-NH2 3.12Å; S544-R635 PolarHBondContact O-NH1 3.49Å; D545-R635 CarbonylContact O-C 3.47Å; D545-R635 WeakPolarHBondContact O-CB 2.82Å; L547-R635 WeakPolarHBondContact O-CD 3.45Å; E551-R635 IonicContact OE1-CZ 2.73Å; E551-R635 IonicContact OE1-NE 2.77Å; E551-R635 PolarHBondContact OE1-NE 2.87Å; E551-R635 IonicContact OE1-NH2 3.8Å; E551-R635 PolarHBondContact OE1-NH2 3.38Å; E551-R635 IonicContact OE2-CZ 2.76Å; E551-R635 IonicContact OE2-NE 3.18Å; E551-R635 IonicContact OE2-NH2 2.75Å; E551-R635 PolarHBondContact OE2-NH2 2.89Å; R635-P637 WeakPolarHBondContact O-CD 3.35Å
636	T	76.2	Confident	77.9	Confident	84 Å²	84	48.6 Å²	48.6	52%	0.515	27%	0.273	S	S	.	.			trans	-124.3	71.3	177	58.3	0	0	0	0	108.9	D545 V638	D545-T636 CarbonylContact O-C 3.54Å; D545-T636 VanDerWaalsContact O-C 3.26Å; D545-T636 PolarHBondContact O-N 2.96Å; T636-V638 PolarHBondContact O-N 2.92Å
637	P	73.6	Confident	79.2	Confident	20 Å²	20	42.7 Å²	42.7	13%	0.13	25%	0.251	C	S	.	.			trans	-58	131.9	175.7	24.5	-35.2	0	0	0	111.7	R546 A548 R635 L640	R546-P637 WeakPolarHBondContact O-CA 3.24Å; R546-P637 WeakPolarHBondContact O-CB 3.41Å; A548-P637 HydrophobicContact CB-CB 3.95Å; R635-P637 WeakPolarHBondContact O-CD 3.35Å; P637-L640 HydrophobicContact CB-CD1 3.82Å; P637-L640 HydrophobicContact CB-CG 4.04Å; P637-L640 HydrophobicContact CG-CD1 3.46Å; P637-L640 VanDerWaalsContact CG-CD1 3.46Å; P637-L640 HydrophobicContact CG-CG 4.22Å
638	V	69.1	Low	80.5	Confident	91 Å²	91	38.9 Å²	38.9	55%	0.552	23%	0.232	S	C	*	.	S	Bend	trans	-101.7	136	-173.8	174.7	0	0	0	0	110.1	Q518 R546 T636	Q518-V638 PolarHBondContact NE2-O 3.03Å; R546-V638 HydrophobicContact CG-CB 4.43Å; R546-V638 HydrophobicContact CG-CG2 3.97Å; T636-V638 PolarHBondContact O-N 2.92Å
639	G	66.4	Low	82.1	Confident	51 Å²	51	35 Å²	35	53%	0.526	20%	0.199	S	C	.	.	S	Bend	trans	81.9	14	174.5	0	0	0	0	0	115.1
640	L	68.9	Low	83	Confident	14 Å²	14	34.5 Å²	34.5	7%	0.073	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-59.2	153.4	169.7	-71.1	-179.9	0	0	0	111.9	A548 P637 K642 E977 F980	A548-L640 HydrophobicContact CB-CD2 4.02Å; P637-L640 HydrophobicContact CB-CD1 3.82Å; P637-L640 HydrophobicContact CB-CG 4.04Å; P637-L640 HydrophobicContact CG-CD1 3.46Å; P637-L640 VanDerWaalsContact CG-CD1 3.46Å; P637-L640 HydrophobicContact CG-CG 4.22Å; L640-K642 PolarHBondContact O-N 3.05Å; L640-E977 HydrophobicContact CB-CB 4.21Å; L640-E977 HydrophobicContact CB-CG 4.43Å; L640-F980 HydrophobicContact CD1-CD2 4.47Å; L640-F980 HydrophobicContact CD1-CE2 3.86Å; L640-F980 HydrophobicContact CD2-CE2 3.82Å; L640-F980 HydrophobicContact CD2-CZ 4.03Å
641	P	74.3	Confident	84	Confident	42 Å²	42	29.4 Å²	29.4	27%	0.273	17%	0.172	S	C	.	.	P	Polyproline II helix	trans	-50.2	129.3	167.4	-24.6	34.1	0	0	0	109.9	R978	P641-R978 WeakPolarHBondContact O-CB 3.16Å; P641-R978 PolarHBondContact O-N 2.74Å
642	K	82.4	Confident	84.2	Confident	74 Å²	74	32.3 Å²	32.3	32%	0.322	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	154.6	175.6	-51.3	-156	176.9	-152.4	0	109.9	L640 F663 I975 I976 E977	L640-K642 PolarHBondContact O-N 3.05Å; K642-F663 WeakPolarHBondContact O-CD2 3.1Å; K642-I975 HydrophobicContact CB-CG2 3.71Å; K642-I975 HydrophobicContact CD-CG2 3.93Å; K642-I975 HydrophobicContact CG-CG2 4.41Å; K642-I976 CarbonylContact C-O 3.58Å; K642-I976 VanDerWaalsContact CA-O 3.3Å; K642-I976 WeakPolarHBondContact CA-O 3.31Å; K642-I976 WeakPolarHBondContact CB-O 3.37Å; K642-E977 HydrophobicContact CD-CG 4.03Å; K642-E977 WeakPolarHBondContact CE-OE1 3.45Å; K642-E977 HydrophobicContact CG-CG 3.95Å; K642-E977 IonicContact NZ-OE1 2.87Å; K642-E977 PolarHBondContact NZ-OE1 2.88Å
643	I	87.3	Confident	84.9	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145	179.4	57.7	-177.9	0	0	0	109.3	F661 E662 L721 I975 I976 R978	I643-F661 CarbonylContact C-O 3.55Å; I643-F661 VanDerWaalsContact CA-O 3.3Å; I643-F661 WeakPolarHBondContact CA-O 3.22Å; I643-F661 WeakPolarHBondContact CB-O 3.46Å; I643-E662 HydrophobicContact CG2-CB 4.29Å; I643-E662 HydrophobicContact CG2-CG 4.45Å; I643-L721 HydrophobicContact CD1-CD2 3.18Å; I643-I975 WeakPolarHBondContact O-CA 3.3Å; I643-I976 HydrophobicContact CD1-CD1 3.81Å; I643-I976 HydrophobicContact CD1-CG1 3.85Å; I643-I976 HydrophobicContact CG1-CD1 4Å; I643-I976 HydrophobicContact CG1-CG1 3.45Å; I643-I976 VanDerWaalsContact CG1-CG1 3.45Å; I643-I976 PolarHBondContact N-O 2.92Å; I643-I976 PolarHBondContact O-N 3.19Å; I643-R978 HydrophobicContact CD1-CB 4.41Å; I643-R978 HydrophobicContact CG2-CB 4.28Å
644	L	91.2	Very high	85.8	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	123.6	177.7	160.4	64.4	0	0	0	109.1	V646 C660 F661 F663 W668 V926 I935 V973	L644-V646 HydrophobicContact CD1-CG2 4.38Å; L644-V646 HydrophobicContact CG-CG2 4.26Å; L644-C660 CarbonylContact O-C 3.58Å; L644-C660 WeakPolarHBondContact O-CA 3.07Å; L644-F661 HydrophobicContact CB-CB 4.23Å; L644-F661 HydrophobicContact CB-CD1 4.41Å; L644-F661 HydrophobicContact CD2-CD1 4.45Å; L644-F661 PolarHBondContact N-O 3.07Å; L644-F661 PolarHBondContact O-N 3.33Å; L644-F663 HydrophobicContact CB-CE2 3.82Å; L644-F663 HydrophobicContact CB-CZ 3.81Å; L644-W668 HydrophobicContact CD2-CH2 3.9Å; L644-W668 HydrophobicContact CD2-CZ2 4.28Å; L644-W668 HydrophobicContact CG-CH2 4.22Å; L644-V926 HydrophobicContact CD1-CG1 4.26Å; L644-V926 HydrophobicContact CD1-CG2 4.17Å; L644-I935 HydrophobicContact CD1-CD1 3.91Å; L644-I935 HydrophobicContact CD2-CD1 3.59Å; L644-I935 HydrophobicContact CD2-CG1 3.86Å; L644-I935 HydrophobicContact CG-CD1 4.41Å; L644-V973 HydrophobicContact CD1-CB 4.22Å; L644-V973 HydrophobicContact CD1-CG1 4.48Å
645	L	92.7	Very high	86.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	142.2	169.8	-57.4	-166.6	0	0	0	111.2	I647 E659 C660 I723 M742 V973 A974 I976	L645-I647 HydrophobicContact CB-CD1 3.79Å; L645-I647 HydrophobicContact CB-CG1 4.37Å; L645-E659 CarbonylContact C-O 3.59Å; L645-E659 WeakPolarHBondContact CA-O 3.28Å; L645-C660 HydrophobicContact CD2-CB 3.7Å; L645-I723 HydrophobicContact CD1-CD1 4.06Å; L645-I723 HydrophobicContact CD2-CD1 3.35Å; L645-I723 HydrophobicContact CG-CD1 4.36Å; L645-M742 HydrophobicContact CD1-CE 3.93Å; L645-M742 HydrophobicContact CD1-SD 3.96Å; L645-V973 WeakPolarHBondContact O-CA 3.33Å; L645-A974 PolarHBondContact N-O 2.74Å; L645-A974 PolarHBondContact O-N 2.96Å; L645-A974 VanDerWaalsContact O-N 3.08Å; L645-I976 HydrophobicContact CD1-CD1 3.67Å; L645-I976 HydrophobicContact CD1-CG1 4.32Å; L645-I976 HydrophobicContact CD2-CD1 4.3Å; L645-I976 HydrophobicContact CG-CD1 3.99Å; L645-I976 HydrophobicContact CG-CG1 4.2Å
646	V	95.5	Very high	87.4	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	107.6	175.2	-170.7	0	0	0	0	108.8	L644 V658 E659 W668 I935 L964 A971 G972 V973	L644-V646 HydrophobicContact CD1-CG2 4.38Å; L644-V646 HydrophobicContact CG-CG2 4.26Å; V646-V658 WeakPolarHBondContact O-CA 3.44Å; V646-E659 HydrophobicContact CB-CB 4.42Å; V646-E659 PolarHBondContact N-O 3.2Å; V646-E659 PolarHBondContact O-N 3.19Å; V646-W668 HydrophobicContact CB-CZ3 4.45Å; V646-W668 HydrophobicContact CG2-CH2 3.55Å; V646-W668 HydrophobicContact CG2-CZ3 3.65Å; V646-I935 HydrophobicContact CG1-CG2 4.38Å; V646-I935 HydrophobicContact CG2-CG2 3.87Å; V646-L964 HydrophobicContact CB-CD2 4.48Å; V646-L964 HydrophobicContact CG1-CD2 4.48Å; V646-L964 HydrophobicContact CG2-CD2 4.02Å; V646-A971 HydrophobicContact CG1-CB 3.84Å; V646-G972 CarbonylContact C-O 3.59Å; V646-G972 WeakPolarHBondContact CA-O 3.35Å; V646-V973 HydrophobicContact CG1-CG1 4.24Å; V646-V973 HydrophobicContact CG2-CG1 4.23Å
647	I	95.9	Very high	88.3	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	110	-161	-57.9	90.6	0	0	0	110.4	L645 V658 L726 V735 M742 V744 G972 A974	L645-I647 HydrophobicContact CB-CD1 3.79Å; L645-I647 HydrophobicContact CB-CG1 4.37Å; I647-V658 HydrophobicContact CG1-CG1 4.4Å; I647-V658 HydrophobicContact CG2-CG2 4.48Å; I647-L726 HydrophobicContact CG2-CD1 3.89Å; I647-L726 HydrophobicContact CG2-CD2 3.96Å; I647-L726 HydrophobicContact CG2-CG 4.09Å; I647-V735 HydrophobicContact CB-CG2 4.5Å; I647-V735 HydrophobicContact CD1-CG1 4.32Å; I647-V735 HydrophobicContact CD1-CG2 4.41Å; I647-M742 HydrophobicContact CD1-SD 3.76Å; I647-M742 HydrophobicContact CG1-CE 3.93Å; I647-M742 HydrophobicContact CG1-SD 3.82Å; I647-V744 HydrophobicContact CG2-CG1 4.14Å; I647-V744 HydrophobicContact CG2-CG2 3.92Å; I647-G972 PolarHBondContact N-O 3.28Å; I647-G972 PolarHBondContact O-N 3.25Å; I647-A974 HydrophobicContact CD1-CB 4.19Å
648	G	96.7	Very high	89.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.2	C	C	.	.			trans	59.4	-135.7	176.2	0	0	0	0	0	112.6	S657 R968 A971	G648-S657 WeakPolarHBondContact CA-O 3.36Å; G648-S657 PolarHBondContact N-O 3.09Å; G648-R968 PolarHBondContact O-NH1 3.11Å; G648-A971 WeakPolarHBondContact O-CB 3.32Å
649	G	97.5	Very high	90.2	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.			trans	107.9	-166.9	-178.6	0	0	0	0	0	113.4	A654 I655 R730 C731 S969	G649-A654 VanDerWaalsContact O-CA 3.32Å; G649-A654 WeakPolarHBondContact O-CA 3.29Å; G649-I655 VanDerWaalsContact O-CG1 3.27Å; G649-I655 WeakPolarHBondContact O-CG1 3.45Å; G649-I655 PolarHBondContact O-N 3.18Å; G649-I655 VanDerWaalsContact O-N 3.07Å; G649-R730 PolarHBondContact N-O 2.8Å; G649-C731 WeakPolarHBondContact O-CB 3.3Å; G649-S969 CarbonylContact C-O 3.59Å; G649-S969 WeakPolarHBondContact CA-O 3.31Å
650	Q	97.2	Very high	91.3	Very high	35 Å²	35	30 Å²	30	16%	0.164	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-110	116.1	-179.3	-77.5	-160.8	-124.5	0	0	111.3	P652 K653 C731 R732 N943 R968 S969	Q650-P652 WeakPolarHBondContact CB-O 3.07Å; Q650-P652 PolarHBondContact NE2-O 3.41Å; Q650-K653 WeakPolarHBondContact CA-O 3.4Å; Q650-C731 HydrophobicContact CG-CB 3.73Å; Q650-C731 VanDerWaalsContact CG-SG 3.55Å; Q650-R732 VanDerWaalsContact OE1-CZ 3.24Å; Q650-N943 PolarHBondContact O-ND2 3.25Å; Q650-R968 WeakPolarHBondContact O-CA 3.47Å; Q650-S969 PolarHBondContact N-O 2.75Å; Q650-S969 PolarHBondContact O-N 2.96Å
651	A	95.3	Very high	92.1	Very high	19 Å²	19	29.8 Å²	29.8	16%	0.157	15%	0.15	C	C	.	.	S	Bend	trans	-141.6	68.5	177.9	0	0	0	0	0	113.3	K653 I655 I966 R968	A651-K653 VanDerWaalsContact C-N 3.34Å; A651-K653 PolarHBondContact N-O 3.21Å; A651-I655 HydrophobicContact CB-CD1 3.93Å; A651-I655 HydrophobicContact CB-CG2 4.35Å; A651-I966 HydrophobicContact CB-CD1 3.75Å; A651-I966 HydrophobicContact CB-CG1 3.98Å; A651-I966 HydrophobicContact CB-CG2 4.3Å; A651-R968 HydrophobicContact CB-CB 4.39Å
652	P	91.2	Very high	92.4	Very high	96 Å²	96	29.6 Å²	29.6	62%	0.623	15%	0.145	S	C	*	.	S	Bend	cis	-82.2	-10.9	-20.9	35.3	-34.9	0	0	0	112.1	Q650	Q650-P652 WeakPolarHBondContact CB-O 3.07Å; Q650-P652 PolarHBondContact NE2-O 3.41Å
653	K	95.4	Very high	92.2	Very high	170 Å²	170	28 Å²	28	74%	0.739	14%	0.138	S	C	*	.	S	Bend	trans	-86.3	165.4	171.6	-66.5	176.6	-178.4	172.2	0	110	Q650 A651 I655	Q650-K653 WeakPolarHBondContact CA-O 3.4Å; A651-K653 VanDerWaalsContact C-N 3.34Å; A651-K653 PolarHBondContact N-O 3.21Å; K653-I655 PolarHBondContact O-N 2.71Å
654	A	96.9	Very high	91.3	Very high	7 Å²	7	35.3 Å²	35.3	6%	0.058	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-58.8	130.6	174.4	0	0	0	0	0	111	G649 R729 C731	G649-A654 VanDerWaalsContact O-CA 3.32Å; G649-A654 WeakPolarHBondContact O-CA 3.29Å; A654-R729 HydrophobicContact CB-CB 4.22Å; A654-R729 WeakPolarHBondContact O-CD 3.3Å; A654-C731 HydrophobicContact CB-CB 4.27Å
655	I	96.9	Very high	89.7	Confident	35 Å²	35	37.8 Å²	37.8	18%	0.179	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-114.7	168.7	-178.4	47.5	166.9	0	0	0	112.3	G649 A651 K653 R729 R730	G649-I655 VanDerWaalsContact O-CG1 3.27Å; G649-I655 WeakPolarHBondContact O-CG1 3.45Å; G649-I655 PolarHBondContact O-N 3.18Å; G649-I655 VanDerWaalsContact O-N 3.07Å; A651-I655 HydrophobicContact CB-CD1 3.93Å; A651-I655 HydrophobicContact CB-CG2 4.35Å; K653-I655 PolarHBondContact O-N 2.71Å; I655-R729 WeakPolarHBondContact O-CA 3.45Å; I655-R730 PolarHBondContact O-N 2.9Å
656	R	95.9	Very high	88.3	Confident	110 Å²	110	39.7 Å²	39.7	42%	0.415	22%	0.218	S	C	.	.			trans	-97.6	-28.8	173.5	-65.8	176.1	67.2	-149.5	-10	112.9	V658 D725 L726 R729	R656-V658 PolarHBondContact O-N 3.33Å; R656-D725 WeakPolarHBondContact CB-OD2 3.23Å; R656-L726 HydrophobicContact CB-CB 4.36Å; R656-L726 VanDerWaalsContact CZ-O 3.23Å; R656-L726 PolarHBondContact NE-O 3.04Å; R656-L726 PolarHBondContact NH2-O 3.37Å; R656-L726 WeakPolarHBondContact O-CB 3.35Å; R656-L726 PolarHBondContact O-N 3.25Å; R656-R729 HydrophobicContact CG-CB 4.44Å; R656-R729 HydrophobicContact CG-CG 3.79Å
657	S	94.3	Very high	86.6	Confident	10 Å²	10	42.4 Å²	42.4	7%	0.07	24%	0.237	C	C	.	.			trans	-43.7	122.4	-174.6	171.6	0	0	0	0	113.7	G648 D725 R968	G648-S657 WeakPolarHBondContact CA-O 3.36Å; G648-S657 PolarHBondContact N-O 3.09Å; S657-D725 WeakPolarHBondContact CA-OD1 3.43Å; S657-D725 PolarHBondContact N-OD2 2.79Å; S657-R968 PolarHBondContact O-NH1 2.57Å; S657-R968 PolarHBondContact OG-NH2 3.24Å
658	V	92.4	Very high	85.2	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.024	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	128.3	161	-173.6	0	0	0	0	108.5	V646 I647 R656 I723 D725 L726 W767	V646-V658 WeakPolarHBondContact O-CA 3.44Å; I647-V658 HydrophobicContact CG1-CG1 4.4Å; I647-V658 HydrophobicContact CG2-CG2 4.48Å; R656-V658 PolarHBondContact O-N 3.33Å; V658-I723 HydrophobicContact CB-CG2 4.15Å; V658-I723 HydrophobicContact CG1-CG2 3.79Å; V658-D725 PolarHBondContact N-OD1 3.45Å; V658-D725 VanDerWaalsContact N-OD1 3.17Å; V658-L726 HydrophobicContact CG2-CG 4.31Å; V658-W767 HydrophobicContact CG2-CZ2 4.26Å
659	E	90.8	Very high	83.6	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	148	170	-63.8	-174.7	-115.6	0	0	109.9	L645 V646 W668 T965 R968	L645-E659 CarbonylContact C-O 3.59Å; L645-E659 WeakPolarHBondContact CA-O 3.28Å; V646-E659 HydrophobicContact CB-CB 4.42Å; V646-E659 PolarHBondContact N-O 3.2Å; V646-E659 PolarHBondContact O-N 3.19Å; E659-W668 HydrophobicContact CB-CE3 3.82Å; E659-W668 HydrophobicContact CB-CZ3 3.87Å; E659-T965 PolarHBondContact OE2-N 2.9Å; E659-T965 PolarHBondContact OE2-OG1 3.33Å; E659-T965 VanDerWaalsContact OE2-OG1 3.11Å; E659-R968 IonicContact OE1-CZ 3.96Å; E659-R968 IonicContact OE1-NE 2.67Å; E659-R968 PolarHBondContact OE1-NE 2.94Å; E659-R968 IonicContact OE1-NH2 3.03Å; E659-R968 PolarHBondContact OE1-NH2 3.46Å
660	C	88.3	Confident	81.5	Confident	7 Å²	7	48.6 Å²	48.6	5%	0.047	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	140	179.6	178.1	0	0	0	0	110.9	L644 L645 W668 T669 I723	L644-C660 CarbonylContact O-C 3.58Å; L644-C660 WeakPolarHBondContact O-CA 3.07Å; L645-C660 HydrophobicContact CD2-CB 3.7Å; C660-W668 CarbonylContact O-C 3.49Å; C660-W668 WeakPolarHBondContact O-CA 3.49Å; C660-T669 WeakPolarHBondContact CB-OG1 3.48Å; C660-T669 PolarHBondContact N-O 2.92Å; C660-T669 PolarHBondContact O-N 3.2Å; C660-T669 PolarHBondContact O-OG1 3Å; C660-I723 HydrophobicContact CB-CD1 4.14Å
661	F	85.5	Confident	79	Confident	10 Å²	10	50.6 Å²	50.6	4%	0.044	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.6	178	176.5	-103.4	0	0	0	112	I643 L644 F663 G666 S667 W668 S962	I643-F661 CarbonylContact C-O 3.55Å; I643-F661 VanDerWaalsContact CA-O 3.3Å; I643-F661 WeakPolarHBondContact CA-O 3.22Å; I643-F661 WeakPolarHBondContact CB-O 3.46Å; L644-F661 HydrophobicContact CB-CB 4.23Å; L644-F661 HydrophobicContact CB-CD1 4.41Å; L644-F661 HydrophobicContact CD2-CD1 4.45Å; L644-F661 PolarHBondContact N-O 3.07Å; L644-F661 PolarHBondContact O-N 3.33Å; F661-F663 HydrophobicContact CD1-CD1 4.16Å; F661-F663 HydrophobicContact CD1-CE1 4.25Å; F661-F663 HydrophobicContact CD1-CG 4.36Å; F661-F663 AromaticContact CE1-CD1 3.71Å; F661-F663 HydrophobicContact CE1-CD1 3.71Å; F661-F663 HydrophobicContact CE1-CE1 4.06Å; F661-F663 HydrophobicContact CE1-CG 4.14Å; F661-G666 VanDerWaalsContact CE2-C 3.41Å; F661-G666 WeakPolarHBondContact CE2-O 3.41Å; F661-S667 WeakPolarHBondContact CA-O 3.39Å; F661-S667 WeakPolarHBondContact CD2-O 3.37Å; F661-W668 HydrophobicContact CB-CD2 3.79Å; F661-W668 HydrophobicContact CB-CE3 3.79Å; F661-W668 HydrophobicContact CB-CH2 3.38Å; F661-W668 HydrophobicContact CB-CZ2 3.36Å; F661-W668 HydrophobicContact CB-CZ3 3.62Å; F661-W668 HydrophobicContact CD1-CZ2 4.4Å; F661-W668 AromaticContact CD2-CD1 3.67Å; F661-W668 AromaticContact CD2-CD2 3.92Å; F661-W668 HydrophobicContact CD2-CD2 3.92Å; F661-W668 AromaticContact CD2-CE2 3.4Å; F661-W668 VanDerWaalsContact CD2-CE2 3.4Å; F661-W668 HydrophobicContact CD2-CG 4.01Å; F661-W668 AromaticContact CD2-CZ2 3.77Å; F661-W668 HydrophobicContact CD2-CZ2 3.77Å; F661-W668 AromaticContact CD2-NE1 3.29Å; F661-W668 VanDerWaalsContact CD2-NE1 3.29Å; F661-W668 AromaticContact CE2-NE1 3.77Å; F661-W668 HydrophobicContact CG-CD2 4.27Å; F661-W668 AromaticContact CG-CE2 3.73Å; F661-W668 HydrophobicContact CG-CH2 4.14Å; F661-W668 AromaticContact CG-CZ2 3.6Å; F661-W668 HydrophobicContact CG-CZ2 3.6Å; F661-S962 VanDerWaalsContact CE2-OG 3.3Å; F661-S962 WeakPolarHBondContact CE2-OG 3.37Å
662	E	81.2	Confident	75.9	Confident	38 Å²	38	53.6 Å²	53.6	18%	0.178	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	115.5	177.6	179.8	149.5	-118.4	0	0	111	I643 Q664 G665 G666 S667 R978	I643-E662 HydrophobicContact CG2-CB 4.29Å; I643-E662 HydrophobicContact CG2-CG 4.45Å; E662-Q664 VanDerWaalsContact C-N 3.27Å; E662-Q664 HydrophobicContact CG-CB 4.4Å; E662-Q664 PolarHBondContact O-N 3.1Å; E662-G665 PolarHBondContact O-N 3.32Å; E662-G666 PolarHBondContact O-N 3.37Å; E662-S667 PolarHBondContact N-O 3.07Å; E662-R978 WeakPolarHBondContact OE1-CD 3.45Å; E662-R978 IonicContact OE1-CZ 2.76Å; E662-R978 IonicContact OE1-NE 3.56Å; E662-R978 IonicContact OE1-NH1 2.65Å; E662-R978 PolarHBondContact OE1-NH1 3.24Å; E662-R978 IonicContact OE2-CZ 3.38Å; E662-R978 IonicContact OE2-NH1 3.25Å; E662-R978 PolarHBondContact OE2-NH1 2.78Å
663	F	78.3	Confident	72.9	Confident	40 Å²	40	52.4 Å²	52.4	18%	0.175	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-30.1	-176.3	-68.6	-84.1	0	0	0	113.3	K642 L644 F661 H928 Y933	K642-F663 WeakPolarHBondContact O-CD2 3.1Å; L644-F663 HydrophobicContact CB-CE2 3.82Å; L644-F663 HydrophobicContact CB-CZ 3.81Å; F661-F663 HydrophobicContact CD1-CD1 4.16Å; F661-F663 HydrophobicContact CD1-CE1 4.25Å; F661-F663 HydrophobicContact CD1-CG 4.36Å; F661-F663 AromaticContact CE1-CD1 3.71Å; F661-F663 HydrophobicContact CE1-CD1 3.71Å; F661-F663 HydrophobicContact CE1-CE1 4.06Å; F661-F663 HydrophobicContact CE1-CG 4.14Å; F663-H928 AromaticContact CD1-CD2 3.61Å; F663-H928 AromaticContact CD2-CD2 3.48Å; F663-H928 VanDerWaalsContact CD2-CD2 3.48Å; F663-H928 WeakPolarHBondContact CD2-CD2 3.43Å; F663-H928 AromaticContact CD2-NE2 3.68Å; F663-H928 HydrophobicContact CE1-CB 4.23Å; F663-H928 AromaticContact CE1-CD2 3.77Å; F663-H928 HydrophobicContact CE2-CB 4.41Å; F663-H928 AromaticContact CE2-CD2 3.64Å; F663-H928 AromaticContact CE2-CG 3.96Å; F663-H928 AromaticContact CG-CD2 3.47Å; F663-H928 VanDerWaalsContact CG-CD2 3.47Å; F663-H928 WeakPolarHBondContact CG-CD2 3.18Å; F663-H928 AromaticContact CG-NE2 3.82Å; F663-H928 HydrophobicContact CZ-CB 3.97Å; F663-H928 AromaticContact CZ-CD2 3.78Å; F663-H928 AromaticContact CZ-CG 3.98Å; F663-Y933 HydrophobicContact CD1-CE1 4.11Å; F663-Y933 HydrophobicContact CD1-CE2 4.41Å; F663-Y933 AromaticContact CD1-CZ 3.95Å; F663-Y933 AromaticContact CE1-CD1 3.95Å; F663-Y933 HydrophobicContact CE1-CD1 3.95Å; F663-Y933 AromaticContact CE1-CD2 3.99Å; F663-Y933 HydrophobicContact CE1-CD2 3.99Å; F663-Y933 AromaticContact CE1-CE1 3.74Å; F663-Y933 HydrophobicContact CE1-CE1 3.74Å; F663-Y933 AromaticContact CE1-CE2 3.81Å; F663-Y933 HydrophobicContact CE1-CE2 3.81Å; F663-Y933 HydrophobicContact CE1-CG 4.07Å; F663-Y933 AromaticContact CE1-CZ 3.68Å
664	Q	68.1	Low	69.5	Low	157 Å²	157	51.2 Å²	51.2	73%	0.734	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-36.5	177.3	-71.9	-178.3	-22.2	0	0	113.1	E662	E662-Q664 VanDerWaalsContact C-N 3.27Å; E662-Q664 HydrophobicContact CG-CB 4.4Å; E662-Q664 PolarHBondContact O-N 3.1Å
665	G	57.4	Low	66.1	Low	54 Å²	54	61.4 Å²	61.4	56%	0.557	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-18.6	-178.3	0	0	0	0	0	114.7	E662 S667	E662-G665 PolarHBondContact O-N 3.32Å; G665-S667 PolarHBondContact O-N 2.75Å
666	G	63.8	Low	62.6	Low	39 Å²	39	64.5 Å²	64.5	40%	0.402	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	12.6	-177.1	0	0	0	0	0	114.6	F661 E662 S962	F661-G666 VanDerWaalsContact CE2-C 3.41Å; F661-G666 WeakPolarHBondContact CE2-O 3.41Å; E662-G666 PolarHBondContact O-N 3.37Å; G666-S962 WeakPolarHBondContact O-CB 3.34Å
667	S	60.5	Low	59.2	Low	58 Å²	58	66.4 Å²	66.4	41%	0.406	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	149.5	-171.7	56.7	0	0	0	0	113	F661 E662 G665	F661-S667 WeakPolarHBondContact CA-O 3.39Å; F661-S667 WeakPolarHBondContact CD2-O 3.37Å; E662-S667 PolarHBondContact N-O 3.07Å; G665-S667 PolarHBondContact O-N 2.75Å
668	W	66.3	Low	55.8	Low	40 Å²	40	75.4 Å²	75.4	15%	0.152	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	140.1	171.1	-76.4	91	0	0	0	110.6	L644 V646 E659 C660 F661 I947 H963 L964	L644-W668 HydrophobicContact CD2-CH2 3.9Å; L644-W668 HydrophobicContact CD2-CZ2 4.28Å; L644-W668 HydrophobicContact CG-CH2 4.22Å; V646-W668 HydrophobicContact CB-CZ3 4.45Å; V646-W668 HydrophobicContact CG2-CH2 3.55Å; V646-W668 HydrophobicContact CG2-CZ3 3.65Å; E659-W668 HydrophobicContact CB-CE3 3.82Å; E659-W668 HydrophobicContact CB-CZ3 3.87Å; C660-W668 CarbonylContact O-C 3.49Å; C660-W668 WeakPolarHBondContact O-CA 3.49Å; F661-W668 HydrophobicContact CB-CD2 3.79Å; F661-W668 HydrophobicContact CB-CE3 3.79Å; F661-W668 HydrophobicContact CB-CH2 3.38Å; F661-W668 HydrophobicContact CB-CZ2 3.36Å; F661-W668 HydrophobicContact CB-CZ3 3.62Å; F661-W668 HydrophobicContact CD1-CZ2 4.4Å; F661-W668 AromaticContact CD2-CD1 3.67Å; F661-W668 AromaticContact CD2-CD2 3.92Å; F661-W668 HydrophobicContact CD2-CD2 3.92Å; F661-W668 AromaticContact CD2-CE2 3.4Å; F661-W668 VanDerWaalsContact CD2-CE2 3.4Å; F661-W668 HydrophobicContact CD2-CG 4.01Å; F661-W668 AromaticContact CD2-CZ2 3.77Å; F661-W668 HydrophobicContact CD2-CZ2 3.77Å; F661-W668 AromaticContact CD2-NE1 3.29Å; F661-W668 VanDerWaalsContact CD2-NE1 3.29Å; F661-W668 AromaticContact CE2-NE1 3.77Å; F661-W668 HydrophobicContact CG-CD2 4.27Å; F661-W668 AromaticContact CG-CE2 3.73Å; F661-W668 HydrophobicContact CG-CH2 4.14Å; F661-W668 AromaticContact CG-CZ2 3.6Å; F661-W668 HydrophobicContact CG-CZ2 3.6Å; W668-I947 HydrophobicContact CH2-CD1 4.03Å; W668-I947 HydrophobicContact CZ2-CD1 3.15Å; W668-H963 VanDerWaalsContact CD1-O 3.24Å; W668-L964 HydrophobicContact CD2-CD2 4.2Å; W668-L964 HydrophobicContact CE3-CD2 3.93Å; W668-L964 HydrophobicContact CH2-CD2 3.41Å; W668-L964 VanDerWaalsContact CH2-CD2 3.41Å; W668-L964 HydrophobicContact CZ2-CD2 3.71Å; W668-L964 HydrophobicContact CZ3-CD2 3.5Å
669	T	62.8	Low	52.6	Low	48 Å²	48	80.3 Å²	80.3	29%	0.294	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	141.2	171.1	49	0	0	0	0	109.6	C660	C660-T669 WeakPolarHBondContact CB-OG1 3.48Å; C660-T669 PolarHBondContact N-O 2.92Å; C660-T669 PolarHBondContact O-N 3.2Å; C660-T669 PolarHBondContact O-OG1 3Å
670	S	53.5	Low	49.4	Very low	42 Å²	42	88.3 Å²	88.3	29%	0.294	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	149	-171.9	-169.9	0	0	0	0	110
671	L	44.6	Very low	46.4	Very low	78 Å²	78	93.6 Å²	93.6	41%	0.408	53%	0.532	S	S	.	.			trans	-120.3	60.5	-173.5	-90.2	160	0	0	0	113.5	I722 I723	L671-I722 HydrophobicContact CD1-CB 4Å; L671-I722 HydrophobicContact CD1-CG1 4.41Å; L671-I722 HydrophobicContact CD1-CG2 3.61Å; L671-I722 HydrophobicContact CD2-CG2 4.24Å; L671-I723 WeakPolarHBondContact CD1-O 3.31Å
672	S	30.4	Very low	43.6	Very low	82 Å²	82	98.5 Å²	98.5	57%	0.573	57%	0.567	S	S	*	*			trans	-157.8	106.1	167.4	59.6	0	0	0	0	112.9
673	G	27.6	Very low	40.9	Very low	71 Å²	71	102.2 Å²	102.2	73%	0.732	60%	0.597	S	S	*	*	S	Bend	trans	84	129.6	176.5	0	0	0	0	0	113.5
674	D	25	Very low	38.6	Very low	144 Å²	144	105.7 Å²	105.7	77%	0.77	63%	0.626	S	S	*	*			cis	-136.2	110.4	2.3	-85.6	-28.5	0	0	0	111.8	V676	D674-V676 HydrophobicContact CB-CG2 4.02Å; D674-V676 PolarHBondContact O-N 2.84Å
675	F	24.5	Very low	36.5	Very low	222 Å²	222	104.6 Å²	104.6	97%	0.974	63%	0.631	S	S	*	*			trans	-82.2	64.8	149.1	-96.3	-82.5	0	0	0	108.8	Q677	F675-Q677 PolarHBondContact O-N 2.94Å
676	V	24.2	Very low	35.2	Very low	100 Å²	100	107.4 Å²	107.4	61%	0.606	64%	0.642	S	S	*	*			trans	-67.3	115.8	159.6	164.7	0	0	0	0	106.6	D674 K678	D674-V676 HydrophobicContact CB-CG2 4.02Å; D674-V676 PolarHBondContact O-N 2.84Å; V676-K678 PolarHBondContact O-N 2.83Å
677	Q	23.8	Very low	33.4	Very low	149 Å²	149	113.4 Å²	113.4	70%	0.696	66%	0.66	S	S	*	*			trans	-54.4	108.2	160.7	-82.8	174.1	-109.3	0	0	108.3	F675 D679	F675-Q677 PolarHBondContact O-N 2.94Å; Q677-D679 VanDerWaalsContact NE2-CG 3.28Å; Q677-D679 PolarHBondContact NE2-OD1 2.63Å; Q677-D679 PolarHBondContact NE2-OD2 3.26Å; Q677-D679 PolarHBondContact O-N 2.97Å
678	K	23.3	Very low	31.9	Very low	200 Å²	200	119.1 Å²	119.1	87%	0.87	69%	0.685	S	S	*	*			trans	-74	68.5	154.8	-85.1	-171.4	171.7	-179.7	0	108.2	V676	V676-K678 PolarHBondContact O-N 2.83Å
679	D	24.6	Very low	29.9	Very low	107 Å²	107	124.8 Å²	124.8	57%	0.572	72%	0.715	S	S	*	*			trans	-59.3	145.4	166.7	-73.8	-23.4	0	0	0	109.3	Q677 S681	Q677-D679 VanDerWaalsContact NE2-CG 3.28Å; Q677-D679 PolarHBondContact NE2-OD1 2.63Å; Q677-D679 PolarHBondContact NE2-OD2 3.26Å; Q677-D679 PolarHBondContact O-N 2.97Å; D679-S681 PolarHBondContact O-N 3.02Å; D679-S681 VanDerWaalsContact O-N 3.16Å
680	N	24	Very low	28.2	Very low	169 Å²	169	128.7 Å²	128.7	90%	0.904	74%	0.742	S	S	*	*	S	Bend	trans	-57.9	110.7	-163.5	-61.1	-73.8	0	0	0	114.8
681	S	24.5	Very low	27	Very low	118 Å²	118	133.9 Å²	133.9	83%	0.825	77%	0.767	S	S	*	*			trans	-154.9	53.3	159.8	78.4	0	0	0	0	115.7	D679	D679-S681 PolarHBondContact O-N 3.02Å; D679-S681 VanDerWaalsContact O-N 3.16Å
682	S	28	Very low	26.2	Very low	113 Å²	113	136 Å²	136	79%	0.79	79%	0.785	S	S	*	*			trans	-149.5	99.8	160.6	62.1	0	0	0	0	112.1
683	S	24.6	Very low	26	Very low	116 Å²	116	137.1 Å²	137.1	81%	0.811	79%	0.793	S	S	*	*			trans	-64.7	129.1	172.9	52.3	0	0	0	0	111.5
684	S	29	Very low	26.2	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	80%	0.798	S	S	*	*			trans	-148.3	93.4	167.3	-74.9	0	0	0	0	109.2	S686	S684-S686 PolarHBondContact O-N 2.8Å
685	T	24.5	Very low	26.2	Very low	134 Å²	134	138.9 Å²	138.9	82%	0.822	80%	0.8	S	S	*	*			trans	-77.3	111	-176.5	-51.3	0	0	0	0	110.6
686	S	31	Very low	26.5	Very low	114 Å²	114	134.1 Å²	134.1	80%	0.797	79%	0.794	S	S	*	*			trans	-128.8	130.4	159.3	51.3	0	0	0	0	109.2	S684	S684-S686 PolarHBondContact O-N 2.8Å
687	Q	25.6	Very low	26.6	Very low	165 Å²	165	138.4 Å²	138.4	77%	0.771	81%	0.807	S	S	*	*			trans	-91.5	129	-169.8	-64.6	166.8	-47.1	0	0	110.9
688	L	28.1	Very low	26.9	Very low	178 Å²	178	137.1 Å²	137.1	93%	0.932	81%	0.812	S	S	*	*			trans	-128.8	106.1	155.2	-92.3	167.2	0	0	0	108.3
689	M	23.7	Very low	27.2	Very low	159 Å²	159	134.5 Å²	134.5	78%	0.783	81%	0.813	S	S	*	*			trans	-83.9	134.1	172.9	-66.1	-176	-178.5	0	0	110.2
690	C	27.9	Very low	27.3	Very low	129 Å²	129	134.4 Å²	134.4	87%	0.872	82%	0.821	S	S	*	*			trans	-138.4	128.9	150.6	-81.4	0	0	0	0	109.2
691	N	28.4	Very low	27.3	Very low	152 Å²	152	134.2 Å²	134.2	81%	0.813	82%	0.82	S	S	*	*			trans	-82.7	145.6	178.4	-79.9	-21.8	0	0	0	111.7
692	P	27.9	Very low	27.4	Very low	123 Å²	123	132 Å²	132	80%	0.799	82%	0.815	S	S	*	*			trans	-100.6	104.6	170.7	34.8	-28.3	0	0	0	112.3
693	S	25.3	Very low	27.2	Very low	104 Å²	104	138.6 Å²	138.6	73%	0.727	83%	0.825	S	S	*	*			trans	-168.3	102.8	164.8	58.6	0	0	0	0	115.1
694	T	32	Very low	27.2	Very low	138 Å²	138	137.5 Å²	137.5	85%	0.847	82%	0.823	S	S	*	*			trans	-169.3	91.1	138.7	21.1	0	0	0	0	112.7
695	S	25.5	Very low	27.1	Very low	114 Å²	114	139.5 Å²	139.5	80%	0.797	83%	0.825	S	S	*	*			trans	7.5	124	137.2	56	0	0	0	0	120.6
696	S	30.2	Very low	27.1	Very low	123 Å²	123	138.1 Å²	138.1	86%	0.86	82%	0.821	S	S	*	*			trans	-150	152.4	133.2	50.5	0	0	0	0	109.9
697	Q	27.9	Very low	26.8	Very low	189 Å²	189	138.7 Å²	138.7	88%	0.883	82%	0.819	S	S	*	*			trans	-99.6	152.9	-178.4	-81.9	-171.7	-42.3	0	0	111.9
698	P	28.8	Very low	27	Very low	123 Å²	123	136.5 Å²	136.5	80%	0.799	81%	0.812	S	S	*	*			trans	-78.4	150.7	174.7	33.5	-35.3	0	0	0	112
699	T	29.3	Very low	26.9	Very low	145 Å²	145	133.2 Å²	133.2	89%	0.89	80%	0.801	S	S	*	*			trans	-127.6	148.9	161.7	49.9	0	0	0	0	110.1
700	S	26.4	Very low	26.9	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	80%	0.801	S	S	*	*			trans	-92.2	134.6	-171.3	53.9	0	0	0	0	112.8
701	N	25.1	Very low	27	Very low	164 Å²	164	130.7 Å²	130.7	88%	0.877	79%	0.785	S	S	*	*				176	135.5	122.7	-87.2	-19.7	0	0	0	110.9
702	G	26.1	Very low	26.7	Very low	71 Å²	71	129.6 Å²	129.6	73%	0.732	78%	0.779	S	S	*	*			trans	169.9	100	176.3	0	0	0	0	0	112	A704	G702-A704 PolarHBondContact O-N 3.04Å
703	Y	23.5	Very low	26.6	Very low	252 Å²	252	128.5 Å²	128.5	99%	0.988	77%	0.774	S	S	*	*			trans	-71.7	113.5	169.4	-76.5	-97.2	0	0	0	108.7
704	A	25.1	Very low	26.5	Very low	94 Å²	94	129.4 Å²	129.4	78%	0.777	77%	0.77	S	S	*	*			trans	-140	144.1	174.3	0	0	0	0	0	110.6	G702	G702-A704 PolarHBondContact O-N 3.04Å
705	N	26.1	Very low	26.2	Very low	153 Å²	153	126.7 Å²	126.7	82%	0.818	76%	0.757	S	S	*	*			trans	-58.6	158.4	-165.3	-61.5	-34.2	0	0	0	115.2	T707	N705-T707 VanDerWaalsContact C-N 3.32Å; N705-T707 PolarHBondContact O-N 2.97Å
706	S	24.3	Very low	26.2	Very low	106 Å²	106	128.5 Å²	128.5	74%	0.741	76%	0.758	S	S	*	*			trans	-69.5	81.1	173.2	58.4	0	0	0	0	112.2
707	T	24.9	Very low	26	Very low	125 Å²	125	126.9 Å²	126.9	77%	0.767	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-66	134.2	168.1	-47.7	0	0	0	0	109.6	N705	N705-T707 VanDerWaalsContact C-N 3.32Å; N705-T707 PolarHBondContact O-N 2.97Å
708	I	30	Very low	26.3	Very low	119 Å²	119	124.9 Å²	124.9	61%	0.61	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-56.8	144.2	172.5	-65	173.4	0	0	0	108.8	N710	I708-N710 PolarHBondContact O-N 3.33Å
709	P	26.3	Very low	26.5	Very low	110 Å²	110	122.2 Å²	122.2	71%	0.714	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-54.7	117.7	-178.4	-25.7	35	0	0	0	110.9	V711	P709-V711 PolarHBondContact O-N 2.84Å
710	N	24.5	Very low	27.2	Very low	145 Å²	145	120.4 Å²	120.4	78%	0.775	71%	0.709	S	S	*	*			trans	-68.5	99.7	-176.7	-166.6	12.6	0	0	0	108.9	I708 N712	I708-N710 PolarHBondContact O-N 3.33Å; N710-N712 VanDerWaalsContact C-N 3.35Å; N710-N712 PolarHBondContact O-N 3.05Å
711	V	28.5	Very low	28.5	Very low	89 Å²	89	116.5 Å²	116.5	54%	0.539	68%	0.679	S	S	.	*			trans	-71	93.7	-178.3	179.9	0	0	0	0	107.9	P709 C713	P709-V711 PolarHBondContact O-N 2.84Å; V711-C713 PolarHBondContact O-N 2.73Å
712	N	23.4	Very low	30.5	Very low	129 Å²	129	113.5 Å²	113.5	69%	0.69	66%	0.662	S	S	*	*			trans	-74.1	75.4	-177.8	-159.2	54	0	0	0	110.5	N710 N714	N710-N712 VanDerWaalsContact C-N 3.35Å; N710-N712 PolarHBondContact O-N 3.05Å; N712-N714 PolarHBondContact ND2-OD1 3.16Å; N712-N714 PolarHBondContact O-N 3.31Å; N712-N714 VanDerWaalsContact O-N 3.11Å
713	C	25.1	Very low	32.8	Very low	101 Å²	101	110.4 Å²	110.4	68%	0.682	63%	0.629	S	S	*	*			trans	-69.7	99.2	172.7	51.5	0	0	0	0	109.3	V711 S715	V711-C713 PolarHBondContact O-N 2.73Å; C713-S715 PolarHBondContact O-N 3.15Å
714	N	23.3	Very low	35.7	Very low	123 Å²	123	100.5 Å²	100.5	66%	0.658	60%	0.596	S	S	*	*			trans	-59.9	91.8	175.8	-73.3	-5.9	0	0	0	110.6	N712 D716	N712-N714 PolarHBondContact ND2-OD1 3.16Å; N712-N714 PolarHBondContact O-N 3.31Å; N712-N714 VanDerWaalsContact O-N 3.11Å; N714-D716 PolarHBondContact O-N 3.42Å; N714-D716 VanDerWaalsContact O-N 3.14Å
715	S	24.9	Very low	38.8	Very low	81 Å²	81	97.8 Å²	97.8	57%	0.566	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	12.5	-172	61.5	0	0	0	0	115	C713 S717	C713-S715 PolarHBondContact O-N 3.15Å; S715-S717 VanDerWaalsContact C-N 3.27Å
716	D	26.5	Very low	42.1	Very low	151 Å²	151	90.5 Å²	90.5	81%	0.807	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	7	177.3	-62.8	-21.3	0	0	0	112.6	N714 I718	N714-D716 PolarHBondContact O-N 3.42Å; N714-D716 VanDerWaalsContact O-N 3.14Å; D716-I718 PolarHBondContact O-N 3.38Å
717	S	26.9	Very low	45.4	Very low	89 Å²	89	88.6 Å²	88.6	62%	0.622	52%	0.515	S	S	*	.			trans	-68.8	101.4	163.5	-63.8	0	0	0	0	108.5	S715 C719	S715-S717 VanDerWaalsContact C-N 3.27Å; S717-C719 PolarHBondContact O-N 2.63Å; S717-C719 PolarHBondContact O-SG 2.76Å
718	I	33.2	Very low	48.6	Very low	148 Å²	148	84.5 Å²	84.5	76%	0.759	49%	0.491	S	S	*	.			trans	-55.9	108.7	164	-64	174.4	0	0	0	106.6	D716 N720	D716-I718 PolarHBondContact O-N 3.38Å; I718-N720 PolarHBondContact O-N 3.37Å
719	C	34	Very low	51.8	Low	66 Å²	66	85.5 Å²	85.5	45%	0.446	49%	0.488	S	S	.	.			trans	-71.4	72.7	-176.5	-66	0	0	0	0	111.1	S717 L721 R978	S717-C719 PolarHBondContact O-N 2.63Å; S717-C719 PolarHBondContact O-SG 2.76Å; C719-L721 PolarHBondContact O-N 2.93Å; C719-R978 PolarHBondContact O-NH2 2.78Å
720	N	43	Very low	55.2	Low	108 Å²	108	80.4 Å²	80.4	58%	0.578	45%	0.454	S	S	*	.			trans	-53.8	116.9	158.7	-75.1	-32.6	0	0	0	107	I718 I722	I718-N720 PolarHBondContact O-N 3.37Å; N720-I722 VanDerWaalsContact C-N 3.35Å; N720-I722 WeakPolarHBondContact O-CG1 3.38Å; N720-I722 PolarHBondContact O-N 3.45Å
721	L	54.7	Low	58.7	Low	22 Å²	22	73.5 Å²	73.5	12%	0.115	42%	0.417	C	S	.	.			trans	-73.7	89.2	-171.7	-163.6	76.6	0	0	0	109.9	I643 C719 I723 I981	I643-L721 HydrophobicContact CD1-CD2 3.18Å; C719-L721 PolarHBondContact O-N 2.93Å; L721-I723 VanDerWaalsContact C-N 3.33Å; L721-I723 HydrophobicContact CD2-CD1 3.81Å; L721-I723 HydrophobicContact CD2-CG1 4.16Å; L721-I723 HydrophobicContact CG-CD1 4.32Å; L721-I723 HydrophobicContact CG-CG1 4.12Å; L721-I723 PolarHBondContact O-N 3.14Å; L721-I981 HydrophobicContact CD1-CB 4.04Å; L721-I981 HydrophobicContact CD1-CD1 3.69Å; L721-I981 HydrophobicContact CD1-CG1 3.94Å; L721-I981 HydrophobicContact CG-CD1 4.37Å
722	I	65.4	Low	62	Low	101 Å²	101	72.5 Å²	72.5	52%	0.518	40%	0.403	S	S	.	.			trans	-73.6	84	-174.7	-74.1	169.4	0	0	0	109.1	L671 N720 N765	L671-I722 HydrophobicContact CD1-CB 4Å; L671-I722 HydrophobicContact CD1-CG1 4.41Å; L671-I722 HydrophobicContact CD1-CG2 3.61Å; L671-I722 HydrophobicContact CD2-CG2 4.24Å; N720-I722 VanDerWaalsContact C-N 3.35Å; N720-I722 WeakPolarHBondContact O-CG1 3.38Å; N720-I722 PolarHBondContact O-N 3.45Å; I722-N765 PolarHBondContact O-ND2 2.77Å; I722-N765 PolarHBondContact O-OD1 3.41Å
723	I	75.9	Confident	65.5	Low	7 Å²	7	67 Å²	67	4%	0.036	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-81.1	122.7	-179.6	-71.4	-179.3	0	0	0	111.3	L645 V658 C660 L671 L721 Y760	L645-I723 HydrophobicContact CD1-CD1 4.06Å; L645-I723 HydrophobicContact CD2-CD1 3.35Å; L645-I723 HydrophobicContact CG-CD1 4.36Å; V658-I723 HydrophobicContact CB-CG2 4.15Å; V658-I723 HydrophobicContact CG1-CG2 3.79Å; C660-I723 HydrophobicContact CB-CD1 4.14Å; L671-I723 WeakPolarHBondContact CD1-O 3.31Å; L721-I723 VanDerWaalsContact C-N 3.33Å; L721-I723 HydrophobicContact CD2-CD1 3.81Å; L721-I723 HydrophobicContact CD2-CG1 4.16Å; L721-I723 HydrophobicContact CG-CD1 4.32Å; L721-I723 HydrophobicContact CG-CG1 4.12Å; L721-I723 PolarHBondContact O-N 3.14Å; I723-Y760 HydrophobicContact CG2-CE1 4.07Å
724	S	83.7	Confident	69	Low	43 Å²	43	62.5 Å²	62.5	30%	0.301	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-60.8	136.3	-179.4	-70.3	0	0	0	0	113.7	N765 W767	S724-N765 WeakPolarHBondContact CB-OD1 3.49Å; S724-N765 PolarHBondContact N-OD1 3.11Å; S724-N765 PolarHBondContact OG-O 2.87Å; S724-N765 PolarHBondContact OG-OD1 2.78Å; S724-W767 PolarHBondContact O-NE1 3.15Å
725	D	91.1	Very high	72.5	Confident	37 Å²	37	57.6 Å²	57.6	20%	0.198	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-64.2	145.9	175.2	-126	42.7	0	0	0	112.8	R656 S657 V658 W767	R656-D725 WeakPolarHBondContact CB-OD2 3.23Å; S657-D725 WeakPolarHBondContact CA-OD1 3.43Å; S657-D725 PolarHBondContact N-OD2 2.79Å; V658-D725 PolarHBondContact N-OD1 3.45Å; V658-D725 VanDerWaalsContact N-OD1 3.17Å; D725-W767 PolarHBondContact O-NE1 3.14Å
726	L	93.8	Very high	75.9	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-48.9	142	178.8	-78.6	166	0	0	0	111.9	I647 R656 V658 S728 R730 V744 E758 W767	I647-L726 HydrophobicContact CG2-CD1 3.89Å; I647-L726 HydrophobicContact CG2-CD2 3.96Å; I647-L726 HydrophobicContact CG2-CG 4.09Å; R656-L726 HydrophobicContact CB-CB 4.36Å; R656-L726 VanDerWaalsContact CZ-O 3.23Å; R656-L726 PolarHBondContact NE-O 3.04Å; R656-L726 PolarHBondContact NH2-O 3.37Å; R656-L726 WeakPolarHBondContact O-CB 3.35Å; R656-L726 PolarHBondContact O-N 3.25Å; V658-L726 HydrophobicContact CG2-CG 4.31Å; L726-S728 WeakPolarHBondContact CB-O 3.22Å; L726-S728 PolarHBondContact O-N 3.35Å; L726-R730 HydrophobicContact CD1-CB 3.98Å; L726-V744 HydrophobicContact CD2-CB 4.46Å; L726-V744 HydrophobicContact CD2-CG1 4.18Å; L726-V744 HydrophobicContact CD2-CG2 4.29Å; L726-E758 HydrophobicContact CD2-CG 4.46Å; L726-W767 HydrophobicContact CD2-CE3 4.4Å; L726-W767 HydrophobicContact CD2-CH2 3.41Å; L726-W767 VanDerWaalsContact CD2-CH2 3.41Å; L726-W767 HydrophobicContact CD2-CZ2 3.78Å; L726-W767 HydrophobicContact CD2-CZ3 3.75Å; L726-W767 HydrophobicContact CG-CH2 4.33Å; L726-W767 HydrophobicContact CG-CZ2 4.28Å
727	P	93.6	Very high	79.1	Confident	67 Å²	67	49.3 Å²	49.3	44%	0.435	27%	0.272	S	S	.	.	S	Bend	trans	-59.8	-32.2	175.5	-25.4	35	0	0	0	113.3	W767	P727-W767 HydrophobicContact CG-CB 3.45Å; P727-W767 VanDerWaalsContact CG-CB 3.45Å; P727-W767 HydrophobicContact CG-CD2 4.27Å; P727-W767 HydrophobicContact CG-CG 3.79Å
728	S	93.3	Very high	81.9	Confident	38 Å²	38	46.4 Å²	46.4	27%	0.266	25%	0.249	S	C	.	.	S	Bend	trans	-131.2	147.8	-177.2	67.3	0	0	0	0	111.5	L726 R730 E758	L726-S728 WeakPolarHBondContact CB-O 3.22Å; L726-S728 PolarHBondContact O-N 3.35Å; S728-R730 PolarHBondContact O-N 2.7Å; S728-E758 PolarHBondContact OG-OE1 2.78Å
729	R	96.6	Very high	84.1	Confident	141 Å²	141	42.3 Å²	42.3	53%	0.532	24%	0.243	S	C	.	.			trans	-59.5	131.6	172.6	-68.5	-178.8	-48.6	-152.7	-0.9	108.8	A654 I655 R656 N749	A654-R729 HydrophobicContact CB-CB 4.22Å; A654-R729 WeakPolarHBondContact O-CD 3.3Å; I655-R729 WeakPolarHBondContact O-CA 3.45Å; R656-R729 HydrophobicContact CG-CB 4.44Å; R656-R729 HydrophobicContact CG-CG 3.79Å; R729-N749 WeakPolarHBondContact O-CA 3.42Å; R729-N749 WeakPolarHBondContact O-CB 3.36Å
730	R	97.5	Very high	86.1	Confident	3 Å²	3	41.4 Å²	41.4	1%	0.011	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-150.8	137	-174.5	-158.7	174.5	-79.2	-117.9	7.8	112.2	G649 I655 L726 S728 G746 S756 E758	G649-R730 PolarHBondContact N-O 2.8Å; I655-R730 PolarHBondContact O-N 2.9Å; L726-R730 HydrophobicContact CD1-CB 3.98Å; S728-R730 PolarHBondContact O-N 2.7Å; R730-G746 WeakPolarHBondContact CD-O 3.5Å; R730-G746 PolarHBondContact NH1-O 2.8Å; R730-S756 PolarHBondContact NH1-O 2.89Å; R730-S756 PolarHBondContact NH2-OG 2.69Å; R730-E758 IonicContact CZ-OE1 2.85Å; R730-E758 IonicContact NE-OE1 3.37Å; R730-E758 IonicContact NH2-OE1 2.73Å; R730-E758 PolarHBondContact NH2-OE1 2.91Å
731	C	97.8	Very high	88.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-143	172.4	168	68.8	0	0	0	0	109.6	G649 Q650 A654 T733 G747 F748	G649-C731 WeakPolarHBondContact O-CB 3.3Å; Q650-C731 HydrophobicContact CG-CB 3.73Å; Q650-C731 VanDerWaalsContact CG-SG 3.55Å; A654-C731 HydrophobicContact CB-CB 4.27Å; C731-T733 PolarHBondContact O-N 2.82Å; C731-T733 VanDerWaalsContact O-N 3.12Å; C731-G747 CarbonylContact O-C 3.52Å; C731-G747 WeakPolarHBondContact O-CA 3.41Å; C731-F748 PolarHBondContact N-O 3.03Å; C731-F748 PolarHBondContact O-N 2.89Å
732	R	98.1	Very high	90	Very high	67 Å²	67	36.3 Å²	36.3	25%	0.253	22%	0.218	S	C	.	.	S	Bend	trans	60.7	23.5	176.2	-55.5	170.9	-177	-144.8	-2.2	113	Q650 G747 A778 T779 Y970	Q650-R732 VanDerWaalsContact OE1-CZ 3.24Å; R732-G747 VanDerWaalsContact O-CA 3.29Å; R732-G747 WeakPolarHBondContact O-CA 3.43Å; R732-A778 HydrophobicContact CB-CB 4.18Å; R732-T779 HydrophobicContact CB-CG2 3.67Å; R732-T779 HydrophobicContact CG-CG2 3.74Å; R732-T779 PolarHBondContact O-N 2.96Å; R732-Y970 HydrophobicContact CB-CD1 4.35Å; R732-Y970 HydrophobicContact CG-CD1 3.58Å; R732-Y970 HydrophobicContact CG-CD2 4.36Å; R732-Y970 HydrophobicContact CG-CE1 4.15Å; R732-Y970 HydrophobicContact CG-CG 3.66Å; R732-Y970 PolarHBondContact N-O 3.02Å
733	T	97.9	Very high	91.4	Very high	14 Å²	14	31.7 Å²	31.7	9%	0.086	19%	0.194	C	C	.	.			trans	-88.3	150.7	-178.4	-171.8	0	0	0	0	109.7	C731 V735 V744 I745 G746	C731-T733 PolarHBondContact O-N 2.82Å; C731-T733 VanDerWaalsContact O-N 3.12Å; T733-V735 HydrophobicContact CG2-CG2 4.21Å; T733-V744 HydrophobicContact CG2-CG1 3.82Å; T733-V744 WeakPolarHBondContact OG1-CG1 3.5Å; T733-I745 PolarHBondContact OG1-N 2.96Å; T733-I745 PolarHBondContact OG1-O 2.75Å; T733-G746 PolarHBondContact OG1-O 2.93Å
734	G	97.5	Very high	92.5	Very high	6 Å²	6	31.3 Å²	31.3	6%	0.062	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	157.8	156.9	0	0	0	0	0	110.1	I745	G734-I745 PolarHBondContact N-O 2.98Å; G734-I745 PolarHBondContact O-N 3.26Å
735	V	97.4	Very high	93.2	Very high	21 Å²	21	29.3 Å²	29.3	13%	0.127	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.5	168.9	-179.5	0	0	0	0	109.3	I647 T733 M742 Y743 V744 A974	I647-V735 HydrophobicContact CB-CG2 4.5Å; I647-V735 HydrophobicContact CD1-CG1 4.32Å; I647-V735 HydrophobicContact CD1-CG2 4.41Å; T733-V735 HydrophobicContact CG2-CG2 4.21Å; V735-M742 HydrophobicContact CG1-CG 3.7Å; V735-M742 HydrophobicContact CG1-SD 3.92Å; V735-Y743 CarbonylContact C-O 3.59Å; V735-Y743 VanDerWaalsContact CA-O 3.26Å; V735-Y743 WeakPolarHBondContact CA-O 3.37Å; V735-V744 HydrophobicContact CG2-CG1 4.37Å; V735-V744 HydrophobicContact CG2-CG2 4.3Å; V735-A974 HydrophobicContact CG1-CB 3.94Å
736	A	96.3	Very high	93.5	Very high	6 Å²	6	27.5 Å²	27.5	5%	0.05	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	153.4	172.8	0	0	0	0	0	110.3	M742 Y743 I745 V782 V784 I789	A736-M742 CarbonylContact O-C 3.46Å; A736-M742 WeakPolarHBondContact O-CA 3.39Å; A736-Y743 PolarHBondContact N-O 3.23Å; A736-Y743 PolarHBondContact O-N 3.48Å; A736-I745 HydrophobicContact CB-CD1 4.46Å; A736-V782 HydrophobicContact CB-CG1 3.82Å; A736-V784 HydrophobicContact CB-CG2 3.76Å; A736-I789 HydrophobicContact CB-CD1 4.1Å; A736-I789 HydrophobicContact CB-CG1 4.34Å; A736-I789 HydrophobicContact CB-CG2 3.56Å
737	V	92.6	Very high	93.7	Very high	51 Å²	51	27.5 Å²	27.5	31%	0.309	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	123.9	170.2	179.7	0	0	0	0	107.8	L741 M742 A974 I976	V737-L741 WeakPolarHBondContact CA-O 3.27Å; V737-M742 HydrophobicContact CG2-CB 4.36Å; V737-M742 HydrophobicContact CG2-CG 4.28Å; V737-A974 HydrophobicContact CG2-CB 3.75Å; V737-I976 HydrophobicContact CG1-CG2 4.11Å; V737-I976 HydrophobicContact CG2-CG2 3.83Å
738	L	87.6	Confident	94	Very high	29 Å²	29	26.1 Å²	26.1	15%	0.152	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	134.7	-178	179.7	63.1	0	0	0	110.2	G740 L741 Y743 V784 G787 I789 I809	L738-G740 VanDerWaalsContact C-N 3.29Å; L738-G740 PolarHBondContact O-N 3.06Å; L738-L741 PolarHBondContact N-O 3.01Å; L738-L741 PolarHBondContact O-N 3.01Å; L738-L741 VanDerWaalsContact O-N 3.1Å; L738-Y743 HydrophobicContact CB-CE2 4.24Å; L738-V784 HydrophobicContact CD1-CG1 4.03Å; L738-G787 WeakPolarHBondContact CD2-O 3.35Å; L738-I789 HydrophobicContact CB-CD1 4.18Å; L738-I789 HydrophobicContact CB-CG1 4.38Å; L738-I789 HydrophobicContact CD2-CD1 4Å; L738-I789 HydrophobicContact CD2-CG1 3.61Å; L738-I809 HydrophobicContact CD2-CD1 3.85Å; L738-I809 HydrophobicContact CD2-CG1 4.11Å; L738-I809 HydrophobicContact CD2-CG2 3.87Å; L738-I809 HydrophobicContact CG-CD1 3.93Å
739	G	77.6	Confident	94.1	Very high	62 Å²	62	26.8 Å²	26.8	64%	0.639	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	31.6	176.8	0	0	0	0	0	114.4	L741	G739-L741 PolarHBondContact O-N 3.46Å
740	G	77.2	Confident	93.9	Very high	47 Å²	47	21.7 Å²	21.7	49%	0.485	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	3.6	-176	0	0	0	0	0	115	L738 L762	L738-G740 VanDerWaalsContact C-N 3.29Å; L738-G740 PolarHBondContact O-N 3.06Å; G740-L762 WeakPolarHBondContact O-CD1 3.24Å; G740-L762 WeakPolarHBondContact O-CG 3.14Å
741	L	86.4	Confident	93.7	Very high	23 Å²	23	25.7 Å²	25.7	12%	0.12	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	144.9	-179.2	-57.1	177.9	0	0	0	111	L625 V737 L738 G739 Y743 V759 Y760 D761	L625-L741 HydrophobicContact CD1-CD1 3.99Å; L625-L741 HydrophobicContact CD2-CD1 4.2Å; L625-L741 HydrophobicContact CG-CD1 4.37Å; V737-L741 WeakPolarHBondContact CA-O 3.27Å; L738-L741 PolarHBondContact N-O 3.01Å; L738-L741 PolarHBondContact O-N 3.01Å; L738-L741 VanDerWaalsContact O-N 3.1Å; G739-L741 PolarHBondContact O-N 3.46Å; L741-Y743 HydrophobicContact CB-CD2 4.48Å; L741-Y743 HydrophobicContact CB-CE2 3.73Å; L741-V759 HydrophobicContact CB-CG1 4Å; L741-V759 HydrophobicContact CD1-CG1 4.07Å; L741-Y760 WeakPolarHBondContact CA-O 3.28Å; L741-D761 HydrophobicContact CD2-CB 3.96Å
742	M	92.7	Very high	93.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.3	173	-179.6	-179.3	61.7	0	0	110.6	L645 I647 V735 A736 V737 V744 V759 Y760 W767 A974	L645-M742 HydrophobicContact CD1-CE 3.93Å; L645-M742 HydrophobicContact CD1-SD 3.96Å; I647-M742 HydrophobicContact CD1-SD 3.76Å; I647-M742 HydrophobicContact CG1-CE 3.93Å; I647-M742 HydrophobicContact CG1-SD 3.82Å; V735-M742 HydrophobicContact CG1-CG 3.7Å; V735-M742 HydrophobicContact CG1-SD 3.92Å; A736-M742 CarbonylContact O-C 3.46Å; A736-M742 WeakPolarHBondContact O-CA 3.39Å; V737-M742 HydrophobicContact CG2-CB 4.36Å; V737-M742 HydrophobicContact CG2-CG 4.28Å; M742-V744 HydrophobicContact CE-CG2 4.46Å; M742-V759 CarbonylContact O-C 3.43Å; M742-V759 WeakPolarHBondContact O-CA 3.29Å; M742-Y760 HydrophobicContact CE-CD1 3.89Å; M742-Y760 HydrophobicContact CE-CG 4.31Å; M742-Y760 PolarHBondContact N-O 2.88Å; M742-Y760 PolarHBondContact O-N 2.86Å; M742-W767 HydrophobicContact CE-CH2 3.7Å; M742-W767 HydrophobicContact CE-CZ2 4.17Å; M742-A974 HydrophobicContact SD-CB 3.95Å
743	Y	95.8	Very high	93.6	Very high	3 Å²	3	30.4 Å²	30.4	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.7	-177.1	-62.4	-103.3	0	0	0	110.1	V735 A736 L738 L741 V757 V759 I789 L807 I809	V735-Y743 CarbonylContact C-O 3.59Å; V735-Y743 VanDerWaalsContact CA-O 3.26Å; V735-Y743 WeakPolarHBondContact CA-O 3.37Å; A736-Y743 PolarHBondContact N-O 3.23Å; A736-Y743 PolarHBondContact O-N 3.48Å; L738-Y743 HydrophobicContact CB-CE2 4.24Å; L741-Y743 HydrophobicContact CB-CD2 4.48Å; L741-Y743 HydrophobicContact CB-CE2 3.73Å; Y743-V757 HydrophobicContact CD1-CG1 4.16Å; Y743-V759 HydrophobicContact CD1-CB 4.46Å; Y743-V759 HydrophobicContact CD1-CG1 4.13Å; Y743-V759 HydrophobicContact CD1-CG2 3.63Å; Y743-V759 HydrophobicContact CE1-CG1 3.89Å; Y743-V759 HydrophobicContact CE1-CG2 3.78Å; Y743-I789 HydrophobicContact CD1-CD1 4.01Å; Y743-I789 HydrophobicContact CD2-CD1 3.5Å; Y743-I789 HydrophobicContact CE1-CD1 4.29Å; Y743-I789 HydrophobicContact CE2-CD1 3.82Å; Y743-I789 HydrophobicContact CG-CD1 3.62Å; Y743-L807 HydrophobicContact CD1-CD2 4.32Å; Y743-L807 HydrophobicContact CE1-CD2 4.31Å; Y743-I809 HydrophobicContact CE1-CG2 4.21Å; Y743-I809 WeakPolarHBondContact OH-CG2 3.3Å
744	V	97.8	Very high	93.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	100.4	-179.2	-174.5	0	0	0	0	109	I647 L726 T733 V735 M742 V757 E758 W767	I647-V744 HydrophobicContact CG2-CG1 4.14Å; I647-V744 HydrophobicContact CG2-CG2 3.92Å; L726-V744 HydrophobicContact CD2-CB 4.46Å; L726-V744 HydrophobicContact CD2-CG1 4.18Å; L726-V744 HydrophobicContact CD2-CG2 4.29Å; T733-V744 HydrophobicContact CG2-CG1 3.82Å; T733-V744 WeakPolarHBondContact OG1-CG1 3.5Å; V735-V744 HydrophobicContact CG2-CG1 4.37Å; V735-V744 HydrophobicContact CG2-CG2 4.3Å; M742-V744 HydrophobicContact CE-CG2 4.46Å; V744-V757 WeakPolarHBondContact O-CA 3.48Å; V744-E758 HydrophobicContact CB-CB 4.39Å; V744-E758 PolarHBondContact N-O 3Å; V744-E758 PolarHBondContact O-N 2.79Å; V744-W767 HydrophobicContact CB-CZ3 4.32Å; V744-W767 HydrophobicContact CG2-CH2 3.64Å; V744-W767 HydrophobicContact CG2-CZ3 3.63Å
745	I	98.4	Very high	93.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	115.5	-158.1	-64.1	159.5	0	0	0	110.9	T733 G734 A736 V757 M773 L780 V782 I789 A791 W814	T733-I745 PolarHBondContact OG1-N 2.96Å; T733-I745 PolarHBondContact OG1-O 2.75Å; G734-I745 PolarHBondContact N-O 2.98Å; G734-I745 PolarHBondContact O-N 3.26Å; A736-I745 HydrophobicContact CB-CD1 4.46Å; I745-V757 HydrophobicContact CB-CG2 4.42Å; I745-V757 HydrophobicContact CG1-CB 4.46Å; I745-V757 HydrophobicContact CG1-CG1 3.76Å; I745-V757 HydrophobicContact CG1-CG2 3.99Å; I745-V757 HydrophobicContact CG2-CG2 4.28Å; I745-M773 HydrophobicContact CG2-CE 3.87Å; I745-M773 HydrophobicContact CG2-CG 4.31Å; I745-M773 HydrophobicContact CG2-SD 3.46Å; I745-M773 WeakPolarHBondContact CG2-SD 2.97Å; I745-L780 HydrophobicContact CG2-CD1 4.16Å; I745-V782 HydrophobicContact CB-CG2 4.26Å; I745-V782 HydrophobicContact CD1-CG1 4.03Å; I745-V782 HydrophobicContact CD1-CG2 4.36Å; I745-V782 HydrophobicContact CG2-CG2 4.21Å; I745-I789 HydrophobicContact CD1-CG2 3.6Å; I745-A791 HydrophobicContact CG2-CB 4.34Å; I745-W814 HydrophobicContact CD1-CH2 4.21Å; I745-W814 HydrophobicContact CD1-CZ2 4.44Å; I745-W814 HydrophobicContact CG1-CZ2 4.45Å; I745-W814 HydrophobicContact CG2-CH2 4.02Å; I745-W814 HydrophobicContact CG2-CZ2 4.13Å
746	G	98.3	Very high	93.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	23%	0.226	C	C	.	.			trans	69.8	-144.9	175.5	0	0	0	0	0	114.1	R730 T733 V754 S756 R777	R730-G746 WeakPolarHBondContact CD-O 3.5Å; R730-G746 PolarHBondContact NH1-O 2.8Å; T733-G746 PolarHBondContact OG1-O 2.93Å; G746-V754 WeakPolarHBondContact O-CG2 3.42Å; G746-S756 PolarHBondContact N-O 3.47Å; G746-S756 VanDerWaalsContact N-O 3.16Å; G746-R777 CarbonylContact C-O 3.58Å
747	G	98.2	Very high	93.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.224	C	C	.	.			trans	92.6	-155.3	-176.3	0	0	0	0	0	114.4	C731 R732 R753 V754 R777	C731-G747 CarbonylContact O-C 3.52Å; C731-G747 WeakPolarHBondContact O-CA 3.41Å; R732-G747 VanDerWaalsContact O-CA 3.29Å; R732-G747 WeakPolarHBondContact O-CA 3.43Å; G747-R753 CarbonylContact O-C 3.47Å; G747-R753 WeakPolarHBondContact O-CA 3.3Å; G747-V754 PolarHBondContact O-N 3.22Å; G747-R777 PolarHBondContact N-O 3.43Å
748	F	98.3	Very high	93.8	Very high	37 Å²	37	34.8 Å²	34.8	16%	0.162	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-135.4	130.1	-169.5	179.5	-108.8	0	0	0	110.4	C731 G750 S751 L752 R753 A778	C731-F748 PolarHBondContact N-O 3.03Å; C731-F748 PolarHBondContact O-N 2.89Å; F748-G750 VanDerWaalsContact CE1-CA 3.4Å; F748-S751 VanDerWaalsContact CE2-C 3.44Å; F748-S751 WeakPolarHBondContact CE2-O 3.33Å; F748-L752 WeakPolarHBondContact CA-O 3.47Å; F748-L752 VanDerWaalsContact CD2-C 3.42Å; F748-L752 VanDerWaalsContact CD2-O 3.22Å; F748-L752 WeakPolarHBondContact CD2-O 3.48Å; F748-R753 HydrophobicContact CD2-CG 4.31Å; F748-A778 HydrophobicContact CB-CB 4.38Å
749	N	95.5	Very high	94.1	Very high	52 Å²	52	33.4 Å²	33.4	28%	0.278	21%	0.205	S	C	.	.			trans	-95.4	10.6	-172.7	71.9	1.3	0	0	0	115.2	R729 S751 L752 V754	R729-N749 WeakPolarHBondContact O-CA 3.42Å; R729-N749 WeakPolarHBondContact O-CB 3.36Å; N749-S751 PolarHBondContact OD1-N 2.84Å; N749-L752 PolarHBondContact N-O 3.35Å; N749-L752 VanDerWaalsContact N-O 3.08Å; N749-L752 PolarHBondContact OD1-N 2.78Å; N749-L752 PolarHBondContact OD1-O 2.73Å; N749-V754 HydrophobicContact CB-CG1 4.39Å
750	G	92.3	Very high	94.8	Very high	35 Å²	35	30.5 Å²	30.5	36%	0.361	18%	0.175	S	C	.	.	S	Bend	trans	95.2	-10.1	-170.3	0	0	0	0	0	114.3	F748	F748-G750 VanDerWaalsContact CE1-CA 3.4Å
751	S	94.3	Very high	95	Very high	86 Å²	86	28.9 Å²	28.9	60%	0.601	16%	0.155	S	C	*	.	S	Bend	trans	-137.9	-44.9	178.4	-54	0	0	0	0	113.3	F748 N749	F748-S751 VanDerWaalsContact CE2-C 3.44Å; F748-S751 WeakPolarHBondContact CE2-O 3.33Å; N749-S751 PolarHBondContact OD1-N 2.84Å
752	L	95.8	Very high	94.5	Very high	95 Å²	95	28.2 Å²	28.2	50%	0.497	15%	0.152	S	C	.	.	S	Bend	trans	-125.1	151.6	-179.1	-65.6	177.3	0	0	0	111.4	F748 N749	F748-L752 WeakPolarHBondContact CA-O 3.47Å; F748-L752 VanDerWaalsContact CD2-C 3.42Å; F748-L752 VanDerWaalsContact CD2-O 3.22Å; F748-L752 WeakPolarHBondContact CD2-O 3.48Å; N749-L752 PolarHBondContact N-O 3.35Å; N749-L752 VanDerWaalsContact N-O 3.08Å; N749-L752 PolarHBondContact OD1-N 2.78Å; N749-L752 PolarHBondContact OD1-O 2.73Å
753	R	97.6	Very high	93.4	Very high	71 Å²	71	32.4 Å²	32.4	27%	0.268	17%	0.174	S	C	.	.	B	Isolated β-bridge	trans	-75.7	139.8	162.7	-69.1	73.5	170.1	168.1	-3.6	107.6	G747 F748 R776 A778 F795 D796	G747-R753 CarbonylContact O-C 3.47Å; G747-R753 WeakPolarHBondContact O-CA 3.3Å; F748-R753 HydrophobicContact CD2-CG 4.31Å; R753-R776 HydrophobicContact CB-CB 4.44Å; R753-R776 WeakPolarHBondContact O-CD 3.41Å; R753-A778 HydrophobicContact CB-CB 4.26Å; R753-A778 HydrophobicContact CG-CB 3.61Å; R753-F795 VanDerWaalsContact NH2-CE1 3.31Å; R753-D796 WeakPolarHBondContact CB-O 3.37Å
754	V	97.9	Very high	92.3	Very high	21 Å²	21	36.6 Å²	36.6	13%	0.127	19%	0.19	C	C	.	.			trans	-115.6	160.7	-172.9	-58.8	0	0	0	0	112.2	G746 G747 N749 R777	G746-V754 WeakPolarHBondContact O-CG2 3.42Å; G747-V754 PolarHBondContact O-N 3.22Å; N749-V754 HydrophobicContact CB-CG1 4.39Å; V754-R777 PolarHBondContact O-N 2.86Å; V754-R777 VanDerWaalsContact O-N 3.08Å
755	R	97.6	Very high	91.4	Very high	123 Å²	123	38.2 Å²	38.2	46%	0.464	20%	0.198	S	C	.	.			trans	-112.1	-4.8	171.5	67.8	-180	-175.6	166.4	-1.4	113.2	N772 M773 C775 R776	R755-N772 HydrophobicContact CG-CB 4.16Å; R755-N772 WeakPolarHBondContact O-CA 3.34Å; R755-M773 HydrophobicContact CB-CB 4.23Å; R755-M773 WeakPolarHBondContact CD-O 3.19Å; R755-M773 PolarHBondContact O-N 2.92Å; R755-C775 WeakPolarHBondContact CB-O 3.46Å; R755-R776 HydrophobicContact CB-CG 4.3Å
756	S	97.3	Very high	90.7	Very high	33 Å²	33	40.8 Å²	40.8	23%	0.231	21%	0.214	C	C	.	.			trans	-73.9	148.9	-178.5	53	0	0	0	0	111.4	R730 G746 N772	R730-S756 PolarHBondContact NH1-O 2.89Å; R730-S756 PolarHBondContact NH2-OG 2.69Å; G746-S756 PolarHBondContact N-O 3.47Å; G746-S756 VanDerWaalsContact N-O 3.16Å; S756-N772 VanDerWaalsContact CA-OD1 3.26Å; S756-N772 WeakPolarHBondContact CA-OD1 3.5Å
757	V	97.3	Very high	90.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130.2	171.9	-178.9	0	0	0	0	106.7	Y743 V744 I745 V759 G770 P771 W814	Y743-V757 HydrophobicContact CD1-CG1 4.16Å; V744-V757 WeakPolarHBondContact O-CA 3.48Å; I745-V757 HydrophobicContact CB-CG2 4.42Å; I745-V757 HydrophobicContact CG1-CB 4.46Å; I745-V757 HydrophobicContact CG1-CG1 3.76Å; I745-V757 HydrophobicContact CG1-CG2 3.99Å; I745-V757 HydrophobicContact CG2-CG2 4.28Å; V757-V759 HydrophobicContact CG1-CG2 4.09Å; V757-G770 WeakPolarHBondContact O-CA 3.25Å; V757-G770 PolarHBondContact O-N 3.01Å; V757-P771 VanDerWaalsContact CG2-O 3.24Å; V757-P771 WeakPolarHBondContact CG2-O 3.43Å; V757-W814 HydrophobicContact CG2-CZ2 3.87Å
758	E	96	Very high	90.1	Very high	13 Å²	13	45.2 Å²	45.2	6%	0.061	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	138.7	163.5	-37.1	-70.3	-173.8	0	0	107.3	L726 S728 R730 V744 W767	L726-E758 HydrophobicContact CD2-CG 4.46Å; S728-E758 PolarHBondContact OG-OE1 2.78Å; R730-E758 IonicContact CZ-OE1 2.85Å; R730-E758 IonicContact NE-OE1 3.37Å; R730-E758 IonicContact NH2-OE1 2.73Å; R730-E758 PolarHBondContact NH2-OE1 2.91Å; V744-E758 HydrophobicContact CB-CB 4.39Å; V744-E758 PolarHBondContact N-O 3Å; V744-E758 PolarHBondContact O-N 2.79Å; E758-W767 HydrophobicContact CB-CE3 3.56Å; E758-W767 HydrophobicContact CB-CZ3 3.69Å
759	V	94.5	Very high	89.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127	178.5	-172.2	0	0	0	0	108.4	W621 L741 M742 Y743 V757 W767 H768	W621-V759 HydrophobicContact CH2-CG2 3.99Å; W621-V759 HydrophobicContact CZ3-CB 4.45Å; W621-V759 HydrophobicContact CZ3-CG1 4.21Å; W621-V759 HydrophobicContact CZ3-CG2 4.25Å; L741-V759 HydrophobicContact CB-CG1 4Å; L741-V759 HydrophobicContact CD1-CG1 4.07Å; M742-V759 CarbonylContact O-C 3.43Å; M742-V759 WeakPolarHBondContact O-CA 3.29Å; Y743-V759 HydrophobicContact CD1-CB 4.46Å; Y743-V759 HydrophobicContact CD1-CG1 4.13Å; Y743-V759 HydrophobicContact CD1-CG2 3.63Å; Y743-V759 HydrophobicContact CE1-CG1 3.89Å; Y743-V759 HydrophobicContact CE1-CG2 3.78Å; V757-V759 HydrophobicContact CG1-CG2 4.09Å; V759-W767 CarbonylContact O-C 3.56Å; V759-W767 WeakPolarHBondContact O-CA 3.26Å; V759-H768 PolarHBondContact N-O 2.89Å; V759-H768 PolarHBondContact O-N 3.37Å
760	Y	91.3	Very high	89.7	Confident	1 Å²	1	45.6 Å²	45.6	0%	0.004	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.2	-180	-176.1	-121.8	0	0	0	110.3	I723 L741 M742 L762 N765 W767	I723-Y760 HydrophobicContact CG2-CE1 4.07Å; L741-Y760 WeakPolarHBondContact CA-O 3.28Å; M742-Y760 HydrophobicContact CE-CD1 3.89Å; M742-Y760 HydrophobicContact CE-CG 4.31Å; M742-Y760 PolarHBondContact N-O 2.88Å; M742-Y760 PolarHBondContact O-N 2.86Å; Y760-L762 HydrophobicContact CD1-CD2 3.52Å; Y760-L762 HydrophobicContact CE1-CD2 3.6Å; Y760-N765 PolarHBondContact OH-OD1 3.14Å; Y760-W767 AromaticContact CD2-CD1 3.75Å; Y760-W767 AromaticContact CD2-CD2 3.77Å; Y760-W767 HydrophobicContact CD2-CD2 3.77Å; Y760-W767 AromaticContact CD2-CE2 3.54Å; Y760-W767 HydrophobicContact CD2-CE3 4.46Å; Y760-W767 AromaticContact CD2-CG 3.9Å; Y760-W767 HydrophobicContact CD2-CG 3.9Å; Y760-W767 HydrophobicContact CD2-CZ2 4.07Å; Y760-W767 AromaticContact CD2-NE1 3.51Å; Y760-W767 AromaticContact CE2-NE1 3.84Å; Y760-W767 HydrophobicContact CG-CD2 4.17Å; Y760-W767 AromaticContact CG-CE2 3.92Å; Y760-W767 HydrophobicContact CG-CE3 4.46Å; Y760-W767 HydrophobicContact CG-CH2 4.3Å; Y760-W767 AromaticContact CG-CZ2 4Å; Y760-W767 HydrophobicContact CG-CZ2 4Å
761	D	82.6	Confident	89.7	Confident	13 Å²	13	45.4 Å²	45.4	7%	0.07	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	110.8	171.9	-175.1	-29.8	0	0	0	109.1	L741 L763 R764 N765 T766	L741-D761 HydrophobicContact CD2-CB 3.96Å; D761-L763 VanDerWaalsContact C-N 3.32Å; D761-L763 PolarHBondContact O-N 3.32Å; D761-L763 PolarHBondContact OD1-N 3.02Å; D761-R764 HydrophobicContact CB-CB 4.13Å; D761-R764 PolarHBondContact O-N 2.87Å; D761-R764 PolarHBondContact OD1-N 2.82Å; D761-R764 VanDerWaalsContact OD2-CD 3.27Å; D761-R764 WeakPolarHBondContact OD2-CD 3.36Å; D761-R764 WeakPolarHBondContact OD2-CG 3.21Å; D761-R764 IonicContact OD2-CZ 3.21Å; D761-R764 IonicContact OD2-NE 3.63Å; D761-R764 IonicContact OD2-NH1 3.86Å; D761-R764 PolarHBondContact OD2-NH1 3.33Å; D761-N765 WeakPolarHBondContact O-CA 3.13Å; D761-N765 PolarHBondContact O-N 3.01Å; D761-T766 PolarHBondContact N-O 3.4Å; D761-T766 PolarHBondContact O-N 3.34Å
762	L	74.6	Confident	89.8	Confident	9 Å²	9	45.4 Å²	45.4	5%	0.047	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-34.1	-177	-59.7	-177.3	0	0	0	112.8	G740 Y760 I976 I981	G740-L762 WeakPolarHBondContact O-CD1 3.24Å; G740-L762 WeakPolarHBondContact O-CG 3.14Å; Y760-L762 HydrophobicContact CD1-CD2 3.52Å; Y760-L762 HydrophobicContact CE1-CD2 3.6Å; L762-I976 HydrophobicContact CD1-CB 3.86Å; L762-I976 HydrophobicContact CD1-CD1 3.95Å; L762-I976 HydrophobicContact CD1-CG1 4.48Å; L762-I976 HydrophobicContact CD1-CG2 3.85Å; L762-I976 HydrophobicContact CD2-CD1 3.54Å; L762-I976 HydrophobicContact CD2-CG2 4.39Å; L762-I976 HydrophobicContact CG-CD1 4.35Å; L762-I981 WeakPolarHBondContact O-CD1 3.07Å
763	L	70.2	Confident	89.9	Confident	89 Å²	89	40.9 Å²	40.9	47%	0.466	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-26.3	-177	-65.8	165.9	0	0	0	111.7	P634 D761	P634-L763 HydrophobicContact CB-CD1 3.78Å; P634-L763 HydrophobicContact CG-CD1 4.4Å; D761-L763 VanDerWaalsContact C-N 3.32Å; D761-L763 PolarHBondContact O-N 3.32Å; D761-L763 PolarHBondContact OD1-N 3.02Å
764	R	73.4	Confident	89.7	Confident	91 Å²	91	43.8 Å²	43.8	34%	0.343	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-9.1	-179.5	-61.9	-172.4	177.4	93	2.1	114.5	L584 D761 T766	L584-R764 VanDerWaalsContact CD2-NH2 3.33Å; D761-R764 HydrophobicContact CB-CB 4.13Å; D761-R764 PolarHBondContact O-N 2.87Å; D761-R764 PolarHBondContact OD1-N 2.82Å; D761-R764 VanDerWaalsContact OD2-CD 3.27Å; D761-R764 WeakPolarHBondContact OD2-CD 3.36Å; D761-R764 WeakPolarHBondContact OD2-CG 3.21Å; D761-R764 IonicContact OD2-CZ 3.21Å; D761-R764 IonicContact OD2-NE 3.63Å; D761-R764 IonicContact OD2-NH1 3.86Å; D761-R764 PolarHBondContact OD2-NH1 3.33Å; R764-T766 WeakPolarHBondContact CB-OG1 3.47Å; R764-T766 PolarHBondContact O-N 3.33Å
765	N	77.9	Confident	89.5	Confident	34 Å²	34	44.6 Å²	44.6	18%	0.182	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	37.6	-174.3	-171	3.2	0	0	0	112.2	I722 S724 Y760 D761 I981	I722-N765 PolarHBondContact O-ND2 2.77Å; I722-N765 PolarHBondContact O-OD1 3.41Å; S724-N765 WeakPolarHBondContact CB-OD1 3.49Å; S724-N765 PolarHBondContact N-OD1 3.11Å; S724-N765 PolarHBondContact OG-O 2.87Å; S724-N765 PolarHBondContact OG-OD1 2.78Å; Y760-N765 PolarHBondContact OH-OD1 3.14Å; D761-N765 WeakPolarHBondContact O-CA 3.13Å; D761-N765 PolarHBondContact O-N 3.01Å; N765-I981 HydrophobicContact CB-CD1 4.39Å
766	T	84.9	Confident	89.5	Confident	54 Å²	54	44.6 Å²	44.6	33%	0.331	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	139.5	-174.8	48.2	0	0	0	0	113.2	D761 R764 H768	D761-T766 PolarHBondContact N-O 3.4Å; D761-T766 PolarHBondContact O-N 3.34Å; R764-T766 WeakPolarHBondContact CB-OG1 3.47Å; R764-T766 PolarHBondContact O-N 3.33Å; T766-H768 PolarHBondContact OG1-CE1 2.79Å; T766-H768 PolarHBondContact OG1-NE2 3.4Å
767	W	91.3	Very high	89.6	Confident	37 Å²	37	43.2 Å²	43.2	14%	0.14	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	141.1	171.5	-70	94.5	0	0	0	111.7	V658 S724 D725 L726 P727 M742 V744 E758 V759 Y760	V658-W767 HydrophobicContact CG2-CZ2 4.26Å; S724-W767 PolarHBondContact O-NE1 3.15Å; D725-W767 PolarHBondContact O-NE1 3.14Å; L726-W767 HydrophobicContact CD2-CE3 4.4Å; L726-W767 HydrophobicContact CD2-CH2 3.41Å; L726-W767 VanDerWaalsContact CD2-CH2 3.41Å; L726-W767 HydrophobicContact CD2-CZ2 3.78Å; L726-W767 HydrophobicContact CD2-CZ3 3.75Å; L726-W767 HydrophobicContact CG-CH2 4.33Å; L726-W767 HydrophobicContact CG-CZ2 4.28Å; P727-W767 HydrophobicContact CG-CB 3.45Å; P727-W767 VanDerWaalsContact CG-CB 3.45Å; P727-W767 HydrophobicContact CG-CD2 4.27Å; P727-W767 HydrophobicContact CG-CG 3.79Å; M742-W767 HydrophobicContact CE-CH2 3.7Å; M742-W767 HydrophobicContact CE-CZ2 4.17Å; V744-W767 HydrophobicContact CB-CZ3 4.32Å; V744-W767 HydrophobicContact CG2-CH2 3.64Å; V744-W767 HydrophobicContact CG2-CZ3 3.63Å; E758-W767 HydrophobicContact CB-CE3 3.56Å; E758-W767 HydrophobicContact CB-CZ3 3.69Å; V759-W767 CarbonylContact O-C 3.56Å; V759-W767 WeakPolarHBondContact O-CA 3.26Å; Y760-W767 AromaticContact CD2-CD1 3.75Å; Y760-W767 AromaticContact CD2-CD2 3.77Å; Y760-W767 HydrophobicContact CD2-CD2 3.77Å; Y760-W767 AromaticContact CD2-CE2 3.54Å; Y760-W767 HydrophobicContact CD2-CE3 4.46Å; Y760-W767 AromaticContact CD2-CG 3.9Å; Y760-W767 HydrophobicContact CD2-CG 3.9Å; Y760-W767 HydrophobicContact CD2-CZ2 4.07Å; Y760-W767 AromaticContact CD2-NE1 3.51Å; Y760-W767 AromaticContact CE2-NE1 3.84Å; Y760-W767 HydrophobicContact CG-CD2 4.17Å; Y760-W767 AromaticContact CG-CE2 3.92Å; Y760-W767 HydrophobicContact CG-CE3 4.46Å; Y760-W767 HydrophobicContact CG-CH2 4.3Å; Y760-W767 AromaticContact CG-CZ2 4Å; Y760-W767 HydrophobicContact CG-CZ2 4Å
768	H	91.2	Very high	89.6	Confident	55 Å²	55	43.3 Å²	43.3	26%	0.255	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	149.4	180	-52.9	-60.7	0	0	0	110	W621 V759 T766 G770	W621-H768 HydrophobicContact CD2-CB 4.18Å; W621-H768 HydrophobicContact CG-CB 4.02Å; V759-H768 PolarHBondContact N-O 2.89Å; V759-H768 PolarHBondContact O-N 3.37Å; T766-H768 PolarHBondContact OG1-CE1 2.79Å; T766-H768 PolarHBondContact OG1-NE2 3.4Å; H768-G770 PolarHBondContact O-N 2.78Å
769	S	93	Very high	89.7	Confident	89 Å²	89	43.5 Å²	43.5	62%	0.622	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	115.7	176.1	-59	0	0	0	0	110.7	W621	W621-S769 PolarHBondContact NE1-O 2.91Å
770	G	92.6	Very high	89.9	Confident	8 Å²	8	44 Å²	44	8%	0.082	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-71.6	169.2	175.5	0	0	0	0	0	113.7	V757 H768 N772	V757-G770 WeakPolarHBondContact O-CA 3.25Å; V757-G770 PolarHBondContact O-N 3.01Å; H768-G770 PolarHBondContact O-N 2.78Å; G770-N772 PolarHBondContact O-N 2.9Å
771	P	93	Very high	90.3	Very high	32 Å²	32	44.3 Å²	44.3	21%	0.208	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-59.1	132.4	169.6	27.1	-33.9	0	0	0	109.7	V757 L807 G812 W814	V757-P771 VanDerWaalsContact CG2-O 3.24Å; V757-P771 WeakPolarHBondContact CG2-O 3.43Å; P771-L807 HydrophobicContact CG-CD1 3.69Å; P771-L807 HydrophobicContact CG-CD2 4.17Å; P771-G812 WeakPolarHBondContact CB-O 3.38Å; P771-W814 PolarHBondContact O-NE1 2.82Å
772	N	96.3	Very high	91	Very high	85 Å²	85	44.6 Å²	44.6	46%	0.455	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-68.2	138.2	176.3	-72.9	-85.4	0	0	0	110	R755 S756 G770 W814	R755-N772 HydrophobicContact CG-CB 4.16Å; R755-N772 WeakPolarHBondContact O-CA 3.34Å; S756-N772 VanDerWaalsContact CA-OD1 3.26Å; S756-N772 WeakPolarHBondContact CA-OD1 3.5Å; G770-N772 PolarHBondContact O-N 2.9Å; N772-W814 VanDerWaalsContact C-CD1 3.46Å
773	M	97.9	Very high	92.1	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-56.5	156.5	161.7	-73	-178.1	-59.5	0	0	110.5	I745 R755 C775 R777 L780 A791 E805 W814	I745-M773 HydrophobicContact CG2-CE 3.87Å; I745-M773 HydrophobicContact CG2-CG 4.31Å; I745-M773 HydrophobicContact CG2-SD 3.46Å; I745-M773 WeakPolarHBondContact CG2-SD 2.97Å; R755-M773 HydrophobicContact CB-CB 4.23Å; R755-M773 WeakPolarHBondContact CD-O 3.19Å; R755-M773 PolarHBondContact O-N 2.92Å; M773-C775 WeakPolarHBondContact CB-O 3.15Å; M773-R777 HydrophobicContact CE-CB 4Å; M773-R777 HydrophobicContact CE-CG 4.18Å; M773-R777 HydrophobicContact SD-CG 4.27Å; M773-L780 HydrophobicContact SD-CD1 4.28Å; M773-A791 HydrophobicContact SD-CB 3.73Å; M773-E805 VanDerWaalsContact CA-OE2 3.24Å; M773-E805 WeakPolarHBondContact CA-OE2 3.46Å; M773-E805 WeakPolarHBondContact CB-OE2 3.5Å; M773-E805 HydrophobicContact CG-CG 4.48Å; M773-W814 HydrophobicContact CG-CD2 3.9Å; M773-W814 HydrophobicContact CG-CE3 4.21Å; M773-W814 HydrophobicContact CG-CH2 4.06Å; M773-W814 HydrophobicContact CG-CZ2 3.7Å; M773-W814 HydrophobicContact CG-CZ3 4.29Å; M773-W814 HydrophobicContact SD-CH2 4.43Å
774	E	94	Very high	93.4	Very high	131 Å²	131	42.8 Å²	42.8	61%	0.612	23%	0.226	S	C	*	.	S	Bend	trans	-64.2	-54	171.4	-175	175	-170	0	0	109.6	E805	E774-E805 PolarHBondContact N-OE2 3.01Å
775	C	92.3	Very high	94.4	Very high	39 Å²	39	39 Å²	39	26%	0.264	21%	0.212	S	C	.	.	S	Bend	trans	-89.5	152.3	-178.9	-66.4	0	0	0	0	113.3	R755 M773 R777 L801 E805	R755-C775 WeakPolarHBondContact CB-O 3.46Å; M773-C775 WeakPolarHBondContact CB-O 3.15Å; C775-R777 HydrophobicContact CB-CG 4.2Å; C775-L801 HydrophobicContact CB-CD1 4.5Å; C775-E805 PolarHBondContact N-OE1 2.94Å
776	R	98.1	Very high	94.9	Very high	123 Å²	123	42.9 Å²	42.9	46%	0.464	23%	0.233	S	C	.	.			trans	-74.2	133.8	161.2	-66	176.1	-179.5	-162	1.9	108.1	R753 R755 D796	R753-R776 HydrophobicContact CB-CB 4.44Å; R753-R776 WeakPolarHBondContact O-CD 3.41Å; R755-R776 HydrophobicContact CB-CG 4.3Å; R776-D796 HydrophobicContact CB-CB 4.38Å; R776-D796 VanDerWaalsContact O-CA 3.29Å; R776-D796 WeakPolarHBondContact O-CA 3.38Å; R776-D796 WeakPolarHBondContact O-CB 3.45Å
777	R	98.5	Very high	95	Very high	3 Å²	3	42 Å²	42	1%	0.011	23%	0.234	C	C	.	.			trans	-142.8	122.9	-178.6	-56.6	-172.7	-178.8	-95.2	-1.2	110.6	G746 G747 V754 M773 C775 L780 G793 L801 S803 E805	G746-R777 CarbonylContact C-O 3.58Å; G747-R777 PolarHBondContact N-O 3.43Å; V754-R777 PolarHBondContact O-N 2.86Å; V754-R777 VanDerWaalsContact O-N 3.08Å; M773-R777 HydrophobicContact CE-CB 4Å; M773-R777 HydrophobicContact CE-CG 4.18Å; M773-R777 HydrophobicContact SD-CG 4.27Å; C775-R777 HydrophobicContact CB-CG 4.2Å; R777-L780 HydrophobicContact CB-CB 4.16Å; R777-L780 HydrophobicContact CB-CD1 3.92Å; R777-L780 HydrophobicContact CB-CD2 4.3Å; R777-L780 HydrophobicContact CB-CG 4.35Å; R777-G793 PolarHBondContact NH1-O 2.93Å; R777-L801 HydrophobicContact CG-CD1 3.86Å; R777-S803 PolarHBondContact NH1-O 2.78Å; R777-S803 PolarHBondContact NH1-OG 3.29Å; R777-S803 PolarHBondContact NH2-OG 3.49Å; R777-E805 IonicContact CZ-OE1 3.85Å; R777-E805 IonicContact NE-OE1 2.82Å; R777-E805 PolarHBondContact NE-OE1 3.43Å; R777-E805 IonicContact NH2-OE1 3.2Å; R777-E805 PolarHBondContact NH2-OE1 2.85Å
778	A	98.4	Very high	95.2	Very high	3 Å²	3	42 Å²	42	3%	0.025	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-124.4	152.7	163.5	0	0	0	0	0	110.1	R732 F748 R753 L780 G794 F795	R732-A778 HydrophobicContact CB-CB 4.18Å; F748-A778 HydrophobicContact CB-CB 4.38Å; R753-A778 HydrophobicContact CB-CB 4.26Å; R753-A778 HydrophobicContact CG-CB 3.61Å; A778-L780 PolarHBondContact O-N 2.8Å; A778-G794 CarbonylContact O-C 3.46Å; A778-G794 VanDerWaalsContact O-CA 3.26Å; A778-G794 WeakPolarHBondContact O-CA 3.46Å; A778-F795 PolarHBondContact N-O 3.44Å; A778-F795 PolarHBondContact O-N 2.98Å
779	T	98.2	Very high	95.5	Very high	17 Å²	17	39.4 Å²	39.4	10%	0.104	23%	0.225	C	C	.	.	S	Bend	trans	52.2	30.1	-171.2	74.9	0	0	0	0	113.5	R732 S826 V827 Y970	R732-T779 HydrophobicContact CB-CG2 3.67Å; R732-T779 HydrophobicContact CG-CG2 3.74Å; R732-T779 PolarHBondContact O-N 2.96Å; T779-S826 WeakPolarHBondContact CB-OG 3.27Å; T779-S826 WeakPolarHBondContact O-CA 3.33Å; T779-S826 PolarHBondContact O-N 2.9Å; T779-S826 PolarHBondContact OG1-N 3.19Å; T779-S826 PolarHBondContact OG1-OG 2.79Å; T779-V827 PolarHBondContact O-N 2.89Å; T779-Y970 HydrophobicContact CG2-CD1 3.97Å; T779-Y970 HydrophobicContact CG2-CE1 3.68Å
780	L	98.7	Very high	95.8	Very high	11 Å²	11	35.3 Å²	35.3	6%	0.058	20%	0.196	C	C	.	.			trans	-69.5	157.7	163.6	72	169.8	0	0	0	111	I745 M773 R777 A778 V782 A791 V792	I745-L780 HydrophobicContact CG2-CD1 4.16Å; M773-L780 HydrophobicContact SD-CD1 4.28Å; R777-L780 HydrophobicContact CB-CB 4.16Å; R777-L780 HydrophobicContact CB-CD1 3.92Å; R777-L780 HydrophobicContact CB-CD2 4.3Å; R777-L780 HydrophobicContact CB-CG 4.35Å; A778-L780 PolarHBondContact O-N 2.8Å; L780-V782 HydrophobicContact CD1-CG2 3.77Å; L780-V782 HydrophobicContact CG-CG2 4.16Å; L780-A791 HydrophobicContact CD1-CB 3.91Å; L780-V792 WeakPolarHBondContact CA-O 3.24Å; L780-V792 WeakPolarHBondContact CB-O 3.45Å
781	G	98.5	Very high	96.1	Very high	6 Å²	6	35 Å²	35	6%	0.062	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	149.3	159.7	0	0	0	0	0	110.5	V792	G781-V792 PolarHBondContact N-O 2.9Å; G781-V792 VanDerWaalsContact N-O 3.07Å; G781-V792 PolarHBondContact O-N 2.75Å
782	V	98.5	Very high	96.3	Very high	20 Å²	20	33.4 Å²	33.4	12%	0.121	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	139.7	172.7	163.1	0	0	0	0	108.8	A736 I745 L780 I789 Y790 A791	A736-V782 HydrophobicContact CB-CG1 3.82Å; I745-V782 HydrophobicContact CB-CG2 4.26Å; I745-V782 HydrophobicContact CD1-CG1 4.03Å; I745-V782 HydrophobicContact CD1-CG2 4.36Å; I745-V782 HydrophobicContact CG2-CG2 4.21Å; L780-V782 HydrophobicContact CD1-CG2 3.77Å; L780-V782 HydrophobicContact CG-CG2 4.16Å; V782-I789 HydrophobicContact CG1-CG2 3.88Å; V782-Y790 VanDerWaalsContact CA-O 3.26Å; V782-Y790 WeakPolarHBondContact CA-O 3.49Å; V782-A791 HydrophobicContact CG2-CB 4.38Å
783	A	98	Very high	96.5	Very high	13 Å²	13	29.4 Å²	29.4	11%	0.107	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	162.2	169	0	0	0	0	0	110.9	Y790 V829 L836	A783-Y790 PolarHBondContact N-O 2.76Å; A783-Y790 PolarHBondContact O-N 3.45Å; A783-V829 HydrophobicContact CB-CG1 3.91Å; A783-L836 HydrophobicContact CB-CD1 3.83Å
784	V	96.7	Very high	96.5	Very high	47 Å²	47	29.3 Å²	29.3	29%	0.285	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132.7	172.7	-178.7	0	0	0	0	108.6	A736 L738 L788 I789 A831	A736-V784 HydrophobicContact CB-CG2 3.76Å; L738-V784 HydrophobicContact CD1-CG1 4.03Å; V784-L788 WeakPolarHBondContact CA-O 3.26Å; V784-I789 HydrophobicContact CG2-CG1 4.41Å; V784-A831 WeakPolarHBondContact O-CB 3.37Å
785	L	95.3	Very high	96.7	Very high	11 Å²	11	25.5 Å²	25.5	6%	0.058	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	130.4	175.3	171.5	62.3	0	0	0	109.7	G787 L788 Y790 A831 L836 P858	L785-G787 PolarHBondContact O-N 3.04Å; L785-G787 VanDerWaalsContact O-N 3.16Å; L785-L788 PolarHBondContact N-O 3.06Å; L785-L788 PolarHBondContact O-N 3.2Å; L785-Y790 HydrophobicContact CB-CD2 4.06Å; L785-Y790 HydrophobicContact CB-CE2 3.74Å; L785-Y790 HydrophobicContact CD2-CE2 4.4Å; L785-Y790 HydrophobicContact CG-CE2 4.32Å; L785-A831 HydrophobicContact CB-CB 4.12Å; L785-A831 HydrophobicContact CD1-CB 4.25Å; L785-L836 HydrophobicContact CD2-CB 3.87Å; L785-P858 HydrophobicContact CD2-CG 3.67Å; L785-P858 HydrophobicContact CG-CG 4.46Å
786	N	88.8	Confident	96.9	Very high	115 Å²	115	26 Å²	26	62%	0.615	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	37.5	177.2	-57	-19.2	0	0	0	114.1	L788	N786-L788 VanDerWaalsContact C-N 3.33Å
787	G	86.7	Confident	96.8	Very high	35 Å²	35	21.8 Å²	21.8	36%	0.361	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	11.7	-179.3	0	0	0	0	0	115.3	L738 L785	L738-G787 WeakPolarHBondContact CD2-O 3.35Å; L785-G787 PolarHBondContact O-N 3.04Å; L785-G787 VanDerWaalsContact O-N 3.16Å
788	L	94.2	Very high	96.6	Very high	39 Å²	39	27.4 Å²	27.4	20%	0.204	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	153	178.6	-58.3	176	0	0	0	110.9	V784 L785 N786 Y790 V806 D808	V784-L788 WeakPolarHBondContact CA-O 3.26Å; L785-L788 PolarHBondContact N-O 3.06Å; L785-L788 PolarHBondContact O-N 3.2Å; N786-L788 VanDerWaalsContact C-N 3.33Å; L788-Y790 HydrophobicContact CB-CE2 3.83Å; L788-V806 HydrophobicContact CB-CG2 3.65Å; L788-V806 HydrophobicContact CD1-CG2 4.17Å; L788-V806 HydrophobicContact CG-CG2 4.45Å; L788-D808 HydrophobicContact CD2-CB 3.67Å
789	I	98.2	Very high	96.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.1	179.3	-48	177.4	0	0	0	109.9	A736 L738 Y743 I745 V782 V784 V806 L807 I809	A736-I789 HydrophobicContact CB-CD1 4.1Å; A736-I789 HydrophobicContact CB-CG1 4.34Å; A736-I789 HydrophobicContact CB-CG2 3.56Å; L738-I789 HydrophobicContact CB-CD1 4.18Å; L738-I789 HydrophobicContact CB-CG1 4.38Å; L738-I789 HydrophobicContact CD2-CD1 4Å; L738-I789 HydrophobicContact CD2-CG1 3.61Å; Y743-I789 HydrophobicContact CD1-CD1 4.01Å; Y743-I789 HydrophobicContact CD2-CD1 3.5Å; Y743-I789 HydrophobicContact CE1-CD1 4.29Å; Y743-I789 HydrophobicContact CE2-CD1 3.82Å; Y743-I789 HydrophobicContact CG-CD1 3.62Å; I745-I789 HydrophobicContact CD1-CG2 3.6Å; V782-I789 HydrophobicContact CG1-CG2 3.88Å; V784-I789 HydrophobicContact CG2-CG1 4.41Å; I789-V806 CarbonylContact O-C 3.58Å; I789-V806 WeakPolarHBondContact O-CA 3.41Å; I789-V806 WeakPolarHBondContact O-CG2 3.48Å; I789-L807 HydrophobicContact CB-CB 4.36Å; I789-L807 HydrophobicContact CD1-CD2 4.43Å; I789-L807 PolarHBondContact N-O 2.87Å; I789-L807 PolarHBondContact O-N 2.74Å; I789-I809 HydrophobicContact CD1-CG2 4.17Å
790	Y	98.6	Very high	96.5	Very high	3 Å²	3	29.7 Å²	29.7	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	135.4	-177.9	-67.1	-100.3	0	0	0	111.1	V782 A783 L785 L788 V806 I817 L836 Y856	V782-Y790 VanDerWaalsContact CA-O 3.26Å; V782-Y790 WeakPolarHBondContact CA-O 3.49Å; A783-Y790 PolarHBondContact N-O 2.76Å; A783-Y790 PolarHBondContact O-N 3.45Å; L785-Y790 HydrophobicContact CB-CD2 4.06Å; L785-Y790 HydrophobicContact CB-CE2 3.74Å; L785-Y790 HydrophobicContact CD2-CE2 4.4Å; L785-Y790 HydrophobicContact CG-CE2 4.32Å; L788-Y790 HydrophobicContact CB-CE2 3.83Å; Y790-V806 HydrophobicContact CD1-CB 3.76Å; Y790-V806 HydrophobicContact CD1-CG2 3.71Å; Y790-V806 HydrophobicContact CD2-CG2 3.94Å; Y790-V806 HydrophobicContact CE1-CB 3.79Å; Y790-V806 HydrophobicContact CE1-CG1 4.44Å; Y790-V806 HydrophobicContact CE1-CG2 3.57Å; Y790-V806 HydrophobicContact CE2-CG2 3.79Å; Y790-V806 HydrophobicContact CG-CB 4.29Å; Y790-V806 HydrophobicContact CG-CG2 3.9Å; Y790-I817 HydrophobicContact CD1-CD1 3.99Å; Y790-I817 HydrophobicContact CE1-CD1 4.19Å; Y790-L836 HydrophobicContact CD1-CD2 3.75Å; Y790-L836 HydrophobicContact CD2-CD2 4.42Å; Y790-L836 HydrophobicContact CG-CD2 3.7Å; Y790-Y856 HydrophobicContact CE1-CD1 4.3Å; Y790-Y856 AromaticContact CE1-CE1 3.66Å; Y790-Y856 HydrophobicContact CE1-CE1 3.66Å
791	A	98.7	Very high	96.5	Very high	0 Å²	0	30 Å²	30	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	111.2	174.2	0	0	0	0	0	109.5	I745 M773 L780 V782 A804 E805 W814	I745-A791 HydrophobicContact CG2-CB 4.34Å; M773-A791 HydrophobicContact SD-CB 3.73Å; L780-A791 HydrophobicContact CD1-CB 3.91Å; V782-A791 HydrophobicContact CG2-CB 4.38Å; A791-A804 VanDerWaalsContact O-CA 3.29Å; A791-A804 WeakPolarHBondContact O-CA 3.35Å; A791-E805 HydrophobicContact CB-CG 4.06Å; A791-E805 PolarHBondContact N-O 2.8Å; A791-E805 PolarHBondContact O-N 2.89Å; A791-W814 HydrophobicContact CB-CH2 3.87Å; A791-W814 HydrophobicContact CB-CZ3 3.64Å
792	V	98.8	Very high	96.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.3	-164	-179.2	0	0	0	0	111.2	L780 G781 A804 M820 V827 V829 L836 A838 W863	L780-V792 WeakPolarHBondContact CA-O 3.24Å; L780-V792 WeakPolarHBondContact CB-O 3.45Å; G781-V792 PolarHBondContact N-O 2.9Å; G781-V792 VanDerWaalsContact N-O 3.07Å; G781-V792 PolarHBondContact O-N 2.75Å; V792-A804 HydrophobicContact CB-CB 4.37Å; V792-A804 HydrophobicContact CG1-CB 4.39Å; V792-A804 HydrophobicContact CG2-CB 4.16Å; V792-M820 HydrophobicContact CG1-CE 3.64Å; V792-M820 HydrophobicContact CG1-SD 3.53Å; V792-M820 VanDerWaalsContact CG1-SD 3.53Å; V792-V827 WeakPolarHBondContact O-CG1 3.38Å; V792-V829 HydrophobicContact CB-CG2 4.02Å; V792-V829 HydrophobicContact CG1-CG2 4.17Å; V792-V829 HydrophobicContact CG2-CG1 4.4Å; V792-V829 HydrophobicContact CG2-CG2 4.44Å; V792-L836 HydrophobicContact CG2-CD2 3.86Å; V792-A838 HydrophobicContact CG1-CB 4.17Å; V792-W863 HydrophobicContact CG1-CH2 3.95Å; V792-W863 HydrophobicContact CG1-CZ2 4.22Å; V792-W863 HydrophobicContact CG2-CH2 4.36Å
793	G	98.6	Very high	96.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.202	C	C	.	.			trans	61.1	-134.7	173.9	0	0	0	0	0	113.4	R777 L801 S803	R777-G793 PolarHBondContact NH1-O 2.93Å; G793-L801 WeakPolarHBondContact CA-O 3.39Å; G793-S803 PolarHBondContact N-O 3.27Å; G793-S803 VanDerWaalsContact N-O 3.07Å
794	G	98.5	Very high	96.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	20%	0.198	C	C	.	.			trans	91.9	-155.9	-174.6	0	0	0	0	0	113.6	A778 G800 L801 R824 S825	A778-G794 CarbonylContact O-C 3.46Å; A778-G794 VanDerWaalsContact O-CA 3.26Å; A778-G794 WeakPolarHBondContact O-CA 3.46Å; G794-G800 WeakPolarHBondContact O-CA 3.24Å; G794-L801 PolarHBondContact O-N 2.91Å; G794-R824 PolarHBondContact N-O 2.79Å; G794-S825 WeakPolarHBondContact O-CB 3.2Å
795	F	98.3	Very high	96.5	Very high	51 Å²	51	30 Å²	30	22%	0.224	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-141.5	129.4	-177.8	-177.8	-89.6	0	0	0	110.1	R753 A778 G797 V799	R753-F795 VanDerWaalsContact NH2-CE1 3.31Å; A778-F795 PolarHBondContact N-O 3.44Å; A778-F795 PolarHBondContact O-N 2.98Å; F795-G797 WeakPolarHBondContact CE1-O 3.46Å; F795-G797 VanDerWaalsContact CZ-C 3.48Å; F795-V799 WeakPolarHBondContact CA-O 3.26Å; F795-V799 WeakPolarHBondContact CD2-O 3.46Å
796	D	97.1	Very high	96.7	Very high	48 Å²	48	29.6 Å²	29.6	26%	0.257	18%	0.182	S	C	.	.			trans	-86.7	-23.9	-171.6	68.6	-17.1	0	0	0	114.5	R753 R776 T798 V799 L801	R753-D796 WeakPolarHBondContact CB-O 3.37Å; R776-D796 HydrophobicContact CB-CB 4.38Å; R776-D796 VanDerWaalsContact O-CA 3.29Å; R776-D796 WeakPolarHBondContact O-CA 3.38Å; R776-D796 WeakPolarHBondContact O-CB 3.45Å; D796-T798 PolarHBondContact OD1-N 2.83Å; D796-V799 PolarHBondContact N-O 2.88Å; D796-V799 PolarHBondContact OD1-N 2.67Å; D796-L801 HydrophobicContact CB-CD1 4.32Å; D796-L801 HydrophobicContact CB-CD2 4.33Å
797	G	95	Very high	97.1	Very high	36 Å²	36	24.2 Å²	24.2	37%	0.371	15%	0.153	S	C	.	.	S	Bend	trans	139.1	-26.4	-167.7	0	0	0	0	0	113.1	F795	F795-G797 WeakPolarHBondContact CE1-O 3.46Å; F795-G797 VanDerWaalsContact CZ-C 3.48Å
798	T	95.4	Very high	97.1	Very high	120 Å²	120	24.7 Å²	24.7	74%	0.736	15%	0.148	S	C	*	.	S	Bend	trans	-130.4	-41	-171.7	-56.9	0	0	0	0	112.3	D796	D796-T798 PolarHBondContact OD1-N 2.83Å
799	V	96.2	Very high	96.6	Very high	64 Å²	64	23.3 Å²	23.3	39%	0.388	14%	0.141	S	C	.	.	S	Bend	trans	-133.6	159.8	-177.4	-64.5	0	0	0	0	112.9	F795 D796 L801	F795-V799 WeakPolarHBondContact CA-O 3.26Å; F795-V799 WeakPolarHBondContact CD2-O 3.46Å; D796-V799 PolarHBondContact N-O 2.88Å; D796-V799 PolarHBondContact OD1-N 2.67Å; V799-L801 HydrophobicContact CG2-CD2 4.32Å
800	G	97.4	Very high	95.7	Very high	5 Å²	5	30.3 Å²	30.3	5%	0.052	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-72.1	147	162.7	0	0	0	0	0	110	G794 Q823	G794-G800 WeakPolarHBondContact O-CA 3.24Å; G800-Q823 WeakPolarHBondContact O-CG 3.41Å; G800-Q823 PolarHBondContact O-NE2 3.07Å; G800-Q823 PolarHBondContact O-OE1 3.07Å; G800-Q823 VanDerWaalsContact O-OE1 3.11Å
801	L	98.4	Very high	94.9	Very high	18 Å²	18	32.4 Å²	32.4	9%	0.094	18%	0.182	C	C	.	.			trans	-104.1	135.9	-178.4	-59.8	175.4	0	0	0	110.4	C775 R777 G793 G794 D796 V799 R824	C775-L801 HydrophobicContact CB-CD1 4.5Å; R777-L801 HydrophobicContact CG-CD1 3.86Å; G793-L801 WeakPolarHBondContact CA-O 3.39Å; G794-L801 PolarHBondContact O-N 2.91Å; D796-L801 HydrophobicContact CB-CD1 4.32Å; D796-L801 HydrophobicContact CB-CD2 4.33Å; V799-L801 HydrophobicContact CG2-CD2 4.32Å; L801-R824 PolarHBondContact O-N 3.08Å
802	N	98.1	Very high	94.2	Very high	56 Å²	56	33.5 Å²	33.5	30%	0.299	19%	0.193	S	C	.	.			trans	-101.6	-14.3	164	71	-41.3	0	0	0	112.2	M820 Y822 Q823	N802-M820 HydrophobicContact CB-CB 4.35Å; N802-M820 WeakPolarHBondContact CB-O 3.35Å; N802-M820 PolarHBondContact ND2-O 2.68Å; N802-M820 WeakPolarHBondContact O-CB 3.48Å; N802-M820 WeakPolarHBondContact O-CE 3.42Å; N802-M820 PolarHBondContact O-N 2.92Å; N802-Y822 WeakPolarHBondContact CB-O 3.47Å; N802-Q823 HydrophobicContact CB-CG 4.35Å
803	S	98.4	Very high	93.7	Very high	27 Å²	27	36.2 Å²	36.2	19%	0.189	21%	0.212	C	C	.	.			trans	-67.6	152.9	174.7	69.2	0	0	0	0	111.8	R777 G793 S819	R777-S803 PolarHBondContact NH1-O 2.78Å; R777-S803 PolarHBondContact NH1-OG 3.29Å; R777-S803 PolarHBondContact NH2-OG 3.49Å; G793-S803 PolarHBondContact N-O 3.27Å; G793-S803 VanDerWaalsContact N-O 3.07Å; S803-S819 WeakPolarHBondContact CA-OG 3.48Å
804	A	98.5	Very high	93.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	155.4	169.3	0	0	0	0	0	109.6	A791 V792 I817 W863	A791-A804 VanDerWaalsContact O-CA 3.29Å; A791-A804 WeakPolarHBondContact O-CA 3.35Å; V792-A804 HydrophobicContact CB-CB 4.37Å; V792-A804 HydrophobicContact CG1-CB 4.39Å; V792-A804 HydrophobicContact CG2-CB 4.16Å; A804-I817 HydrophobicContact CB-CD1 3.78Å; A804-I817 HydrophobicContact CB-CG1 3.61Å; A804-I817 WeakPolarHBondContact O-CG1 3.43Å; A804-I817 PolarHBondContact O-N 2.55Å; A804-W863 HydrophobicContact CB-CZ2 4.2Å
805	E	98.4	Very high	93.6	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.5	178.5	57.6	-167.2	106.1	0	0	109.9	M773 E774 C775 R777 A791 W814 R815	M773-E805 VanDerWaalsContact CA-OE2 3.24Å; M773-E805 WeakPolarHBondContact CA-OE2 3.46Å; M773-E805 WeakPolarHBondContact CB-OE2 3.5Å; M773-E805 HydrophobicContact CG-CG 4.48Å; E774-E805 PolarHBondContact N-OE2 3.01Å; C775-E805 PolarHBondContact N-OE1 2.94Å; R777-E805 IonicContact CZ-OE1 3.85Å; R777-E805 IonicContact NE-OE1 2.82Å; R777-E805 PolarHBondContact NE-OE1 3.43Å; R777-E805 IonicContact NH2-OE1 3.2Å; R777-E805 PolarHBondContact NH2-OE1 2.85Å; A791-E805 HydrophobicContact CB-CG 4.06Å; A791-E805 PolarHBondContact N-O 2.8Å; A791-E805 PolarHBondContact O-N 2.89Å; E805-W814 HydrophobicContact CB-CE3 4.18Å; E805-W814 HydrophobicContact CG-CE3 3.75Å; E805-W814 HydrophobicContact CG-CZ3 4.1Å; E805-R815 CarbonylContact C-O 3.57Å; E805-R815 VanDerWaalsContact CA-O 3.28Å; E805-R815 WeakPolarHBondContact CA-O 3.28Å; E805-R815 WeakPolarHBondContact CB-O 3.33Å
806	V	98.1	Very high	93.5	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133.9	-176.2	66	0	0	0	0	110.7	L788 I789 Y790 W814 R815 I817	L788-V806 HydrophobicContact CB-CG2 3.65Å; L788-V806 HydrophobicContact CD1-CG2 4.17Å; L788-V806 HydrophobicContact CG-CG2 4.45Å; I789-V806 CarbonylContact O-C 3.58Å; I789-V806 WeakPolarHBondContact O-CA 3.41Å; I789-V806 WeakPolarHBondContact O-CG2 3.48Å; Y790-V806 HydrophobicContact CD1-CB 3.76Å; Y790-V806 HydrophobicContact CD1-CG2 3.71Å; Y790-V806 HydrophobicContact CD2-CG2 3.94Å; Y790-V806 HydrophobicContact CE1-CB 3.79Å; Y790-V806 HydrophobicContact CE1-CG1 4.44Å; Y790-V806 HydrophobicContact CE1-CG2 3.57Å; Y790-V806 HydrophobicContact CE2-CG2 3.79Å; Y790-V806 HydrophobicContact CG-CB 4.29Å; Y790-V806 HydrophobicContact CG-CG2 3.9Å; V806-W814 VanDerWaalsContact C-CE3 3.48Å; V806-W814 WeakPolarHBondContact O-CA 3.41Å; V806-R815 HydrophobicContact CG1-CG 3.5Å; V806-R815 PolarHBondContact N-O 2.94Å; V806-R815 PolarHBondContact O-N 2.82Å; V806-I817 HydrophobicContact CB-CG2 4.05Å; V806-I817 HydrophobicContact CG1-CG2 3.51Å
807	L	96.8	Very high	93.6	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	121.4	172.4	175.6	58.9	0	0	0	109.5	Y743 P771 I789 I809 S813 W814	Y743-L807 HydrophobicContact CD1-CD2 4.32Å; Y743-L807 HydrophobicContact CE1-CD2 4.31Å; P771-L807 HydrophobicContact CG-CD1 3.69Å; P771-L807 HydrophobicContact CG-CD2 4.17Å; I789-L807 HydrophobicContact CB-CB 4.36Å; I789-L807 HydrophobicContact CD1-CD2 4.43Å; I789-L807 PolarHBondContact N-O 2.87Å; I789-L807 PolarHBondContact O-N 2.74Å; L807-I809 HydrophobicContact CD2-CG2 4.34Å; L807-I809 HydrophobicContact CG-CG2 4.27Å; L807-S813 WeakPolarHBondContact CD1-O 3.41Å; L807-W814 HydrophobicContact CB-CD2 3.76Å; L807-W814 HydrophobicContact CB-CE3 3.74Å; L807-W814 HydrophobicContact CB-CG 4.47Å; L807-W814 HydrophobicContact CB-CH2 3.76Å; L807-W814 HydrophobicContact CB-CZ2 3.78Å; L807-W814 HydrophobicContact CB-CZ3 3.74Å; L807-W814 HydrophobicContact CD1-CG 4.49Å; L807-W814 HydrophobicContact CD2-CZ2 3.91Å; L807-W814 HydrophobicContact CG-CZ2 4.41Å
808	D	87.9	Confident	93.7	Very high	45 Å²	45	43.6 Å²	43.6	24%	0.241	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	120.7	155.3	164	37.4	0	0	0	108.9	L788 W810 S811 G812 S813	L788-D808 HydrophobicContact CD2-CB 3.67Å; D808-W810 VanDerWaalsContact C-N 3.28Å; D808-W810 PolarHBondContact O-N 2.95Å; D808-W810 VanDerWaalsContact OD1-CD1 3.28Å; D808-W810 PolarHBondContact OD1-N 3.48Å; D808-S811 WeakPolarHBondContact CB-OG 3.48Å; D808-S811 PolarHBondContact O-OG 3.29Å; D808-S811 WeakPolarHBondContact OD2-CB 3.43Å; D808-S811 PolarHBondContact OD2-N 2.79Å; D808-S811 PolarHBondContact OD2-OG 3.48Å; D808-G812 VanDerWaalsContact O-CA 3.32Å; D808-G812 WeakPolarHBondContact O-CA 3.37Å; D808-G812 PolarHBondContact O-N 2.83Å; D808-S813 PolarHBondContact N-O 2.88Å; D808-S813 PolarHBondContact O-N 3.29Å
809	I	83.1	Confident	93.9	Very high	11 Å²	11	40.8 Å²	40.8	6%	0.056	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-20.5	-178.3	59.4	160.8	0	0	0	113.2	L625 L738 Y743 I789 L807	L625-I809 HydrophobicContact CD2-CB 4.26Å; L738-I809 HydrophobicContact CD2-CD1 3.85Å; L738-I809 HydrophobicContact CD2-CG1 4.11Å; L738-I809 HydrophobicContact CD2-CG2 3.87Å; L738-I809 HydrophobicContact CG-CD1 3.93Å; Y743-I809 HydrophobicContact CE1-CG2 4.21Å; Y743-I809 WeakPolarHBondContact OH-CG2 3.3Å; I789-I809 HydrophobicContact CD1-CG2 4.17Å; L807-I809 HydrophobicContact CD2-CG2 4.34Å; L807-I809 HydrophobicContact CG-CG2 4.27Å
810	W	78.9	Confident	94	Very high	147 Å²	147	37.9 Å²	37.9	56%	0.557	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-49.1	-178.1	-55.5	106.9	0	0	0	111.6	L625 R626 D808 G812	L625-W810 WeakPolarHBondContact O-CZ3 3.12Å; R626-W810 VanDerWaalsContact CG-O 3.26Å; R626-W810 WeakPolarHBondContact CG-O 3.23Å; R626-W810 PolarHBondContact NE-O 2.66Å; D808-W810 VanDerWaalsContact C-N 3.28Å; D808-W810 PolarHBondContact O-N 2.95Å; D808-W810 VanDerWaalsContact OD1-CD1 3.28Å; D808-W810 PolarHBondContact OD1-N 3.48Å; W810-G812 PolarHBondContact O-N 2.81Å
811	S	81.2	Confident	94	Very high	47 Å²	47	41.9 Å²	41.9	33%	0.329	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.4	165.1	62.8	0	0	0	0	112.1	R626 D808 S813	R626-S811 PolarHBondContact NH2-O 3.22Å; D808-S811 WeakPolarHBondContact CB-OG 3.48Å; D808-S811 PolarHBondContact O-OG 3.29Å; D808-S811 WeakPolarHBondContact OD2-CB 3.43Å; D808-S811 PolarHBondContact OD2-N 2.79Å; D808-S811 PolarHBondContact OD2-OG 3.48Å; S811-S813 PolarHBondContact O-N 3.41Å; S811-S813 PolarHBondContact OG-OG 3.23Å
812	G	84.3	Confident	93.9	Very high	23 Å²	23	45.1 Å²	45.1	24%	0.237	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	28.6	-176.5	0	0	0	0	0	112.4	P771 D808 W810	P771-G812 WeakPolarHBondContact CB-O 3.38Å; D808-G812 VanDerWaalsContact O-CA 3.32Å; D808-G812 WeakPolarHBondContact O-CA 3.37Å; D808-G812 PolarHBondContact O-N 2.83Å; W810-G812 PolarHBondContact O-N 2.81Å
813	S	89.5	Confident	94	Very high	57 Å²	57	44.5 Å²	44.5	40%	0.399	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138.2	-169.4	74.3	0	0	0	0	112.8	L807 D808 S811	L807-S813 WeakPolarHBondContact CD1-O 3.41Å; D808-S813 PolarHBondContact N-O 2.88Å; D808-S813 PolarHBondContact O-N 3.29Å; S811-S813 PolarHBondContact O-N 3.41Å; S811-S813 PolarHBondContact OG-OG 3.23Å
814	W	97.2	Very high	94	Very high	35 Å²	35	43.2 Å²	43.2	13%	0.133	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	136.8	167.6	-70	95.5	0	0	0	109.5	I745 V757 P771 N772 M773 A791 E805 V806 L807	I745-W814 HydrophobicContact CD1-CH2 4.21Å; I745-W814 HydrophobicContact CD1-CZ2 4.44Å; I745-W814 HydrophobicContact CG1-CZ2 4.45Å; I745-W814 HydrophobicContact CG2-CH2 4.02Å; I745-W814 HydrophobicContact CG2-CZ2 4.13Å; V757-W814 HydrophobicContact CG2-CZ2 3.87Å; P771-W814 PolarHBondContact O-NE1 2.82Å; N772-W814 VanDerWaalsContact C-CD1 3.46Å; M773-W814 HydrophobicContact CG-CD2 3.9Å; M773-W814 HydrophobicContact CG-CE3 4.21Å; M773-W814 HydrophobicContact CG-CH2 4.06Å; M773-W814 HydrophobicContact CG-CZ2 3.7Å; M773-W814 HydrophobicContact CG-CZ3 4.29Å; M773-W814 HydrophobicContact SD-CH2 4.43Å; A791-W814 HydrophobicContact CB-CH2 3.87Å; A791-W814 HydrophobicContact CB-CZ3 3.64Å; E805-W814 HydrophobicContact CB-CE3 4.18Å; E805-W814 HydrophobicContact CG-CE3 3.75Å; E805-W814 HydrophobicContact CG-CZ3 4.1Å; V806-W814 VanDerWaalsContact C-CE3 3.48Å; V806-W814 WeakPolarHBondContact O-CA 3.41Å; L807-W814 HydrophobicContact CB-CD2 3.76Å; L807-W814 HydrophobicContact CB-CE3 3.74Å; L807-W814 HydrophobicContact CB-CG 4.47Å; L807-W814 HydrophobicContact CB-CH2 3.76Å; L807-W814 HydrophobicContact CB-CZ2 3.78Å; L807-W814 HydrophobicContact CB-CZ3 3.74Å; L807-W814 HydrophobicContact CD1-CG 4.49Å; L807-W814 HydrophobicContact CD2-CZ2 3.91Å; L807-W814 HydrophobicContact CG-CZ2 4.41Å
815	R	96.3	Very high	93.9	Very high	116 Å²	116	43.8 Å²	43.8	44%	0.438	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	146.5	166.4	67.8	179.6	-175.1	86.6	-4.4	110.3	E805 V806	E805-R815 CarbonylContact C-O 3.57Å; E805-R815 VanDerWaalsContact CA-O 3.28Å; E805-R815 WeakPolarHBondContact CA-O 3.28Å; E805-R815 WeakPolarHBondContact CB-O 3.33Å; V806-R815 HydrophobicContact CG1-CG 3.5Å; V806-R815 PolarHBondContact N-O 2.94Å; V806-R815 PolarHBondContact O-N 2.82Å
816	P	97.8	Very high	93.9	Very high	82 Å²	82	44.6 Å²	44.6	53%	0.532	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	152.6	167.7	27.7	-34.5	0	0	0	110.9
817	I	98	Very high	93.9	Very high	11 Å²	11	45 Å²	45	6%	0.056	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	169.1	162.3	66.5	161.3	0	0	0	108.5	Y790 A804 V806 Y856 W863	Y790-I817 HydrophobicContact CD1-CD1 3.99Å; Y790-I817 HydrophobicContact CE1-CD1 4.19Å; A804-I817 HydrophobicContact CB-CD1 3.78Å; A804-I817 HydrophobicContact CB-CG1 3.61Å; A804-I817 WeakPolarHBondContact O-CG1 3.43Å; A804-I817 PolarHBondContact O-N 2.55Å; V806-I817 HydrophobicContact CB-CG2 4.05Å; V806-I817 HydrophobicContact CG1-CG2 3.51Å; I817-Y856 HydrophobicContact CB-CE2 4.48Å; I817-Y856 HydrophobicContact CD1-CD1 4.32Å; I817-Y856 HydrophobicContact CD1-CD2 4.11Å; I817-Y856 HydrophobicContact CD1-CE1 4.13Å; I817-Y856 HydrophobicContact CD1-CE2 3.91Å; I817-Y856 HydrophobicContact CD1-CG 4.3Å; I817-W863 HydrophobicContact CD1-CZ2 4.17Å
818	P	98.5	Very high	94	Very high	45 Å²	45	45.2 Å²	45.2	29%	0.292	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-50	146.7	173.7	-31.2	39.7	0	0	0	112.5	D861 W863	P818-D861 WeakPolarHBondContact CD-OD1 3.3Å; P818-D861 WeakPolarHBondContact CG-O 3.4Å; P818-W863 VanDerWaalsContact O-CD1 3.24Å; P818-W863 PolarHBondContact O-NE1 2.75Å
819	S	98.4	Very high	94.5	Very high	61 Å²	61	43.7 Å²	43.7	43%	0.427	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-84.6	150.6	-178.1	-61.8	0	0	0	0	111.9	S803	S803-S819 WeakPolarHBondContact CA-OG 3.48Å
820	M	98.5	Very high	95.2	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.02	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-66.1	160.8	169.8	-62.6	175.3	-65.3	0	0	111.3	V792 N802 R824 A838 W863	V792-M820 HydrophobicContact CG1-CE 3.64Å; V792-M820 HydrophobicContact CG1-SD 3.53Å; V792-M820 VanDerWaalsContact CG1-SD 3.53Å; N802-M820 HydrophobicContact CB-CB 4.35Å; N802-M820 WeakPolarHBondContact CB-O 3.35Å; N802-M820 PolarHBondContact ND2-O 2.68Å; N802-M820 WeakPolarHBondContact O-CB 3.48Å; N802-M820 WeakPolarHBondContact O-CE 3.42Å; N802-M820 PolarHBondContact O-N 2.92Å; M820-R824 HydrophobicContact CE-CB 4.02Å; M820-R824 HydrophobicContact CE-CG 4.16Å; M820-R824 HydrophobicContact SD-CG 4.28Å; M820-A838 HydrophobicContact SD-CB 3.59Å; M820-A838 VanDerWaalsContact SD-CB 3.59Å; M820-W863 HydrophobicContact CG-CD2 3.6Å; M820-W863 HydrophobicContact CG-CE3 3.93Å; M820-W863 HydrophobicContact CG-CG 4.13Å; M820-W863 HydrophobicContact CG-CH2 4.11Å; M820-W863 HydrophobicContact CG-CZ2 3.79Å; M820-W863 HydrophobicContact CG-CZ3 4.18Å; M820-W863 HydrophobicContact SD-CH2 4.11Å; M820-W863 HydrophobicContact SD-CZ2 4.23Å; M820-W863 HydrophobicContact SD-CZ3 4.3Å
821	T	97.4	Very high	96.1	Very high	89 Å²	89	37.6 Å²	37.6	55%	0.546	22%	0.22	S	C	.	.	S	Bend	trans	-65.8	-41.7	175.2	-43.6	0	0	0	0	111.6	E854	T821-E854 WeakPolarHBondContact CA-OE2 3.4Å; T821-E854 WeakPolarHBondContact CB-OE2 3.49Å; T821-E854 PolarHBondContact N-OE2 3Å; T821-E854 PolarHBondContact OG1-OE2 2.83Å
822	Y	97.4	Very high	96.7	Very high	85 Å²	85	35.7 Å²	35.7	33%	0.333	21%	0.206	S	C	.	.	S	Bend	trans	-109.8	153.5	-175.9	-64.7	-74	0	0	0	112.4	N802 R824 L865	N802-Y822 WeakPolarHBondContact CB-O 3.47Å; Y822-R824 PolarHBondContact O-N 2.81Å; Y822-L865 HydrophobicContact CD2-CD2 4.45Å; Y822-L865 HydrophobicContact CE2-CD1 4.32Å; Y822-L865 HydrophobicContact CE2-CD2 4.03Å
823	Q	98.2	Very high	96.9	Very high	44 Å²	44	39.8 Å²	39.8	21%	0.206	22%	0.223	C	C	.	.			trans	-75	125.5	167.5	-68.9	-175.6	1.5	0	0	108.8	G800 N802 D843 T845	G800-Q823 WeakPolarHBondContact O-CG 3.41Å; G800-Q823 PolarHBondContact O-NE2 3.07Å; G800-Q823 PolarHBondContact O-OE1 3.07Å; G800-Q823 VanDerWaalsContact O-OE1 3.11Å; N802-Q823 HydrophobicContact CB-CG 4.35Å; Q823-D843 PolarHBondContact N-OD2 2.97Å; Q823-D843 VanDerWaalsContact N-OD2 3.08Å; Q823-D843 WeakPolarHBondContact O-CA 3.44Å; Q823-D843 VanDerWaalsContact O-CB 3.28Å; Q823-D843 WeakPolarHBondContact O-CB 3.35Å; Q823-T845 HydrophobicContact CG-CG2 4.38Å
824	R	98.5	Very high	97	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.223	C	C	.	.			trans	-125.4	86.1	-174.6	-57.1	-168.8	177	-100.4	0	111.1	G794 L801 M820 Y822 V827 G840 L850 S852 E854	G794-R824 PolarHBondContact N-O 2.79Å; L801-R824 PolarHBondContact O-N 3.08Å; M820-R824 HydrophobicContact CE-CB 4.02Å; M820-R824 HydrophobicContact CE-CG 4.16Å; M820-R824 HydrophobicContact SD-CG 4.28Å; Y822-R824 PolarHBondContact O-N 2.81Å; R824-V827 HydrophobicContact CB-CB 3.8Å; R824-V827 HydrophobicContact CB-CG1 4.32Å; R824-V827 HydrophobicContact CB-CG2 3.8Å; R824-V827 HydrophobicContact CG-CG2 4.48Å; R824-V827 WeakPolarHBondContact O-CG1 3.38Å; R824-G840 PolarHBondContact NH1-O 2.84Å; R824-L850 HydrophobicContact CG-CD1 3.99Å; R824-S852 PolarHBondContact NH1-O 2.81Å; R824-S852 PolarHBondContact NH2-O 2.9Å; R824-S852 PolarHBondContact NH2-OG 3.29Å; R824-E854 IonicContact CZ-OE1 2.74Å; R824-E854 VanDerWaalsContact CZ-OE1 3.23Å; R824-E854 IonicContact NE-OE1 2.88Å; R824-E854 PolarHBondContact NE-OE1 2.84Å; R824-E854 IonicContact NH2-OE1 3.23Å; R824-E854 PolarHBondContact NH2-OE1 2.81Å
825	S	98.3	Very high	97	Very high	13 Å²	13	39.9 Å²	39.9	9%	0.091	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-87.4	146.9	166.6	65.4	0	0	0	0	110.5	G794 V827 G841 Y842	G794-S825 WeakPolarHBondContact O-CB 3.2Å; S825-V827 VanDerWaalsContact C-N 3.28Å; S825-V827 PolarHBondContact O-N 2.81Å; S825-G841 CarbonylContact O-C 3.57Å; S825-G841 VanDerWaalsContact O-CA 3.3Å; S825-G841 WeakPolarHBondContact O-CA 3.48Å; S825-Y842 PolarHBondContact N-O 2.98Å; S825-Y842 PolarHBondContact O-N 2.71Å; S825-Y842 PolarHBondContact OG-O 2.79Å
826	S	98	Very high	97.1	Very high	19 Å²	19	34.4 Å²	34.4	13%	0.133	21%	0.207	C	C	.	.	S	Bend	trans	53.7	44.6	-172.7	-55.6	0	0	0	0	112.9	T779 G841 G875	T779-S826 WeakPolarHBondContact CB-OG 3.27Å; T779-S826 WeakPolarHBondContact O-CA 3.33Å; T779-S826 PolarHBondContact O-N 2.9Å; T779-S826 PolarHBondContact OG1-N 3.19Å; T779-S826 PolarHBondContact OG1-OG 2.79Å; S826-G841 WeakPolarHBondContact O-CA 3.33Å; S826-G875 WeakPolarHBondContact O-CA 3.36Å; S826-G875 PolarHBondContact O-N 2.72Å
827	V	98.7	Very high	97.1	Very high	9 Å²	9	31.1 Å²	31.1	6%	0.055	18%	0.184	C	C	.	.			trans	-88.2	135.3	-177.1	65	0	0	0	0	111.1	T779 V792 R824 S825 V829 A838	T779-V827 PolarHBondContact O-N 2.89Å; V792-V827 WeakPolarHBondContact O-CG1 3.38Å; R824-V827 HydrophobicContact CB-CB 3.8Å; R824-V827 HydrophobicContact CB-CG1 4.32Å; R824-V827 HydrophobicContact CB-CG2 3.8Å; R824-V827 HydrophobicContact CG-CG2 4.48Å; R824-V827 WeakPolarHBondContact O-CG1 3.38Å; S825-V827 VanDerWaalsContact C-N 3.28Å; S825-V827 PolarHBondContact O-N 2.81Å; V827-V829 HydrophobicContact CG1-CG2 4.23Å; V827-V829 HydrophobicContact CG2-CG2 4.26Å; V827-A838 HydrophobicContact CG2-CB 4.23Å
828	G	98.4	Very high	97.2	Very high	6 Å²	6	30.6 Å²	30.6	6%	0.062	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	139.1	168.6	0	0	0	0	0	109.8	V839	G828-V839 PolarHBondContact N-O 3.44Å; G828-V839 VanDerWaalsContact N-O 3.17Å; G828-V839 WeakPolarHBondContact O-CB 3.47Å; G828-V839 PolarHBondContact O-N 2.76Å
829	V	98.6	Very high	97.2	Very high	13 Å²	13	28.5 Å²	28.5	8%	0.079	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	141.5	-177.6	173.3	0	0	0	0	110.2	A783 V792 V827 L836 Y837 A838	A783-V829 HydrophobicContact CB-CG1 3.91Å; V792-V829 HydrophobicContact CB-CG2 4.02Å; V792-V829 HydrophobicContact CG1-CG2 4.17Å; V792-V829 HydrophobicContact CG2-CG1 4.4Å; V792-V829 HydrophobicContact CG2-CG2 4.44Å; V827-V829 HydrophobicContact CG1-CG2 4.23Å; V827-V829 HydrophobicContact CG2-CG2 4.26Å; V829-L836 HydrophobicContact CG1-CD1 3.56Å; V829-L836 HydrophobicContact CG1-CG 4.17Å; V829-Y837 VanDerWaalsContact CA-O 3.28Å; V829-Y837 WeakPolarHBondContact CA-O 3.48Å; V829-A838 HydrophobicContact CG2-CB 4.45Å
830	G	97.4	Very high	97.2	Very high	6 Å²	6	25.6 Å²	25.6	6%	0.062	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	158.8	172	0	0	0	0	0	111.7	Y837	G830-Y837 PolarHBondContact N-O 2.73Å; G830-Y837 PolarHBondContact O-N 2.86Å
831	A	96.5	Very high	97.2	Very high	24 Å²	24	25.4 Å²	25.4	20%	0.198	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	139.7	172.2	0	0	0	0	0	109.7	V784 L785 K835	V784-A831 WeakPolarHBondContact O-CB 3.37Å; L785-A831 HydrophobicContact CB-CB 4.12Å; L785-A831 HydrophobicContact CD1-CB 4.25Å; A831-K835 VanDerWaalsContact CA-O 3.31Å; A831-K835 WeakPolarHBondContact CA-O 3.38Å
832	L	95	Very high	97.2	Very high	7 Å²	7	24.9 Å²	24.9	4%	0.037	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	138.6	178.8	171.9	63.5	0	0	0	108.8	G834 K835 Y837 E880 N883 L885 F903 P905	L832-G834 VanDerWaalsContact C-N 3.31Å; L832-G834 PolarHBondContact O-N 2.98Å; L832-K835 PolarHBondContact N-O 2.89Å; L832-K835 PolarHBondContact O-N 3.32Å; L832-K835 VanDerWaalsContact O-O 3.14Å; L832-Y837 HydrophobicContact CB-CD2 4.09Å; L832-Y837 HydrophobicContact CB-CE2 3.83Å; L832-Y837 HydrophobicContact CD2-CE2 4.44Å; L832-Y837 HydrophobicContact CG-CE2 4.38Å; L832-E880 HydrophobicContact CB-CG 4.46Å; L832-E880 HydrophobicContact CD1-CG 4.01Å; L832-N883 VanDerWaalsContact CD1-C 3.46Å; L832-L885 HydrophobicContact CD2-CB 3.93Å; L832-F903 HydrophobicContact CD2-CD1 4.19Å; L832-P905 HydrophobicContact CD1-CG 4.45Å; L832-P905 HydrophobicContact CD2-CB 4.18Å; L832-P905 HydrophobicContact CD2-CG 4.02Å; L832-P905 HydrophobicContact CG-CG 4.43Å
833	D	89.2	Confident	97.2	Very high	110 Å²	110	21 Å²	21	59%	0.588	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.6	49.2	178	-168	33.6	0	0	0	114.4	K835	D833-K835 PolarHBondContact O-N 2.71Å; D833-K835 VanDerWaalsContact O-N 3.12Å
834	G	91.1	Very high	97.1	Very high	38 Å²	38	20.5 Å²	20.5	39%	0.392	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	5.5	179.6	0	0	0	0	0	115.8	L832	L832-G834 VanDerWaalsContact C-N 3.31Å; L832-G834 PolarHBondContact O-N 2.98Å
835	K	96.7	Very high	96.9	Very high	56 Å²	56	24.9 Å²	24.9	24%	0.243	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	166	-178.2	-58.4	-177	-159.6	-57.9	0	112	A831 L832 D833 Y837 Y856 D857	A831-K835 VanDerWaalsContact CA-O 3.31Å; A831-K835 WeakPolarHBondContact CA-O 3.38Å; L832-K835 PolarHBondContact N-O 2.89Å; L832-K835 PolarHBondContact O-N 3.32Å; L832-K835 VanDerWaalsContact O-O 3.14Å; D833-K835 PolarHBondContact O-N 2.71Å; D833-K835 VanDerWaalsContact O-N 3.12Å; K835-Y837 HydrophobicContact CB-CE2 4.05Å; K835-Y856 WeakPolarHBondContact CB-O 3.5Å; K835-D857 HydrophobicContact CD-CB 4.49Å; K835-D857 IonicContact NZ-OD1 3.94Å; K835-D857 IonicContact NZ-OD2 3.62Å; K835-D857 PolarHBondContact NZ-OD2 2.85Å
836	L	98.3	Very high	96.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.5	-176.9	-177.2	71.3	0	0	0	110.3	A783 L785 Y790 V792 V829 C855 Y856 W863	A783-L836 HydrophobicContact CB-CD1 3.83Å; L785-L836 HydrophobicContact CD2-CB 3.87Å; Y790-L836 HydrophobicContact CD1-CD2 3.75Å; Y790-L836 HydrophobicContact CD2-CD2 4.42Å; Y790-L836 HydrophobicContact CG-CD2 3.7Å; V792-L836 HydrophobicContact CG2-CD2 3.86Å; V829-L836 HydrophobicContact CG1-CD1 3.56Å; V829-L836 HydrophobicContact CG1-CG 4.17Å; L836-C855 CarbonylContact O-C 3.26Å; L836-C855 WeakPolarHBondContact O-CA 3.18Å; L836-Y856 HydrophobicContact CB-CD1 4.17Å; L836-Y856 HydrophobicContact CD2-CD1 4.37Å; L836-Y856 PolarHBondContact N-O 2.81Å; L836-Y856 PolarHBondContact O-N 3.31Å; L836-W863 HydrophobicContact CD2-CH2 4.12Å; L836-W863 HydrophobicContact CG-CH2 4.48Å
837	Y	98.6	Very high	96.5	Very high	14 Å²	14	36.3 Å²	36.3	6%	0.055	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.5	-175.7	-68.6	-101	0	0	0	111.2	V829 G830 L832 K835 V853 E854 C855 V866 L885 F903	V829-Y837 VanDerWaalsContact CA-O 3.28Å; V829-Y837 WeakPolarHBondContact CA-O 3.48Å; G830-Y837 PolarHBondContact N-O 2.73Å; G830-Y837 PolarHBondContact O-N 2.86Å; L832-Y837 HydrophobicContact CB-CD2 4.09Å; L832-Y837 HydrophobicContact CB-CE2 3.83Å; L832-Y837 HydrophobicContact CD2-CE2 4.44Å; L832-Y837 HydrophobicContact CG-CE2 4.38Å; K835-Y837 HydrophobicContact CB-CE2 4.05Å; Y837-V853 HydrophobicContact CD1-CG1 4.32Å; Y837-E854 CarbonylContact C-O 3.56Å; Y837-E854 WeakPolarHBondContact CA-O 3.4Å; Y837-C855 HydrophobicContact CD1-CB 3.98Å; Y837-C855 HydrophobicContact CE1-CB 3.85Å; Y837-C855 VanDerWaalsContact CZ-SG 3.55Å; Y837-V866 HydrophobicContact CD1-CG2 4.36Å; Y837-V866 HydrophobicContact CE1-CG2 4.36Å; Y837-L885 VanDerWaalsContact CB-CD2 3.5Å; Y837-L885 HydrophobicContact CD1-CD2 4.33Å; Y837-L885 HydrophobicContact CD2-CD2 4.38Å; Y837-L885 HydrophobicContact CG-CD2 3.84Å; Y837-F903 HydrophobicContact CE1-CD1 4.46Å; Y837-F903 AromaticContact CE1-CE1 3.85Å; Y837-F903 HydrophobicContact CE1-CE1 3.85Å; Y837-F903 HydrophobicContact CE1-CZ 4.34Å
838	A	98.8	Very high	96.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	108.1	173.1	0	0	0	0	0	110.1	V792 M820 V827 V829 V853 E854 W863	V792-A838 HydrophobicContact CG1-CB 4.17Å; M820-A838 HydrophobicContact SD-CB 3.59Å; M820-A838 VanDerWaalsContact SD-CB 3.59Å; V827-A838 HydrophobicContact CG2-CB 4.23Å; V829-A838 HydrophobicContact CG2-CB 4.45Å; A838-V853 WeakPolarHBondContact O-CA 3.43Å; A838-E854 PolarHBondContact N-O 2.89Å; A838-E854 PolarHBondContact O-N 2.78Å; A838-W863 HydrophobicContact CB-CH2 4.02Å; A838-W863 HydrophobicContact CB-CZ3 3.69Å
839	V	98.8	Very high	96.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	118.6	-165.3	-177.1	0	0	0	0	110.5	G828 G841 V853 M869 V878 L885 A887 W910	G828-V839 PolarHBondContact N-O 3.44Å; G828-V839 VanDerWaalsContact N-O 3.17Å; G828-V839 WeakPolarHBondContact O-CB 3.47Å; G828-V839 PolarHBondContact O-N 2.76Å; V839-G841 PolarHBondContact O-N 3.06Å; V839-V853 HydrophobicContact CG1-CG2 4.16Å; V839-V853 HydrophobicContact CG2-CG1 3.98Å; V839-M869 HydrophobicContact CG1-CE 3.88Å; V839-M869 HydrophobicContact CG1-CG 4.35Å; V839-M869 HydrophobicContact CG1-SD 3.38Å; V839-M869 WeakPolarHBondContact CG1-SD 3.38Å; V839-V878 HydrophobicContact CB-CG2 4.01Å; V839-V878 HydrophobicContact CG1-CG2 4.15Å; V839-V878 HydrophobicContact CG2-CG1 4.25Å; V839-V878 HydrophobicContact CG2-CG2 4.35Å; V839-L885 HydrophobicContact CG2-CD2 3.81Å; V839-A887 HydrophobicContact CG1-CB 3.97Å; V839-W910 HydrophobicContact CG1-CH2 4.24Å
840	G	98.5	Very high	96.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.			trans	60	-134.8	175.1	0	0	0	0	0	113.5	R824 L850 S852	R824-G840 PolarHBondContact NH1-O 2.84Å; G840-L850 WeakPolarHBondContact CA-O 3.17Å; G840-S852 PolarHBondContact N-O 3.08Å
841	G	98.3	Very high	96.4	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.			trans	96.4	-162.6	-172.7	0	0	0	0	0	113.2	S825 S826 V839 C849 L850 R873	S825-G841 CarbonylContact O-C 3.57Å; S825-G841 VanDerWaalsContact O-CA 3.3Å; S825-G841 WeakPolarHBondContact O-CA 3.48Å; S826-G841 WeakPolarHBondContact O-CA 3.33Å; V839-G841 PolarHBondContact O-N 3.06Å; G841-C849 CarbonylContact O-C 3.53Å; G841-C849 WeakPolarHBondContact O-CA 3.36Å; G841-L850 PolarHBondContact O-N 3.16Å; G841-R873 PolarHBondContact N-O 3.15Å
842	Y	98.4	Very high	96.5	Very high	79 Å²	79	42 Å²	42	31%	0.31	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	125.6	179.5	-178.6	-93.5	0	0	0	110.7	S825 R847 R848	S825-Y842 PolarHBondContact N-O 2.98Å; S825-Y842 PolarHBondContact O-N 2.71Å; S825-Y842 PolarHBondContact OG-O 2.79Å; Y842-R847 VanDerWaalsContact OH-CA 3.29Å; Y842-R847 WeakPolarHBondContact OH-CA 3.17Å; Y842-R847 WeakPolarHBondContact OH-CB 3.39Å; Y842-R848 WeakPolarHBondContact CA-O 3.47Å; Y842-R848 VanDerWaalsContact CD2-C 3.4Å; Y842-R848 WeakPolarHBondContact CD2-O 3.35Å
843	D	97.9	Very high	96.6	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	118.2	174.1	-171.9	-46.1	0	0	0	109.7	Q823 T845 V846 R847 R848 L850	Q823-D843 PolarHBondContact N-OD2 2.97Å; Q823-D843 VanDerWaalsContact N-OD2 3.08Å; Q823-D843 WeakPolarHBondContact O-CA 3.44Å; Q823-D843 VanDerWaalsContact O-CB 3.28Å; Q823-D843 WeakPolarHBondContact O-CB 3.35Å; D843-T845 VanDerWaalsContact C-N 3.35Å; D843-T845 WeakPolarHBondContact OD1-CA 3.13Å; D843-T845 VanDerWaalsContact OD1-CB 3.3Å; D843-T845 WeakPolarHBondContact OD1-CB 3.49Å; D843-T845 PolarHBondContact OD1-N 3.35Å; D843-T845 PolarHBondContact OD1-OG1 2.91Å; D843-V846 HydrophobicContact CB-CG2 3.76Å; D843-V846 PolarHBondContact OD1-N 2.72Å; D843-R847 CarbonylContact O-C 3.53Å; D843-R847 WeakPolarHBondContact O-CA 3.35Å; D843-R847 PolarHBondContact O-N 2.75Å; D843-R848 PolarHBondContact N-O 2.99Å; D843-R848 PolarHBondContact O-N 2.96Å; D843-R848 VanDerWaalsContact O-N 3.13Å; D843-L850 HydrophobicContact CB-CD1 4.29Å; D843-L850 HydrophobicContact CB-CD2 4.11Å; D843-L850 HydrophobicContact CB-CG 4.4Å
844	G	94.4	Very high	97.1	Very high	33 Å²	33	36.5 Å²	36.5	34%	0.34	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-17.8	-178.2	0	0	0	0	0	114.7	R847	G844-R847 WeakPolarHBondContact O-CG 3.34Å
845	T	94.1	Very high	97.4	Very high	92 Å²	92	34.9 Å²	34.9	56%	0.564	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-48.9	179.6	72.2	0	0	0	0	110.8	Q823 D843	Q823-T845 HydrophobicContact CG-CG2 4.38Å; D843-T845 VanDerWaalsContact C-N 3.35Å; D843-T845 WeakPolarHBondContact OD1-CA 3.13Å; D843-T845 VanDerWaalsContact OD1-CB 3.3Å; D843-T845 WeakPolarHBondContact OD1-CB 3.49Å; D843-T845 PolarHBondContact OD1-N 3.35Å; D843-T845 PolarHBondContact OD1-OG1 2.91Å
846	V	94.3	Very high	97.5	Very high	74 Å²	74	32.3 Å²	32.3	45%	0.448	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-8	174.9	-64.4	0	0	0	0	113.1	D843 R848	D843-V846 HydrophobicContact CB-CG2 3.76Å; D843-V846 PolarHBondContact OD1-N 2.72Å; V846-R848 HydrophobicContact CG2-CB 4.15Å; V846-R848 HydrophobicContact CG2-CG 4.42Å
847	R	94.9	Very high	97.5	Very high	197 Å²	197	34 Å²	34	74%	0.743	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	44.1	-179.7	-60.6	-177.1	177.7	-175.8	-0.9	114	Y842 D843 G844	Y842-R847 VanDerWaalsContact OH-CA 3.29Å; Y842-R847 WeakPolarHBondContact OH-CA 3.17Å; Y842-R847 WeakPolarHBondContact OH-CB 3.39Å; D843-R847 CarbonylContact O-C 3.53Å; D843-R847 WeakPolarHBondContact O-CA 3.35Å; D843-R847 PolarHBondContact O-N 2.75Å; G844-R847 WeakPolarHBondContact O-CG 3.34Å
848	R	96.3	Very high	97.3	Very high	138 Å²	138	35 Å²	35	52%	0.521	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.9	-174.9	-68.4	172.2	-171.8	-177.6	1.5	112.4	Y842 D843 V846	Y842-R848 WeakPolarHBondContact CA-O 3.47Å; Y842-R848 VanDerWaalsContact CD2-C 3.4Å; Y842-R848 WeakPolarHBondContact CD2-O 3.35Å; D843-R848 PolarHBondContact N-O 2.99Å; D843-R848 PolarHBondContact O-N 2.96Å; D843-R848 VanDerWaalsContact O-N 3.13Å; V846-R848 HydrophobicContact CG2-CB 4.15Å; V846-R848 HydrophobicContact CG2-CG 4.42Å
849	C	97.8	Very high	97.1	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.02	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	144.5	158.5	-53.1	0	0	0	0	109	G841 R872 S874 D892	G841-C849 CarbonylContact O-C 3.53Å; G841-C849 WeakPolarHBondContact O-CA 3.36Å; C849-R872 HydrophobicContact CB-CB 4.11Å; C849-R872 VanDerWaalsContact O-CD 3.28Å; C849-R872 WeakPolarHBondContact O-CD 3.38Å; C849-R872 WeakPolarHBondContact O-CG 3.28Å; C849-S874 VanDerWaalsContact SG-CB 3.53Å; C849-D892 HydrophobicContact CB-CB 4.38Å; C849-D892 WeakPolarHBondContact CB-OD1 3.29Å; C849-D892 PolarHBondContact SG-OD1 3.12Å; C849-D892 VanDerWaalsContact SG-OD1 3.41Å
850	L	98.3	Very high	97	Very high	13 Å²	13	45 Å²	45	7%	0.068	24%	0.238	C	C	.	.			trans	-103.2	141.6	-172.9	-59.6	177.9	0	0	0	111.7	R824 G840 G841 D843 R872 R873	R824-L850 HydrophobicContact CG-CD1 3.99Å; G840-L850 WeakPolarHBondContact CA-O 3.17Å; G841-L850 PolarHBondContact O-N 3.16Å; D843-L850 HydrophobicContact CB-CD1 4.29Å; D843-L850 HydrophobicContact CB-CD2 4.11Å; D843-L850 HydrophobicContact CB-CG 4.4Å; L850-R872 WeakPolarHBondContact O-CA 3.49Å; L850-R873 PolarHBondContact O-N 3.01Å
851	S	97.8	Very high	96.9	Very high	20 Å²	20	48.5 Å²	48.5	14%	0.14	26%	0.257	C	S	.	.			trans	-97.9	-25.9	164.6	39.5	0	0	0	0	111.4	E868 M869 C871	S851-E868 VanDerWaalsContact CB-OE2 3.24Å; S851-E868 WeakPolarHBondContact CB-OE2 3.4Å; S851-E868 PolarHBondContact OG-OE2 3.17Å; S851-M869 PolarHBondContact O-N 2.93Å; S851-C871 WeakPolarHBondContact CB-O 3.37Å
852	S	98.3	Very high	96.9	Very high	5 Å²	5	50.8 Å²	50.8	4%	0.035	27%	0.273	C	S	.	.			trans	-63.9	150.2	179.6	68.5	0	0	0	0	113	R824 G840 E868	R824-S852 PolarHBondContact NH1-O 2.81Å; R824-S852 PolarHBondContact NH2-O 2.9Å; R824-S852 PolarHBondContact NH2-OG 3.29Å; G840-S852 PolarHBondContact N-O 3.08Å; S852-E868 WeakPolarHBondContact CB-OE1 3.49Å
853	V	98.7	Very high	96.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	137	-179.5	-178	0	0	0	0	108.2	Y837 A838 V839 V866 M869 W910	Y837-V853 HydrophobicContact CD1-CG1 4.32Å; A838-V853 WeakPolarHBondContact O-CA 3.43Å; V839-V853 HydrophobicContact CG1-CG2 4.16Å; V839-V853 HydrophobicContact CG2-CG1 3.98Å; V853-V866 HydrophobicContact CB-CG2 3.79Å; V853-V866 HydrophobicContact CG1-CG2 3.67Å; V853-V866 PolarHBondContact O-N 3.08Å; V853-M869 HydrophobicContact CG2-CG 4.02Å; V853-W910 HydrophobicContact CG1-CZ2 4.41Å; V853-W910 HydrophobicContact CG2-CZ2 3.87Å
854	E	98.6	Very high	96.9	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	137.8	177.6	-72.9	173.3	-97.9	0	0	110.5	T821 R824 Y837 A838 W863 S864 L865	T821-E854 WeakPolarHBondContact CA-OE2 3.4Å; T821-E854 WeakPolarHBondContact CB-OE2 3.49Å; T821-E854 PolarHBondContact N-OE2 3Å; T821-E854 PolarHBondContact OG1-OE2 2.83Å; R824-E854 IonicContact CZ-OE1 2.74Å; R824-E854 VanDerWaalsContact CZ-OE1 3.23Å; R824-E854 IonicContact NE-OE1 2.88Å; R824-E854 PolarHBondContact NE-OE1 2.84Å; R824-E854 IonicContact NH2-OE1 3.23Å; R824-E854 PolarHBondContact NH2-OE1 2.81Å; Y837-E854 CarbonylContact C-O 3.56Å; Y837-E854 WeakPolarHBondContact CA-O 3.4Å; A838-E854 PolarHBondContact N-O 2.89Å; A838-E854 PolarHBondContact O-N 2.78Å; E854-W863 HydrophobicContact CB-CE3 3.81Å; E854-W863 HydrophobicContact CB-CZ3 4.37Å; E854-S864 CarbonylContact C-O 3.26Å; E854-S864 VanDerWaalsContact CA-O 3.25Å; E854-S864 WeakPolarHBondContact CA-O 3.47Å; E854-L865 HydrophobicContact CG-CD2 3.51Å; E854-L865 HydrophobicContact CG-CG 4.08Å
855	C	98.3	Very high	97.1	Very high	4 Å²	4	53.8 Å²	53.8	3%	0.027	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121.7	179.8	-176.1	0	0	0	0	109.6	L836 Y837 W863 S864 V866	L836-C855 CarbonylContact O-C 3.26Å; L836-C855 WeakPolarHBondContact O-CA 3.18Å; Y837-C855 HydrophobicContact CD1-CB 3.98Å; Y837-C855 HydrophobicContact CE1-CB 3.85Å; Y837-C855 VanDerWaalsContact CZ-SG 3.55Å; C855-W863 CarbonylContact O-C 3.58Å; C855-W863 WeakPolarHBondContact O-CA 3.44Å; C855-S864 PolarHBondContact N-O 3.27Å; C855-S864 PolarHBondContact O-N 3.24Å; C855-S864 PolarHBondContact O-OG 2.86Å; C855-S864 VanDerWaalsContact O-OG 3.05Å; C855-V866 HydrophobicContact CB-CG1 3.61Å; C855-V866 HydrophobicContact CB-CG2 4.5Å
856	Y	98.7	Very high	97.2	Very high	3 Å²	3	51.3 Å²	51.3	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	128	171.5	169.3	-101.4	0	0	0	110.4	Y790 I817 K835 L836 P858 D861 S862 W863	Y790-Y856 HydrophobicContact CE1-CD1 4.3Å; Y790-Y856 AromaticContact CE1-CE1 3.66Å; Y790-Y856 HydrophobicContact CE1-CE1 3.66Å; I817-Y856 HydrophobicContact CB-CE2 4.48Å; I817-Y856 HydrophobicContact CD1-CD1 4.32Å; I817-Y856 HydrophobicContact CD1-CD2 4.11Å; I817-Y856 HydrophobicContact CD1-CE1 4.13Å; I817-Y856 HydrophobicContact CD1-CE2 3.91Å; I817-Y856 HydrophobicContact CD1-CG 4.3Å; K835-Y856 WeakPolarHBondContact CB-O 3.5Å; L836-Y856 HydrophobicContact CB-CD1 4.17Å; L836-Y856 HydrophobicContact CD2-CD1 4.37Å; L836-Y856 PolarHBondContact N-O 2.81Å; L836-Y856 PolarHBondContact O-N 3.31Å; Y856-P858 HydrophobicContact CD1-CG 4.13Å; Y856-P858 HydrophobicContact CE1-CB 4.04Å; Y856-P858 HydrophobicContact CE1-CG 3.76Å; Y856-D861 WeakPolarHBondContact CE2-OD1 3.43Å; Y856-D861 PolarHBondContact OH-OD1 2.87Å; Y856-S862 WeakPolarHBondContact CA-O 3.21Å; Y856-W863 HydrophobicContact CD2-CD2 4.46Å; Y856-W863 HydrophobicContact CG-CD2 4.47Å; Y856-W863 HydrophobicContact CG-CZ2 4.36Å
857	D	97.3	Very high	97.4	Very high	34 Å²	34	50.6 Å²	50.6	18%	0.182	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111.5	174.4	-171.2	-17.9	0	0	0	109.9	K835 V859 S860 D861 S862	K835-D857 HydrophobicContact CD-CB 4.49Å; K835-D857 IonicContact NZ-OD1 3.94Å; K835-D857 IonicContact NZ-OD2 3.62Å; K835-D857 PolarHBondContact NZ-OD2 2.85Å; D857-V859 PolarHBondContact O-N 3.11Å; D857-V859 VanDerWaalsContact O-N 3.14Å; D857-V859 WeakPolarHBondContact OD1-CB 3.26Å; D857-V859 PolarHBondContact OD1-N 3.44Å; D857-S860 WeakPolarHBondContact CB-OG 3.2Å; D857-S860 PolarHBondContact O-N 2.96Å; D857-D861 WeakPolarHBondContact O-CA 3.32Å; D857-D861 PolarHBondContact O-N 2.78Å; D857-S862 PolarHBondContact N-O 2.81Å; D857-S862 PolarHBondContact O-N 3.18Å
858	P	94.2	Very high	97.5	Very high	36 Å²	36	46.3 Å²	46.3	23%	0.234	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-15.1	177.7	-18.9	29.9	0	0	0	114.5	L785 Y856	L785-P858 HydrophobicContact CD2-CG 3.67Å; L785-P858 HydrophobicContact CG-CG 4.46Å; Y856-P858 HydrophobicContact CD1-CG 4.13Å; Y856-P858 HydrophobicContact CE1-CB 4.04Å; Y856-P858 HydrophobicContact CE1-CG 3.76Å
859	V	94.5	Very high	97.6	Very high	137 Å²	137	40 Å²	40	83%	0.83	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-35.4	-178.8	-175.4	0	0	0	0	111.7	D857	D857-V859 PolarHBondContact O-N 3.11Å; D857-V859 VanDerWaalsContact O-N 3.14Å; D857-V859 WeakPolarHBondContact OD1-CB 3.26Å; D857-V859 PolarHBondContact OD1-N 3.44Å
860	S	96.9	Very high	97.5	Very high	72 Å²	72	44.6 Å²	44.6	50%	0.503	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-5.3	174.8	58.9	0	0	0	0	114	D857 S862	D857-S860 WeakPolarHBondContact CB-OG 3.2Å; D857-S860 PolarHBondContact O-N 2.96Å; S860-S862 PolarHBondContact OG-OG 3.43Å
861	D	97	Very high	97.3	Very high	75 Å²	75	45.8 Å²	45.8	40%	0.401	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	59.2	-172.2	-162.5	26.6	0	0	0	111.2	P818 Y856 D857	P818-D861 WeakPolarHBondContact CD-OD1 3.3Å; P818-D861 WeakPolarHBondContact CG-O 3.4Å; Y856-D861 WeakPolarHBondContact CE2-OD1 3.43Å; Y856-D861 PolarHBondContact OH-OD1 2.87Å; D857-D861 WeakPolarHBondContact O-CA 3.32Å; D857-D861 PolarHBondContact O-N 2.78Å
862	S	98.3	Very high	97.3	Very high	48 Å²	48	49.4 Å²	49.4	34%	0.336	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	147.5	-176.7	64.6	0	0	0	0	113.4	Y856 D857 S860	Y856-S862 WeakPolarHBondContact CA-O 3.21Å; D857-S862 PolarHBondContact N-O 2.81Å; D857-S862 PolarHBondContact O-N 3.18Å; S860-S862 PolarHBondContact OG-OG 3.43Å
863	W	98.7	Very high	97.3	Very high	30 Å²	30	49.3 Å²	49.3	11%	0.114	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	145	166.4	-67.8	92.3	0	0	0	110.5	V792 A804 I817 P818 M820 L836 A838 E854 C855 Y856	V792-W863 HydrophobicContact CG1-CH2 3.95Å; V792-W863 HydrophobicContact CG1-CZ2 4.22Å; V792-W863 HydrophobicContact CG2-CH2 4.36Å; A804-W863 HydrophobicContact CB-CZ2 4.2Å; I817-W863 HydrophobicContact CD1-CZ2 4.17Å; P818-W863 VanDerWaalsContact O-CD1 3.24Å; P818-W863 PolarHBondContact O-NE1 2.75Å; M820-W863 HydrophobicContact CG-CD2 3.6Å; M820-W863 HydrophobicContact CG-CE3 3.93Å; M820-W863 HydrophobicContact CG-CG 4.13Å; M820-W863 HydrophobicContact CG-CH2 4.11Å; M820-W863 HydrophobicContact CG-CZ2 3.79Å; M820-W863 HydrophobicContact CG-CZ3 4.18Å; M820-W863 HydrophobicContact SD-CH2 4.11Å; M820-W863 HydrophobicContact SD-CZ2 4.23Å; M820-W863 HydrophobicContact SD-CZ3 4.3Å; L836-W863 HydrophobicContact CD2-CH2 4.12Å; L836-W863 HydrophobicContact CG-CH2 4.48Å; A838-W863 HydrophobicContact CB-CH2 4.02Å; A838-W863 HydrophobicContact CB-CZ3 3.69Å; E854-W863 HydrophobicContact CB-CE3 3.81Å; E854-W863 HydrophobicContact CB-CZ3 4.37Å; C855-W863 CarbonylContact O-C 3.58Å; C855-W863 WeakPolarHBondContact O-CA 3.44Å; Y856-W863 HydrophobicContact CD2-CD2 4.46Å; Y856-W863 HydrophobicContact CG-CD2 4.47Å; Y856-W863 HydrophobicContact CG-CZ2 4.36Å
864	S	98	Very high	97.3	Very high	56 Å²	56	49.5 Å²	49.5	39%	0.392	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145.3	175.7	58.7	0	0	0	0	110.2	E854 C855	E854-S864 CarbonylContact C-O 3.26Å; E854-S864 VanDerWaalsContact CA-O 3.25Å; E854-S864 WeakPolarHBondContact CA-O 3.47Å; C855-S864 PolarHBondContact N-O 3.27Å; C855-S864 PolarHBondContact O-N 3.24Å; C855-S864 PolarHBondContact O-OG 2.86Å; C855-S864 VanDerWaalsContact O-OG 3.05Å
865	L	98.1	Very high	97.2	Very high	93 Å²	93	49.8 Å²	49.8	49%	0.487	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	131.1	171.1	-79	162.4	0	0	0	109.6	Y822 E854	Y822-L865 HydrophobicContact CD2-CD2 4.45Å; Y822-L865 HydrophobicContact CE2-CD1 4.32Å; Y822-L865 HydrophobicContact CE2-CD2 4.03Å; E854-L865 HydrophobicContact CG-CD2 3.51Å; E854-L865 HydrophobicContact CG-CG 4.08Å
866	V	97	Very high	97.2	Very high	39 Å²	39	50 Å²	50	24%	0.236	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	177.2	172.9	-59	0	0	0	0	110	Y837 V853 C855 E868	Y837-V866 HydrophobicContact CD1-CG2 4.36Å; Y837-V866 HydrophobicContact CE1-CG2 4.36Å; V853-V866 HydrophobicContact CB-CG2 3.79Å; V853-V866 HydrophobicContact CG1-CG2 3.67Å; V853-V866 PolarHBondContact O-N 3.08Å; C855-V866 HydrophobicContact CB-CG1 3.61Å; C855-V866 HydrophobicContact CB-CG2 4.5Å; V866-E868 PolarHBondContact O-N 3.05Å
867	S	97.2	Very high	97.2	Very high	59 Å²	59	50.1 Å²	50.1	41%	0.413	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-48.1	128.8	-179.6	-58.3	0	0	0	0	112.6	G908 W910	S867-G908 VanDerWaalsContact CB-O 3.22Å; S867-G908 WeakPolarHBondContact CB-O 3.11Å; S867-G908 PolarHBondContact OG-O 2.9Å; S867-W910 PolarHBondContact O-NE1 2.82Å
868	E	98.1	Very high	97.2	Very high	107 Å²	107	49.4 Å²	49.4	50%	0.5	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-68	151.9	177.2	-55.2	-148.3	170.1	0	0	111.9	S851 S852 V866	S851-E868 VanDerWaalsContact CB-OE2 3.24Å; S851-E868 WeakPolarHBondContact CB-OE2 3.4Å; S851-E868 PolarHBondContact OG-OE2 3.17Å; S852-E868 WeakPolarHBondContact CB-OE1 3.49Å; V866-E868 PolarHBondContact O-N 3.05Å
869	M	98.1	Very high	97.4	Very high	7 Å²	7	48.8 Å²	48.8	3%	0.034	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-62	152.1	165.1	-69	-178.8	-62.5	0	0	111.2	V839 S851 V853 C871 R873 A887 E901 W910	V839-M869 HydrophobicContact CG1-CE 3.88Å; V839-M869 HydrophobicContact CG1-CG 4.35Å; V839-M869 HydrophobicContact CG1-SD 3.38Å; V839-M869 WeakPolarHBondContact CG1-SD 3.38Å; S851-M869 PolarHBondContact O-N 2.93Å; V853-M869 HydrophobicContact CG2-CG 4.02Å; M869-C871 WeakPolarHBondContact CB-O 3.21Å; M869-C871 PolarHBondContact O-N 2.86Å; M869-R873 HydrophobicContact CE-CB 4.04Å; M869-R873 HydrophobicContact CE-CG 4.16Å; M869-R873 HydrophobicContact SD-CG 4.27Å; M869-A887 HydrophobicContact SD-CB 3.89Å; M869-E901 HydrophobicContact CG-CG 4.46Å; M869-W910 HydrophobicContact CG-CD2 4.13Å; M869-W910 HydrophobicContact CG-CE3 4.42Å; M869-W910 HydrophobicContact CG-CH2 4.35Å; M869-W910 HydrophobicContact CG-CZ2 4.05Å
870	T	95.6	Very high	97.4	Very high	99 Å²	99	45.6 Å²	45.6	61%	0.607	26%	0.258	S	S	*	.	S	Bend	trans	-64.1	-20.6	177.8	60.3	0	0	0	0	113.6	E901	T870-E901 WeakPolarHBondContact CB-OE2 3.22Å; T870-E901 WeakPolarHBondContact CG2-OE2 3.36Å; T870-E901 PolarHBondContact N-OE2 3.38Å; T870-E901 VanDerWaalsContact OG1-CD 3.28Å; T870-E901 PolarHBondContact OG1-OE1 3.08Å; T870-E901 PolarHBondContact OG1-OE2 2.9Å
871	C	94.1	Very high	97.3	Very high	37 Å²	37	42.6 Å²	42.6	25%	0.25	24%	0.237	C	C	.	.	S	Bend	trans	-138.8	170.9	170.1	70.8	0	0	0	0	112.4	S851 M869 R873 Q897	S851-C871 WeakPolarHBondContact CB-O 3.37Å; M869-C871 WeakPolarHBondContact CB-O 3.21Å; M869-C871 PolarHBondContact O-N 2.86Å; C871-R873 PolarHBondContact SG-NE 2.82Å; C871-R873 VanDerWaalsContact SG-NE 3.43Å; C871-R873 PolarHBondContact SG-NH2 2.87Å; C871-R873 VanDerWaalsContact SG-NH2 3.36Å; C871-Q897 PolarHBondContact SG-OE1 2.72Å
872	R	97.6	Very high	97	Very high	97 Å²	97	43.8 Å²	43.8	37%	0.366	24%	0.243	S	C	.	.			trans	-83.2	136.4	174.5	-69.1	170.6	176.3	171.8	5.8	110.2	C849 L850 D892 Q897	C849-R872 HydrophobicContact CB-CB 4.11Å; C849-R872 VanDerWaalsContact O-CD 3.28Å; C849-R872 WeakPolarHBondContact O-CD 3.38Å; C849-R872 WeakPolarHBondContact O-CG 3.28Å; L850-R872 WeakPolarHBondContact O-CA 3.49Å; R872-D892 HydrophobicContact CB-CB 4.25Å; R872-D892 WeakPolarHBondContact CD-OD2 3.29Å; R872-Q897 PolarHBondContact O-NE2 2.75Å
873	R	98.1	Very high	96.7	Very high	2 Å²	2	45 Å²	45	1%	0.008	25%	0.246	C	C	.	.			trans	-139.8	110.5	-179.8	-53.5	179.3	-176	-90.7	0.1	110.9	G841 L850 M869 C871 P876 G889 S899 E901	G841-R873 PolarHBondContact N-O 3.15Å; L850-R873 PolarHBondContact O-N 3.01Å; M869-R873 HydrophobicContact CE-CB 4.04Å; M869-R873 HydrophobicContact CE-CG 4.16Å; M869-R873 HydrophobicContact SD-CG 4.27Å; C871-R873 PolarHBondContact SG-NE 2.82Å; C871-R873 VanDerWaalsContact SG-NE 3.43Å; C871-R873 PolarHBondContact SG-NH2 2.87Å; C871-R873 VanDerWaalsContact SG-NH2 3.36Å; R873-P876 HydrophobicContact CB-CB 3.87Å; R873-P876 HydrophobicContact CB-CG 4.03Å; R873-P876 WeakPolarHBondContact O-CD 3.36Å; R873-G889 WeakPolarHBondContact CD-O 3.3Å; R873-G889 PolarHBondContact NH1-O 3.39Å; R873-S899 PolarHBondContact NH1-O 2.83Å; R873-S899 PolarHBondContact NH1-OG 2.91Å; R873-S899 PolarHBondContact NH2-OG 2.91Å; R873-E901 IonicContact CZ-OE1 2.66Å; R873-E901 IonicContact NE-OE1 2.69Å; R873-E901 PolarHBondContact NE-OE1 2.61Å; R873-E901 IonicContact NH2-OE1 2.73Å; R873-E901 PolarHBondContact NH2-OE1 3.03Å
874	S	98.1	Very high	96.6	Very high	4 Å²	4	47 Å²	47	3%	0.028	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-91.4	139.6	159.5	166.5	0	0	0	0	109.3	C849 G890 H891	C849-S874 VanDerWaalsContact SG-CB 3.53Å; S874-G890 CarbonylContact O-C 3.59Å; S874-G890 WeakPolarHBondContact O-CA 3.42Å; S874-H891 VanDerWaalsContact CB-NE2 3.35Å; S874-H891 WeakPolarHBondContact CB-NE2 3.39Å; S874-H891 PolarHBondContact N-O 2.81Å; S874-H891 PolarHBondContact O-CD2 2.94Å; S874-H891 PolarHBondContact O-N 3.36Å; S874-H891 PolarHBondContact OG-NE2 2.82Å
875	G	97.2	Very high	96.5	Very high	6 Å²	6	44.4 Å²	44.4	6%	0.062	24%	0.235	C	C	.	.	S	Bend	trans	56.3	38	-173.4	0	0	0	0	0	116.1	S826 G890 N922	S826-G875 WeakPolarHBondContact O-CA 3.36Å; S826-G875 PolarHBondContact O-N 2.72Å; G875-G890 WeakPolarHBondContact O-CA 3.24Å; G875-N922 WeakPolarHBondContact CA-OD1 3.3Å; G875-N922 PolarHBondContact O-N 2.81Å; G875-N922 VanDerWaalsContact O-N 3.12Å
876	P	98.2	Very high	96.6	Very high	9 Å²	9	40.5 Å²	40.5	6%	0.058	21%	0.214	C	C	.	.			trans	-66.8	146.3	170.4	31.2	-32.4	0	0	0	109.8	R873 V878	R873-P876 HydrophobicContact CB-CB 3.87Å; R873-P876 HydrophobicContact CB-CG 4.03Å; R873-P876 WeakPolarHBondContact O-CD 3.36Å; P876-V878 HydrophobicContact CB-CG2 4.35Å; P876-V878 HydrophobicContact CG-CG2 4.32Å
877	S	98.1	Very high	96.6	Very high	6 Å²	6	38.7 Å²	38.7	4%	0.042	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	129.7	169	-41.2	0	0	0	0	107.8	V888 A923	S877-V888 PolarHBondContact N-O 3.23Å; S877-V888 PolarHBondContact O-N 3.31Å; S877-A923 PolarHBondContact OG-O 3.32Å
878	V	98.3	Very high	96.7	Very high	19 Å²	19	35.9 Å²	35.9	12%	0.115	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.2	-170.9	172	0	0	0	0	110.3	V839 P876 L885 Y886 A887	V839-V878 HydrophobicContact CB-CG2 4.01Å; V839-V878 HydrophobicContact CG1-CG2 4.15Å; V839-V878 HydrophobicContact CG2-CG1 4.25Å; V839-V878 HydrophobicContact CG2-CG2 4.35Å; P876-V878 HydrophobicContact CB-CG2 4.35Å; P876-V878 HydrophobicContact CG-CG2 4.32Å; V878-L885 HydrophobicContact CG1-CD1 3.7Å; V878-L885 HydrophobicContact CG1-CD2 4.46Å; V878-L885 HydrophobicContact CG1-CG 4.1Å; V878-Y886 VanDerWaalsContact CA-O 3.28Å; V878-Y886 WeakPolarHBondContact CA-O 3.46Å; V878-A887 HydrophobicContact CG2-CB 4.25Å
879	C	97.1	Very high	96.7	Very high	22 Å²	22	30.8 Å²	30.8	15%	0.149	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	152.3	-179.6	-160.4	0	0	0	0	110.6	Y886 L925 A927 L932	C879-Y886 PolarHBondContact N-O 3.18Å; C879-Y886 PolarHBondContact O-N 2.77Å; C879-L925 HydrophobicContact CB-CB 4.44Å; C879-L925 HydrophobicContact CB-CD2 3.63Å; C879-L925 HydrophobicContact CB-CG 3.75Å; C879-A927 PolarHBondContact SG-N 2.83Å; C879-A927 VanDerWaalsContact SG-N 3.43Å; C879-L932 HydrophobicContact CB-CD2 4.25Å
880	E	96.4	Very high	96.7	Very high	70 Å²	70	30.4 Å²	30.4	33%	0.327	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	140.5	169.5	-169.9	-76.2	127.3	0	0	109.2	L832 N882 N883 R884 A927	L832-E880 HydrophobicContact CB-CG 4.46Å; L832-E880 HydrophobicContact CD1-CG 4.01Å; E880-N882 PolarHBondContact OE1-N 2.82Å; E880-N882 VanDerWaalsContact OE1-N 3.15Å; E880-N883 VanDerWaalsContact OE1-CA 3.23Å; E880-N883 WeakPolarHBondContact OE1-CA 3.4Å; E880-N883 PolarHBondContact OE1-N 3.43Å; E880-R884 CarbonylContact C-O 3.53Å; E880-R884 WeakPolarHBondContact CA-O 3.33Å; E880-R884 PolarHBondContact OE1-N 2.91Å; E880-A927 WeakPolarHBondContact O-CB 3.31Å
881	L	94.5	Very high	96.8	Very high	9 Å²	9	27 Å²	27	5%	0.047	14%	0.135	C	C	.	.			trans	-153	129.8	169	169.6	66	0	0	0	109.6	N883 R884 Y886 A927 L932 P952	L881-N883 PolarHBondContact O-N 2.93Å; L881-R884 PolarHBondContact N-O 2.87Å; L881-R884 WeakPolarHBondContact O-CB 3.41Å; L881-R884 PolarHBondContact O-N 2.94Å; L881-R884 VanDerWaalsContact O-N 3.16Å; L881-Y886 HydrophobicContact CB-CD2 4.18Å; L881-Y886 HydrophobicContact CB-CE2 3.87Å; L881-Y886 HydrophobicContact CD2-CE2 4.43Å; L881-Y886 HydrophobicContact CG-CE2 4.43Å; L881-A927 HydrophobicContact CB-CB 4.1Å; L881-A927 HydrophobicContact CD1-CB 4.2Å; L881-L932 HydrophobicContact CB-CD2 3.72Å; L881-L932 HydrophobicContact CD2-CD2 3.73Å; L881-L932 HydrophobicContact CD2-CG 3.7Å; L881-L932 HydrophobicContact CG-CD2 4.33Å; L881-P952 HydrophobicContact CD2-CG 4.29Å
882	N	90.4	Very high	97	Very high	100 Å²	100	28.1 Å²	28.1	54%	0.535	14%	0.138	S	C	.	.	S	Bend	trans	55.5	45.6	173.8	-58.2	-24.6	0	0	0	114	E880 R884	E880-N882 PolarHBondContact OE1-N 2.82Å; E880-N882 VanDerWaalsContact OE1-N 3.15Å; N882-R884 VanDerWaalsContact C-N 3.33Å
883	N	91.4	Very high	96.7	Very high	73 Å²	73	25.4 Å²	25.4	39%	0.39	14%	0.141	S	C	.	.	S	Bend	trans	63.1	30.8	-175.7	-160.4	61.3	0	0	0	114	L832 E880 L881 P905 E906	L832-N883 VanDerWaalsContact CD1-C 3.46Å; E880-N883 VanDerWaalsContact OE1-CA 3.23Å; E880-N883 WeakPolarHBondContact OE1-CA 3.4Å; E880-N883 PolarHBondContact OE1-N 3.43Å; L881-N883 PolarHBondContact O-N 2.93Å; N883-P905 WeakPolarHBondContact O-CD 3.2Å; N883-E906 PolarHBondContact ND2-OE1 2.82Å
884	R	95.9	Very high	96.4	Very high	74 Å²	74	31 Å²	31	28%	0.279	18%	0.177	S	C	.	.			trans	-139.6	137.8	-174.1	-64.7	171.5	176.7	-71.5	-37.4	111	E880 L881 N882 Y886 V902 S904 E906	E880-R884 CarbonylContact C-O 3.53Å; E880-R884 WeakPolarHBondContact CA-O 3.33Å; E880-R884 PolarHBondContact OE1-N 2.91Å; L881-R884 PolarHBondContact N-O 2.87Å; L881-R884 WeakPolarHBondContact O-CB 3.41Å; L881-R884 PolarHBondContact O-N 2.94Å; L881-R884 VanDerWaalsContact O-N 3.16Å; N882-R884 VanDerWaalsContact C-N 3.33Å; R884-Y886 HydrophobicContact CB-CD2 4.48Å; R884-Y886 HydrophobicContact CB-CE2 3.86Å; R884-V902 HydrophobicContact CB-CG2 3.66Å; R884-V902 HydrophobicContact CG-CG2 4.39Å; R884-S904 PolarHBondContact NH1-OG 2.95Å; R884-E906 IonicContact NH2-OE1 2.88Å; R884-E906 IonicContact NH2-OE2 2.71Å; R884-E906 PolarHBondContact NH2-OE2 3.32Å; R884-E906 VanDerWaalsContact NH2-OE2 3.14Å
885	L	97.9	Very high	96.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	117.6	-179.6	-171.5	73.4	0	0	0	110	L832 Y837 V839 V878 V902 F903 W910	L832-L885 HydrophobicContact CD2-CB 3.93Å; Y837-L885 VanDerWaalsContact CB-CD2 3.5Å; Y837-L885 HydrophobicContact CD1-CD2 4.33Å; Y837-L885 HydrophobicContact CD2-CD2 4.38Å; Y837-L885 HydrophobicContact CG-CD2 3.84Å; V839-L885 HydrophobicContact CG2-CD2 3.81Å; V878-L885 HydrophobicContact CG1-CD1 3.7Å; V878-L885 HydrophobicContact CG1-CD2 4.46Å; V878-L885 HydrophobicContact CG1-CG 4.1Å; L885-V902 WeakPolarHBondContact O-CA 3.48Å; L885-F903 HydrophobicContact CB-CB 4.25Å; L885-F903 PolarHBondContact N-O 2.87Å; L885-F903 PolarHBondContact O-N 3.17Å; L885-W910 HydrophobicContact CD2-CH2 4.37Å
886	Y	98.6	Very high	96.3	Very high	12 Å²	12	35.2 Å²	35.2	5%	0.047	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	139	179.2	-68.8	-101.3	0	0	0	110.7	V878 C879 L881 R884 V902 I913 L932 Y950	V878-Y886 VanDerWaalsContact CA-O 3.28Å; V878-Y886 WeakPolarHBondContact CA-O 3.46Å; C879-Y886 PolarHBondContact N-O 3.18Å; C879-Y886 PolarHBondContact O-N 2.77Å; L881-Y886 HydrophobicContact CB-CD2 4.18Å; L881-Y886 HydrophobicContact CB-CE2 3.87Å; L881-Y886 HydrophobicContact CD2-CE2 4.43Å; L881-Y886 HydrophobicContact CG-CE2 4.43Å; R884-Y886 HydrophobicContact CB-CD2 4.48Å; R884-Y886 HydrophobicContact CB-CE2 3.86Å; Y886-V902 HydrophobicContact CD1-CB 3.74Å; Y886-V902 HydrophobicContact CD1-CG2 3.82Å; Y886-V902 HydrophobicContact CD2-CG2 3.97Å; Y886-V902 HydrophobicContact CE1-CB 3.68Å; Y886-V902 HydrophobicContact CE1-CG1 4.43Å; Y886-V902 HydrophobicContact CE1-CG2 3.58Å; Y886-V902 HydrophobicContact CE2-CG2 3.73Å; Y886-V902 HydrophobicContact CG-CB 4.28Å; Y886-V902 HydrophobicContact CG-CG2 4.01Å; Y886-I913 HydrophobicContact CD1-CD1 4.2Å; Y886-I913 HydrophobicContact CD1-CG2 4.49Å; Y886-I913 HydrophobicContact CE1-CG2 4.16Å; Y886-L932 HydrophobicContact CD1-CD1 3.74Å; Y886-L932 HydrophobicContact CD2-CD1 4.03Å; Y886-L932 HydrophobicContact CE1-CD1 4.29Å; Y886-L932 HydrophobicContact CG-CD1 3.59Å; Y886-Y950 HydrophobicContact CE1-CD1 4.43Å; Y886-Y950 AromaticContact CE1-CE1 3.73Å; Y886-Y950 HydrophobicContact CE1-CE1 3.73Å
887	A	98.5	Very high	96.2	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	111.9	173.4	0	0	0	0	0	109.2	V839 M869 V878 G900 E901 W910	V839-A887 HydrophobicContact CG1-CB 3.97Å; M869-A887 HydrophobicContact SD-CB 3.89Å; V878-A887 HydrophobicContact CG2-CB 4.25Å; A887-G900 CarbonylContact O-C 3.59Å; A887-G900 VanDerWaalsContact O-CA 3.29Å; A887-G900 WeakPolarHBondContact O-CA 3.32Å; A887-E901 HydrophobicContact CB-CG 4.38Å; A887-E901 PolarHBondContact N-O 3.23Å; A887-E901 PolarHBondContact O-N 2.92Å; A887-W910 HydrophobicContact CB-CH2 4.04Å; A887-W910 HydrophobicContact CB-CZ3 3.77Å
888	V	98.5	Very high	96.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.4	-167.1	-171.8	0	0	0	0	111.2	S877 L916 L925 I934 W957	S877-V888 PolarHBondContact N-O 3.23Å; S877-V888 PolarHBondContact O-N 3.31Å; V888-L916 HydrophobicContact CG1-CD1 3.91Å; V888-L916 HydrophobicContact CG1-CD2 4.06Å; V888-L916 HydrophobicContact CG1-CG 4.03Å; V888-L925 HydrophobicContact CB-CD2 4.35Å; V888-L925 HydrophobicContact CG2-CD2 3.91Å; V888-I934 HydrophobicContact CB-CD1 4.24Å; V888-I934 HydrophobicContact CG1-CD1 3.73Å; V888-W957 HydrophobicContact CG1-CH2 4.07Å; V888-W957 HydrophobicContact CG1-CZ2 3.72Å; V888-W957 HydrophobicContact CG2-CH2 4.4Å; V888-W957 HydrophobicContact CG2-CZ2 4.13Å
889	G	98.1	Very high	96.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.214	C	C	.	.			trans	64.7	-136.2	176.2	0	0	0	0	0	113.3	R873 S899 R920	R873-G889 WeakPolarHBondContact CD-O 3.3Å; R873-G889 PolarHBondContact NH1-O 3.39Å; G889-S899 PolarHBondContact N-O 3.27Å; G889-R920 CarbonylContact C-O 3.55Å; G889-R920 VanDerWaalsContact CA-O 3.31Å; G889-R920 WeakPolarHBondContact CA-O 3.25Å
890	G	98.2	Very high	96.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.208	C	C	.	.			trans	86	-164.5	-171.3	0	0	0	0	0	112.4	S874 G875 Q897 R920	S874-G890 CarbonylContact O-C 3.59Å; S874-G890 WeakPolarHBondContact O-CA 3.42Å; G875-G890 WeakPolarHBondContact O-CA 3.24Å; G890-Q897 PolarHBondContact O-N 3.35Å; G890-R920 PolarHBondContact N-O 2.74Å
891	H	98	Very high	96.3	Very high	28 Å²	28	33.2 Å²	33.2	13%	0.13	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	156.2	178.9	72	107.2	0	0	0	113.3	S874 G893 T895 V896 R921	S874-H891 VanDerWaalsContact CB-NE2 3.35Å; S874-H891 WeakPolarHBondContact CB-NE2 3.39Å; S874-H891 PolarHBondContact N-O 2.81Å; S874-H891 PolarHBondContact O-CD2 2.94Å; S874-H891 PolarHBondContact O-N 3.36Å; S874-H891 PolarHBondContact OG-NE2 2.82Å; H891-G893 PolarHBondContact ND1-O 3.21Å; H891-T895 CarbonylContact C-O 3.55Å; H891-T895 WeakPolarHBondContact CA-O 3.5Å; H891-T895 VanDerWaalsContact CB-O 3.31Å; H891-T895 WeakPolarHBondContact CB-O 3.5Å; H891-V896 HydrophobicContact CB-CG2 4.27Å; H891-R921 HydrophobicContact CB-CB 4.46Å; H891-R921 WeakPolarHBondContact CD2-CD 3.45Å
892	D	96.8	Very high	96.5	Very high	59 Å²	59	33.3 Å²	33.3	32%	0.316	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	120.4	157.7	-167.3	4.8	0	0	0	109.1	C849 R872 T895	C849-D892 HydrophobicContact CB-CB 4.38Å; C849-D892 WeakPolarHBondContact CB-OD1 3.29Å; C849-D892 PolarHBondContact SG-OD1 3.12Å; C849-D892 VanDerWaalsContact SG-OD1 3.41Å; R872-D892 HydrophobicContact CB-CB 4.25Å; R872-D892 WeakPolarHBondContact CD-OD2 3.29Å; D892-T895 PolarHBondContact N-O 2.99Å; D892-T895 WeakPolarHBondContact O-CB 3.47Å; D892-T895 PolarHBondContact O-N 3.37Å
893	G	91.8	Very high	96.8	Very high	41 Å²	41	29 Å²	29	42%	0.423	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	-124.6	-170.7	0	0	0	0	0	112	H891 T895	H891-G893 PolarHBondContact ND1-O 3.21Å; G893-T895 VanDerWaalsContact C-N 3.34Å
894	P	91.6	Very high	96.9	Very high	118 Å²	118	25.6 Å²	25.6	77%	0.766	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-16.6	176.1	33.7	-35.6	0	0	0	113.7	V896	P894-V896 PolarHBondContact O-N 2.88Å
895	T	96	Very high	96.5	Very high	91 Å²	91	23.5 Å²	23.5	56%	0.558	15%	0.148	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	100.5	-168.9	-54.2	0	0	0	0	111.2	H891 D892 G893	H891-T895 CarbonylContact C-O 3.55Å; H891-T895 WeakPolarHBondContact CA-O 3.5Å; H891-T895 VanDerWaalsContact CB-O 3.31Å; H891-T895 WeakPolarHBondContact CB-O 3.5Å; D892-T895 PolarHBondContact N-O 2.99Å; D892-T895 WeakPolarHBondContact O-CB 3.47Å; D892-T895 PolarHBondContact O-N 3.37Å; G893-T895 VanDerWaalsContact C-N 3.34Å
896	V	97.3	Very high	96.1	Very high	9 Å²	9	29 Å²	29	6%	0.055	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	138.4	169.1	-171.4	0	0	0	0	110.1	H891 P894 K919 R921 D939	H891-V896 HydrophobicContact CB-CG2 4.27Å; P894-V896 PolarHBondContact O-N 2.88Å; V896-K919 HydrophobicContact CB-CB 4.33Å; V896-K919 HydrophobicContact CG1-CB 3.98Å; V896-R921 HydrophobicContact CG1-CB 4.02Å; V896-R921 HydrophobicContact CG1-CG 4.02Å; V896-R921 HydrophobicContact CG2-CG 4.1Å; V896-D939 VanDerWaalsContact CB-O 3.3Å; V896-D939 WeakPolarHBondContact CB-O 3.41Å; V896-D939 WeakPolarHBondContact CG2-O 3.21Å
897	Q	96.7	Very high	95.8	Very high	26 Å²	26	32.5 Å²	32.5	12%	0.121	20%	0.196	C	C	.	.			trans	-106.2	152	-168.3	-57.9	-177.6	39.3	0	0	112.6	C871 R872 G890 R920	C871-Q897 PolarHBondContact SG-OE1 2.72Å; R872-Q897 PolarHBondContact O-NE2 2.75Å; G890-Q897 PolarHBondContact O-N 3.35Å; Q897-R920 PolarHBondContact O-N 3.15Å; Q897-R920 VanDerWaalsContact O-N 3.11Å
898	T	97.8	Very high	95.6	Very high	40 Å²	40	33.6 Å²	33.6	25%	0.245	21%	0.207	C	C	.	.			trans	-97.4	-26.4	165.8	46.8	0	0	0	0	112.4	D915 L916 K919	T898-D915 PolarHBondContact OG1-OD2 2.77Å; T898-L916 WeakPolarHBondContact CG2-O 3.44Å; T898-L916 WeakPolarHBondContact O-CB 3.37Å; T898-L916 VanDerWaalsContact O-CG 3.31Å; T898-L916 WeakPolarHBondContact O-CG 3Å; T898-L916 PolarHBondContact O-N 3.24Å; T898-K919 HydrophobicContact CG2-CB 4.49Å; T898-K919 HydrophobicContact CG2-CG 3.78Å
899	S	97.9	Very high	95.5	Very high	16 Å²	16	36.6 Å²	36.6	11%	0.112	23%	0.226	C	C	.	.			trans	-67	153.6	-171.1	72.6	0	0	0	0	112.9	R873 G889 D915	R873-S899 PolarHBondContact NH1-O 2.83Å; R873-S899 PolarHBondContact NH1-OG 2.91Å; R873-S899 PolarHBondContact NH2-OG 2.91Å; G889-S899 PolarHBondContact N-O 3.27Å; S899-D915 VanDerWaalsContact CA-OD1 3.31Å; S899-D915 WeakPolarHBondContact CA-OD1 3.44Å; S899-D915 WeakPolarHBondContact CB-OD1 3.08Å
900	G	97.9	Very high	95.5	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	163.9	165.4	0	0	0	0	0	111.4	A887 I913	A887-G900 CarbonylContact O-C 3.59Å; A887-G900 VanDerWaalsContact O-CA 3.29Å; A887-G900 WeakPolarHBondContact O-CA 3.32Å; G900-I913 WeakPolarHBondContact O-CG1 3.18Å; G900-I913 PolarHBondContact O-N 3Å
901	E	98.3	Very high	95.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	153.9	174.5	55.7	-159.6	119.8	0	0	111.5	M869 T870 R873 A887 W910 Q911	M869-E901 HydrophobicContact CG-CG 4.46Å; T870-E901 WeakPolarHBondContact CB-OE2 3.22Å; T870-E901 WeakPolarHBondContact CG2-OE2 3.36Å; T870-E901 PolarHBondContact N-OE2 3.38Å; T870-E901 VanDerWaalsContact OG1-CD 3.28Å; T870-E901 PolarHBondContact OG1-OE1 3.08Å; T870-E901 PolarHBondContact OG1-OE2 2.9Å; R873-E901 IonicContact CZ-OE1 2.66Å; R873-E901 IonicContact NE-OE1 2.69Å; R873-E901 PolarHBondContact NE-OE1 2.61Å; R873-E901 IonicContact NH2-OE1 2.73Å; R873-E901 PolarHBondContact NH2-OE1 3.03Å; A887-E901 HydrophobicContact CB-CG 4.38Å; A887-E901 PolarHBondContact N-O 3.23Å; A887-E901 PolarHBondContact O-N 2.92Å; E901-W910 HydrophobicContact CB-CE3 4.16Å; E901-W910 HydrophobicContact CG-CD2 4.47Å; E901-W910 HydrophobicContact CG-CE3 3.71Å; E901-W910 HydrophobicContact CG-CZ3 4.19Å; E901-Q911 CarbonylContact C-O 3.51Å; E901-Q911 WeakPolarHBondContact CA-O 3.29Å; E901-Q911 WeakPolarHBondContact CB-O 3.43Å
902	V	98.2	Very high	95.4	Very high	12 Å²	12	49 Å²	49	7%	0.073	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.1	-176.1	63.3	0	0	0	0	110.6	R884 L885 Y886 W910 Q911 I913	R884-V902 HydrophobicContact CB-CG2 3.66Å; R884-V902 HydrophobicContact CG-CG2 4.39Å; L885-V902 WeakPolarHBondContact O-CA 3.48Å; Y886-V902 HydrophobicContact CD1-CB 3.74Å; Y886-V902 HydrophobicContact CD1-CG2 3.82Å; Y886-V902 HydrophobicContact CD2-CG2 3.97Å; Y886-V902 HydrophobicContact CE1-CB 3.68Å; Y886-V902 HydrophobicContact CE1-CG1 4.43Å; Y886-V902 HydrophobicContact CE1-CG2 3.58Å; Y886-V902 HydrophobicContact CE2-CG2 3.73Å; Y886-V902 HydrophobicContact CG-CB 4.28Å; Y886-V902 HydrophobicContact CG-CG2 4.01Å; V902-W910 CarbonylContact O-C 3.53Å; V902-W910 WeakPolarHBondContact O-CA 3.33Å; V902-Q911 HydrophobicContact CG1-CB 4.25Å; V902-Q911 PolarHBondContact N-O 3.14Å; V902-Q911 PolarHBondContact O-N 3.35Å; V902-I913 HydrophobicContact CB-CG2 4.09Å; V902-I913 HydrophobicContact CG1-CG2 3.75Å
903	F	98.3	Very high	95.5	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.035	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	133.2	174.1	-178.4	-106.3	0	0	0	110.5	L832 Y837 L885 P905 G908 W910	L832-F903 HydrophobicContact CD2-CD1 4.19Å; Y837-F903 HydrophobicContact CE1-CD1 4.46Å; Y837-F903 AromaticContact CE1-CE1 3.85Å; Y837-F903 HydrophobicContact CE1-CE1 3.85Å; Y837-F903 HydrophobicContact CE1-CZ 4.34Å; L885-F903 HydrophobicContact CB-CB 4.25Å; L885-F903 PolarHBondContact N-O 2.87Å; L885-F903 PolarHBondContact O-N 3.17Å; F903-P905 HydrophobicContact CE1-CB 4.19Å; F903-G908 VanDerWaalsContact CE2-C 3.49Å; F903-W910 HydrophobicContact CB-CD2 3.79Å; F903-W910 HydrophobicContact CB-CE3 3.72Å; F903-W910 HydrophobicContact CB-CH2 3.73Å; F903-W910 HydrophobicContact CB-CZ2 3.77Å; F903-W910 HydrophobicContact CB-CZ3 3.7Å; F903-W910 HydrophobicContact CD2-CD2 4.15Å; F903-W910 AromaticContact CD2-CE2 3.8Å; F903-W910 HydrophobicContact CD2-CG 4.26Å; F903-W910 HydrophobicContact CD2-CZ2 4.25Å; F903-W910 AromaticContact CD2-NE1 3.71Å; F903-W910 HydrophobicContact CG-CD2 4.45Å; F903-W910 HydrophobicContact CG-CZ2 4.22Å
904	S	92.2	Very high	95.8	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.014	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	116	171.3	-42.4	0	0	0	0	108.3	R884 E906 T907 G908 T909	R884-S904 PolarHBondContact NH1-OG 2.95Å; S904-E906 WeakPolarHBondContact CB-OE2 3.4Å; S904-E906 PolarHBondContact O-N 2.75Å; S904-T907 WeakPolarHBondContact CB-OG1 3.42Å; S904-T907 PolarHBondContact O-N 2.79Å; S904-G908 WeakPolarHBondContact O-CA 3.4Å; S904-G908 PolarHBondContact O-N 2.88Å; S904-T909 PolarHBondContact N-O 3.11Å
905	P	87.8	Confident	96.1	Very high	31 Å²	31	43.2 Å²	43.2	20%	0.201	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-26.6	-179.2	27.9	-34	0	0	0	111.9	L832 N883 F903	L832-P905 HydrophobicContact CD1-CG 4.45Å; L832-P905 HydrophobicContact CD2-CB 4.18Å; L832-P905 HydrophobicContact CD2-CG 4.02Å; L832-P905 HydrophobicContact CG-CG 4.43Å; N883-P905 WeakPolarHBondContact O-CD 3.2Å; F903-P905 HydrophobicContact CE1-CB 4.19Å
906	E	89.6	Confident	96.2	Very high	114 Å²	114	39.2 Å²	39.2	53%	0.533	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-29.7	-176.2	-42.5	84.2	177.2	0	0	112.9	N883 R884 S904	N883-E906 PolarHBondContact ND2-OE1 2.82Å; R884-E906 IonicContact NH2-OE1 2.88Å; R884-E906 IonicContact NH2-OE2 2.71Å; R884-E906 PolarHBondContact NH2-OE2 3.32Å; R884-E906 VanDerWaalsContact NH2-OE2 3.14Å; S904-E906 WeakPolarHBondContact CB-OE2 3.4Å; S904-E906 PolarHBondContact O-N 2.75Å
907	T	92.9	Very high	96.2	Very high	87 Å²	87	43.2 Å²	43.2	53%	0.534	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-14	176.2	63.4	0	0	0	0	113	S904 T909	S904-T907 WeakPolarHBondContact CB-OG1 3.42Å; S904-T907 PolarHBondContact O-N 2.79Å; T907-T909 PolarHBondContact O-N 2.79Å; T907-T909 PolarHBondContact OG1-N 2.98Å; T907-T909 PolarHBondContact OG1-OG1 2.85Å
908	G	93.1	Very high	96.2	Very high	22 Å²	22	43.8 Å²	43.8	23%	0.227	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	24.1	-172	0	0	0	0	0	113.8	S867 F903 S904	S867-G908 VanDerWaalsContact CB-O 3.22Å; S867-G908 WeakPolarHBondContact CB-O 3.11Å; S867-G908 PolarHBondContact OG-O 2.9Å; F903-G908 VanDerWaalsContact CE2-C 3.49Å; S904-G908 WeakPolarHBondContact O-CA 3.4Å; S904-G908 PolarHBondContact O-N 2.88Å
909	T	96.6	Very high	96.2	Very high	64 Å²	64	47.3 Å²	47.3	39%	0.393	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	147.3	-174.8	58.4	0	0	0	0	114.3	S904 T907	S904-T909 PolarHBondContact N-O 3.11Å; T907-T909 PolarHBondContact O-N 2.79Å; T907-T909 PolarHBondContact OG1-N 2.98Å; T907-T909 PolarHBondContact OG1-OG1 2.85Å
910	W	98.2	Very high	96.2	Very high	24 Å²	24	46.6 Å²	46.6	9%	0.091	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	142.1	169.9	-67.3	94.7	0	0	0	111	V839 V853 S867 M869 L885 A887 E901 V902 F903	V839-W910 HydrophobicContact CG1-CH2 4.24Å; V853-W910 HydrophobicContact CG1-CZ2 4.41Å; V853-W910 HydrophobicContact CG2-CZ2 3.87Å; S867-W910 PolarHBondContact O-NE1 2.82Å; M869-W910 HydrophobicContact CG-CD2 4.13Å; M869-W910 HydrophobicContact CG-CE3 4.42Å; M869-W910 HydrophobicContact CG-CH2 4.35Å; M869-W910 HydrophobicContact CG-CZ2 4.05Å; L885-W910 HydrophobicContact CD2-CH2 4.37Å; A887-W910 HydrophobicContact CB-CH2 4.04Å; A887-W910 HydrophobicContact CB-CZ3 3.77Å; E901-W910 HydrophobicContact CB-CE3 4.16Å; E901-W910 HydrophobicContact CG-CD2 4.47Å; E901-W910 HydrophobicContact CG-CE3 3.71Å; E901-W910 HydrophobicContact CG-CZ3 4.19Å; V902-W910 CarbonylContact O-C 3.53Å; V902-W910 WeakPolarHBondContact O-CA 3.33Å; F903-W910 HydrophobicContact CB-CD2 3.79Å; F903-W910 HydrophobicContact CB-CE3 3.72Å; F903-W910 HydrophobicContact CB-CH2 3.73Å; F903-W910 HydrophobicContact CB-CZ2 3.77Å; F903-W910 HydrophobicContact CB-CZ3 3.7Å; F903-W910 HydrophobicContact CD2-CD2 4.15Å; F903-W910 AromaticContact CD2-CE2 3.8Å; F903-W910 HydrophobicContact CD2-CG 4.26Å; F903-W910 HydrophobicContact CD2-CZ2 4.25Å; F903-W910 AromaticContact CD2-NE1 3.71Å; F903-W910 HydrophobicContact CG-CD2 4.45Å; F903-W910 HydrophobicContact CG-CZ2 4.22Å
911	Q	97.1	Very high	96.2	Very high	105 Å²	105	48.4 Å²	48.4	49%	0.491	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	139.2	175.3	-57.1	-176.1	22.9	0	0	109.6	E901 V902	E901-Q911 CarbonylContact C-O 3.51Å; E901-Q911 WeakPolarHBondContact CA-O 3.29Å; E901-Q911 WeakPolarHBondContact CB-O 3.43Å; V902-Q911 HydrophobicContact CG1-CB 4.25Å; V902-Q911 PolarHBondContact N-O 3.14Å; V902-Q911 PolarHBondContact O-N 3.35Å
912	R	97.5	Very high	96.2	Very high	160 Å²	160	49 Å²	49	60%	0.604	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	132.4	179.2	179.3	170.8	-178.7	179.9	1.5	110.8	D915	R912-D915 IonicContact CZ-OD1 2.65Å; R912-D915 IonicContact NE-OD1 2.82Å; R912-D915 PolarHBondContact NE-OD1 3.08Å; R912-D915 IonicContact NH2-OD1 2.99Å; R912-D915 PolarHBondContact NH2-OD1 2.86Å; R912-D915 IonicContact NH2-OD2 3.08Å; R912-D915 PolarHBondContact NH2-OD2 2.8Å
913	I	98.1	Very high	96.2	Very high	8 Å²	8	49.1 Å²	49.1	4%	0.041	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	177	169.8	61.3	155.6	0	0	0	110.6	Y886 G900 V902 Y950 W957	Y886-I913 HydrophobicContact CD1-CD1 4.2Å; Y886-I913 HydrophobicContact CD1-CG2 4.49Å; Y886-I913 HydrophobicContact CE1-CG2 4.16Å; G900-I913 WeakPolarHBondContact O-CG1 3.18Å; G900-I913 PolarHBondContact O-N 3Å; V902-I913 HydrophobicContact CB-CG2 4.09Å; V902-I913 HydrophobicContact CG1-CG2 3.75Å; I913-Y950 HydrophobicContact CB-CE2 4.26Å; I913-Y950 HydrophobicContact CD1-CD2 4.3Å; I913-Y950 HydrophobicContact CD1-CE1 4.37Å; I913-Y950 HydrophobicContact CD1-CE2 3.9Å; I913-Y950 WeakPolarHBondContact CG2-OH 3.34Å; I913-W957 HydrophobicContact CD1-CZ2 4.07Å
914	A	98	Very high	96.1	Very high	26 Å²	26	49 Å²	49	22%	0.215	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-55.6	143.7	171.8	0	0	0	0	0	112.2	N955 W957	A914-N955 WeakPolarHBondContact CB-O 3.45Å; A914-N955 WeakPolarHBondContact CB-OD1 3.37Å; A914-N955 PolarHBondContact N-OD1 3.2Å; A914-W957 PolarHBondContact O-NE1 2.97Å
915	D	98.5	Very high	96.4	Very high	61 Å²	61	49.6 Å²	49.6	33%	0.326	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-73.4	146.4	175.4	-76.4	17.7	0	0	0	110.7	T898 S899 R912	T898-D915 PolarHBondContact OG1-OD2 2.77Å; S899-D915 VanDerWaalsContact CA-OD1 3.31Å; S899-D915 WeakPolarHBondContact CA-OD1 3.44Å; S899-D915 WeakPolarHBondContact CB-OD1 3.08Å; R912-D915 IonicContact CZ-OD1 2.65Å; R912-D915 IonicContact NE-OD1 2.82Å; R912-D915 PolarHBondContact NE-OD1 3.08Å; R912-D915 IonicContact NH2-OD1 2.99Å; R912-D915 PolarHBondContact NH2-OD1 2.86Å; R912-D915 IonicContact NH2-OD2 3.08Å; R912-D915 PolarHBondContact NH2-OD2 2.8Å
916	L	98.4	Very high	96.8	Very high	8 Å²	8	48.6 Å²	48.6	4%	0.042	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-59.2	150.7	169.6	-64.9	167.2	0	0	0	111.9	V888 T898 V918 R920 I934 W957	V888-L916 HydrophobicContact CG1-CD1 3.91Å; V888-L916 HydrophobicContact CG1-CD2 4.06Å; V888-L916 HydrophobicContact CG1-CG 4.03Å; T898-L916 WeakPolarHBondContact CG2-O 3.44Å; T898-L916 WeakPolarHBondContact O-CB 3.37Å; T898-L916 VanDerWaalsContact O-CG 3.31Å; T898-L916 WeakPolarHBondContact O-CG 3Å; T898-L916 PolarHBondContact O-N 3.24Å; L916-V918 VanDerWaalsContact C-N 3.29Å; L916-V918 WeakPolarHBondContact CB-O 3.4Å; L916-R920 HydrophobicContact CD1-CB 3.91Å; L916-R920 HydrophobicContact CD1-CG 4.04Å; L916-I934 HydrophobicContact CD1-CD1 4.12Å; L916-I934 HydrophobicContact CD2-CD1 4.24Å; L916-I934 HydrophobicContact CD2-CG2 3.74Å; L916-W957 HydrophobicContact CD2-CD2 3.61Å; L916-W957 HydrophobicContact CD2-CE3 3.76Å; L916-W957 HydrophobicContact CD2-CG 4.2Å; L916-W957 HydrophobicContact CD2-CH2 3.95Å; L916-W957 HydrophobicContact CD2-CZ2 3.81Å; L916-W957 HydrophobicContact CD2-CZ3 3.92Å
917	N	97.8	Very high	97	Very high	93 Å²	93	44.7 Å²	44.7	50%	0.497	24%	0.237	S	C	.	.	S	Bend	trans	-68.7	-30.5	171	-59.6	-91.5	0	0	0	111.5	E948 W957 I959	N917-E948 VanDerWaalsContact CB-OE2 3.26Å; N917-E948 WeakPolarHBondContact CB-OE2 3.42Å; N917-E948 PolarHBondContact N-OE2 3.12Å; N917-E948 PolarHBondContact ND2-OE2 3.07Å; N917-W957 WeakPolarHBondContact ND2-CB 3.39Å; N917-W957 PolarHBondContact ND2-O 3.24Å; N917-I959 HydrophobicContact CB-CD1 3.84Å; N917-I959 HydrophobicContact CB-CG1 3.95Å
918	V	96.4	Very high	96.9	Very high	37 Å²	37	42.4 Å²	42.4	22%	0.224	22%	0.22	C	C	.	.	S	Bend	trans	-122	142.2	178.9	-169.8	0	0	0	0	110.4	L916 R920 L944 E948	L916-V918 VanDerWaalsContact C-N 3.29Å; L916-V918 WeakPolarHBondContact CB-O 3.4Å; V918-R920 PolarHBondContact O-N 2.99Å; V918-L944 HydrophobicContact CG1-CD1 3.8Å; V918-L944 HydrophobicContact CG1-CD2 4.16Å; V918-E948 PolarHBondContact N-OE1 2.98Å
919	K	97.8	Very high	96.6	Very high	115 Å²	115	47.3 Å²	47.3	50%	0.5	24%	0.241	S	C	.	.			trans	-63.1	131.4	171.4	-71.8	172.6	-176.9	169.7	0	109.8	V896 T898 D939	V896-K919 HydrophobicContact CB-CB 4.33Å; V896-K919 HydrophobicContact CG1-CB 3.98Å; T898-K919 HydrophobicContact CG2-CB 4.49Å; T898-K919 HydrophobicContact CG2-CG 3.78Å; K919-D939 HydrophobicContact CB-CB 4.27Å; K919-D939 WeakPolarHBondContact O-CA 3.34Å
920	R	98	Very high	96.2	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.238	C	C	.	.			trans	-140	125.2	-179.7	-62.5	179.5	-169.9	-93.8	-1.5	111.6	G889 G890 Q897 L916 V918 A923 I934 G936 L944 S946 E948	G889-R920 CarbonylContact C-O 3.55Å; G889-R920 VanDerWaalsContact CA-O 3.31Å; G889-R920 WeakPolarHBondContact CA-O 3.25Å; G890-R920 PolarHBondContact N-O 2.74Å; Q897-R920 PolarHBondContact O-N 3.15Å; Q897-R920 VanDerWaalsContact O-N 3.11Å; L916-R920 HydrophobicContact CD1-CB 3.91Å; L916-R920 HydrophobicContact CD1-CG 4.04Å; V918-R920 PolarHBondContact O-N 2.99Å; R920-A923 HydrophobicContact CB-CB 4.37Å; R920-I934 HydrophobicContact CB-CD1 4.45Å; R920-G936 PolarHBondContact NH1-O 2.9Å; R920-L944 HydrophobicContact CG-CD1 3.84Å; R920-S946 PolarHBondContact NH1-O 2.73Å; R920-S946 PolarHBondContact NH2-O 3.18Å; R920-S946 PolarHBondContact NH2-OG 2.81Å; R920-E948 IonicContact CZ-OE1 2.83Å; R920-E948 VanDerWaalsContact CZ-OE1 3.23Å; R920-E948 IonicContact NE-OE1 4Å; R920-E948 PolarHBondContact NE-OE1 3.46Å; R920-E948 IonicContact NH2-OE1 3.18Å; R920-E948 PolarHBondContact NH2-OE1 3.41Å
921	R	97.2	Very high	96.1	Very high	40 Å²	40	46.8 Å²	46.8	15%	0.151	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-117.9	158.2	154.3	63.9	170.6	-170.4	-120.5	-12.7	109.5	H891 V896 A923 G937 E938	H891-R921 HydrophobicContact CB-CB 4.46Å; H891-R921 WeakPolarHBondContact CD2-CD 3.45Å; V896-R921 HydrophobicContact CG1-CB 4.02Å; V896-R921 HydrophobicContact CG1-CG 4.02Å; V896-R921 HydrophobicContact CG2-CG 4.1Å; R921-A923 PolarHBondContact O-N 3.03Å; R921-A923 VanDerWaalsContact O-N 3.15Å; R921-G937 WeakPolarHBondContact O-CA 3.45Å; R921-E938 HydrophobicContact CG-CG 3.54Å; R921-E938 IonicContact CZ-OE1 3.49Å; R921-E938 IonicContact CZ-OE2 3.53Å; R921-E938 PolarHBondContact N-O 3.17Å; R921-E938 IonicContact NE-OE1 3.5Å; R921-E938 PolarHBondContact NE-OE1 2.9Å; R921-E938 IonicContact NE-OE2 3.54Å; R921-E938 PolarHBondContact NE-OE2 3.42Å; R921-E938 VanDerWaalsContact NH2-CD 3.26Å; R921-E938 IonicContact NH2-OE1 3.59Å; R921-E938 PolarHBondContact NH2-OE1 2.83Å; R921-E938 IonicContact NH2-OE2 2.74Å; R921-E938 PolarHBondContact NH2-OE2 3.02Å; R921-E938 PolarHBondContact O-N 3.28Å
922	N	97.8	Very high	96.1	Very high	13 Å²	13	41.8 Å²	41.8	7%	0.07	22%	0.22	C	C	.	.	S	Bend	trans	56.5	32.3	172.6	-50.7	-51.4	0	0	0	113.8	G875 E938 Y970	G875-N922 WeakPolarHBondContact CA-OD1 3.3Å; G875-N922 PolarHBondContact O-N 2.81Å; G875-N922 VanDerWaalsContact O-N 3.12Å; N922-E938 PolarHBondContact ND2-OE1 2.79Å; N922-Y970 HydrophobicContact CB-CD1 3.7Å; N922-Y970 HydrophobicContact CB-CD2 3.92Å; N922-Y970 HydrophobicContact CB-CE1 3.74Å; N922-Y970 HydrophobicContact CB-CE2 3.91Å; N922-Y970 HydrophobicContact CB-CG 3.84Å; N922-Y970 PolarHBondContact ND2-OH 2.99Å; N922-Y970 PolarHBondContact O-N 3.23Å; N922-Y970 VanDerWaalsContact OD1-CE1 3.25Å; N922-Y970 WeakPolarHBondContact OD1-CE1 3.29Å
923	A	98.1	Very high	96	Very high	14 Å²	14	35.1 Å²	35.1	12%	0.116	20%	0.195	C	C	.	.			trans	-85.9	163.8	172.5	0	0	0	0	0	110.6	S877 R920 R921 I934 G936	S877-A923 PolarHBondContact OG-O 3.32Å; R920-A923 HydrophobicContact CB-CB 4.37Å; R921-A923 PolarHBondContact O-N 3.03Å; R921-A923 VanDerWaalsContact O-N 3.15Å; A923-I934 HydrophobicContact CB-CD1 4.19Å; A923-I934 HydrophobicContact CB-CG1 3.83Å; A923-G936 WeakPolarHBondContact CB-O 3.43Å
924	G	97.4	Very high	96	Very high	6 Å²	6	34.7 Å²	34.7	6%	0.062	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	147	163.1	0	0	0	0	0	110.7	I934 I935 V973	G924-I934 CarbonylContact O-C 3.6Å; G924-I934 WeakPolarHBondContact O-CA 3.39Å; G924-I934 WeakPolarHBondContact O-CG1 3.43Å; G924-I935 PolarHBondContact N-O 3.13Å; G924-I935 PolarHBondContact O-N 2.92Å; G924-V973 VanDerWaalsContact CA-CG2 3.46Å
925	L	97.9	Very high	96	Very high	14 Å²	14	33.7 Å²	33.7	7%	0.073	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	132.4	171.9	-178.2	73.6	0	0	0	108.8	C879 V888 L932 Y933 I934 W957	C879-L925 HydrophobicContact CB-CB 4.44Å; C879-L925 HydrophobicContact CB-CD2 3.63Å; C879-L925 HydrophobicContact CB-CG 3.75Å; V888-L925 HydrophobicContact CB-CD2 4.35Å; V888-L925 HydrophobicContact CG2-CD2 3.91Å; L925-L932 HydrophobicContact CD1-CB 4.01Å; L925-L932 HydrophobicContact CD1-CD1 4.42Å; L925-Y933 WeakPolarHBondContact CA-O 3.2Å; L925-I934 HydrophobicContact CD1-CB 3.76Å; L925-I934 HydrophobicContact CD1-CD1 4.48Å; L925-I934 HydrophobicContact CD1-CG1 4.17Å; L925-W957 HydrophobicContact CD1-CH2 4.26Å
926	V	96.6	Very high	95.9	Very high	10 Å²	10	30.8 Å²	30.8	6%	0.061	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	155.7	177.4	-59.3	0	0	0	0	110.9	L644 L932 Y933 I935 V973 I975	L644-V926 HydrophobicContact CD1-CG1 4.26Å; L644-V926 HydrophobicContact CD1-CG2 4.17Å; V926-L932 CarbonylContact O-C 3.56Å; V926-L932 WeakPolarHBondContact O-CA 3.48Å; V926-Y933 PolarHBondContact N-O 3.41Å; V926-Y933 PolarHBondContact O-N 2.98Å; V926-I935 HydrophobicContact CG2-CD1 3.97Å; V926-V973 HydrophobicContact CG1-CB 3.96Å; V926-V973 HydrophobicContact CG1-CG2 3.6Å; V926-I975 HydrophobicContact CB-CD1 3.64Å; V926-I975 HydrophobicContact CB-CG1 4.01Å; V926-I975 HydrophobicContact CG1-CD1 4.46Å; V926-I975 HydrophobicContact CG1-CG1 4.32Å; V926-I975 HydrophobicContact CG2-CD1 3.65Å; V926-I975 HydrophobicContact CG2-CG1 3.98Å
927	A	93.9	Very high	95.8	Very high	32 Å²	32	30.5 Å²	30.5	26%	0.264	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	127.3	173.5	0	0	0	0	0	110.8	C879 E880 L881 F931 L932 I975	C879-A927 PolarHBondContact SG-N 2.83Å; C879-A927 VanDerWaalsContact SG-N 3.43Å; E880-A927 WeakPolarHBondContact O-CB 3.31Å; L881-A927 HydrophobicContact CB-CB 4.1Å; L881-A927 HydrophobicContact CD1-CB 4.2Å; A927-F931 CarbonylContact C-O 3.58Å; A927-F931 WeakPolarHBondContact CA-O 3.46Å; A927-L932 HydrophobicContact CB-CD2 3.92Å; A927-I975 WeakPolarHBondContact O-CD1 3.44Å
928	H	91.2	Very high	95.8	Very high	38 Å²	38	27.3 Å²	27.3	18%	0.176	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	137.1	175.3	-169.3	48.2	0	0	0	111.1	F663 G930 F931 Y933 I975	F663-H928 AromaticContact CD1-CD2 3.61Å; F663-H928 AromaticContact CD2-CD2 3.48Å; F663-H928 VanDerWaalsContact CD2-CD2 3.48Å; F663-H928 WeakPolarHBondContact CD2-CD2 3.43Å; F663-H928 AromaticContact CD2-NE2 3.68Å; F663-H928 HydrophobicContact CE1-CB 4.23Å; F663-H928 AromaticContact CE1-CD2 3.77Å; F663-H928 HydrophobicContact CE2-CB 4.41Å; F663-H928 AromaticContact CE2-CD2 3.64Å; F663-H928 AromaticContact CE2-CG 3.96Å; F663-H928 AromaticContact CG-CD2 3.47Å; F663-H928 VanDerWaalsContact CG-CD2 3.47Å; F663-H928 WeakPolarHBondContact CG-CD2 3.18Å; F663-H928 AromaticContact CG-NE2 3.82Å; F663-H928 HydrophobicContact CZ-CB 3.97Å; F663-H928 AromaticContact CZ-CD2 3.78Å; F663-H928 AromaticContact CZ-CG 3.98Å; H928-G930 PolarHBondContact O-N 2.85Å; H928-G930 VanDerWaalsContact O-N 3.14Å; H928-F931 PolarHBondContact N-O 2.86Å; H928-F931 WeakPolarHBondContact O-CB 3.32Å; H928-F931 PolarHBondContact O-N 2.86Å; H928-F931 VanDerWaalsContact O-O 3.14Å; H928-Y933 HydrophobicContact CB-CD2 4.14Å; H928-Y933 HydrophobicContact CB-CE2 3.94Å; H928-I975 HydrophobicContact CB-CD1 3.77Å
929	D	86.8	Confident	95.8	Very high	125 Å²	125	27.4 Å²	27.4	67%	0.668	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	36.3	171.4	-162.9	42.1	0	0	0	114.7	F931	D929-F931 VanDerWaalsContact C-N 3.34Å; D929-F931 HydrophobicContact CB-CD2 4.32Å; D929-F931 WeakPolarHBondContact O-CD2 3.44Å; D929-F931 WeakPolarHBondContact O-CE2 3.35Å
930	G	87.9	Confident	95.5	Very high	32 Å²	32	23.8 Å²	23.8	33%	0.33	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	1.6	-177.3	0	0	0	0	0	115.5	H928 P952	H928-G930 PolarHBondContact O-N 2.85Å; H928-G930 VanDerWaalsContact O-N 3.14Å; G930-P952 WeakPolarHBondContact O-CD 3.39Å; G930-P952 VanDerWaalsContact O-CG 3.27Å; G930-P952 WeakPolarHBondContact O-CG 3.32Å
931	F	94.9	Very high	95.2	Very high	46 Å²	46	32.4 Å²	32.4	20%	0.202	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	161.2	-177.8	-54.2	-83.1	0	0	0	112.3	A927 H928 D929 Y933 K949 Y950 D951	A927-F931 CarbonylContact C-O 3.58Å; A927-F931 WeakPolarHBondContact CA-O 3.46Å; H928-F931 PolarHBondContact N-O 2.86Å; H928-F931 WeakPolarHBondContact O-CB 3.32Å; H928-F931 PolarHBondContact O-N 2.86Å; H928-F931 VanDerWaalsContact O-O 3.14Å; D929-F931 VanDerWaalsContact C-N 3.34Å; D929-F931 HydrophobicContact CB-CD2 4.32Å; D929-F931 WeakPolarHBondContact O-CD2 3.44Å; D929-F931 WeakPolarHBondContact O-CE2 3.35Å; F931-Y933 HydrophobicContact CB-CE2 3.88Å; F931-K949 HydrophobicContact CB-CG 4.16Å; F931-K949 HydrophobicContact CD1-CD 4.46Å; F931-K949 HydrophobicContact CG-CD 4.37Å; F931-K949 HydrophobicContact CG-CG 4.45Å; F931-Y950 WeakPolarHBondContact CA-O 3.32Å; F931-Y950 WeakPolarHBondContact CB-O 3.39Å; F931-Y950 WeakPolarHBondContact CD1-O 3.41Å; F931-D951 HydrophobicContact CD1-CB 4.3Å; F931-D951 HydrophobicContact CE1-CB 4.25Å
932	L	96.9	Very high	95.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	148.2	164.4	-55.5	172.5	0	0	0	111	C879 L881 Y886 L925 V926 A927 K949 Y950 W957	C879-L932 HydrophobicContact CB-CD2 4.25Å; L881-L932 HydrophobicContact CB-CD2 3.72Å; L881-L932 HydrophobicContact CD2-CD2 3.73Å; L881-L932 HydrophobicContact CD2-CG 3.7Å; L881-L932 HydrophobicContact CG-CD2 4.33Å; Y886-L932 HydrophobicContact CD1-CD1 3.74Å; Y886-L932 HydrophobicContact CD2-CD1 4.03Å; Y886-L932 HydrophobicContact CE1-CD1 4.29Å; Y886-L932 HydrophobicContact CG-CD1 3.59Å; L925-L932 HydrophobicContact CD1-CB 4.01Å; L925-L932 HydrophobicContact CD1-CD1 4.42Å; V926-L932 CarbonylContact O-C 3.56Å; V926-L932 WeakPolarHBondContact O-CA 3.48Å; A927-L932 HydrophobicContact CB-CD2 3.92Å; L932-K949 CarbonylContact O-C 3.55Å; L932-K949 WeakPolarHBondContact O-CA 3.44Å; L932-Y950 HydrophobicContact CD1-CD1 4.07Å; L932-Y950 HydrophobicContact CG-CD1 4.31Å; L932-Y950 PolarHBondContact N-O 2.82Å; L932-Y950 PolarHBondContact O-N 3.05Å; L932-W957 HydrophobicContact CB-CH2 4.5Å
933	Y	96.6	Very high	95	Very high	19 Å²	19	36.5 Å²	36.5	8%	0.075	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.1	173.2	-67.2	-101.3	0	0	0	109	F663 L925 V926 H928 F931 I935 E948 K949 L960	F663-Y933 HydrophobicContact CD1-CE1 4.11Å; F663-Y933 HydrophobicContact CD1-CE2 4.41Å; F663-Y933 AromaticContact CD1-CZ 3.95Å; F663-Y933 AromaticContact CE1-CD1 3.95Å; F663-Y933 HydrophobicContact CE1-CD1 3.95Å; F663-Y933 AromaticContact CE1-CD2 3.99Å; F663-Y933 HydrophobicContact CE1-CD2 3.99Å; F663-Y933 AromaticContact CE1-CE1 3.74Å; F663-Y933 HydrophobicContact CE1-CE1 3.74Å; F663-Y933 AromaticContact CE1-CE2 3.81Å; F663-Y933 HydrophobicContact CE1-CE2 3.81Å; F663-Y933 HydrophobicContact CE1-CG 4.07Å; F663-Y933 AromaticContact CE1-CZ 3.68Å; L925-Y933 WeakPolarHBondContact CA-O 3.2Å; V926-Y933 PolarHBondContact N-O 3.41Å; V926-Y933 PolarHBondContact O-N 2.98Å; H928-Y933 HydrophobicContact CB-CD2 4.14Å; H928-Y933 HydrophobicContact CB-CE2 3.94Å; F931-Y933 HydrophobicContact CB-CE2 3.88Å; Y933-I935 WeakPolarHBondContact O-CD1 3.31Å; Y933-E948 WeakPolarHBondContact CA-O 3.26Å; Y933-K949 HydrophobicContact CD1-CB 4.18Å; Y933-K949 HydrophobicContact CD1-CG 4.34Å; Y933-K949 HydrophobicContact CE1-CB 4.02Å; Y933-K949 HydrophobicContact CE1-CD 3.89Å; Y933-K949 HydrophobicContact CE1-CG 3.86Å; Y933-K949 HydrophobicContact CE2-CG 4.37Å; Y933-K949 WeakPolarHBondContact OH-CD 3.31Å; Y933-K949 WeakPolarHBondContact OH-CE 3.33Å; Y933-K949 PolarHBondContact OH-NZ 2.65Å; Y933-L960 HydrophobicContact CD1-CD1 4Å; Y933-L960 HydrophobicContact CE1-CD1 4.01Å
934	I	97.7	Very high	95	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.7	176.6	-164.5	169	0	0	0	110.5	V888 L916 R920 A923 G924 L925 I947 E948 W957	V888-I934 HydrophobicContact CB-CD1 4.24Å; V888-I934 HydrophobicContact CG1-CD1 3.73Å; L916-I934 HydrophobicContact CD1-CD1 4.12Å; L916-I934 HydrophobicContact CD2-CD1 4.24Å; L916-I934 HydrophobicContact CD2-CG2 3.74Å; R920-I934 HydrophobicContact CB-CD1 4.45Å; A923-I934 HydrophobicContact CB-CD1 4.19Å; A923-I934 HydrophobicContact CB-CG1 3.83Å; G924-I934 CarbonylContact O-C 3.6Å; G924-I934 WeakPolarHBondContact O-CA 3.39Å; G924-I934 WeakPolarHBondContact O-CG1 3.43Å; L925-I934 HydrophobicContact CD1-CB 3.76Å; L925-I934 HydrophobicContact CD1-CD1 4.48Å; L925-I934 HydrophobicContact CD1-CG1 4.17Å; I934-I947 WeakPolarHBondContact O-CA 3.31Å; I934-I947 WeakPolarHBondContact O-CG2 3.41Å; I934-E948 HydrophobicContact CG2-CB 3.77Å; I934-E948 PolarHBondContact N-O 2.88Å; I934-E948 PolarHBondContact O-N 2.73Å; I934-W957 HydrophobicContact CB-CH2 4.21Å; I934-W957 HydrophobicContact CB-CZ3 3.98Å; I934-W957 HydrophobicContact CG2-CE3 4.12Å; I934-W957 HydrophobicContact CG2-CH2 4.04Å; I934-W957 HydrophobicContact CG2-CZ3 3.47Å; I934-W957 VanDerWaalsContact CG2-CZ3 3.47Å
935	I	97.2	Very high	94.9	Very high	5 Å²	5	38.9 Å²	38.9	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	120	-158.7	-60.4	124.6	0	0	0	110.5	L644 V646 G924 V926 Y933 G937 I947 L964 V973	L644-I935 HydrophobicContact CD1-CD1 3.91Å; L644-I935 HydrophobicContact CD2-CD1 3.59Å; L644-I935 HydrophobicContact CD2-CG1 3.86Å; L644-I935 HydrophobicContact CG-CD1 4.41Å; V646-I935 HydrophobicContact CG1-CG2 4.38Å; V646-I935 HydrophobicContact CG2-CG2 3.87Å; G924-I935 PolarHBondContact N-O 3.13Å; G924-I935 PolarHBondContact O-N 2.92Å; V926-I935 HydrophobicContact CG2-CD1 3.97Å; Y933-I935 WeakPolarHBondContact O-CD1 3.31Å; I935-G937 PolarHBondContact O-N 2.94Å; I935-I947 HydrophobicContact CG1-CD1 4.31Å; I935-I947 HydrophobicContact CG1-CG1 4.4Å; I935-I947 HydrophobicContact CG1-CG2 3.99Å; I935-I947 HydrophobicContact CG2-CD1 4.1Å; I935-I947 HydrophobicContact CG2-CG1 4.27Å; I935-L964 HydrophobicContact CG2-CD1 3.98Å; I935-L964 HydrophobicContact CG2-CD2 4.08Å; I935-L964 HydrophobicContact CG2-CG 4.41Å; I935-V973 HydrophobicContact CB-CG1 4.41Å; I935-V973 HydrophobicContact CD1-CG1 4.23Å; I935-V973 HydrophobicContact CG2-CG1 4.45Å
936	G	97	Very high	94.8	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.222	C	C	.	.			trans	58.2	-132.1	177.6	0	0	0	0	0	112.8	R920 A923 L944 S946	R920-G936 PolarHBondContact NH1-O 2.9Å; A923-G936 WeakPolarHBondContact CB-O 3.43Å; G936-L944 VanDerWaalsContact CA-O 3.31Å; G936-L944 WeakPolarHBondContact CA-O 3.24Å; G936-S946 PolarHBondContact N-O 3.41Å
937	G	97.7	Very high	94.8	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.01	22%	0.219	C	C	.	.			trans	91.5	-161.5	-172.2	0	0	0	0	0	112.2	R921 I935 N943 L944 R968	R921-G937 WeakPolarHBondContact O-CA 3.45Å; I935-G937 PolarHBondContact O-N 2.94Å; G937-N943 CarbonylContact O-C 3.57Å; G937-N943 WeakPolarHBondContact O-CA 3.37Å; G937-L944 PolarHBondContact O-N 2.83Å; G937-R968 PolarHBondContact N-O 2.8Å
938	E	96.7	Very high	94.9	Very high	26 Å²	26	37 Å²	37	12%	0.121	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-135.2	144.5	176.4	57.7	178.2	158.5	0	0	111.2	R921 N922 N942 Y970	R921-E938 HydrophobicContact CG-CG 3.54Å; R921-E938 IonicContact CZ-OE1 3.49Å; R921-E938 IonicContact CZ-OE2 3.53Å; R921-E938 PolarHBondContact N-O 3.17Å; R921-E938 IonicContact NE-OE1 3.5Å; R921-E938 PolarHBondContact NE-OE1 2.9Å; R921-E938 IonicContact NE-OE2 3.54Å; R921-E938 PolarHBondContact NE-OE2 3.42Å; R921-E938 VanDerWaalsContact NH2-CD 3.26Å; R921-E938 IonicContact NH2-OE1 3.59Å; R921-E938 PolarHBondContact NH2-OE1 2.83Å; R921-E938 IonicContact NH2-OE2 2.74Å; R921-E938 PolarHBondContact NH2-OE2 3.02Å; R921-E938 PolarHBondContact O-N 3.28Å; N922-E938 PolarHBondContact ND2-OE1 2.79Å; E938-N942 WeakPolarHBondContact CA-O 3.28Å; E938-N942 WeakPolarHBondContact CB-O 3.5Å; E938-Y970 WeakPolarHBondContact OE1-CE2 3.4Å
939	D	95.8	Very high	95.1	Very high	40 Å²	40	37.4 Å²	37.4	21%	0.214	21%	0.208	C	C	.	.			trans	-89.4	-13.8	-179.7	59.4	14.5	0	0	0	113.5	V896 K919 E941 N942 L944	V896-D939 VanDerWaalsContact CB-O 3.3Å; V896-D939 WeakPolarHBondContact CB-O 3.41Å; V896-D939 WeakPolarHBondContact CG2-O 3.21Å; K919-D939 HydrophobicContact CB-CB 4.27Å; K919-D939 WeakPolarHBondContact O-CA 3.34Å; D939-E941 WeakPolarHBondContact OD1-CA 3.35Å; D939-E941 PolarHBondContact OD1-N 2.81Å; D939-N942 PolarHBondContact N-O 2.85Å; D939-N942 PolarHBondContact OD1-N 3.19Å; D939-L944 HydrophobicContact CB-CD1 4.48Å; D939-L944 HydrophobicContact CB-CD2 4.34Å
940	G	91.3	Very high	95.6	Very high	39 Å²	39	31.8 Å²	31.8	40%	0.402	18%	0.177	S	C	.	.	S	Bend	trans	125.7	-25.4	-173.4	0	0	0	0	0	113.3
941	E	91.7	Very high	96	Very high	180 Å²	180	32.7 Å²	32.7	84%	0.841	18%	0.175	S	C	*	.	S	Bend	trans	-121	-40.4	-177.2	-63.4	179.6	-173.6	0	0	111.9	D939	D939-E941 WeakPolarHBondContact OD1-CA 3.35Å; D939-E941 PolarHBondContact OD1-N 2.81Å
942	N	95.2	Very high	95.8	Very high	93 Å²	93	32.2 Å²	32.2	50%	0.497	18%	0.176	S	C	.	.	S	Bend	trans	-125.6	153.2	-171.9	-56.5	-77	0	0	0	112.2	E938 D939	E938-N942 WeakPolarHBondContact CA-O 3.28Å; E938-N942 WeakPolarHBondContact CB-O 3.5Å; D939-N942 PolarHBondContact N-O 2.85Å; D939-N942 PolarHBondContact OD1-N 3.19Å
943	N	97	Very high	95.7	Very high	46 Å²	46	40 Å²	40	25%	0.246	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-86	136.2	163.3	-59.8	-59.9	0	0	0	109.3	Q650 G937 G967 S969	Q650-N943 PolarHBondContact O-ND2 3.25Å; G937-N943 CarbonylContact O-C 3.57Å; G937-N943 WeakPolarHBondContact O-CA 3.37Å; N943-G967 VanDerWaalsContact CB-C 3.45Å; N943-G967 VanDerWaalsContact CB-O 3.25Å; N943-G967 WeakPolarHBondContact CB-O 3.4Å; N943-S969 VanDerWaalsContact OD1-CB 3.24Å; N943-S969 WeakPolarHBondContact OD1-CB 3.47Å; N943-S969 PolarHBondContact OD1-OG 3.04Å
944	L	97.6	Very high	95.6	Very high	19 Å²	19	41.2 Å²	41.2	10%	0.099	23%	0.234	C	C	.	.			trans	-95.5	142.7	-169.4	-58	172.3	0	0	0	112.3	V918 R920 G936 G937 D939 G967 R968	V918-L944 HydrophobicContact CG1-CD1 3.8Å; V918-L944 HydrophobicContact CG1-CD2 4.16Å; R920-L944 HydrophobicContact CG-CD1 3.84Å; G936-L944 VanDerWaalsContact CA-O 3.31Å; G936-L944 WeakPolarHBondContact CA-O 3.24Å; G937-L944 PolarHBondContact O-N 2.83Å; D939-L944 HydrophobicContact CB-CD1 4.48Å; D939-L944 HydrophobicContact CB-CD2 4.34Å; L944-G967 WeakPolarHBondContact O-CA 3.18Å; L944-R968 PolarHBondContact O-N 2.85Å
945	T	96	Very high	95.6	Very high	51 Å²	51	44.6 Å²	44.6	31%	0.313	25%	0.252	S	S	.	.			trans	-94.7	-20.7	167.9	55	0	0	0	0	113.1	L964 G967	T945-L964 WeakPolarHBondContact CG2-O 3.33Å; T945-L964 PolarHBondContact O-N 3.5Å; T945-G967 VanDerWaalsContact CG2-N 3.32Å
946	S	95.3	Very high	95.6	Very high	16 Å²	16	48 Å²	48	11%	0.112	27%	0.273	C	S	.	.			trans	-76.5	154.6	-171.4	60.6	0	0	0	0	112.7	R920 G936	R920-S946 PolarHBondContact NH1-O 2.73Å; R920-S946 PolarHBondContact NH2-O 3.18Å; R920-S946 PolarHBondContact NH2-OG 2.81Å; G936-S946 PolarHBondContact N-O 3.41Å
947	I	95.5	Very high	95.7	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	140.2	-175.6	-58.5	-177.6	0	0	0	108	W668 I934 I935 L960 L964	W668-I947 HydrophobicContact CH2-CD1 4.03Å; W668-I947 HydrophobicContact CZ2-CD1 3.15Å; I934-I947 WeakPolarHBondContact O-CA 3.31Å; I934-I947 WeakPolarHBondContact O-CG2 3.41Å; I935-I947 HydrophobicContact CG1-CD1 4.31Å; I935-I947 HydrophobicContact CG1-CG1 4.4Å; I935-I947 HydrophobicContact CG1-CG2 3.99Å; I935-I947 HydrophobicContact CG2-CD1 4.1Å; I935-I947 HydrophobicContact CG2-CG1 4.27Å; I947-L960 HydrophobicContact CB-CB 4.49Å; I947-L960 HydrophobicContact CB-CD1 4.33Å; I947-L960 HydrophobicContact CG2-CD1 3.75Å; I947-L960 HydrophobicContact CG2-CG 4.28Å; I947-L960 PolarHBondContact O-N 2.85Å; I947-L964 HydrophobicContact CD1-CD2 4.12Å; I947-L964 HydrophobicContact CD1-CG 4.32Å
948	E	96.5	Very high	95.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	137.6	177.8	-64.7	170.8	-114.2	0	0	110.9	N917 V918 R920 Y933 I934 W957 S958 I959	N917-E948 VanDerWaalsContact CB-OE2 3.26Å; N917-E948 WeakPolarHBondContact CB-OE2 3.42Å; N917-E948 PolarHBondContact N-OE2 3.12Å; N917-E948 PolarHBondContact ND2-OE2 3.07Å; V918-E948 PolarHBondContact N-OE1 2.98Å; R920-E948 IonicContact CZ-OE1 2.83Å; R920-E948 VanDerWaalsContact CZ-OE1 3.23Å; R920-E948 IonicContact NE-OE1 4Å; R920-E948 PolarHBondContact NE-OE1 3.46Å; R920-E948 IonicContact NH2-OE1 3.18Å; R920-E948 PolarHBondContact NH2-OE1 3.41Å; Y933-E948 WeakPolarHBondContact CA-O 3.26Å; I934-E948 HydrophobicContact CG2-CB 3.77Å; I934-E948 PolarHBondContact N-O 2.88Å; I934-E948 PolarHBondContact O-N 2.73Å; E948-W957 HydrophobicContact CB-CE3 3.74Å; E948-W957 HydrophobicContact CB-CZ3 4.33Å; E948-S958 CarbonylContact C-O 3.53Å; E948-S958 VanDerWaalsContact CA-O 3.24Å; E948-S958 WeakPolarHBondContact CA-O 3.16Å; E948-I959 HydrophobicContact CG-CB 4.47Å; E948-I959 HydrophobicContact CG-CG1 3.85Å
949	K	95.6	Very high	95.5	Very high	45 Å²	45	54.5 Å²	54.5	20%	0.196	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.7	176.3	179.9	-177.2	178.4	173.9	0	109.8	F931 L932 Y933 W957 S958 L960	F931-K949 HydrophobicContact CB-CG 4.16Å; F931-K949 HydrophobicContact CD1-CD 4.46Å; F931-K949 HydrophobicContact CG-CD 4.37Å; F931-K949 HydrophobicContact CG-CG 4.45Å; L932-K949 CarbonylContact O-C 3.55Å; L932-K949 WeakPolarHBondContact O-CA 3.44Å; Y933-K949 HydrophobicContact CD1-CB 4.18Å; Y933-K949 HydrophobicContact CD1-CG 4.34Å; Y933-K949 HydrophobicContact CE1-CB 4.02Å; Y933-K949 HydrophobicContact CE1-CD 3.89Å; Y933-K949 HydrophobicContact CE1-CG 3.86Å; Y933-K949 HydrophobicContact CE2-CG 4.37Å; Y933-K949 WeakPolarHBondContact OH-CD 3.31Å; Y933-K949 WeakPolarHBondContact OH-CE 3.33Å; Y933-K949 PolarHBondContact OH-NZ 2.65Å; K949-W957 WeakPolarHBondContact O-CA 3.39Å; K949-S958 PolarHBondContact N-O 2.87Å; K949-S958 PolarHBondContact O-N 3.02Å; K949-S958 PolarHBondContact O-OG 2.76Å; K949-L960 HydrophobicContact CB-CD2 3.97Å; K949-L960 HydrophobicContact CB-CG 4.48Å
950	Y	98	Very high	95.4	Very high	7 Å²	7	53.9 Å²	53.9	3%	0.027	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	129.3	174.6	-179.6	-112.1	0	0	0	111.6	Y886 I913 F931 L932 P952 N955 T956 W957	Y886-Y950 HydrophobicContact CE1-CD1 4.43Å; Y886-Y950 AromaticContact CE1-CE1 3.73Å; Y886-Y950 HydrophobicContact CE1-CE1 3.73Å; I913-Y950 HydrophobicContact CB-CE2 4.26Å; I913-Y950 HydrophobicContact CD1-CD2 4.3Å; I913-Y950 HydrophobicContact CD1-CE1 4.37Å; I913-Y950 HydrophobicContact CD1-CE2 3.9Å; I913-Y950 WeakPolarHBondContact CG2-OH 3.34Å; F931-Y950 WeakPolarHBondContact CA-O 3.32Å; F931-Y950 WeakPolarHBondContact CB-O 3.39Å; F931-Y950 WeakPolarHBondContact CD1-O 3.41Å; L932-Y950 HydrophobicContact CD1-CD1 4.07Å; L932-Y950 HydrophobicContact CG-CD1 4.31Å; L932-Y950 PolarHBondContact N-O 2.82Å; L932-Y950 PolarHBondContact O-N 3.05Å; Y950-P952 HydrophobicContact CD1-CB 4.37Å; Y950-P952 HydrophobicContact CE1-CB 3.79Å; Y950-N955 PolarHBondContact OH-OD1 3.28Å; Y950-T956 WeakPolarHBondContact CA-O 3.5Å; Y950-T956 WeakPolarHBondContact CD2-O 3.43Å; Y950-W957 AromaticContact CD2-CD1 3.92Å; Y950-W957 AromaticContact CD2-CD2 3.93Å; Y950-W957 HydrophobicContact CD2-CD2 3.93Å; Y950-W957 AromaticContact CD2-CE2 3.63Å; Y950-W957 HydrophobicContact CD2-CG 4.11Å; Y950-W957 HydrophobicContact CD2-CZ2 4.12Å; Y950-W957 AromaticContact CD2-NE1 3.6Å; Y950-W957 HydrophobicContact CG-CD2 4.28Å; Y950-W957 HydrophobicContact CG-CH2 4.42Å; Y950-W957 HydrophobicContact CG-CZ2 4.09Å
951	D	95.2	Very high	95.2	Very high	52 Å²	52	58.1 Å²	58.1	28%	0.278	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	115.3	167.4	-174	-27.5	0	0	0	109.9	F931 I953 G954 N955 T956	F931-D951 HydrophobicContact CD1-CB 4.3Å; F931-D951 HydrophobicContact CE1-CB 4.25Å; D951-I953 VanDerWaalsContact C-N 3.34Å; D951-I953 WeakPolarHBondContact OD1-CA 3.27Å; D951-I953 WeakPolarHBondContact OD1-CB 3.4Å; D951-I953 PolarHBondContact OD1-N 3.25Å; D951-G954 PolarHBondContact OD1-N 3.44Å; D951-N955 WeakPolarHBondContact O-CA 3.24Å; D951-N955 PolarHBondContact O-N 2.94Å; D951-T956 PolarHBondContact N-O 2.99Å; D951-T956 PolarHBondContact O-N 2.64Å
952	P	92.2	Very high	94.9	Very high	35 Å²	35	50.4 Å²	50.4	23%	0.227	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-17.4	178.1	32.2	-36	0	0	0	114.2	L881 G930 Y950	L881-P952 HydrophobicContact CD2-CG 4.29Å; G930-P952 WeakPolarHBondContact O-CD 3.39Å; G930-P952 VanDerWaalsContact O-CG 3.27Å; G930-P952 WeakPolarHBondContact O-CG 3.32Å; Y950-P952 HydrophobicContact CD1-CB 4.37Å; Y950-P952 HydrophobicContact CE1-CB 3.79Å
953	I	93.2	Very high	94.5	Very high	164 Å²	164	50.2 Å²	50.2	84%	0.841	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-46.2	176.1	-53.9	176.8	0	0	0	109.2	D951	D951-I953 VanDerWaalsContact C-N 3.34Å; D951-I953 WeakPolarHBondContact OD1-CA 3.27Å; D951-I953 WeakPolarHBondContact OD1-CB 3.4Å; D951-I953 PolarHBondContact OD1-N 3.25Å
954	G	95.3	Very high	94.3	Very high	44 Å²	44	48.2 Å²	48.2	45%	0.454	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-23.9	174.7	0	0	0	0	0	114.2	D951	D951-G954 PolarHBondContact OD1-N 3.44Å
955	N	97.3	Very high	93.9	Very high	72 Å²	72	51.8 Å²	51.8	39%	0.385	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	56.4	-166.6	-174.4	24.9	0	0	0	111.6	A914 Y950 D951	A914-N955 WeakPolarHBondContact CB-O 3.45Å; A914-N955 WeakPolarHBondContact CB-OD1 3.37Å; A914-N955 PolarHBondContact N-OD1 3.2Å; Y950-N955 PolarHBondContact OH-OD1 3.28Å; D951-N955 WeakPolarHBondContact O-CA 3.24Å; D951-N955 PolarHBondContact O-N 2.94Å
956	T	97.9	Very high	93.7	Very high	75 Å²	75	53 Å²	53	46%	0.46	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	148.5	-176.7	51.4	0	0	0	0	112.1	Y950 D951	Y950-T956 WeakPolarHBondContact CA-O 3.5Å; Y950-T956 WeakPolarHBondContact CD2-O 3.43Å; D951-T956 PolarHBondContact N-O 2.99Å; D951-T956 PolarHBondContact O-N 2.64Å
957	W	98.3	Very high	93.7	Very high	19 Å²	19	52.9 Å²	52.9	7%	0.072	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	130.4	170.1	-69.9	96.2	0	0	0	110.5	V888 I913 A914 L916 N917 L925 L932 I934 E948 K949 Y950	V888-W957 HydrophobicContact CG1-CH2 4.07Å; V888-W957 HydrophobicContact CG1-CZ2 3.72Å; V888-W957 HydrophobicContact CG2-CH2 4.4Å; V888-W957 HydrophobicContact CG2-CZ2 4.13Å; I913-W957 HydrophobicContact CD1-CZ2 4.07Å; A914-W957 PolarHBondContact O-NE1 2.97Å; L916-W957 HydrophobicContact CD2-CD2 3.61Å; L916-W957 HydrophobicContact CD2-CE3 3.76Å; L916-W957 HydrophobicContact CD2-CG 4.2Å; L916-W957 HydrophobicContact CD2-CH2 3.95Å; L916-W957 HydrophobicContact CD2-CZ2 3.81Å; L916-W957 HydrophobicContact CD2-CZ3 3.92Å; N917-W957 WeakPolarHBondContact ND2-CB 3.39Å; N917-W957 PolarHBondContact ND2-O 3.24Å; L925-W957 HydrophobicContact CD1-CH2 4.26Å; L932-W957 HydrophobicContact CB-CH2 4.5Å; I934-W957 HydrophobicContact CB-CH2 4.21Å; I934-W957 HydrophobicContact CB-CZ3 3.98Å; I934-W957 HydrophobicContact CG2-CE3 4.12Å; I934-W957 HydrophobicContact CG2-CH2 4.04Å; I934-W957 HydrophobicContact CG2-CZ3 3.47Å; I934-W957 VanDerWaalsContact CG2-CZ3 3.47Å; E948-W957 HydrophobicContact CB-CE3 3.74Å; E948-W957 HydrophobicContact CB-CZ3 4.33Å; K949-W957 WeakPolarHBondContact O-CA 3.39Å; Y950-W957 AromaticContact CD2-CD1 3.92Å; Y950-W957 AromaticContact CD2-CD2 3.93Å; Y950-W957 HydrophobicContact CD2-CD2 3.93Å; Y950-W957 AromaticContact CD2-CE2 3.63Å; Y950-W957 HydrophobicContact CD2-CG 4.11Å; Y950-W957 HydrophobicContact CD2-CZ2 4.12Å; Y950-W957 AromaticContact CD2-NE1 3.6Å; Y950-W957 HydrophobicContact CG-CD2 4.28Å; Y950-W957 HydrophobicContact CG-CH2 4.42Å; Y950-W957 HydrophobicContact CG-CZ2 4.09Å
958	S	96.3	Very high	93.7	Very high	60 Å²	60	52.9 Å²	52.9	42%	0.42	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.9	175.2	49.1	0	0	0	0	110.5	E948 K949	E948-S958 CarbonylContact C-O 3.53Å; E948-S958 VanDerWaalsContact CA-O 3.24Å; E948-S958 WeakPolarHBondContact CA-O 3.16Å; K949-S958 PolarHBondContact N-O 2.87Å; K949-S958 PolarHBondContact O-N 3.02Å; K949-S958 PolarHBondContact O-OG 2.76Å
959	I	95.1	Very high	93.8	Very high	85 Å²	85	52.9 Å²	52.9	44%	0.436	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	129.9	172.8	-59.3	169.7	0	0	0	108.3	N917 E948	N917-I959 HydrophobicContact CB-CD1 3.84Å; N917-I959 HydrophobicContact CB-CG1 3.95Å; E948-I959 HydrophobicContact CG-CB 4.47Å; E948-I959 HydrophobicContact CG-CG1 3.85Å
960	L	92.3	Very high	93.9	Very high	28 Å²	28	52.7 Å²	52.7	15%	0.147	31%	0.305	C	S	.	.			trans	-76.5	145.3	172.6	-61.4	-172.9	0	0	0	110.7	Y933 I947 K949 S962	Y933-L960 HydrophobicContact CD1-CD1 4Å; Y933-L960 HydrophobicContact CE1-CD1 4.01Å; I947-L960 HydrophobicContact CB-CB 4.49Å; I947-L960 HydrophobicContact CB-CD1 4.33Å; I947-L960 HydrophobicContact CG2-CD1 3.75Å; I947-L960 HydrophobicContact CG2-CG 4.28Å; I947-L960 PolarHBondContact O-N 2.85Å; K949-L960 HydrophobicContact CB-CD2 3.97Å; K949-L960 HydrophobicContact CB-CG 4.48Å; L960-S962 PolarHBondContact O-N 2.76Å
961	P	87.7	Confident	93.9	Very high	127 Å²	127	53.1 Å²	53.1	83%	0.825	31%	0.311	S	S	*	.	S	Bend	trans	-72.2	-11.3	173.8	32	-36.5	0	0	0	112.9	H963	P961-H963 PolarHBondContact O-CD2 2.82Å
962	S	84.4	Confident	94	Very high	18 Å²	18	50.9 Å²	50.9	13%	0.126	30%	0.299	C	S	.	.			trans	-90.9	135.7	176.3	62.4	0	0	0	0	110.8	F661 G666 L960	F661-S962 VanDerWaalsContact CE2-OG 3.3Å; F661-S962 WeakPolarHBondContact CE2-OG 3.37Å; G666-S962 WeakPolarHBondContact O-CB 3.34Å; L960-S962 PolarHBondContact O-N 2.76Å
963	H	88.9	Confident	94.2	Very high	89 Å²	89	50.5 Å²	50.5	41%	0.412	30%	0.296	S	S	.	.			trans	-126.9	148.3	-174.4	-67.8	-90.4	0	0	0	110.5	W668 P961	W668-H963 VanDerWaalsContact CD1-O 3.24Å; P961-H963 PolarHBondContact O-CD2 2.82Å
964	L	91.3	Very high	94.2	Very high	5 Å²	5	43 Å²	43	3%	0.026	26%	0.259	C	S	.	.			trans	-59.3	144.7	166.8	-56.2	176.3	0	0	0	110.2	V646 W668 I935 T945 I947 I966 R968	V646-L964 HydrophobicContact CB-CD2 4.48Å; V646-L964 HydrophobicContact CG1-CD2 4.48Å; V646-L964 HydrophobicContact CG2-CD2 4.02Å; W668-L964 HydrophobicContact CD2-CD2 4.2Å; W668-L964 HydrophobicContact CE3-CD2 3.93Å; W668-L964 HydrophobicContact CH2-CD2 3.41Å; W668-L964 VanDerWaalsContact CH2-CD2 3.41Å; W668-L964 HydrophobicContact CZ2-CD2 3.71Å; W668-L964 HydrophobicContact CZ3-CD2 3.5Å; I935-L964 HydrophobicContact CG2-CD1 3.98Å; I935-L964 HydrophobicContact CG2-CD2 4.08Å; I935-L964 HydrophobicContact CG2-CG 4.41Å; T945-L964 WeakPolarHBondContact CG2-O 3.33Å; T945-L964 PolarHBondContact O-N 3.5Å; I947-L964 HydrophobicContact CD1-CD2 4.12Å; I947-L964 HydrophobicContact CD1-CG 4.32Å; L964-I966 PolarHBondContact O-N 3.49Å; L964-R968 HydrophobicContact CD1-CG 3.68Å
965	T	90	Very high	93.9	Very high	93 Å²	93	42.7 Å²	42.7	57%	0.571	25%	0.247	S	C	*	.	S	Bend	trans	-65	-24.8	179.6	64.1	0	0	0	0	112.6	E659	E659-T965 PolarHBondContact OE2-N 2.9Å; E659-T965 PolarHBondContact OE2-OG1 3.33Å; E659-T965 VanDerWaalsContact OE2-OG1 3.11Å
966	I	91.9	Very high	93.4	Very high	76 Å²	76	39.8 Å²	39.8	39%	0.39	23%	0.231	S	C	.	.	S	Bend	trans	-140.1	139.5	173.1	-166.7	168.4	0	0	0	111.8	A651 L964 R968	A651-I966 HydrophobicContact CB-CD1 3.75Å; A651-I966 HydrophobicContact CB-CG1 3.98Å; A651-I966 HydrophobicContact CB-CG2 4.3Å; L964-I966 PolarHBondContact O-N 3.49Å; I966-R968 PolarHBondContact O-N 3.35Å
967	G	94.6	Very high	92.4	Very high	14 Å²	14	39.4 Å²	39.4	14%	0.144	22%	0.224	C	C	.	.			trans	-66.6	120.1	179	0	0	0	0	0	111	N943 L944 T945	N943-G967 VanDerWaalsContact CB-C 3.45Å; N943-G967 VanDerWaalsContact CB-O 3.25Å; N943-G967 WeakPolarHBondContact CB-O 3.4Å; L944-G967 WeakPolarHBondContact O-CA 3.18Å; T945-G967 VanDerWaalsContact CG2-N 3.32Å
968	R	96.7	Very high	91.1	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.008	24%	0.235	C	C	.	.			trans	-139	136.2	-171.9	57.5	174.5	78.1	-156.9	8.2	113.8	G648 Q650 A651 S657 E659 G937 L944 L964 I966 A971	G648-R968 PolarHBondContact O-NH1 3.11Å; Q650-R968 WeakPolarHBondContact O-CA 3.47Å; A651-R968 HydrophobicContact CB-CB 4.39Å; S657-R968 PolarHBondContact O-NH1 2.57Å; S657-R968 PolarHBondContact OG-NH2 3.24Å; E659-R968 IonicContact OE1-CZ 3.96Å; E659-R968 IonicContact OE1-NE 2.67Å; E659-R968 PolarHBondContact OE1-NE 2.94Å; E659-R968 IonicContact OE1-NH2 3.03Å; E659-R968 PolarHBondContact OE1-NH2 3.46Å; G937-R968 PolarHBondContact N-O 2.8Å; L944-R968 PolarHBondContact O-N 2.85Å; L964-R968 HydrophobicContact CD1-CG 3.68Å; I966-R968 PolarHBondContact O-N 3.35Å; R968-A971 HydrophobicContact CG-CB 4.43Å
969	S	97.5	Very high	89.4	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.007	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-116.5	161.5	172.6	63.6	0	0	0	0	111.6	G649 Q650 N943 A971	G649-S969 CarbonylContact C-O 3.59Å; G649-S969 WeakPolarHBondContact CA-O 3.31Å; Q650-S969 PolarHBondContact N-O 2.75Å; Q650-S969 PolarHBondContact O-N 2.96Å; N943-S969 VanDerWaalsContact OD1-CB 3.24Å; N943-S969 WeakPolarHBondContact OD1-CB 3.47Å; N943-S969 PolarHBondContact OD1-OG 3.04Å; S969-A971 PolarHBondContact O-N 2.85Å; S969-A971 VanDerWaalsContact O-N 3.08Å
970	Y	97.9	Very high	87.1	Confident	40 Å²	40	40.4 Å²	40.4	16%	0.157	22%	0.219	C	C	.	.	S	Bend	trans	51.2	30.3	-175.9	-56.7	-91	0	0	0	114	R732 T779 N922 E938	R732-Y970 HydrophobicContact CB-CD1 4.35Å; R732-Y970 HydrophobicContact CG-CD1 3.58Å; R732-Y970 HydrophobicContact CG-CD2 4.36Å; R732-Y970 HydrophobicContact CG-CE1 4.15Å; R732-Y970 HydrophobicContact CG-CG 3.66Å; R732-Y970 PolarHBondContact N-O 3.02Å; T779-Y970 HydrophobicContact CG2-CD1 3.97Å; T779-Y970 HydrophobicContact CG2-CE1 3.68Å; N922-Y970 HydrophobicContact CB-CD1 3.7Å; N922-Y970 HydrophobicContact CB-CD2 3.92Å; N922-Y970 HydrophobicContact CB-CE1 3.74Å; N922-Y970 HydrophobicContact CB-CE2 3.91Å; N922-Y970 HydrophobicContact CB-CG 3.84Å; N922-Y970 PolarHBondContact ND2-OH 2.99Å; N922-Y970 PolarHBondContact O-N 3.23Å; N922-Y970 VanDerWaalsContact OD1-CE1 3.25Å; N922-Y970 WeakPolarHBondContact OD1-CE1 3.29Å; E938-Y970 WeakPolarHBondContact OE1-CE2 3.4Å
971	A	97.6	Very high	84.4	Confident	17 Å²	17	44.1 Å²	44.1	14%	0.14	24%	0.238	C	C	.	.			trans	-76	146.9	169	0	0	0	0	0	109.3	V646 G648 R968 S969	V646-A971 HydrophobicContact CG1-CB 3.84Å; G648-A971 WeakPolarHBondContact O-CB 3.32Å; R968-A971 HydrophobicContact CG-CB 4.43Å; S969-A971 PolarHBondContact O-N 2.85Å; S969-A971 VanDerWaalsContact O-N 3.08Å
972	G	96.7	Very high	84.2	Confident	4 Å²	4	40 Å²	40	4%	0.041	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	150.6	163.2	0	0	0	0	0	109.8	V646 I647	V646-G972 CarbonylContact C-O 3.59Å; V646-G972 WeakPolarHBondContact CA-O 3.35Å; I647-G972 PolarHBondContact N-O 3.28Å; I647-G972 PolarHBondContact O-N 3.25Å
973	V	96.4	Very high	84.2	Confident	27 Å²	27	41.2 Å²	41.2	16%	0.164	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.8	169.3	-68.4	0	0	0	0	110	L644 L645 V646 G924 V926 I935	L644-V973 HydrophobicContact CD1-CB 4.22Å; L644-V973 HydrophobicContact CD1-CG1 4.48Å; L645-V973 WeakPolarHBondContact O-CA 3.33Å; V646-V973 HydrophobicContact CG1-CG1 4.24Å; V646-V973 HydrophobicContact CG2-CG1 4.23Å; G924-V973 VanDerWaalsContact CA-CG2 3.46Å; V926-V973 HydrophobicContact CG1-CB 3.96Å; V926-V973 HydrophobicContact CG1-CG2 3.6Å; I935-V973 HydrophobicContact CB-CG1 4.41Å; I935-V973 HydrophobicContact CD1-CG1 4.23Å; I935-V973 HydrophobicContact CG2-CG1 4.45Å
974	A	93.7	Very high	84	Confident	7 Å²	7	38.5 Å²	38.5	6%	0.058	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	147.3	177.7	0	0	0	0	0	109.9	L645 I647 V735 V737 M742	L645-A974 PolarHBondContact N-O 2.74Å; L645-A974 PolarHBondContact O-N 2.96Å; L645-A974 VanDerWaalsContact O-N 3.08Å; I647-A974 HydrophobicContact CD1-CB 4.19Å; V735-A974 HydrophobicContact CG1-CB 3.94Å; V737-A974 HydrophobicContact CG2-CB 3.75Å; M742-A974 HydrophobicContact SD-CB 3.95Å
975	I	90.4	Very high	83.6	Confident	38 Å²	38	40.5 Å²	40.5	20%	0.195	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.5	162.1	-66.3	165.1	0	0	0	107.5	K642 I643 V926 A927 H928	K642-I975 HydrophobicContact CB-CG2 3.71Å; K642-I975 HydrophobicContact CD-CG2 3.93Å; K642-I975 HydrophobicContact CG-CG2 4.41Å; I643-I975 WeakPolarHBondContact O-CA 3.3Å; V926-I975 HydrophobicContact CB-CD1 3.64Å; V926-I975 HydrophobicContact CB-CG1 4.01Å; V926-I975 HydrophobicContact CG1-CD1 4.46Å; V926-I975 HydrophobicContact CG1-CG1 4.32Å; V926-I975 HydrophobicContact CG2-CD1 3.65Å; V926-I975 HydrophobicContact CG2-CG1 3.98Å; A927-I975 WeakPolarHBondContact O-CD1 3.44Å; H928-I975 HydrophobicContact CB-CD1 3.77Å
976	I	86.2	Confident	83.2	Confident	10 Å²	10	37.2 Å²	37.2	5%	0.051	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	159.7	171.5	61.8	171.2	0	0	0	109	K642 I643 L645 V737 L762	K642-I976 CarbonylContact C-O 3.58Å; K642-I976 VanDerWaalsContact CA-O 3.3Å; K642-I976 WeakPolarHBondContact CA-O 3.31Å; K642-I976 WeakPolarHBondContact CB-O 3.37Å; I643-I976 HydrophobicContact CD1-CD1 3.81Å; I643-I976 HydrophobicContact CD1-CG1 3.85Å; I643-I976 HydrophobicContact CG1-CD1 4Å; I643-I976 HydrophobicContact CG1-CG1 3.45Å; I643-I976 VanDerWaalsContact CG1-CG1 3.45Å; I643-I976 PolarHBondContact N-O 2.92Å; I643-I976 PolarHBondContact O-N 3.19Å; L645-I976 HydrophobicContact CD1-CD1 3.67Å; L645-I976 HydrophobicContact CD1-CG1 4.32Å; L645-I976 HydrophobicContact CD2-CD1 4.3Å; L645-I976 HydrophobicContact CG-CD1 3.99Å; L645-I976 HydrophobicContact CG-CG1 4.2Å; V737-I976 HydrophobicContact CG1-CG2 4.11Å; V737-I976 HydrophobicContact CG2-CG2 3.83Å; L762-I976 HydrophobicContact CD1-CB 3.86Å; L762-I976 HydrophobicContact CD1-CD1 3.95Å; L762-I976 HydrophobicContact CD1-CG1 4.48Å; L762-I976 HydrophobicContact CD1-CG2 3.85Å; L762-I976 HydrophobicContact CD2-CD1 3.54Å; L762-I976 HydrophobicContact CD2-CG2 4.39Å; L762-I976 HydrophobicContact CG-CD1 4.35Å
977	E	77.4	Confident	82.6	Confident	68 Å²	68	34.6 Å²	34.6	32%	0.318	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	141.6	165.6	-78.4	150.2	175.5	0	0	109	L640 K642 S979	L640-E977 HydrophobicContact CB-CB 4.21Å; L640-E977 HydrophobicContact CB-CG 4.43Å; K642-E977 HydrophobicContact CD-CG 4.03Å; K642-E977 WeakPolarHBondContact CE-OE1 3.45Å; K642-E977 HydrophobicContact CG-CG 3.95Å; K642-E977 IonicContact NZ-OE1 2.87Å; K642-E977 PolarHBondContact NZ-OE1 2.88Å; E977-S979 PolarHBondContact O-N 2.93Å; E977-S979 PolarHBondContact O-OG 3.35Å
978	R	70.7	Confident	81.7	Confident	79 Å²	79	36.1 Å²	36.1	30%	0.298	18%	0.179	S	C	.	.			trans	-66.7	84	179.8	-174.7	176.9	177.8	166.7	2.5	109.5	P641 I643 E662 C719	P641-R978 WeakPolarHBondContact O-CB 3.16Å; P641-R978 PolarHBondContact O-N 2.74Å; I643-R978 HydrophobicContact CD1-CB 4.41Å; I643-R978 HydrophobicContact CG2-CB 4.28Å; E662-R978 WeakPolarHBondContact OE1-CD 3.45Å; E662-R978 IonicContact OE1-CZ 2.76Å; E662-R978 IonicContact OE1-NE 3.56Å; E662-R978 IonicContact OE1-NH1 2.65Å; E662-R978 PolarHBondContact OE1-NH1 3.24Å; E662-R978 IonicContact OE2-CZ 3.38Å; E662-R978 IonicContact OE2-NH1 3.25Å; E662-R978 PolarHBondContact OE2-NH1 2.78Å; C719-R978 PolarHBondContact O-NH2 2.78Å
979	S	59.9	Low	80.6	Confident	24 Å²	24	38.7 Å²	38.7	17%	0.168	19%	0.192	C	C	.	.			trans	-60.1	144	176.7	-57.8	0	0	0	0	109.6	E977 I981	E977-S979 PolarHBondContact O-N 2.93Å; E977-S979 PolarHBondContact O-OG 3.35Å; S979-I981 PolarHBondContact O-N 3.16Å
980	F	47.1	Very low	79.1	Confident	81 Å²	81	41.8 Å²	41.8	36%	0.355	21%	0.208	S	C	.	.			trans	-69.8	116.6	-179.7	-69.7	-94.5	0	0	0	110.1	A548 L640	A548-F980 HydrophobicContact CB-CE2 3.55Å; A548-F980 HydrophobicContact CB-CZ 3.72Å; A548-F980 WeakPolarHBondContact O-CE1 3.44Å; A548-F980 VanDerWaalsContact O-CE2 3.29Å; A548-F980 WeakPolarHBondContact O-CE2 3.25Å; A548-F980 WeakPolarHBondContact O-CZ 3.5Å; L640-F980 HydrophobicContact CD1-CD2 4.47Å; L640-F980 HydrophobicContact CD1-CE2 3.86Å; L640-F980 HydrophobicContact CD2-CE2 3.82Å; L640-F980 HydrophobicContact CD2-CZ 4.03Å
981	I	35.8	Very low	77.4	Confident	107 Å²	107	42 Å²	42	55%	0.549	21%	0.212	S	C	.	.			trans	-127.6	0	168.6	-50.8	-176.1	0	0	0	106.6	L721 L762 N765 S979	L721-I981 HydrophobicContact CD1-CB 4.04Å; L721-I981 HydrophobicContact CD1-CD1 3.69Å; L721-I981 HydrophobicContact CD1-CG1 3.94Å; L721-I981 HydrophobicContact CG-CD1 4.37Å; L762-I981 WeakPolarHBondContact O-CD1 3.07Å; N765-I981 HydrophobicContact CB-CD1 4.39Å; S979-I981 PolarHBondContact O-N 3.16Å

Retrieved 981 of 981 residues in 171.1 ms (Link to these results)

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